#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 2.71 -0.91 1.61 0.04 -1.26 -4.90 135.00 132.30 2jxj s PRO 81 Ca 0.00 -0.03 -0.02 0.00 0.04 0.00 0.00 61.00 60.99 2jxj s PRO 81 Cb 0.00 -4.78 0.24 0.00 0.04 0.00 0.00 34.50 30.00 2jxj s PRO 81 CO 0.00 -2.96 0.93 1.28 0.04 0.00 0.00 177.00 176.29 2jxj n LEU 82 N 12.77 4.63 0.22 -3.56 4.77 -1.26 -4.87 117.00 129.70 2jxj n LEU 82 Ca 0.30 -5.18 0.06 0.00 -0.03 0.00 0.00 56.01 51.16 2jxj n LEU 82 Cb 0.49 -1.10 0.55 0.00 -2.33 0.00 0.00 43.42 41.03 2jxj n LEU 82 CO 0.65 1.64 0.99 1.23 -1.33 0.00 0.00 177.39 180.57 2jxj h GLY 83 N 5.69 0.06 -5.33 -0.72 0.00 -2.09 -3.47 103.07 97.20 2jxj h GLY 83 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2jxj h GLY 83 CO 0.95 0.03 -0.12 1.44 0.00 0.00 0.00 176.54 178.84 2jxj n SER 84 N -4.42 -7.81 -0.03 0.19 7.64 -1.26 -4.86 113.62 103.06 2jxj n SER 84 Ca -0.02 0.07 -0.13 0.00 1.01 0.00 0.00 58.87 59.81 2jxj n SER 84 Cb 0.17 -5.31 -0.11 0.00 -1.01 0.00 0.00 64.21 57.95 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 0.82 -0.03 -0.54 1.43 -0.00 -1.99 -2.46 114.38 111.61 2jxj h ARG 85 Ca 0.00 0.00 -0.07 0.00 -0.50 0.00 0.00 59.98 59.41 2jxj h ARG 85 Cb 1.00 0.01 -0.02 0.00 0.00 0.00 0.00 29.97 30.95 2jxj h ARG 85 CO 0.27 0.66 0.04 -0.39 0.00 0.00 0.00 179.97 180.55 2jxj h VAL 86 N -0.79 1.25 -0.32 2.04 -1.51 -2.00 -2.39 116.25 112.53 2jxj h VAL 86 Ca -0.00 -1.00 -0.04 0.00 -1.23 0.00 0.00 66.70 64.43 2jxj h VAL 86 Cb 0.70 0.79 -0.01 0.00 -2.13 0.00 0.00 31.29 30.64 2jxj h VAL 86 CO 0.01 0.36 0.06 -0.09 -1.23 0.00 0.00 177.57 176.68 2jxj h ARG 87 N 0.84 0.52 -0.41 5.19 2.43 -1.95 -2.40 114.38 118.60 2jxj h ARG 87 Ca 0.17 -0.13 0.01 0.00 -0.81 0.00 0.00 59.98 59.21 2jxj h ARG 87 Cb 0.44 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 2jxj h ARG 87 CO 0.02 0.60 0.26 -0.07 -1.51 0.00 0.00 179.97 179.27 2jxj h LEU 88 N 0.36 0.44 -0.75 3.80 3.38 -1.30 -2.46 115.31 118.77 2jxj h LEU 88 Ca 0.10 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.11 2jxj h LEU 88 Cb 0.33 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 2jxj h LEU 88 CO 0.00 0.31 0.46 0.44 0.09 0.00 0.00 178.44 179.75 2jxj h ASP 89 N 0.53 0.74 -0.60 -0.43 5.19 -1.34 -2.28 116.42 118.22 2jxj h ASP 89 Ca 0.16 0.01 0.03 0.00 -0.62 0.00 0.00 57.03 56.61 2jxj h ASP 89 Cb -0.03 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.30 2jxj h ASP 89 CO -0.05 0.49 0.36 0.15 -3.12 0.00 0.00 179.24 177.07 2jxj h PHE 90 N 0.87 0.67 -0.32 4.55 3.57 -1.02 -1.63 116.94 123.64 2jxj h PHE 90 Ca 0.31 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.84 2jxj h PHE 90 Cb 0.08 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 2jxj h PHE 90 CO -0.04 0.38 0.21 -0.07 -2.23 0.00 0.00 178.31 176.56 2jxj h LEU 91 N 0.71 0.36 -0.47 0.59 -0.00 -0.98 -1.71 115.31 113.80 2jxj h LEU 91 Ca 0.24 -0.01 -0.09 0.00 -0.00 0.00 0.00 57.88 58.02 2jxj h LEU 91 Cb 0.04 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 40.59 2jxj h LEU 91 CO -0.11 0.26 -0.07 0.44 -0.00 0.00 0.00 178.44 178.96 2jxj h ASP 92 N 0.43 0.87 -0.36 -0.43 3.32 -0.92 -1.89 116.42 117.44 2jxj h ASP 92 Ca 0.12 -0.34 -0.08 0.00 0.02 0.00 0.00 57.03 56.75 2jxj h ASP 92 Cb -0.04 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 