#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxp n GLY 2 N 0.00 -0.63 3.87 3.17 0.00 -1.26 -5.17 105.19 105.17 2jxp n GLY 2 Ca 0.00 0.12 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 2jxp n GLY 2 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jxp s PHE 3 N 0.00 3.58 -0.26 1.61 0.08 -1.26 -5.01 117.98 116.73 2jxp s PHE 3 Ca 0.00 0.51 0.16 0.00 0.12 0.00 0.00 56.93 57.72 2jxp s PHE 3 Cb 0.00 -1.95 0.52 0.00 -0.57 0.00 0.00 43.02 41.02 2jxp s PHE 3 CO 0.00 0.71 1.42 1.63 -0.10 0.00 0.00 175.22 178.88 2jxp n LYS 4 N 2.08 2.99 -1.68 0.44 4.01 -1.26 -5.04 118.16 119.70 2jxp n LYS 4 Ca -0.20 -2.78 -0.45 0.00 -0.51 0.00 0.00 58.31 54.38 2jxp n LYS 4 Cb 0.55 -1.80 -0.04 0.00 -0.51 0.00 0.00 35.03 33.23 2jxp n LYS 4 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2jxp n LEU 5 N -0.36 3.56 -4.59 -0.35 7.99 -1.26 -4.92 117.00 117.07 2jxp n LEU 5 Ca 0.21 1.03 -0.42 0.00 -0.01 0.00 0.00 56.01 56.81 2jxp n LEU 5 Cb 0.86 -1.47 -0.02 0.00 -0.11 0.00 0.00 43.42 42.67 2jxp n LEU 5 CO 0.15 -0.04 1.31 -0.60 -1.51 0.00 0.00 177.39 176.69 2jxp s ARG 6 N 2.18 3.42 -0.02 3.23 6.06 -1.26 -4.92 118.95 127.64 2jxp s ARG 6 Ca 0.82 0.87 -0.26 0.00 -2.50 0.00 0.00 55.73 54.67 2jxp s ARG 6 Cb -0.60 -4.10 -0.20 0.00 0.06 0.00 0.00 34.95 30.12 2jxp s ARG 6 CO 0.40 -1.77 1.27 0.78 -2.50 0.00 0.00 175.30 173.48 2jxp h GLY 7 N 12.88 -0.04 -4.48 8.12 0.00 -2.03 -3.43 103.07 114.10 2jxp h GLY 7 Ca -0.28 0.01 -0.54 0.00 0.00 0.00 0.00 47.33 46.52 2jxp h GLY 7 CO 1.11 -0.01 0.46 -0.86 0.00 0.00 0.00 176.54 177.24 2jxp s GLN 8 N -4.34 4.50 0.35 4.80 -2.07 -1.26 -4.94 119.66 116.70 2jxp s GLN 8 Ca -0.16 1.54 0.07 0.00 -1.82 0.00 0.00 55.36 54.99 2jxp s GLN 8 Cb 0.02 -3.44 0.75 0.00 -1.09 0.00 0.00 33.01 29.26 2jxp s GLN 8 CO 0.66 -0.16 1.91 -0.24 -1.32 0.00 0.00 175.29 176.14 2jxp h VAL 9 N 4.75 0.94 -2.08 3.63 3.04 -1.95 -3.45 116.25 121.12 2jxp h VAL 9 Ca -0.40 -0.26 0.23 0.00 -1.01 0.00 0.00 66.70 65.26 2jxp h VAL 9 Cb 1.21 0.12 -0.09 0.00 -2.01 0.00 0.00 31.29 30.52 2jxp h VAL 9 CO 0.78 0.14 0.62 -0.55 -1.01 0.00 0.00 177.57 177.56 2jxp s SER 10 N -5.98 -0.11 0.14 3.17 0.15 -1.26 -5.11 113.70 104.70 2jxp s SER 10 Ca -0.10 -0.35 -0.12 0.00 0.70 0.00 0.00 55.95 56.07 2jxp s SER 10 Cb 0.21 0.37 0.01 0.00 -1.71 0.00 0.00 66.02 64.90 2jxp s SER 10 CO 0.78 -0.70 0.33 -1.83 1.20 0.00 0.00 173.24 173.02 2jxp s GLU 11 N -2.81 1.08 -0.12 5.44 -1.05 -1.26 -4.91 118.70 115.07 2jxp s GLU 11 Ca 0.15 -0.93 -0.11 0.00 -0.15 0.00 0.00 54.97 53.93 2jxp s GLU 11 Cb 0.00 0.42 0.03 0.00 -0.44 0.00 0.00 34.13 34.14 2jxp s GLU 11 CO 0.01 -0.41 0.32 -0.48 0.95 0.00 0.00 175.26 175.65 2jxp s LEU 12 N -2.88 0.75 0.00 1.83 0.05 -1.26 -4.09 118.68 113.08 2jxp s LEU 12 Ca 0.08 0.65 0.00 0.00 0.05 0.00 0.00 54.13 54.92 2jxp s LEU 12 Cb 0.03 1.11 0.00 0.00 -2.05 0.00 0.00 46.19 45.27 2jxp s LEU 12 CO -0.07 -0.11 0.54 -2.65 -0.55 0.00 0.00 176.35 173.50 2jxp n PRO 13 N 2.95 0.76 -3.96 1.48 -0.02 -1.26 -4.81 135.00 130.14 2jxp n PRO 13 Ca -0.13 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.18 2jxp n PRO 13 Cb 0.58 -1.23 -0.06 0.00 -0.02 0.00 0.00 33.50 32.77 2jxp n PRO 13 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2jxp n PHE 14 N -0.13 -0.79 0.06 6.00 1.16 -1.26 -5.10 117.46 117.39 2jxp n PHE 14 Ca 0.00 -2.46 0.00 0.00 -1.87 0.00 0.00 57.45 53.12 2jxp n