#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxj h PRO 81 N 0.00 0.00 -4.41 1.61 0.13 -2.06 -3.41 132.00 123.87 2jxj h PRO 81 Ca 0.00 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 64.40 2jxj h PRO 81 Cb 0.00 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 30.88 2jxj h PRO 81 CO 0.00 0.46 -0.41 -0.51 -0.23 0.00 0.00 178.00 177.31 2jxj s LEU 82 N -7.47 5.30 0.00 1.56 1.43 -1.26 -4.81 118.68 113.43 2jxj s LEU 82 Ca -0.01 -1.33 0.00 0.00 -1.03 0.00 0.00 54.13 51.76 2jxj s LEU 82 Cb 0.12 -2.09 0.00 0.00 0.03 0.00 0.00 46.19 44.26 2jxj s LEU 82 CO 0.72 -0.56 0.00 0.61 0.23 0.00 0.00 176.35 177.35 2jxj n GLY 83 N 5.06 -1.12 3.27 -3.19 0.00 -1.26 -5.04 105.19 102.92 2jxj n GLY 83 Ca -0.11 0.57 -0.44 0.00 0.00 0.00 0.00 46.02 46.03 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 5.69 -0.13 1.61 7.64 -1.26 -4.82 113.62 122.35 2jxj n SER 84 Ca 0.00 -3.12 -0.11 0.00 1.01 0.00 0.00 58.87 56.65 2jxj n SER 84 Cb 0.00 -1.37 0.01 0.00 -1.01 0.00 0.00 64.21 61.83 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 6.40 0.94 -0.62 1.43 3.08 -1.94 -2.94 114.38 120.73 2jxj h ARG 85 Ca 0.20 -0.44 0.03 0.00 0.07 0.00 0.00 59.98 59.84 2jxj h ARG 85 Cb 0.81 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.81 2jxj h ARG 85 CO 1.12 1.10 0.41 -0.39 -1.07 0.00 0.00 179.97 181.13 2jxj h VAL 86 N 0.80 1.10 -0.01 2.04 -1.51 -1.99 0.18 116.25 116.87 2jxj h VAL 86 Ca 0.09 -0.26 -0.00 0.00 -1.23 0.00 0.00 66.70 65.30 2jxj h VAL 86 Cb 0.86 0.28 -0.00 0.00 -2.13 0.00 0.00 31.29 30.30 2jxj h VAL 86 CO 0.08 0.14 -0.00 0.03 -1.23 0.00 0.00 177.57 176.58 2jxj h ARG 87 N 0.76 0.02 -0.42 5.19 3.08 -1.93 -1.87 114.38 119.22 2jxj h ARG 87 Ca 0.24 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.23 2jxj h ARG 87 Cb 0.03 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2jxj h ARG 87 CO -0.06 0.37 0.05 -0.07 -1.07 0.00 0.00 179.97 179.19 2jxj h LEU 88 N -0.32 0.68 -0.73 3.04 4.07 -1.31 -2.68 115.31 118.05 2jxj h LEU 88 Ca 0.00 -0.27 0.04 0.00 0.08 0.00 0.00 57.88 57.74 2jxj h LEU 88 Cb 0.36 -0.18 -0.05 0.00 1.08 0.00 0.00 40.66 41.87 2jxj h LEU 88 CO 0.00 0.78 0.44 0.44 -1.08 0.00 0.00 178.44 179.02 2jxj h ASP 89 N 0.55 0.70 0.01 -0.43 5.19 -0.66 -1.04 116.42 120.75 2jxj h ASP 89 Ca 0.13 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.55 2jxj h ASP 89 Cb 0.40 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 39.77 2jxj h ASP 89 CO 0.01 0.47 -0.00 0.15 -3.12 0.00 0.00 179.24 176.75 2jxj h PHE 90 N 0.84 -0.01 -0.28 4.55 3.04 -1.20 -2.37 116.94 121.51 2jxj h PHE 90 Ca 0.31 -0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.25 2jxj h PHE 90 Cb 0.10 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.60 2jxj h PHE 90 CO -0.05 0.01 0.16 -0.07 -2.02 0.00 0.00 178.31 176.34 2jxj h LEU 91 N -0.03 0.32 -0.28 0.59 3.38 -1.14 -2.46 115.31 115.70 2jxj h LEU 91 Ca -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2jxj h LEU 91 Cb 0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2jxj h LEU 91 CO 0.00 0.26 0.17 0.44 0.09 0.00 0.00 178.44 179.40 2jxj h ASP 92 N 0.38 0.33 -0.38 -0.43 5.19 -0.68 -1.61 116.42 119.21 2jxj h ASP 92 Ca 0.10 -0.05 -0.06 0.00 -0.62 0.00 0.00 57.03 56.40 