2jxj h ASP 92 CO -0.03 1.01 -0.07 1.56 -1.72 0.00 0.00 179.24 180.00 2jxj h GLN 93 N 0.72 0.68 -0.27 3.56 1.08 -0.99 0.57 115.11 120.46 2jxj h GLN 93 Ca 0.12 -0.25 -0.00 0.00 -1.45 0.00 0.00 58.65 57.07 2jxj h GLN 93 Cb 0.61 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.98 2jxj h GLN 93 CO 0.04 0.83 0.16 1.25 -0.95 0.00 0.00 178.83 180.15 2jxj h LEU 94 N 0.48 0.33 -0.58 1.46 5.85 -1.29 0.80 115.31 122.36 2jxj h LEU 94 Ca 0.09 -0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.60 2jxj h LEU 94 Cb 0.57 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 2jxj h LEU 94 CO 0.03 0.30 -0.45 0.00 -0.34 0.00 0.00 178.44 177.98 2jxj h ALA 95 N 1.04 0.76 -0.03 1.25 0.00 -1.32 -2.02 119.26 118.94 2jxj h ALA 95 Ca 0.10 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.41 2jxj h ALA 95 Cb 0.03 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.73 2jxj h ALA 95 CO -0.02 0.66 -0.48 0.87 0.00 0.00 0.00 179.25 180.29 2jxj h LYS 96 N 0.50 0.37 -0.08 0.00 1.57 -0.67 -2.04 116.57 116.23 2jxj h LYS 96 Ca 0.03 -0.37 -0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2jxj h LYS 96 Cb 0.98 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.38 2jxj h LYS 96 CO 0.09 1.03 0.05 0.35 -0.57 0.00 0.00 179.45 180.40 2jxj h PHE 97 N -0.15 0.11 -0.18 -1.35 3.57 0.60 -2.66 116.94 116.90 2jxj h PHE 97 Ca -0.05 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.37 2jxj h PHE 97 Cb 1.18 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.87 2jxj h PHE 97 CO 0.14 0.14 -0.21 -1.49 -2.23 0.00 0.00 178.31 174.66 2jxj h TRP 98 N 0.05 0.33 -0.96 0.41 4.06 -1.47 -2.84 115.95 115.54 2jxj h TRP 98 Ca 0.03 -0.06 0.10 0.00 2.06 0.00 0.00 58.89 61.02 2jxj h TRP 98 Cb 0.06 -0.09 -0.08 0.00 -1.00 0.00 0.00 29.16 28.06 2jxj h TRP 98 CO -0.05 0.50 0.60 0.93 -3.56 0.00 0.00 178.44 176.86 2jxj h GLU 99 N 0.28 0.97 0.00 0.49 5.08 -1.01 0.58 114.58 120.97 2jxj h GLU 99 Ca 0.05 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2jxj h GLU 99 Cb 0.53 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 2jxj h GLU 99 CO 0.04 0.64 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.48 2jxj h LEU 100 N 1.00 0.00 -0.22 1.33 3.38 -1.33 -2.37 115.31 117.11 2jxj h LEU 100 Ca 0.45 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.21 2jxj h LEU 100 Cb 0.35 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.11 2jxj h LEU 100 CO -0.23 0.13 -0.72 1.56 0.09 0.00 0.00 178.44 179.28 2jxj h GLN 101 N 0.00 0.78 0.00 1.13 1.08 -0.96 -3.48 115.11 113.65 2jxj h GLN 101 Ca -0.00 -0.60 0.00 0.00 -1.45 0.00 0.00 58.65 56.60 2jxj h GLN 101 Cb 0.24 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2jxj h GLN 101 CO 0.02 1.21 0.00 0.41 -0.95 0.00 0.00 178.83 179.52 2jxj n GLY 102 N 0.60 1.60 0.04 3.46 0.00 -0.83 -5.01 105.19 105.05 2jxj n GLY 102 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.92 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 3.21 -1.52 1.61 2.88 -1.21 -5.06 113.62 113.52 2jxj n SER 103 Ca 0.00 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2jxj n SER 103 Cb 0.00 0.68 0.00 0.00 -0.75 0.00 0.00 64.21 64.14 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 -2.27 -4.90 -1.94 2.46 -1.04 -1.24 -4.85 114.28 100.50 