PHE 14 Cb 0.11 0.29 0.00 0.00 -1.61 0.00 0.00 39.48 38.27 2jxp n PHE 14 CO 0.00 0.00 0.00 -0.85 -1.87 0.00 0.00 176.76 174.04 2jxp n GLU 15 N -0.56 0.00 -2.49 3.97 0.28 -1.26 -4.43 120.64 116.14 2jxp n GLU 15 Ca 0.06 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.64 2jxp n GLU 15 Cb 0.54 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.39 2jxp n GLU 15 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2jxp s ARG 16 N -2.00 3.59 -0.11 3.44 1.81 -1.26 0.28 118.95 124.71 2jxp s ARG 16 Ca 0.00 0.61 0.03 0.00 -1.72 0.00 0.00 55.73 54.66 2jxp s ARG 16 Cb 0.00 -3.99 0.00 0.00 -0.45 0.00 0.00 34.95 30.51 2jxp s ARG 16 CO 0.00 -1.56 -0.23 0.14 -0.68 0.00 0.00 175.30 172.97 2jxp s VAL 17 N 5.04 2.10 -0.39 3.52 -7.23 -0.88 -0.46 120.40 122.11 2jxp s VAL 17 Ca 0.52 -0.99 -0.17 0.00 -1.81 0.00 0.00 61.98 59.53 2jxp s VAL 17 Cb -0.10 -1.81 0.01 0.00 0.56 0.00 0.00 36.38 35.04 2jxp s VAL 17 CO 0.30 0.56 0.41 -0.47 -0.31 0.00 0.00 175.10 175.59 2jxp s TYR 18 N 0.46 3.19 -0.06 2.82 5.04 -0.43 -0.80 117.35 127.56 2jxp s TYR 18 Ca -0.16 -0.20 -0.05 0.00 -2.44 0.00 0.00 57.07 54.23 2jxp s TYR 18 Cb -0.17 -2.81 -0.04 0.00 0.35 0.00 0.00 41.96 39.29 2jxp s TYR 18 CO 0.06 -0.59 0.16 -1.50 -1.34 0.00 0.00 175.55 172.34 2jxp s ILE 19 N 2.11 5.44 -0.25 3.14 2.07 -1.26 -0.10 121.20 132.35 2jxp s ILE 19 Ca 0.12 0.00 -0.03 0.00 -1.41 0.00 0.00 60.65 59.34 2jxp s ILE 19 Cb -0.17 -3.46 0.10 0.00 0.13 0.00 0.00 42.46 39.07 2jxp s ILE 19 CO 0.13 0.46 0.21 0.28 -1.91 0.00 0.00 174.94 174.11 2jxp s THR 20 N -1.18 -0.26 -0.46 4.00 -1.32 -0.75 -4.95 115.64 110.73 2jxp s THR 20 Ca 0.21 -0.39 -0.23 0.00 -1.21 0.00 0.00 61.69 60.08 2jxp s THR 20 Cb -0.12 -0.83 0.03 0.00 -1.51 0.00 0.00 72.50 70.06 2jxp s THR 20 CO 0.12 -0.42 0.77 0.00 -2.21 0.00 0.00 174.62 172.88 2jxp s ALA 21 N 2.26 3.29 -2.00 11.08 0.00 -1.26 -3.58 121.76 131.55 2jxp s ALA 21 Ca 0.08 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 51.01 2jxp s ALA 21 Cb -0.15 -3.46 0.24 0.00 0.00 0.00 0.00 23.12 19.74 2jxp s ALA 21 CO -0.24 -1.94 0.63 -0.35 0.00 0.00 0.00 175.76 173.86 2jxp n PRO 22 N 6.69 0.37 -0.57 0.00 -0.04 -1.26 -2.06 135.00 138.14 2jxp n PRO 22 Ca 0.02 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2jxp n PRO 22 Cb 0.48 -1.17 -0.00 0.00 -0.04 0.00 0.00 33.50 32.77 2jxp n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jxp n ALA 23 N -0.67 2.11 -3.37 0.55 0.00 -1.26 -5.04 120.51 112.83 2jxp n ALA 23 Ca 0.03 -0.55 -0.13 0.00 0.00 0.00 0.00 53.44 52.79 2jxp n ALA 23 Cb 0.01 -0.25 0.01 0.00 0.00 0.00 0.00 19.45 19.22 2jxp n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jxp n GLY 24 N 0.02 -1.21 3.85 0.00 0.00 -0.87 -4.97 105.19 102.00 2jxp n GLY 24 Ca -0.01 0.51 -0.38 0.00 0.00 0.00 0.00 46.02 46.14 2jxp n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jxp s LEU 25 N -4.79 4.46 0.14 0.99 1.43 -1.26 -5.01 118.68 114.64 2jxp s LEU 25 Ca 0.12 0.87 -0.25 0.00 -1.03 0.00 0.00 54.13 53.84 2jxp s LEU 25 Cb -0.03 -2.50 -0.01 0.00 0.03 0.00 0.00 46.19 43.67 2jxp s LEU 25 CO 0.81 0.34 1.62 0.71 0.23 0.00 0.00 176.35 180.05 2jxp h THR 26 N 3.74 0.33 -1.28 5.49 1.35 -1.99 -0.98 112.91 119.56 2jxp h THR 26 Ca -0.52 0.00 0.40 0.00 -0.55 0.00 0.00 66.41 65.74 2jxp h THR 26 Cb 1.22 0.33 -0.12 0.00 -1.73 0.00 0.00 68.15 67.85 2jxp h THR 26 CO 0.61 0.00 0.84 -0.29 -0.25 