2jxj h ASP 92 Cb -0.00 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.40 2jxj h ASP 92 CO -0.02 0.28 0.04 1.56 -3.12 0.00 0.00 179.24 177.98 2jxj h GLN 93 N 0.35 0.74 0.10 3.56 1.08 -1.13 0.14 115.11 119.94 2jxj h GLN 93 Ca 0.10 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2jxj h GLN 93 Cb 0.01 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.34 2jxj h GLN 93 CO -0.02 0.72 -0.05 1.25 -0.95 0.00 0.00 178.83 179.79 2jxj h LEU 94 N 0.70 -0.11 -0.19 1.46 5.85 -1.09 0.42 115.31 122.35 2jxj h LEU 94 Ca 0.15 -0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.66 2jxj h LEU 94 Cb 0.38 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 2jxj h LEU 94 CO 0.01 0.05 -0.23 0.00 -0.34 0.00 0.00 178.44 177.93 2jxj h ALA 95 N 0.63 0.28 -0.34 1.25 0.00 -1.20 -2.51 119.26 117.38 2jxj h ALA 95 Ca -0.01 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 2jxj h ALA 95 Cb 0.22 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2jxj h ALA 95 CO 0.02 0.24 0.06 0.87 0.00 0.00 0.00 179.25 180.44 2jxj h LYS 96 N 0.15 0.56 -0.13 0.00 1.57 -0.72 -0.40 116.57 117.60 2jxj h LYS 96 Ca 0.03 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2jxj h LYS 96 Cb 0.79 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 2jxj h LYS 96 CO 0.05 0.64 0.05 0.35 -0.57 0.00 0.00 179.45 179.97 2jxj h PHE 97 N 0.40 0.10 -0.18 -1.35 3.04 -0.20 -2.39 116.94 116.34 2jxj h PHE 97 Ca 0.10 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.99 2jxj h PHE 97 Cb 0.34 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.81 2jxj h PHE 97 CO 0.02 0.05 -0.21 -1.49 -2.02 0.00 0.00 178.31 174.67 2jxj h TRP 98 N 0.12 0.35 -0.89 0.41 4.06 -1.41 -2.78 115.95 115.82 2jxj h TRP 98 Ca 0.05 -0.06 0.10 0.00 2.06 0.00 0.00 58.89 61.05 2jxj h TRP 98 Cb 0.02 -0.09 -0.07 0.00 -1.00 0.00 0.00 29.16 28.02 2jxj h TRP 98 CO -0.10 0.52 0.57 1.49 -3.56 0.00 0.00 178.44 177.36 2jxj h GLU 99 N 0.29 0.83 -0.73 0.49 4.22 -0.55 -0.64 114.58 118.50 2jxj h GLU 99 Ca 0.05 -0.05 0.03 0.00 0.08 0.00 0.00 59.36 59.47 2jxj h GLU 99 Cb 0.54 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 2jxj h GLU 99 CO 0.04 0.55 0.48 -0.07 -2.18 0.00 0.00 179.01 177.83 2jxj h LEU 100 N 0.86 0.78 -0.31 1.64 4.07 -1.28 -2.33 115.31 118.72 2jxj h LEU 100 Ca 0.42 -0.01 -0.10 0.00 0.08 0.00 0.00 57.88 58.26 2jxj h LEU 100 Cb 0.45 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 2jxj h LEU 100 CO -0.18 0.54 -0.21 1.56 -1.08 0.00 0.00 178.44 179.07 2jxj h GLN 101 N 0.90 0.68 0.00 1.13 7.50 -1.23 -3.48 115.11 120.62 2jxj h GLN 101 Ca 0.29 -0.32 0.00 0.00 0.50 0.00 0.00 58.65 59.12 2jxj h GLN 101 Cb 0.03 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 27.56 2jxj h GLN 101 CO -0.08 0.93 0.00 0.41 -1.50 0.00 0.00 178.83 178.59 2jxj n GLY 102 N 0.04 1.74 0.09 3.46 0.00 -0.88 -5.02 105.19 104.62 2jxj n GLY 102 Ca -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 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 0.38 -2.31 1.61 2.88 -1.23 -5.06 113.62 109.88 2jxj n SER 103 Ca 0.00 0.18 -0.04 0.00 -1.33 0.00 0.00 58.87 57.67 2jxj n SER 103 Cb 0.00 0.67 -0.04 0.00 -0.75 0.00 0.00 64.21 64.09 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 -2.80-10.40 -2.08 2.46 -1.04 -1.26 -4.88 114.28 94.28 2jxj n THR 104 Ca -0.22 2.08 -0.42 0.00 -2.04 0.00 0.00 64.05 63.44 2jxj n THR 104 Cb 1.02 -5.80 -0.03 0.00 -1.82 0.00 0.00 70.33 63.71 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 -0.51 4.32 -0.23 -4.42 0.20 -1.26 -4.99 118.68 111.79 2jxj s LEU 105 Ca -0.21 2.23 -0.00 0.00 0.69 0.00 0.00 54.13 56.83 2jxj s LEU 105 Cb 0.01 -3.55 0.06 0.00 -0.43 0.00 0.00 46.19 42.29 2jxj s LEU 105 CO 0.59 -0.85 -0.03 -0.75 -0.29 0.00 0.00 176.35 175.03 2jxj s LYS 106 N 3.18 1.36 -0.28 1.98 2.20 -1.26 -4.99 119.74 121.93 2jxj s LYS 106 Ca 0.70 -0.85 -0.29 0.00 -0.36 0.00 0.00 55.97 55.17 2jxj s LYS 106 Cb -0.34 -2.46 -0.07 0.00 -1.51 0.00 0.00 37.83 33.45 2jxj s LYS 106 CO 0.28 -0.61 2.25 -0.89 -0.36 0.00 0.00 175.35 176.02 2jxj n ILE 107 N 4.77 0.26 -2.37 5.43 -0.00 -1.26 -4.93 119.36 121.26 2jxj n ILE 107 Ca -0.11 -0.46 -0.39 0.00 -0.00 0.00 0.00 62.75 61.79 2jxj n ILE 107 Cb 0.45 -2.39 -0.03 0.00 -0.00 0.00 0.00 39.64 37.66 2jxj n ILE 107 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2jxj s PRO 108 N 6.59 4.33 -0.15 0.38 0.04 -1.26 -4.98 135.00 139.96 2jxj s PRO 108 Ca 1.03 1.84 -0.16 0.00 0.04 0.00 0.00 61.00 63.74 2jxj s PRO 108 Cb -0.43 -2.91 -0.04 0.00 0.04 0.00 0.00 34.50 31.16 2jxj s PRO 108 CO 0.37 -0.08 0.41 0.08 0.04 0.00 0.00 177.00 177.82 2jxj s VAL 109 N -1.31 5.23 -0.07 -0.36 1.01 -1.26 -3.76 120.40 119.87 2jxj s VAL 109 Ca 0.51 0.78 0.02 0.00 0.00 0.00 0.00 61.98 63.29 2jxj s VAL 109 Cb -0.31 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.34 2jxj s VAL 109 CO 0.40 0.33 -0.11 -0.69 0.00 0.00 0.00 175.10 175.03 2jxj s VAL 110 N 0.74 1.09 -1.54 2.92 1.01 -0.20 -4.76 120.40 119.66 2jxj s VAL 110 Ca 0.22 -0.43 -0.05 0.00 0.00 0.00 0.00 61.98 61.72 2jxj s VAL 110 Cb -0.14 -1.02 0.01 0.00 0.00 0.00 0.00 36.38 35.22 2jxj s VAL 110 CO 0.08 0.35 0.66 -0.62 0.00 0.00 0.00 175.10 175.56 2jxj n GLU 111 N 4.05 -5.13 -2.50 2.72 -0.58 -1.26 -1.34 120.64 116.60 2jxj n GLU 111 Ca -0.21 0.90 -0.20 0.00 -0.42 0.00 0.00 57.16 57.23 2jxj n GLU 111 Cb 0.51 -5.78 -0.00 0.00 -0.57 0.00 0.00 31.44 25.61 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 -4.12 -2.22 -3.79 3.49 1.74 -1.26 -4.98 116.66 105.53 2jxj n ARG 112 Ca -0.10 0.94 -0.11 0.00 -0.77 0.00 0.00 57.85 57.80 2jxj n ARG 112 Cb 0.61 -5.56 -0.08 0.00 -1.02 0.00 0.00 32.46 26.41 2jxj n ARG 112 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2jxj s LYS 113 N -5.12 0.74 0.17 5.56 2.47 -0.45 -5.14 119.74 117.97 2jxj s LYS 113 Ca 0.06 -0.49 -0.30 0.00 -1.56 0.00 0.00 55.97 53.68 2jxj s LYS 113 Cb -0.03 0.32 -0.08 0.00 -1.46 0.00 0.00 37.83 36.58 2jxj s LYS 113 CO 0.07 -0.22 1.25 0.42 0.16 0.00 0.00 175.35 177.03 2jxj s ILE 114 N -2.32 3.49 -0.48 5.43 -1.09 -1.26 -1.03 121.20 123.94 2jxj s ILE 114 Ca -0.07 1.21 -0.23 0.00 -2.23 0.00 0.00 60.65 59.33 2jxj s ILE 114 Cb -0.02 -3.77 0.03 0.00 -1.58 0.00 0.00 42.46 37.12 2jxj s ILE 114 CO -0.02 0.17 0.80 -0.22 -1.23 0.00 0.00 174.94 174.45 2jxj s LEU 115 N 0.02 4.29 0.53 2.97 0.20 -1.25 -4.90 118.68 120.55 2jxj s LEU 115 Ca 0.55 -0.25 -0.22 0.00 0.69 0.00 0.00 54.13 54.90 2jxj s LEU 115 Cb -0.34 -2.88 -0.05 0.00 -0.43 0.00 0.00 46.19 