2jxj n THR 104 Ca -0.12 2.17 -0.41 0.00 -2.04 0.00 0.00 64.05 63.65 2jxj n THR 104 Cb 0.74 -3.01 -0.02 0.00 -1.82 0.00 0.00 70.33 66.21 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 -1.88 4.37 -0.22 -4.42 0.20 -1.26 -4.95 118.68 110.52 2jxj s LEU 105 Ca 0.00 2.73 -0.00 0.00 0.69 0.00 0.00 54.13 57.55 2jxj s LEU 105 Cb 0.00 -3.62 0.06 0.00 -0.43 0.00 0.00 46.19 42.20 2jxj s LEU 105 CO 0.00 -0.77 -0.03 -0.54 -0.29 0.00 0.00 176.35 174.72 2jxj s LYS 106 N -0.18 1.36 -0.29 1.98 1.02 -1.26 -5.02 119.74 117.34 2jxj s LYS 106 Ca 0.62 -0.84 -0.29 0.00 0.02 0.00 0.00 55.97 55.48 2jxj s LYS 106 Cb -0.44 -2.46 -0.02 0.00 -0.52 0.00 0.00 37.83 34.39 2jxj s LYS 106 CO 0.43 -0.61 1.74 0.42 -0.92 0.00 0.00 175.35 176.41 2jxj s ILE 107 N 1.52 3.53 0.39 2.17 1.09 -1.26 -4.98 121.20 123.67 2jxj s ILE 107 Ca -0.05 0.56 -0.24 0.00 -1.10 0.00 0.00 60.65 59.83 2jxj s ILE 107 Cb -0.18 -3.66 -0.09 0.00 -1.06 0.00 0.00 42.46 37.47 2jxj s ILE 107 CO -0.07 -0.38 1.05 -2.16 -0.10 0.00 0.00 174.94 173.28 2jxj s PRO 108 N 5.35 4.19 -0.27 2.79 0.04 -1.26 -5.04 135.00 140.80 2jxj s PRO 108 Ca 0.77 1.51 -0.04 0.00 0.04 0.00 0.00 61.00 63.28 2jxj s PRO 108 Cb -0.23 -2.56 0.02 0.00 0.04 0.00 0.00 34.50 31.76 2jxj s PRO 108 CO 0.33 -0.12 0.00 0.08 0.04 0.00 0.00 177.00 177.33 2jxj s VAL 109 N -1.65 3.37 -0.09 -0.36 1.01 -1.26 -3.76 120.40 117.66 2jxj s VAL 109 Ca 0.57 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.72 2jxj s VAL 109 Cb -0.22 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 2jxj s VAL 109 CO 0.28 0.16 -0.16 -0.69 0.00 0.00 0.00 175.10 174.68 2jxj s VAL 110 N 1.41 2.83 -1.54 2.92 1.01 -0.56 -4.61 120.40 121.87 2jxj s VAL 110 Ca 0.01 -0.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 2jxj s VAL 110 Cb -0.17 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2jxj s VAL 110 CO -0.01 0.55 0.63 -0.62 0.00 0.00 0.00 175.10 175.65 2jxj n GLU 111 N 3.05 -4.95 -2.48 2.72 1.02 -1.26 -1.28 120.64 117.46 2jxj n GLU 111 Ca -0.18 0.88 -0.21 0.00 -0.02 0.00 0.00 57.16 57.64 2jxj n GLU 111 Cb 0.52 -5.75 -0.00 0.00 -0.02 0.00 0.00 31.44 26.19 2jxj n GLU 111 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2jxj n ARG 112 N -4.07 -2.10 -3.80 3.49 5.12 -1.26 -4.97 116.66 109.08 2jxj n ARG 112 Ca -0.10 0.97 -0.13 0.00 -1.93 0.00 0.00 57.85 56.67 2jxj n ARG 112 Cb 0.61 -5.66 -0.10 0.00 -1.16 0.00 0.00 32.46 26.15 2jxj n ARG 112 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2jxj s LYS 113 N -5.13 0.52 0.11 5.56 -0.14 -0.40 -5.14 119.74 115.12 2jxj s LYS 113 Ca 0.04 -0.08 -0.31 0.00 -1.36 0.00 0.00 55.97 54.26 2jxj s LYS 113 Cb -0.02 0.23 -0.08 0.00 -1.68 0.00 0.00 37.83 36.29 2jxj s LYS 113 CO 0.05 -0.12 1.36 0.42 -0.76 0.00 0.00 175.35 176.29 2jxj s ILE 114 N -0.91 3.41 -0.18 2.17 -1.09 -1.26 -1.49 121.20 121.84 2jxj s ILE 114 Ca -0.10 1.02 -0.15 0.00 -2.23 0.00 0.00 60.65 59.19 2jxj s ILE 114 Cb -0.05 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.14 2jxj s ILE 114 CO 0.02 0.08 0.33 -0.22 -1.23 0.00 0.00 174.94 173.93 2jxj s LEU 115 N 1.03 4.20 1.31 2.97 0.20 -1.25 -4.93 118.68 122.21 2jxj s LEU 115 Ca 0.63 0.49 -0.18 0.00 0.69 0.00 0.00 54.13 55.77 2jxj s LEU 115 Cb -0.36 -2.42 0.33 0.00 -0.43 0.00 0.00 46.19 43.31 