0.00 0.00 175.52 176.42 2jxp h ILE 27 N -0.36 0.20 0.07 6.82 6.09 -1.96 0.13 117.51 128.51 2jxp h ILE 27 Ca 0.10 -0.05 -0.12 0.00 -1.37 0.00 0.00 64.86 63.42 2jxp h ILE 27 Cb 0.52 0.06 0.01 0.00 0.47 0.00 0.00 36.82 37.88 2jxp h ILE 27 CO -0.34 0.02 -0.52 1.23 -3.07 0.00 0.00 178.15 175.47 2jxp h GLY 28 N 0.14 0.25 1.06 8.18 0.00 -1.63 -2.61 103.07 108.47 2jxp h GLY 28 Ca 0.77 -0.58 -0.06 0.00 0.00 0.00 0.00 47.33 47.45 2jxp h GLY 28 CO -0.37 0.51 0.22 0.23 0.00 0.00 0.00 176.54 177.14 2jxp h SER 29 N -0.51 1.10 -0.50 0.19 0.87 -0.01 -1.15 113.55 113.53 2jxp h SER 29 Ca -0.09 -0.22 -0.12 0.00 -1.23 0.00 0.00 61.79 60.14 2jxp h SER 29 Cb 1.37 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 63.02 2jxp h SER 29 CO 0.10 1.02 -0.14 0.44 -0.53 0.00 0.00 176.83 177.72 2jxp h ASP 30 N 1.11 1.00 -0.76 6.23 5.19 -0.99 -3.12 116.42 125.09 2jxp h ASP 30 Ca 0.24 -0.34 0.05 0.00 -0.62 0.00 0.00 57.03 56.36 2jxp h ASP 30 Cb 0.33 -0.27 -0.06 0.00 0.18 0.00 0.00 39.33 39.51 2jxp h ASP 30 CO -0.01 1.13 0.46 0.25 -3.12 0.00 0.00 179.24 177.95 2jxp h LEU 31 N 0.88 0.71 -0.92 1.55 5.85 -1.01 -1.15 115.31 121.23 2jxp h LEU 31 Ca 0.13 0.02 0.22 0.00 0.84 0.00 0.00 57.88 59.09 2jxp h LEU 31 Cb 0.70 -0.13 -0.12 0.00 0.37 0.00 0.00 40.66 41.48 2jxp h LEU 31 CO 0.05 0.46 0.45 -0.33 -0.34 0.00 0.00 178.44 178.73 2jxp h GLU 32 N 0.85 0.46 0.01 1.25 5.08 -1.16 -0.43 114.58 120.64 2jxp h GLU 32 Ca 0.33 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2jxp h GLU 32 Cb 0.14 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2jxp h GLU 32 CO -0.16 0.30 -0.01 0.00 -1.00 0.00 0.00 179.01 178.14 2jxp h ARG 33 N 0.47 -0.02 -0.48 2.33 3.08 -1.33 -2.80 114.38 115.62 2jxp h ARG 33 Ca 0.57 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.68 2jxp h ARG 33 Cb 1.05 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.05 2jxp h ARG 33 CO -0.50 0.65 0.18 0.28 -1.07 0.00 0.00 179.97 179.52 2jxp h VAL 34 N -0.72 0.85 0.62 2.04 2.07 -0.70 -0.60 116.25 119.81 2jxp h VAL 34 Ca -0.00 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 2jxp h VAL 34 Cb 0.68 0.46 0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2jxp h VAL 34 CO 0.00 0.07 -0.30 0.40 0.02 0.00 0.00 177.57 177.76 2jxp h ILE 35 N 0.36 0.33 -0.07 4.57 1.08 -1.22 -0.61 117.51 121.96 2jxp h ILE 35 Ca 0.23 -0.19 0.02 0.00 -0.39 0.00 0.00 64.86 64.53 2jxp h ILE 35 Cb 0.23 0.40 -0.00 0.00 -3.07 0.00 0.00 36.82 34.37 2jxp h ILE 35 CO -0.22 0.02 0.06 -1.28 -0.69 0.00 0.00 178.15 176.04 2jxp h SER 36 N -0.96 0.00 0.01 1.72 0.87 -1.24 -1.61 113.55 112.34 2jxp h SER 36 Ca -0.08 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.13 2jxp h SER 36 Cb 0.68 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.59 2jxp h SER 36 CO 0.14 0.00 -1.87 0.35 -0.53 0.00 0.00 176.83 174.92 2jxp n THR 37 N -4.21 1.54 0.10 2.23 -2.24 -0.26 -4.66 114.28 106.78 2jxp n THR 37 Ca -0.01 -0.22 -0.18 0.00 -2.27 0.00 0.00 64.05 61.37 2jxp n THR 37 Cb 0.16 -1.94 -0.12 0.00 -2.10 0.00 0.00 70.33 66.33 2jxp n THR 37 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2jxp h HIS 38 N -0.93 0.69 -1.41 4.78 -0.00 -1.06 -3.46 115.15 113.76 2jxp h HIS 38 Ca -0.51 -0.46 -0.47 0.00 -0.00 0.00 0.00 60.37 58.93 2jxp h HIS 38 Cb 1.48 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 28.84 2jxp h HIS 38 CO 0.02 1.33 -0.32 0.95 -0.00 