42.49 2jxj s LEU 115 CO 0.36 -0.99 1.36 -0.67 -0.29 0.00 0.00 176.35 176.13 2jxj n ASP 116 N 6.84 2.75 -0.06 3.68 -0.08 -1.26 -4.93 116.55 123.49 2jxj n ASP 116 Ca 0.01 1.00 -0.10 0.00 -1.51 0.00 0.00 54.79 54.19 2jxj n ASP 116 Cb 0.48 -1.58 -0.03 0.00 2.34 0.00 0.00 41.12 42.33 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 -0.87 1.57 -0.02 -2.67 4.77 -1.26 -4.16 117.00 114.35 2jxj n LEU 117 Ca 0.10 0.26 -0.09 0.00 -0.03 0.00 0.00 56.01 56.25 2jxj n LEU 117 Cb 0.44 -0.59 -0.03 0.00 -2.33 0.00 0.00 43.42 40.91 2jxj n LEU 117 CO 0.54 -0.20 0.78 0.22 -1.33 0.00 0.00 177.39 177.40 2jxj h TYR 118 N -0.67 -0.29 -0.38 -1.77 5.03 -1.96 0.35 116.97 117.28 2jxj h TYR 118 Ca -0.13 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.22 2jxj h TYR 118 Cb 0.88 0.15 -0.03 0.00 1.55 0.00 0.00 36.73 39.28 2jxj h TYR 118 CO -0.22 -0.18 0.20 0.00 -1.32 0.00 0.00 178.16 176.63 2jxj h ALA 119 N 1.00 0.47 -0.59 1.82 0.00 -2.00 -2.06 119.26 117.90 2jxj h ALA 119 Ca 0.10 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2jxj h ALA 119 Cb 0.27 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2jxj h ALA 119 CO -0.24 -0.16 0.15 1.25 0.00 0.00 0.00 179.25 180.25 2jxj h LEU 120 N 0.40 0.88 -1.23 0.00 5.85 -1.61 -2.62 115.31 116.97 2jxj h LEU 120 Ca 0.16 -0.23 0.05 0.00 0.84 0.00 0.00 57.88 58.70 2jxj h LEU 120 Cb 0.05 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 2jxj h LEU 120 CO -0.10 0.88 0.54 -1.28 -0.34 0.00 0.00 178.44 178.14 2jxj h SER 121 N 0.84 0.83 -0.33 1.25 0.87 0.02 -2.15 113.55 114.89 2jxj h SER 121 Ca 0.18 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.66 2jxj h SER 121 Cb 0.33 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2jxj h SER 121 CO 0.00 0.55 -0.13 0.11 -0.53 0.00 0.00 176.83 176.83 2jxj h LYS 122 N 0.95 0.66 -0.66 2.24 1.57 -1.11 -2.98 116.57 117.24 2jxj h LYS 122 Ca 0.34 -0.28 0.03 0.00 -1.87 0.00 0.00 60.65 58.87 2jxj h LYS 122 Cb 0.15 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 2jxj h LYS 122 CO -0.11 0.86 0.42 0.82 -0.57 0.00 0.00 179.45 180.86 2jxj h ILE 123 N 0.44 1.09 -0.08 1.86 2.04 -1.06 -1.47 117.51 120.34 2jxj h ILE 123 Ca 0.08 -0.28 0.02 0.00 1.00 0.00 0.00 64.86 65.67 2jxj h ILE 123 Cb 0.65 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2jxj h ILE 123 CO 0.04 0.15 -0.03 0.58 0.00 0.00 0.00 178.15 178.89 2jxj h VAL 124 N 0.82 0.90 -0.32 1.67 2.07 -1.38 -2.34 116.25 117.67 2jxj h VAL 124 Ca 0.26 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.80 2jxj h VAL 124 Cb 0.01 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 2jxj h VAL 124 CO -0.10 0.00 0.19 0.00 0.02 0.00 0.00 177.57 177.68 2jxj h ALA 125 N 1.06 0.40 -0.02 1.67 0.00 -1.35 -1.28 119.26 119.74 2jxj h ALA 125 Ca 0.04 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2jxj h ALA 125 Cb 0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2jxj h ALA 125 CO -0.09 -0.17 0.12 0.66 0.00 0.00 0.00 179.25 179.76 2jxj h SER 126 N 0.39 0.00 0.48 0.00 4.64 -1.02 -0.66 113.55 117.37 2jxj h SER 126 Ca 0.12 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.14 2jxj h SER 126 Cb -0.01 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2jxj h SER 126 CO -0.05 0.00 -1.62 0.11 -0.87 0.00 0.00 176.83 174.39 2jxj h LYS 127 N 0.00 0.12 0.00 4.77 1.57 -0.71 -3.47 116.57 118.85 2jxj h LYS 127 Ca 0.01 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2jxj h LYS 127 Cb 0.24 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2jxj h LYS 127 CO -0.00 0.87 0.00 0.41 -0.57 0.00 0.00 179.45 180.16 2jxj n GLY 128 N 1.64 0.00 3.86 3.86 0.00 -0.27 -4.65 105.19 109.62 2jxj n GLY 128 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 2.00 0.27 -0.02 0.00 -1.07 -3.70 105.19 102.67 2jxj n GLY 129 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.80 0.04 1.61 -0.00 -1.26 -3.99 117.46 112.06 2jxj n PHE 130 Ca 0.00 0.13 0.14 0.00 -0.00 0.00 0.00 57.45 57.72 2jxj n PHE 130 Cb 0.00 0.61 0.60 0.00 -0.00 0.00 0.00 39.48 40.69 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 0.15 -0.60 -4.13 5.08 -1.95 -0.75 114.58 112.38 2jxj h GLU 131 Ca 0.00 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2jxj h GLU 131 Cb 0.00 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 2jxj h GLU 131 CO 0.00 0.10 0.13 0.52 -1.00 0.00 0.00 179.01 178.76 2jxj h MET 132 N 0.16 0.96 -0.37 2.33 2.86 -1.88 0.12 114.93 119.11 2jxj h MET 132 Ca 0.19 -0.22 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 2jxj h MET 132 Cb 0.56 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 2jxj h MET 132 CO -0.03 0.87 -0.05 0.28 1.06 0.00 0.00 176.91 179.03 2jxj h VAL 133 N 0.91 1.27 -0.30 -2.22 2.07 -1.41 -2.07 116.25 114.50 2jxj h VAL 133 Ca 0.19 -1.10 -0.13 0.00 0.82 0.00 0.00 66.70 66.49 2jxj h VAL 133 Cb 0.36 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 2jxj h VAL 133 CO 0.00 0.36 -0.31 0.74 0.02 0.00 0.00 177.57 178.39 2jxj h THR 134 N 0.49 1.30 -0.06 2.57 2.02 -1.30 0.72 112.91 118.65 2jxj h THR 134 Ca 0.10 -1.48 -0.02 0.00 0.77 0.00 0.00 66.41 65.78 2jxj h THR 134 Cb 0.55 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 2jxj h THR 134 CO 0.03 0.48 -0.05 0.11 0.37 0.00 0.00 175.52 176.45 2jxj h LYS 135 N 0.49 0.08 -0.02 6.66 1.79 -0.74 -2.04 116.57 122.79 2jxj h LYS 135 Ca 0.05 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2jxj h LYS 135 Cb 0.88 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.52 2jxj h LYS 135 CO 0.08 0.15 -0.31 0.39 -1.08 0.00 0.00 179.45 178.67 2jxj n GLU 136 N -4.43 1.55 -3.07 3.15 1.02 -0.78 -4.98 120.64 113.11 2jxj n GLU 136 Ca -0.02 -1.02 -0.21 0.00 -0.02 0.00 0.00 57.16 55.89 2jxj n GLU 136 Cb 0.16 -1.35 0.04 0.00 -0.02 0.00 0.00 31.44 30.27 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 0.14 -5.11 0.00 3.49 4.81 0.20 -4.87 118.16 116.81 2jxj n LYS 137 Ca 0.08 0.83 0.12 0.00 -0.87 0.00 0.00 58.31 58.47 2jxj n LYS 137 Cb 0.40 -5.58 0.51 0.00 0.02 0.00 0.00 35.03 30.38 2jxj n LYS 137 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2jxj n LYS 138 N -3.96 0.01 -0.23 1.64 4.76 0.18 -3.52 118.16 117.04 2jxj n LYS 138 Ca -0.08 0.09 0.14 0.00 -2.87 0.00 0.00 58.31 55.58 2jxj n LYS 138 Cb 0.60 -1.50 0.43 0.00 -1.84 0.00 0.00 35.03 32.72 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 0.00 0.68 -0.17 2.13 4.06 -1.90 0.12 115.95 120.87 2jxj h TRP 139 Ca 0.00 0.02 -0.08 0.00 2.06 0.00 0.00 58.89 60.89 2jxj h TRP 139 Cb 0.41 