2jxj s LEU 115 CO 0.30 0.03 0.89 -0.67 -0.29 0.00 0.00 176.35 176.61 2jxj n ASP 116 N 3.97 -2.92 0.05 3.68 -0.08 -1.26 -4.90 116.55 115.08 2jxj n ASP 116 Ca -0.11 -0.49 0.00 0.00 -1.51 0.00 0.00 54.79 52.68 2jxj n ASP 116 Cb 0.52 -1.12 0.00 0.00 2.34 0.00 0.00 41.12 42.86 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 -5.14 0.31 -0.01 -2.67 4.77 -1.26 -4.65 117.00 108.36 2jxj n LEU 117 Ca 0.07 0.17 -0.09 0.00 -0.03 0.00 0.00 56.01 56.13 2jxj n LEU 117 Cb 0.57 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 2jxj n LEU 117 CO 0.49 -0.66 0.79 0.22 -1.33 0.00 0.00 177.39 176.91 2jxj h TYR 118 N 0.00 -0.25 -0.96 -1.77 3.20 -1.96 0.27 116.97 115.50 2jxj h TYR 118 Ca 0.00 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.94 2jxj h TYR 118 Cb 0.00 0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.34 2jxj h TYR 118 CO 0.00 -0.16 0.62 0.00 -1.64 0.00 0.00 178.16 176.98 2jxj h ALA 119 N 1.00 1.32 -0.24 1.82 0.00 -2.00 -1.67 119.26 119.49 2jxj h ALA 119 Ca 0.09 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2jxj h ALA 119 Cb 0.24 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2jxj h ALA 119 CO -0.21 0.43 -0.17 1.25 0.00 0.00 0.00 179.25 180.55 2jxj h LEU 120 N 1.15 0.56 -1.50 0.00 7.12 -1.64 -2.83 115.31 118.18 2jxj h LEU 120 Ca 0.41 -0.44 0.06 0.00 0.13 0.00 0.00 57.88 58.03 2jxj h LEU 120 Cb 0.12 -0.16 -0.04 0.00 -0.53 0.00 0.00 40.66 40.05 2jxj h LEU 120 CO -0.16 0.89 0.41 -1.28 -0.13 0.00 0.00 178.44 178.17 2jxj h SER 121 N 0.24 0.55 -0.25 1.25 0.87 -0.03 -2.11 113.55 114.07 2jxj h SER 121 Ca 0.05 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 2jxj h SER 121 Cb 0.70 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 2jxj h SER 121 CO 0.05 0.36 -0.10 0.11 -0.53 0.00 0.00 176.83 176.71 2jxj h LYS 122 N 0.62 0.51 -0.91 2.24 1.57 -1.21 -2.95 116.57 116.44 2jxj h LYS 122 Ca 0.26 -0.22 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 2jxj h LYS 122 Cb 0.24 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.48 2jxj h LYS 122 CO -0.08 0.76 0.59 0.82 -0.57 0.00 0.00 179.45 180.97 2jxj h ILE 123 N 0.24 1.17 -0.02 1.86 2.04 -1.15 -1.55 117.51 120.10 2jxj h ILE 123 Ca 0.06 -0.40 0.01 0.00 1.00 0.00 0.00 64.86 65.53 2jxj h ILE 123 Cb 0.59 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 2jxj h ILE 123 CO 0.03 0.21 -0.02 0.58 0.00 0.00 0.00 178.15 178.95 2jxj h VAL 124 N 1.16 0.94 -0.30 1.67 2.07 -1.37 -2.45 116.25 117.97 2jxj h VAL 124 Ca 0.36 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.88 2jxj h VAL 124 Cb -0.03 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2jxj h VAL 124 CO -0.11 0.00 0.20 0.00 0.02 0.00 0.00 177.57 177.68 2jxj h ALA 125 N 0.99 0.38 -0.07 1.67 0.00 -1.31 -1.54 119.26 119.37 2jxj h ALA 125 Ca 0.01 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2jxj h ALA 125 Cb 0.05 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2jxj h ALA 125 CO -0.03 -0.15 0.17 0.66 0.00 0.00 0.00 179.25 179.89 2jxj h SER 126 N 0.41 0.00 0.40 0.00 4.64 -1.10 -0.76 113.55 117.14 2jxj h SER 126 Ca 0.11 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.12 2jxj h SER 126 Cb -0.