0.00 0.00 177.93 179.91 2jxp s THR 39 N -2.84 2.71 0.06 2.45 -4.23 -0.61 -4.93 115.64 108.25 2jxp s THR 39 Ca -0.06 -1.21 0.30 0.00 -1.18 0.00 0.00 61.69 59.54 2jxp s THR 39 Cb 0.07 -2.92 0.34 0.00 1.34 0.00 0.00 72.50 71.33 2jxp s THR 39 CO 0.90 0.00 1.90 -0.09 -0.54 0.00 0.00 174.62 176.79 2jxp h ARG 40 N 0.83 0.00 -7.10 3.99 9.65 -1.90 -3.43 114.38 116.42 2jxp h ARG 40 Ca -0.40 0.00 -0.50 0.00 -1.10 0.00 0.00 59.98 57.98 2jxp h ARG 40 Cb 1.27 0.00 0.07 0.00 -1.39 0.00 0.00 29.97 29.93 2jxp h ARG 40 CO 0.52 0.07 0.42 0.00 2.80 0.00 0.00 179.97 183.78 2jxp s ALA 41 N -3.62 2.69 -0.05 2.80 0.00 -1.26 -4.90 121.76 117.42 2jxp s ALA 41 Ca 0.01 0.78 0.04 0.00 0.00 0.00 0.00 51.96 52.79 2jxp s ALA 41 Cb 0.09 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2jxp s ALA 41 CO 0.58 -0.78 -0.15 0.21 0.00 0.00 0.00 175.76 175.62 2jxp s LYS 42 N -3.36 1.69 0.24 0.00 2.47 0.14 -4.01 119.74 116.91 2jxp s LYS 42 Ca 0.72 -0.53 -0.30 0.00 -1.56 0.00 0.00 55.97 54.30 2jxp s LYS 42 Cb -0.23 -1.45 -0.09 0.00 -1.46 0.00 0.00 37.83 34.60 2jxp s LYS 42 CO 0.28 0.17 1.14 0.08 0.16 0.00 0.00 175.35 177.18 2jxp s VAL 43 N 0.21 3.52 -0.01 4.02 1.01 -1.26 -2.07 120.40 125.82 2jxp s VAL 43 Ca -0.07 1.41 0.02 0.00 0.00 0.00 0.00 61.98 63.35 2jxp s VAL 43 Cb -0.12 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 2jxp s VAL 43 CO 0.03 0.29 -0.05 0.68 0.00 0.00 0.00 175.10 176.05 2jxp s VAL 44 N -0.70 3.82 -0.85 2.92 -7.23 0.02 -4.87 120.40 113.52 2jxp s VAL 44 Ca 0.48 -0.66 0.25 0.00 -1.81 0.00 0.00 61.98 60.24 2jxp s VAL 44 Cb -0.32 -2.66 0.24 0.00 0.56 0.00 0.00 36.38 34.20 2jxp s VAL 44 CO 0.40 0.43 1.78 -3.20 -0.31 0.00 0.00 175.10 174.19 2jxp n ASN 45 N 1.63 0.35 -3.82 4.85 2.85 -1.26 -4.20 115.26 115.67 2jxp n ASN 45 Ca -0.16 0.55 -0.12 0.00 -0.11 0.00 0.00 54.58 54.74 2jxp n ASN 45 Cb 0.53 -0.64 -0.10 0.00 1.24 0.00 0.00 39.78 40.81 2jxp n ASN 45 CO 0.00 0.00 0.00 -1.59 -2.11 0.00 0.00 177.26 173.56 2jxp s LYS 46 N -3.07 0.44 -0.01 1.20 0.00 -1.26 -5.02 119.74 112.02 2jxp s LYS 46 Ca 0.11 -0.08 0.02 0.00 0.00 0.00 0.00 55.97 56.01 2jxp s LYS 46 Cb 0.14 0.20 0.07 0.00 0.00 0.00 0.00 37.83 38.24 2jxp s LYS 46 CO 0.49 -0.10 0.78 0.00 0.00 0.00 0.00 175.35 176.53 2jxp n ALA 47 N 1.98 2.57 0.47 0.59 0.00 -1.26 -3.70 120.51 121.16 2jxp n ALA 47 Ca -0.19 -0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.22 2jxp n ALA 47 Cb 0.57 -1.01 0.47 0.00 0.00 0.00 0.00 19.45 19.48 2jxp n ALA 47 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2jxp n GLU 48 N -0.08 0.22 -3.30 0.00 0.28 -1.26 -4.45 120.64 112.04 2jxp n GLU 48 Ca 0.02 0.36 -0.10 0.00 -0.16 0.00 0.00 57.16 57.28 2jxp n GLU 48 Cb 0.23 -1.85 -0.05 0.00 1.43 0.00 0.00 31.44 31.19 2jxp n GLU 48 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 2jxp s LYS 49 N -3.25 0.61 -0.28 3.44 2.20 -1.24 -5.14 119.74 116.07 2jxp s LYS 49 Ca 0.06 -0.39 -0.21 0.00 -0.36 0.00 0.00 55.97 55.07 2jxp s LYS 49 Cb 0.10 -0.39 0.13 0.00 -1.51 0.00 0.00 37.83 36.16 2jxp s LYS 49 CO 0.46 -1.14 0.98 -1.54 -0.36 0.00 0.00 175.35 173.74 2jxp s SER 50 N 1.90 -0.52 0.12 1.43 1.04 -1.26 -4.78 113.70 111.64 2jxp s SER 50 Ca 0.14 0.91 -0.01 0.00 0.48 0.00 0.00 55.95 57.47 2jxp s SER 50 Cb -0.12 1.06 -0.13 0.00 0.10 0.00 0.00 66.02 66.93 2jxp s SER 50 CO -0.13 -0.15 1.28 -0.33 0.98 0.00 0.00 173.24 174.89 2jxp h GLU 51 N 