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.34 2jxj h TRP 139 CO 0.00 0.25 -0.27 0.77 -3.56 0.00 0.00 178.44 175.63 2jxj h SER 140 N 0.57 0.32 0.40 -3.49 0.02 -1.89 -2.68 113.55 106.80 2jxj h SER 140 Ca 0.42 -0.10 -0.14 0.00 -0.84 0.00 0.00 61.79 61.13 2jxj h SER 140 Cb 0.80 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 2jxj h SER 140 CO -0.17 0.59 -0.60 0.11 -1.14 0.00 0.00 176.83 175.61 2jxj h LYS 141 N 0.29 0.20 -0.28 3.45 1.79 -1.01 -3.05 116.57 117.97 2jxj h LYS 141 Ca 0.04 -0.14 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 2jxj h LYS 141 Cb 0.63 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 2jxj h LYS 141 CO 0.05 0.74 0.14 0.28 -1.08 0.00 0.00 179.45 179.58 2jxj h VAL 142 N 0.15 1.13 -0.56 0.50 2.07 -1.04 -2.28 116.25 116.22 2jxj h VAL 142 Ca -0.01 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 2jxj h VAL 142 Cb 1.10 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 2jxj h VAL 142 CO 0.09 0.13 0.29 1.23 0.02 0.00 0.00 177.57 179.34 2jxj h GLY 143 N 0.32 0.85 0.92 2.17 0.00 -1.53 -1.06 103.07 104.75 2jxj h GLY 143 Ca 0.10 -0.40 0.03 0.00 0.00 0.00 0.00 47.33 47.05 2jxj h GLY 143 CO -0.01 0.39 0.65 1.76 0.00 0.00 0.00 176.54 179.32 2jxj h SER 144 N 0.76 1.09 0.25 0.19 0.02 -1.42 -0.29 113.55 114.16 2jxj h SER 144 Ca 0.20 -0.01 -0.16 0.00 -0.84 0.00 0.00 61.79 60.98 2jxj h SER 144 Cb 0.08 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2jxj h SER 144 CO -0.03 0.76 -0.61 0.03 -1.14 0.00 0.00 176.83 175.84 2jxj h ARG 145 N 1.27 0.35 0.00 3.45 3.08 -1.09 -3.04 114.38 118.40 2jxj h ARG 145 Ca 0.39 -0.24 -0.09 0.00 0.07 0.00 0.00 59.98 60.10 2jxj h ARG 145 Cb -0.03 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2jxj h ARG 145 CO -0.11 0.85 -0.43 1.25 -1.07 0.00 0.00 179.97 180.46 2jxj h LEU 146 N 0.26 0.00 0.00 3.04 6.46 -0.43 -3.47 115.31 121.18 2jxj h LEU 146 Ca -0.01 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 2jxj h LEU 146 Cb 1.14 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.07 2jxj h LEU 146 CO 0.10 0.43 0.00 0.61 -0.62 0.00 0.00 178.44 178.96 2jxj n GLY 147 N -0.21 1.73 3.68 3.75 0.00 -0.53 -5.10 105.19 108.51 2jxj n GLY 147 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.00 3.31 0.59 1.61 2.02 -0.23 -5.00 117.35 117.64 2jxj s TYR 148 Ca 0.00 1.40 -0.19 0.00 -0.37 0.00 0.00 57.07 57.91 2jxj s TYR 148 Cb 0.00 -3.30 -0.04 0.00 -0.40 0.00 0.00 41.96 38.21 2jxj s TYR 148 CO 0.00 -0.73 1.10 1.28 -1.57 0.00 0.00 175.55 175.63 2jxj n LEU 149 N 5.63 4.40 -4.75 -1.29 4.77 -1.26 -4.53 117.00 119.98 2jxj n LEU 149 Ca 0.11 0.85 -0.41 0.00 -0.03 0.00 0.00 56.01 56.53 2jxj n LEU 149 Cb 0.47 -1.45 -0.03 0.00 -2.33 0.00 0.00 43.42 40.08 2jxj n LEU 149 CO 0.53 -1.46 0.97 -2.16 -1.33 0.00 0.00 177.39 173.94 2jxj s PRO 150 N -2.86 4.40 0.00 3.23 0.04 -1.26 -4.96 135.00 133.59 2jxj s PRO 150 Ca 0.76 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.89 2jxj s PRO 150 Cb -0.42 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 30.97 2jxj s PRO 150 CO 0.46 -0.20 0.00 0.41 0.04 0.00 0.00 177.00 177.72 2jxj n GLY 151 N 1.81 -1.27 3.81 0.56 0.00 -1.26 -5.15 105.19 103.67 2jxj n GLY 151 Ca 0.04 -0.96 -0.32 0.00 0.00 0.00 