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 2jxj h SER 126 CO -0.03 0.00 -1.69 0.11 -0.87 0.00 0.00 176.83 174.35 2jxj h LYS 127 N 0.00 0.17 0.00 4.77 1.79 -0.83 -3.47 116.57 119.00 2jxj h LYS 127 Ca 0.03 -0.29 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 2jxj h LYS 127 Cb 0.37 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 2jxj h LYS 127 CO -0.00 0.95 0.00 0.41 -1.08 0.00 0.00 179.45 179.73 2jxj n GLY 128 N 1.71 0.00 4.63 3.86 0.00 -0.32 -4.69 105.19 110.38 2jxj n GLY 128 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 1.94 0.10 -0.02 0.00 -1.04 -3.54 105.19 102.63 2jxj n GLY 129 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.23 1.61 -0.00 -1.26 -3.88 117.46 112.57 2jxj n PHE 130 Ca 0.00 0.03 0.07 0.00 -0.00 0.00 0.00 57.45 57.55 2jxj n PHE 130 Cb 0.00 0.29 0.33 0.00 -0.00 0.00 0.00 39.48 40.09 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 0.79 -0.32 -4.13 5.08 -1.95 -0.63 114.58 113.42 2jxj h GLU 131 Ca 0.00 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 2jxj h GLU 131 Cb 0.00 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 2jxj h GLU 131 CO 0.00 0.52 0.04 1.98 -1.00 0.00 0.00 179.01 180.56 2jxj h MET 132 N 0.82 0.48 0.00 2.33 4.05 -1.89 -0.06 114.93 120.66 2jxj h MET 132 Ca 0.36 -0.08 -0.00 0.00 -0.28 0.00 0.00 59.70 59.70 2jxj h MET 132 Cb 0.34 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.06 2jxj h MET 132 CO -0.14 0.47 -0.00 0.28 0.23 0.00 0.00 176.91 177.76 2jxj h VAL 133 N 0.47 1.27 -0.26 -5.77 2.07 -1.39 -2.75 116.25 109.89 2jxj h VAL 133 Ca 0.11 -0.82 -0.08 0.00 0.82 0.00 0.00 66.70 66.73 2jxj h VAL 133 Cb 0.24 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2jxj h VAL 133 CO 0.00 0.21 -0.20 0.74 0.02 0.00 0.00 177.57 178.34 2jxj h THR 134 N -0.35 1.25 -0.15 2.57 2.02 -1.30 0.41 112.91 117.35 2jxj h THR 134 Ca -0.00 -1.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.01 2jxj h THR 134 Cb 0.35 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 2jxj h THR 134 CO 0.00 0.37 0.01 0.11 0.37 0.00 0.00 175.52 176.38 2jxj h LYS 135 N 0.42 0.22 -0.25 6.66 1.57 -0.95 -2.43 116.57 121.82 2jxj h LYS 135 Ca 0.07 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2jxj h LYS 135 Cb 0.59 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2jxj h LYS 135 CO 0.04 0.23 0.00 0.39 -0.57 0.00 0.00 179.45 179.54 2jxj n GLU 136 N -4.42 2.51 -2.76 3.15 -0.58 -1.01 -4.97 120.64 112.57 2jxj n GLU 136 Ca -0.01 -1.83 -0.19 0.00 -0.42 0.00 0.00 57.16 54.72 2jxj n GLU 136 Cb 0.15 -1.22 0.00 0.00 -0.57 0.00 0.00 31.44 29.81 2jxj n GLU 136 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2jxj n LYS 137 N 0.37 -3.02 0.09 3.49 5.02 0.89 -4.82 118.16 120.19 2jxj n LYS 137 Ca 0.09 0.75 0.10 0.00 -2.02 0.00 0.00 58.31 57.23 2jxj n LYS 137 Cb 0.37 -5.45 0.43 0.00 -0.02 0.00 0.00 35.03 30.36 2jxj n LYS 137 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jxj n LYS 138 N -3.35 0.13 -0.26 1.97 5.02 0.11 -2.95 118.16 118.82 2jxj n LYS 138 Ca -0.14 0.40 0.13 0.00 -2.02 0.00 0.00 58.31 56.68 2jxj n LYS 138 Cb 0.62 -1.76 0.40 0.00 -0.02 0.00 0.00 35.03 34.26 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 0.00 0.78 -0.74 2.13 4.06 -1.88 0.23 115.95 120.53 2jxj h TRP 139 Ca 0.00 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.95 2jxj h TRP 139 Cb 