5.16 0.25 -4.32 4.02 3.07 -1.15 -3.41 114.58 118.21 2jxp h GLU 51 Ca -0.28 -0.33 -0.15 0.00 -0.50 0.00 0.00 59.36 58.10 2jxp h GLU 51 Cb 1.19 0.11 -0.15 0.00 -0.84 0.00 0.00 28.75 29.05 2jxp h GLU 51 CO 0.14 1.07 -0.66 0.00 -1.40 0.00 0.00 179.01 178.17 2jxp s ALA 52 N -3.01 0.66 -0.04 3.43 0.00 -1.15 -2.65 121.76 119.00 2jxp s ALA 52 Ca -0.04 -1.32 0.02 0.00 0.00 0.00 0.00 51.96 50.62 2jxp s ALA 52 Cb 0.09 0.54 0.01 0.00 0.00 0.00 0.00 23.12 23.77 2jxp s ALA 52 CO 0.85 -0.43 -0.08 0.42 0.00 0.00 0.00 175.76 176.53 2jxp s ILE 53 N -3.98 0.74 -0.45 0.00 1.01 -0.44 -1.32 121.20 116.76 2jxp s ILE 53 Ca 0.15 -0.27 -0.10 0.00 0.00 0.00 0.00 60.65 60.43 2jxp s ILE 53 Cb 0.08 -0.71 0.10 0.00 0.01 0.00 0.00 42.46 41.94 2jxp s ILE 53 CO -0.05 0.26 0.32 -0.63 0.00 0.00 0.00 174.94 174.84 2jxp s ILE 54 N 0.65 4.30 -0.76 2.92 1.01 0.86 -0.20 121.20 129.97 2jxp s ILE 54 Ca -0.10 -1.57 -0.12 0.00 0.00 0.00 0.00 60.65 58.85 2jxp s ILE 54 Cb -0.13 -3.73 0.20 0.00 0.01 0.00 0.00 42.46 38.81 2jxp s ILE 54 CO 0.01 -0.65 0.68 -1.58 0.00 0.00 0.00 174.94 173.40 2jxp s GLN 55 N 1.41 3.35 0.10 2.79 -0.44 -0.56 -1.80 119.66 124.51 2jxp s GLN 55 Ca 0.04 -2.40 -0.30 0.00 -2.50 0.00 0.00 55.36 50.19 2jxp s GLN 55 Cb -0.25 -4.29 -0.06 0.00 -1.64 0.00 0.00 33.01 26.77 2jxp s GLN 55 CO 0.01 -1.27 1.20 -1.50 0.50 0.00 0.00 175.29 174.23 2jxp s ILE 56 N 0.26 3.90 0.00 -2.34 -1.16 -1.23 -0.66 121.20 119.95 2jxp s ILE 56 Ca 0.16 1.42 0.00 0.00 -0.51 0.00 0.00 60.65 61.72 2jxp s ILE 56 Cb -0.14 -3.91 0.00 0.00 0.61 0.00 0.00 42.46 39.03 2jxp s ILE 56 CO -0.07 0.14 0.00 0.52 -2.81 0.00 0.00 174.94 172.72 2jxp n VAL 57 N 3.56 0.00 -3.87 4.00 0.31 0.93 -4.25 118.33 119.01 2jxp n VAL 57 Ca 0.08 0.47 -0.09 0.00 -0.01 0.00 0.00 64.34 64.79 2jxp n VAL 57 Cb 0.46 -1.43 -0.07 0.00 -0.91 0.00 0.00 33.84 31.89 2jxp n VAL 57 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 2jxp s HIS 58 N -0.93 0.18 -0.32 3.52 3.76 -1.14 -4.77 115.29 115.58 2jxp s HIS 58 Ca 0.00 -0.60 0.01 0.00 -0.15 0.00 0.00 55.06 54.32 2jxp s HIS 58 Cb 0.00 -0.06 0.10 0.00 1.11 0.00 0.00 32.58 33.73 2jxp s HIS 58 CO 0.00 -0.57 0.08 0.00 -0.85 0.00 0.00 174.74 173.40 2jxp s ALA 59 N -3.87 2.12 -0.33 -1.40 0.00 -1.26 -1.48 121.76 115.53 2jxp s ALA 59 Ca 0.07 -2.04 -0.14 0.00 0.00 0.00 0.00 51.96 49.85 2jxp s ALA 59 Cb 0.05 -1.77 -0.02 0.00 0.00 0.00 0.00 23.12 21.38 2jxp s ALA 59 CO -0.10 -1.67 0.31 0.42 0.00 0.00 0.00 175.76 174.72 2jxp s ILE 60 N 1.31 5.22 -0.04 0.00 -1.09 0.55 -4.93 121.20 122.22 2jxp s ILE 60 Ca 0.10 0.00 0.04 0.00 -2.23 0.00 0.00 60.65 58.56 2jxp s ILE 60 Cb -0.18 -3.75 -0.00 0.00 -1.58 0.00 0.00 42.46 36.95 2jxp s ILE 60 CO -0.18 -0.02 -0.15 0.00 -1.23 0.00 0.00 174.94 173.36 2jxp s ARG 61 N 1.90 1.55 0.07 2.79 3.03 -1.26 0.05 118.95 127.07 2jxp s ARG 61 Ca 0.10 -0.54 0.01 0.00 2.03 0.00 0.00 55.73 57.33 2jxp s ARG 61 Cb -0.17 -1.38 -0.03 0.00 -1.03 0.00 0.00 34.95 32.34 2jxp s ARG 61 CO 0.11 0.23 -0.06 -1.21 -1.13 0.00 0.00 175.30 173.24 2jxp s GLU 62 N 0.01 0.67 -0.21 3.89 2.02 -0.17 -5.01 118.70 119.90 2jxp s GLU 62 Ca -0.02 -1.10 -0.07 0.00 0.02 0.00 0.00 54.97 53.80 2jxp s GLU 62 Cb -0.10 -0.14 -0.03 0.00 0.10 0.00 0.00 34.13 33.96 2jxp s GLU 62 CO 0.01 -0.02 0.05 -1.59 0.02 0.00 0.00 175.26 173.74 2jxp s LYS 63 N -3.03 3.78 0.33 1.61 -2.85 -1.26 -1.11 119.74 117.20 2jxp s