0.00 46.02 44.78 2jxj n GLY 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jxj s LYS 152 N -0.76 3.27 7.96 1.61 3.01 -1.26 -4.76 119.74 128.81 2jxj s LYS 152 Ca 0.00 1.17 0.00 0.00 -1.01 0.00 0.00 55.97 56.13 2jxj s LYS 152 Cb 0.00 -2.03 0.00 0.00 -1.01 0.00 0.00 37.83 34.79 2jxj s LYS 152 CO 0.00 -0.85 0.00 0.41 0.51 0.00 0.00 175.35 175.42 2jxj n GLY 153 N -1.12 4.00 5.00 -3.33 0.00 -1.26 -4.84 105.19 103.64 2jxj n GLY 153 Ca 0.09 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 0.00 0.00 -0.08 2.61 -1.04 -1.26 -3.86 114.28 110.64 2jxj n THR 154 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 2jxj n THR 154 Cb 0.00 0.00 0.24 0.00 -1.82 0.00 0.00 70.33 68.75 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 0.77 1.09 3.41 0.00 -1.88 -0.91 103.07 105.55 2jxj h GLY 155 Ca 0.00 -0.43 -0.12 0.00 0.00 0.00 0.00 47.33 46.78 2jxj h GLY 155 CO 0.00 0.41 -0.12 1.76 0.00 0.00 0.00 176.54 178.59 2jxj h SER 156 N 0.70 1.01 -0.07 0.19 0.02 -1.95 -2.48 113.55 110.97 2jxj h SER 156 Ca 0.16 -0.36 -0.15 0.00 -0.84 0.00 0.00 61.79 60.59 2jxj h SER 156 Cb 0.27 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2jxj h SER 156 CO -0.00 1.14 -0.48 -0.07 -1.14 0.00 0.00 176.83 176.28 2jxj h LEU 157 N 0.88 0.68 -1.01 5.07 4.07 -1.80 -2.80 115.31 120.40 2jxj h LEU 157 Ca 0.13 -0.34 -0.04 0.00 0.08 0.00 0.00 57.88 57.72 2jxj h LEU 157 Cb 0.69 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 42.21 2jxj h LEU 157 CO 0.05 1.05 0.27 -0.07 -1.08 0.00 0.00 178.44 178.66 2jxj h LEU 158 N 0.50 0.90 -0.43 1.67 3.38 -1.05 -0.35 115.31 119.92 2jxj h LEU 158 Ca 0.03 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 2jxj h LEU 158 Cb 1.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2jxj h LEU 158 CO 0.10 0.80 -0.13 0.50 0.09 0.00 0.00 178.44 179.79 2jxj h LYS 159 N 0.96 0.85 -0.23 1.13 3.11 -1.35 -0.38 116.57 120.66 2jxj h LYS 159 Ca 0.23 -0.34 -0.05 0.00 -2.81 0.00 0.00 60.65 57.68 2jxj h LYS 159 Cb 0.18 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.36 2jxj h LYS 159 CO -0.02 0.97 -0.04 0.77 -2.81 0.00 0.00 179.45 178.32 2jxj h SER 160 N 0.67 0.43 -0.18 4.20 0.02 -1.22 -1.33 113.55 116.15 2jxj h SER 160 Ca 0.10 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.69 2jxj h SER 160 Cb 0.68 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 2jxj h SER 160 CO 0.05 0.68 0.05 0.45 -1.14 0.00 0.00 176.83 176.92 2jxj h HIS 161 N 0.18 0.29 -0.84 3.45 3.86 -1.05 -2.84 115.15 118.19 2jxj h HIS 161 Ca 0.06 -0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.26 2jxj h HIS 161 Cb 0.48 -0.08 -0.05 0.00 1.06 0.00 0.00 27.41 28.82 2jxj h HIS 161 CO 0.05 0.38 0.55 -0.92 0.86 0.00 0.00 177.93 178.84 2jxj h TYR 162 N 0.11 1.03 -0.99 2.45 3.20 -1.07 -2.35 116.97 119.35 2jxj h TYR 162 Ca 0.06 0.03 -0.53 0.00 3.14 0.00 0.00 58.73 61.42 2jxj h TYR 162 Cb 0.23 -0.34 -0.21 0.00 1.54 0.00 0.00 36.73 37.95 2jxj h TYR 162 CO 0.00 0.62 0.64 -1.91 -1.64 0.00 0.00 178.16 175.87 2jxj n GLU 163 N -4.54 2.34 0.00 1.82 2.13 -0.51 -0.29 120.64 121.60 2jxj n GLU 163 Ca 0.10 -2.53 0.00 0.00 0.66 0.00 0.00 57.16 55.39 2jxj n GLU 163 Cb 0.05 -2.03 0.00 0.00 0.27 0.00 0.00 31.44 29.74 2jxj n GLU 163 