0.28 -0.24 -0.04 0.00 -1.00 0.00 0.00 29.16 28.16 2jxj h TRP 139 CO 0.00 0.28 0.39 0.77 -3.56 0.00 0.00 178.44 176.32 2jxj h SER 140 N 0.65 0.93 0.43 -3.49 0.02 -1.91 -2.14 113.55 108.05 2jxj h SER 140 Ca 0.45 -0.08 -0.14 0.00 -0.84 0.00 0.00 61.79 61.17 2jxj h SER 140 Cb 0.77 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 2jxj h SER 140 CO -0.20 0.76 -0.61 0.11 -1.14 0.00 0.00 176.83 175.75 2jxj h LYS 141 N 1.04 0.17 -0.08 3.45 1.57 -1.19 -2.57 116.57 118.95 2jxj h LYS 141 Ca 0.26 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2jxj h LYS 141 Cb 0.05 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 2jxj h LYS 141 CO -0.04 0.72 0.04 0.28 -0.57 0.00 0.00 179.45 179.88 2jxj h VAL 142 N 0.13 1.12 -0.43 0.50 2.07 -0.72 -2.01 116.25 116.91 2jxj h VAL 142 Ca -0.01 -0.36 -0.12 0.00 0.82 0.00 0.00 66.70 67.03 2jxj h VAL 142 Cb 1.10 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 2jxj h VAL 142 CO 0.09 0.11 -0.20 1.23 0.02 0.00 0.00 177.57 178.82 2jxj h GLY 143 N -0.01 0.92 1.01 2.17 0.00 -1.48 -3.02 103.07 102.67 2jxj h GLY 143 Ca 0.03 -0.78 0.01 0.00 0.00 0.00 0.00 47.33 46.58 2jxj h GLY 143 CO -0.00 0.71 0.64 1.76 0.00 0.00 0.00 176.54 179.65 2jxj h SER 144 N 0.74 1.14 0.00 0.19 0.02 -1.35 -1.62 113.55 112.66 2jxj h SER 144 Ca 0.11 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2jxj h SER 144 Cb 0.73 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 2jxj h SER 144 CO 0.06 0.83 -0.06 0.03 -1.14 0.00 0.00 176.83 176.55 2jxj h ARG 145 N 1.33 0.15 0.24 3.45 2.47 -1.24 -3.21 114.38 117.59 2jxj h ARG 145 Ca 0.36 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 59.04 2jxj h ARG 145 Cb -0.13 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.16 2jxj h ARG 145 CO -0.08 0.23 -0.12 -0.07 0.56 0.00 0.00 179.97 180.49 2jxj h LEU 146 N 0.15 -0.28 0.00 3.04 3.38 -1.24 -3.48 115.31 116.89 2jxj h LEU 146 Ca 0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2jxj h LEU 146 Cb 0.21 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2jxj h LEU 146 CO 0.01 -0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.07 2jxj n GLY 147 N 0.27 0.00 3.60 0.83 0.00 -0.98 -5.14 105.19 103.78 2jxj n GLY 147 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 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 3.03 0.30 1.61 2.02 -1.17 -5.04 117.35 118.10 2jxj s TYR 148 Ca 0.00 0.02 -0.17 0.00 -0.37 0.00 0.00 57.07 56.55 2jxj s TYR 148 Cb 0.00 -1.78 -0.09 0.00 -0.40 0.00 0.00 41.96 39.69 2jxj s TYR 148 CO 0.00 0.31 0.75 -0.51 -1.57 0.00 0.00 175.55 174.53 2jxj s LEU 149 N -0.61 4.15 -0.15 -1.29 1.02 -1.26 -4.60 118.68 115.94 2jxj s LEU 149 Ca 0.10 1.36 -0.36 0.00 0.02 0.00 0.00 54.13 55.25 2jxj s LEU 149 Cb -0.12 -3.96 -0.13 0.00 0.02 0.00 0.00 46.19 42.00 2jxj s LEU 149 CO 0.02 -0.14 1.81 -2.65 0.02 0.00 0.00 176.35 175.42 2jxj n PRO 150 N -0.02 1.79 -3.54 1.29 -0.02 -1.26 -4.93 135.00 128.30 2jxj n PRO 150 Ca 0.02 0.66 0.03 0.00 -2.02 0.00 0.00 63.50 62.18 2jxj n PRO 150 Cb 0.52 -2.44 -0.06 0.00 -0.02 0.00 0.00 33.50 31.51 2jxj n PRO 150 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2jxj s GLY 151 N 3.72 0.54 0.15 -1.23 0.00 -1.26 -5.14 107.32 104.10 2jxj s GLY 151 Ca 0.94 3.78 -0.31 0.00 0.00 0.00 