LYS 63 Ca 0.03 -0.43 0.04 0.00 -1.00 0.00 0.00 55.97 54.60 2jxp s LYS 63 Cb 0.00 -3.23 -0.03 0.00 -2.06 0.00 0.00 37.83 32.51 2jxp s LYS 63 CO -0.04 0.04 0.16 1.03 0.10 0.00 0.00 175.35 176.65 2jxp s ARG 64 N 0.99 1.69 -0.14 1.78 0.52 0.11 -4.99 118.95 118.90 2jxp s ARG 64 Ca 0.03 -1.98 -0.13 0.00 -0.52 0.00 0.00 55.73 53.14 2jxp s ARG 64 Cb -0.14 -0.18 -0.05 0.00 0.52 0.00 0.00 34.95 35.10 2jxp s ARG 64 CO 0.03 -0.47 0.27 0.42 0.02 0.00 0.00 175.30 175.56 2jxp s ILE 65 N -3.49 5.31 -0.15 1.52 -1.09 -1.26 0.10 121.20 122.14 2jxp s ILE 65 Ca 0.34 0.50 -0.11 0.00 -2.23 0.00 0.00 60.65 59.14 2jxp s ILE 65 Cb 0.04 -3.59 -0.05 0.00 -1.58 0.00 0.00 42.46 37.28 2jxp s ILE 65 CO 0.18 0.45 -0.16 -0.11 -1.23 0.00 0.00 174.94 174.07 2jxp n LEU 66 N 3.15 1.82 -4.14 2.97 7.94 -0.10 -4.62 117.00 124.02 2jxp n LEU 66 Ca -0.14 0.59 -0.18 0.00 -1.11 0.00 0.00 56.01 55.18 2jxp n LEU 66 Cb 0.52 -0.87 -0.12 0.00 0.53 0.00 0.00 43.42 43.48 2jxp n LEU 66 CO 0.38 -0.39 -0.45 -0.44 -1.11 0.00 0.00 177.39 175.38 2jxp s SER 67 N -5.86 1.55 -0.03 1.96 0.01 -1.18 -4.99 113.70 105.16 2jxp s SER 67 Ca -0.17 -0.54 0.03 0.00 1.31 0.00 0.00 55.95 56.57 2jxp s SER 67 Cb 0.03 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.20 2jxp s SER 67 CO 0.27 -0.05 -0.11 -0.76 0.41 0.00 0.00 173.24 173.00 2jxp s LEU 68 N -1.48 1.81 -1.28 2.44 1.43 -1.26 -2.31 118.68 118.02 2jxp s LEU 68 Ca -0.02 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 52.74 2jxp s LEU 68 Cb -0.09 -0.64 -0.06 0.00 0.03 0.00 0.00 46.19 45.43 2jxp s LEU 68 CO 0.02 0.08 2.43 -1.20 0.23 0.00 0.00 176.35 177.91 2jxp n SER 69 N 3.26 5.76 0.00 2.29 7.64 0.82 -4.83 113.62 128.56 2jxp n SER 69 Ca -0.18 -2.58 0.00 0.00 1.01 0.00 0.00 58.87 57.11 2jxp n SER 69 Cb 0.54 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.34 2jxp n SER 69 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2jxp n GLU 70 N 4.82 0.00 -0.66 1.43 4.07 -1.26 -4.24 120.64 124.80 2jxp n GLU 70 Ca 0.60 0.00 -0.05 0.00 -0.06 0.00 0.00 57.16 57.64 2jxp n GLU 70 Cb 0.27 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 31.57 2jxp n GLU 70 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2jxp n SER 71 N 0.45 4.58 0.00 4.31 7.64 -1.26 -4.67 113.62 124.67 2jxp n SER 71 Ca 0.00 -2.29 0.00 0.00 1.01 0.00 0.00 58.87 57.59 2jxp n SER 71 Cb 0.00 -1.11 0.00 0.00 -1.01 0.00 0.00 64.21 62.09 2jxp n SER 71 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jxp n GLY 72 N 2.09 2.13 3.61 0.23 0.00 -1.26 -4.95 105.19 107.04 2jxp n GLY 72 Ca 0.19 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.76 2jxp n GLY 72 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jxp n ARG 73 N -1.97 2.08 -2.13 1.61 3.00 -1.26 -4.81 116.66 113.18 2jxp n ARG 73 Ca 0.00 0.69 -0.41 0.00 -0.00 0.00 0.00 57.85 58.13 2jxp n ARG 73 Cb 0.00 -2.89 -0.03 0.00 0.00 0.00 0.00 32.46 29.55 2jxp n ARG 73 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2jxp s VAL 74 N 6.05 2.88 0.00 5.15 1.01 -1.26 -0.13 120.40 134.10 2jxp s VAL 74 Ca 0.97 0.79 0.00 0.00 0.00 0.00 0.00 61.98 63.75 2jxp s VAL 74 Cb -0.55 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.32 2jxp s VAL 74 CO 0.44 0.15 0.00 0.54 0.00 0.00 0.00 175.10 176.23 2jxp n ARG 75 N 1.80 0.00 -4.05 2.72 1.74 -0.98 -4.83 116.66 113.06 2jxp n ARG 75 Ca 0.04 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.76 