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2jxj n ARG 164 N -0.02 0.00 0.00 5.31 0.63 -0.89 -4.84 116.66 116.85 2jxj n ARG 164 Ca 0.47 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.40 2jxj n ARG 164 Cb 0.54 -0.61 0.00 0.00 0.45 0.00 0.00 32.46 32.84 2jxj n ARG 164 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 2jxj n ILE 165 N -2.20 0.00 0.21 5.15 -0.00 -1.23 -4.75 119.36 116.54 2jxj n ILE 165 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 62.75 62.67 2jxj n ILE 165 Cb 0.25 -0.44 -0.04 0.00 -0.00 0.00 0.00 39.64 39.41 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 -0.45 0.14 1.39 6.46 -1.75 -2.23 115.31 118.86 2jxj h LEU 166 Ca 0.00 0.02 0.02 0.00 -0.12 0.00 0.00 57.88 57.79 2jxj h LEU 166 Cb 0.29 0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.31 2jxj h LEU 166 CO 0.00 -0.29 -0.29 0.22 -0.62 0.00 0.00 178.44 177.46 2jxj h TYR 167 N -0.61 -0.78 -0.29 1.25 3.20 -0.97 -2.02 116.97 116.74 2jxj h TYR 167 Ca -0.05 0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.92 2jxj h TYR 167 Cb 0.41 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.00 2jxj h TYR 167 CO 0.10 -0.40 0.32 -1.00 -1.64 0.00 0.00 178.16 175.55 2jxj h PRO 168 N -0.52 0.00 0.11 1.82 0.13 -1.78 -2.27 132.00 129.49 2jxj h PRO 168 Ca 0.03 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.17 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 -0.15 0.00 -0.19 -0.92 -0.23 0.00 0.00 178.00 176.51 2jxj h TYR 169 N 0.00 -0.49 -0.14 1.56 3.20 -0.71 -0.24 116.97 120.14 2jxj h TYR 169 Ca 0.14 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.05 2jxj h TYR 169 Cb 0.78 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 39.22 2jxj h TYR 169 CO 0.00 -0.27 -0.05 0.93 -1.64 0.00 0.00 178.16 177.13 2jxj h GLU 170 N -0.36 -0.02 -0.93 1.82 4.39 -1.47 -2.05 114.58 115.96 2jxj h GLU 170 Ca 0.02 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.82 2jxj h GLU 170 Cb 0.38 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.96 2jxj h GLU 170 CO -0.10 -0.01 0.60 -0.07 -1.16 0.00 0.00 179.01 178.27 2jxj h LEU 171 N -0.02 0.85 -1.24 1.33 3.38 -1.51 0.41 115.31 118.52 2jxj h LEU 171 Ca 0.07 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.10 2jxj h LEU 171 Cb 0.13 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 2jxj h LEU 171 CO -0.16 0.50 0.53 0.15 0.09 0.00 0.00 178.44 179.55 2jxj h PHE 172 N 0.94 0.95 0.14 1.13 3.04 -0.32 0.98 116.94 123.80 2jxj h PHE 172 Ca 0.43 0.02 -0.29 0.00 3.98 0.00 0.00 57.97 62.11 2jxj h PHE 172 Cb 0.39 -0.32 0.00 0.00 2.56 0.00 0.00 35.95 38.58 2jxj h PHE 172 CO -0.00 0.55 -1.45 1.96 -2.02 0.00 0.00 178.31 177.34 2jxj h GLN 173 N 0.98 0.30 -1.01 1.11 4.20 -0.91 -3.34 115.11 116.44 2jxj h GLN 173 Ca 0.32 -0.51 -0.48 0.00 0.06 0.00 0.00 58.65 58.04 2jxj h GLN 173 Cb 0.05 0.19 -0.27 0.00 0.30 0.00 0.00 27.48 27.75 2jxj h GLN 173 CO -0.10 1.24 0.60 0.43 -0.67 0.00 0.00 178.83 180.34 2jxj n SER 174 N -3.85 4.05 0.00 1.46 7.64 0.13 -5.12 113.62 117.93 2jxj n SER 174 Ca -0.24 -3.45 0.00 0.00 1.01 0.00 0.00 58.87 56.20 2jxj n SER 174 Cb 0.95 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 2jxj n SER 174 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64