0.00 44.72 49.14 2jxj s GLY 151 CO 0.56 2.91 1.38 0.54 0.00 0.00 0.00 173.10 178.49 2jxj s LYS 152 N 1.29 4.33 0.00 2.90 1.02 -1.26 -3.80 119.74 124.22 2jxj s LYS 152 Ca -0.06 2.11 0.00 0.00 0.02 0.00 0.00 55.97 58.03 2jxj s LYS 152 Cb -0.02 -3.22 0.00 0.00 -0.52 0.00 0.00 37.83 34.08 2jxj s LYS 152 CO -0.11 -0.40 0.00 0.41 -0.92 0.00 0.00 175.35 174.33 2jxj n GLY 153 N 3.09 1.98 0.82 -3.33 0.00 -1.26 -5.01 105.19 101.47 2jxj n GLY 153 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2jxj n GLY 153 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jxj n THR 154 N -0.61 0.00 -0.32 2.61 -1.04 -1.25 -4.75 114.28 108.93 2jxj n THR 154 Ca 0.00 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.04 2jxj n THR 154 Cb 0.00 -0.66 0.22 0.00 -1.82 0.00 0.00 70.33 68.07 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 1.35 1.84 3.41 0.00 -1.94 -1.15 103.07 106.58 2jxj h GLY 155 Ca 0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 2jxj h GLY 155 CO 0.00 0.34 -0.07 1.76 0.00 0.00 0.00 176.54 178.56 2jxj h SER 156 N 1.09 0.18 0.12 0.19 0.02 -1.98 -2.16 113.55 111.01 2jxj h SER 156 Ca 0.39 -0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 61.16 2jxj h SER 156 Cb 0.13 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 2jxj h SER 156 CO -0.14 0.29 -0.54 -0.07 -1.14 0.00 0.00 176.83 175.23 2jxj h LEU 157 N 0.19 0.51 -0.41 5.07 4.07 -1.51 -2.25 115.31 120.97 2jxj h LEU 157 Ca 0.04 -0.27 -0.16 0.00 0.08 0.00 0.00 57.88 57.58 2jxj h LEU 157 Cb 0.26 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 2jxj h LEU 157 CO 0.01 0.95 -0.41 -0.07 -1.08 0.00 0.00 178.44 177.84 2jxj h LEU 158 N 0.35 0.96 -0.33 1.67 3.38 -1.04 -1.48 115.31 118.83 2jxj h LEU 158 Ca 0.01 -0.45 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 2jxj h LEU 158 Cb 1.06 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 2jxj h LEU 158 CO 0.10 1.24 -0.08 0.11 0.09 0.00 0.00 178.44 179.89 2jxj h LYS 159 N 0.72 0.63 -0.28 1.13 1.57 -1.38 0.17 116.57 119.14 2jxj h LYS 159 Ca 0.05 -0.24 -0.03 0.00 -1.87 0.00 0.00 60.65 58.56 2jxj h LYS 159 Cb 1.00 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 2jxj h LYS 159 CO 0.10 0.81 0.07 0.77 -0.57 0.00 0.00 179.45 180.63 2jxj h SER 160 N 0.41 0.42 -0.30 0.86 0.02 -1.40 -0.61 113.55 112.96 2jxj h SER 160 Ca 0.08 -0.23 -0.07 0.00 -0.84 0.00 0.00 61.79 60.73 2jxj h SER 160 Cb 0.58 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 2jxj h SER 160 CO 0.03 0.54 -0.09 0.45 -1.14 0.00 0.00 176.83 176.62 2jxj h HIS 161 N 0.28 0.67 -0.12 3.45 3.86 -1.25 -3.21 115.15 118.83 2jxj h HIS 161 Ca 0.09 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 2jxj h HIS 161 Cb 0.29 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 2jxj h HIS 161 CO 0.01 0.79 0.06 -0.92 0.86 0.00 0.00 177.93 178.74 2jxj h TYR 162 N 0.35 0.12 -1.07 2.45 3.20 -0.60 -3.21 116.97 118.21 2jxj h TYR 162 Ca 0.07 0.00 -0.74 0.00 3.14 0.00 0.00 58.73 61.20 2jxj h TYR 162 Cb 0.59 -0.04 -0.12 0.00 1.54 0.00 0.00 36.73 38.70 2jxj h TYR 162 CO 0.05 0.07 2.33 -1.91 -1.64 0.00 0.00 178.16 177.06 2jxj n GLU 163 N -5.03 3.63 0.00 1.82 2.13 -0.24 -2.21 120.64 120.74 2jxj n GLU 163 Ca -0.05 -3.32 0.00 0.00 0.66 0.00 0.00 57.16 54.46 2jxj n GLU 163 Cb 