2jxp n ARG 75 Cb 0.42 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.77 2jxp n ARG 75 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2jxp s GLU 76 N 0.00 3.61 -0.31 5.56 8.01 -1.24 -2.03 118.70 132.30 2jxp s GLU 76 Ca 0.00 -0.30 -0.14 0.00 0.01 0.00 0.00 54.97 54.54 2jxp s GLU 76 Cb 0.00 -3.11 -0.03 0.00 -4.31 0.00 0.00 34.13 26.68 2jxp s GLU 76 CO 0.00 0.51 0.31 0.12 0.01 0.00 0.00 175.26 176.20 2jxp s PHE 77 N -0.29 3.22 -0.68 1.61 5.36 0.96 -0.92 117.98 127.24 2jxp s PHE 77 Ca 0.09 0.09 -0.26 0.00 -0.96 0.00 0.00 56.93 55.89 2jxp s PHE 77 Cb -0.12 -2.55 0.04 0.00 -0.34 0.00 0.00 43.02 40.05 2jxp s PHE 77 CO 0.01 -0.31 1.15 -2.00 -1.46 0.00 0.00 175.22 172.62 2jxp s GLU 78 N 1.93 3.23 -0.65 10.12 2.12 0.28 -1.62 118.70 134.10 2jxp s GLU 78 Ca 0.11 -0.33 -0.23 0.00 0.36 0.00 0.00 54.97 54.88 2jxp s GLU 78 Cb -0.16 -4.16 0.07 0.00 0.26 0.00 0.00 34.13 30.14 2jxp s GLU 78 CO 0.11 -1.93 0.96 -0.51 -0.54 0.00 0.00 175.26 173.34 2jxp s LEU 79 N 5.02 4.39 -0.06 2.70 1.43 -0.65 0.05 118.68 131.56 2jxp s LEU 79 Ca 0.32 -0.97 -0.11 0.00 -1.03 0.00 0.00 54.13 52.34 2jxp s LEU 79 Cb -0.11 -2.43 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 2jxp s LEU 79 CO 0.16 -1.43 0.29 0.54 0.23 0.00 0.00 176.35 176.14 2jxp s VAL 80 N 4.03 5.24 -0.05 -1.59 0.11 -0.27 -0.41 120.40 127.47 2jxp s VAL 80 Ca 0.22 0.57 -0.00 0.00 -2.93 0.00 0.00 61.98 59.84 2jxp s VAL 80 Cb -0.17 -3.58 0.03 0.00 -1.53 0.00 0.00 36.38 31.13 2jxp s VAL 80 CO 0.10 0.59 -0.01 -0.47 -3.33 0.00 0.00 175.10 171.98 2jxp s TYR 81 N -0.99 0.54 -0.04 1.54 5.04 0.08 -1.00 117.35 122.52 2jxp s TYR 81 Ca 0.20 -0.10 0.06 0.00 -2.44 0.00 0.00 57.07 54.79 2jxp s TYR 81 Cb -0.15 -0.61 -0.01 0.00 0.35 0.00 0.00 41.96 41.54 2jxp s TYR 81 CO 0.09 -0.21 -0.22 1.03 -1.34 0.00 0.00 175.55 174.89 2jxp s ARG 82 N 1.36 2.07 -0.05 4.97 0.52 0.11 -0.36 118.95 127.57 2jxp s ARG 82 Ca -0.05 -0.80 0.05 0.00 -0.52 0.00 0.00 55.73 54.41 2jxp s ARG 82 Cb -0.13 -1.86 -0.01 0.00 0.52 0.00 0.00 34.95 33.47 2jxp s ARG 82 CO -0.02 0.40 -0.20 0.08 0.02 0.00 0.00 175.30 175.58 2jxp s VAL 83 N -0.29 1.64 -0.13 3.52 1.01 -0.86 -0.33 120.40 124.96 2jxp s VAL 83 Ca 0.02 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.19 2jxp s VAL 83 Cb -0.11 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.88 2jxp s VAL 83 CO 0.01 0.46 -0.21 0.00 0.00 0.00 0.00 175.10 175.37 2jxp s ALA 84 N -0.02 2.11 -0.05 5.51 0.00 -0.55 -0.39 121.76 128.38 2jxp s ALA 84 Ca -0.04 -0.99 -0.09 0.00 0.00 0.00 0.00 51.96 50.83 2jxp s ALA 84 Cb -0.12 -0.94 0.02 0.00 0.00 0.00 0.00 23.12 22.08 2jxp s ALA 84 CO 0.03 -0.01 0.22 0.00 0.00 0.00 0.00 175.76 176.00 2jxp s ALA 85 N 0.81 -0.55 -0.16 0.00 0.00 -1.26 -0.05 121.76 120.55 2jxp s ALA 85 Ca -0.08 0.35 -0.05 0.00 0.00 0.00 0.00 51.96 52.18 2jxp s ALA 85 Cb -0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 2jxp s ALA 85 CO -0.01 -0.17 0.00 1.03 0.00 0.00 0.00 175.76 176.61 2jxp s ARG 86 N -0.63 3.79 -0.46 0.00 0.52 0.16 -3.56 118.95 118.77 2jxp s ARG 86 Ca -0.07 -0.45 -0.17 0.00 -0.52 0.00 0.00 55.73 54.52 2jxp s ARG 86 Cb -0.04 -3.03 0.05 0.00 0.52 0.00 0.00 34.95 32.45 2jxp s ARG 86 CO 0.01 0.26 0.45 -1.17 0.02 0.00 0.00 175.30 174.88 2jxp s LEU 87 N 0.35 5.17 0.43 2.53 0.20 -1.26 -1.50 118.68 124.60 2jxp s LEU 87 Ca -0.01 -0.98 0.07 0.00 0.69 0.00 