0.04 -2.94 0.00 0.00 0.27 0.00 0.00 31.44 28.81 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 3.92 0.00 0.00 5.31 1.74 -1.21 -4.86 116.66 121.56 2jxj n ARG 164 Ca 0.46 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 2jxj n ARG 164 Cb 0.35 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.79 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 -1.85 0.31 0.00 0.55 -0.00 -1.25 -4.76 119.36 112.36 2jxj n ILE 165 Ca 0.00 -0.37 0.00 0.00 -0.00 0.00 0.00 62.75 62.38 2jxj n ILE 165 Cb 0.00 1.01 0.00 0.00 -0.00 0.00 0.00 39.64 40.65 2jxj n ILE 165 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2jxj n LEU 166 N -0.15 0.00 -0.17 1.39 4.77 -1.08 -4.67 117.00 117.08 2jxj n LEU 166 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 2jxj n LEU 166 Cb 0.32 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.49 2jxj n LEU 166 CO 0.00 -0.48 0.95 0.22 -1.33 0.00 0.00 177.39 176.74 2jxj h TYR 167 N 0.00 0.27 -0.69 -1.77 3.20 -1.80 -1.55 116.97 114.63 2jxj h TYR 167 Ca 0.00 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.04 2jxj h TYR 167 Cb 0.00 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.19 2jxj h TYR 167 CO 0.00 0.05 0.47 -1.35 -1.64 0.00 0.00 178.16 175.69 2jxj h PRO 168 N 0.32 0.33 0.12 1.82 0.11 -1.86 -2.32 132.00 130.52 2jxj h PRO 168 Ca 0.27 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.37 2jxj h PRO 168 Cb 0.34 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 2jxj h PRO 168 CO -0.30 0.22 -0.19 -0.92 -0.21 0.00 0.00 178.00 176.60 2jxj h TYR 169 N 0.34 -0.50 -0.01 0.65 3.20 -1.55 0.38 116.97 119.48 2jxj h TYR 169 Ca 0.33 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.22 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 -0.28 -0.02 0.93 -1.64 0.00 0.00 178.16 177.15 2jxj h GLU 170 N -0.37 -0.03 -0.86 1.82 3.07 -1.46 -2.56 114.58 114.18 2jxj h GLU 170 Ca 0.02 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.89 2jxj h GLU 170 Cb 0.38 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.26 2jxj h GLU 170 CO -0.10 -0.02 0.57 -0.07 -1.40 0.00 0.00 179.01 177.99 2jxj h LEU 171 N -0.03 0.98 -1.60 1.33 3.38 -1.30 -0.43 115.31 117.64 2jxj h LEU 171 Ca 0.01 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.03 2jxj h LEU 171 Cb 0.05 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2jxj h LEU 171 CO -0.03 0.71 0.37 0.15 0.09 0.00 0.00 178.44 179.73 2jxj h PHE 172 N 1.16 0.50 0.13 1.13 3.04 0.15 0.93 116.94 123.97 2jxj h PHE 172 Ca 0.32 0.01 -0.25 0.00 3.98 0.00 0.00 57.97 62.03 2jxj h PHE 172 Cb -0.13 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 38.22 2jxj h PHE 172 CO -0.00 0.26 -1.23 1.96 -2.02 0.00 0.00 178.31 177.28 2jxj h GLN 173 N 0.49 0.27 -1.01 1.11 4.20 -1.07 -3.33 115.11 115.76 2jxj h GLN 173 Ca 0.24 -0.45 -0.48 0.00 0.06 0.00 0.00 58.65 58.01 2jxj h GLN 173 Cb 0.33 0.17 -0.28 0.00 0.30 0.00 0.00 27.48 28.00 2jxj h GLN 173 CO -0.07 1.22 0.62 0.43 -0.67 0.00 0.00 178.83 180.36 2jxj n SER 174 N -3.98 4.05 -0.24 1.46 7.64 -0.25 -5.13 113.62 117.17 2jxj n SER 174 Ca -0.21 -3.48 0.15 0.00 1.01 0.00 0.00 58.87 56.34 2jxj n SER 174 Cb 0.88 -0.83 0.74 0.00 -1.01 0.00 0.00 64.21 63.99 2jxj n SER 174 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64