0.00 54.13 53.90 2jxp s LEU 87 Cb -0.13 -2.31 -0.02 0.00 -0.43 0.00 0.00 46.19 43.30 2jxp s LEU 87 CO 0.02 -0.66 0.36 -0.76 -0.29 0.00 0.00 176.35 175.01 2jxp s LEU 88 N 2.04 3.30 0.00 -0.68 1.43 0.72 -2.14 118.68 123.35 2jxp s LEU 88 Ca 0.09 -0.83 0.00 0.00 -1.03 0.00 0.00 54.13 52.36 2jxp s LEU 88 Cb -0.20 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.11 2jxp s LEU 88 CO 0.10 -0.68 0.00 -0.90 0.23 0.00 0.00 176.35 175.11 2jxp n ASP 89 N -1.53 0.81 0.23 2.29 5.75 -0.78 -1.33 116.55 122.00 2jxp n ASP 89 Ca 0.03 -0.83 0.08 0.00 -0.01 0.00 0.00 54.79 54.05 2jxp n ASP 89 Cb 0.62 0.00 0.61 0.00 -1.03 0.00 0.00 41.12 41.33 2jxp n ASP 89 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jxp h ALA 90 N 0.55 1.96 -0.14 2.12 0.00 -1.74 -0.52 119.26 121.50 2jxp h ALA 90 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jxp h ALA 90 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2jxp h ALA 90 CO 0.00 0.03 0.00 0.72 0.00 0.00 0.00 179.25 180.00 2jxp n HIS 91 N -4.53 0.18 -1.17 0.00 8.25 -1.26 -4.88 115.22 111.81 2jxp n HIS 91 Ca -0.02 -0.09 -0.06 0.00 -0.26 0.00 0.00 57.72 57.28 2jxp n HIS 91 Cb 0.09 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.18 2jxp n HIS 91 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2jxp n ASN 92 N -0.10 -5.02 -4.93 0.41 5.03 -0.20 -4.99 115.26 105.46 2jxp n ASN 92 Ca 0.07 0.15 -0.26 0.00 0.87 0.00 0.00 54.58 55.41 2jxp n ASN 92 Cb 0.14 -3.05 -0.02 0.00 -1.02 0.00 0.00 39.78 35.82 2jxp n ASN 92 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2jxp s ALA 93 N -1.79 3.70 -1.12 5.41 0.00 -1.26 -4.76 121.76 121.94 2jxp s ALA 93 Ca 0.00 -0.79 -0.24 0.00 0.00 0.00 0.00 51.96 50.93 2jxp s ALA 93 Cb 0.00 -2.14 -0.11 0.00 0.00 0.00 0.00 23.12 20.86 2jxp s ALA 93 CO 0.00 0.15 1.99 -1.21 0.00 0.00 0.00 175.76 176.68 2jxp s GLU 94 N -3.90 2.19 0.03 0.00 8.01 -1.26 -1.86 118.70 121.91 2jxp s GLU 94 Ca 0.41 -0.88 -0.27 0.00 0.01 0.00 0.00 54.97 54.25 2jxp s GLU 94 Cb -0.10 -5.16 -0.15 0.00 -4.31 0.00 0.00 34.13 24.41 2jxp s GLU 94 CO 0.33 -4.26 1.25 1.25 0.01 0.00 0.00 175.26 173.83 2jxp h LEU 95 N 18.89 -0.82 0.01 1.80 7.12 -1.76 -3.38 115.31 137.17 2jxp h LEU 95 Ca 0.16 0.03 -0.37 0.00 0.13 0.00 0.00 57.88 57.82 2jxp h LEU 95 Cb 0.96 0.21 -0.06 0.00 -0.53 0.00 0.00 40.66 41.24 2jxp h LEU 95 CO 1.17 -0.52 -2.36 0.00 -0.13 0.00 0.00 178.44 176.60 2jxp n ALA 96 N -2.58 1.43 -2.77 1.25 0.00 -0.91 -5.05 120.51 111.88 2jxp n ALA 96 Ca -0.12 -1.14 -0.00 0.00 0.00 0.00 0.00 53.44 52.17 2jxp n ALA 96 Cb 0.38 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.61 2jxp n ALA 96 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jxp n SER 97 N -3.06 -7.93 -4.69 0.00 2.88 -0.96 -4.91 113.62 94.95 2jxp n SER 97 Ca -0.38 1.33 -0.30 0.00 -1.33 0.00 0.00 58.87 58.20 2jxp n SER 97 Cb 1.07 -5.02 0.15 0.00 -0.75 0.00 0.00 64.21 59.66 2jxp n SER 97 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2jxp s LEU 98 N -1.61 2.07 0.80 2.46 2.96 -1.23 -4.79 118.68 119.34 2jxp s LEU 98 Ca 0.01 1.47 -0.05 0.00 -0.22 0.00 0.00 54.13 55.34 2jxp s LEU 98 Cb -0.00 -3.82 0.15 0.00 0.50 0.00 0.00 46.19 43.03 2jxp s LEU 98 CO 0.72 -2.85 1.09 0.00 -1.32 0.00 0.00 176.35 173.99 2jxp s GLN 99 N -4.89 1.33 -0.01 1.98 -2.07 -1.26 -4.75 119.66 109.99 2jxp s GLN 99 Ca 0.64 -0.96 -0.15 0.00 -1.82 0.00 0.00 55.36 53.07 2jxp s GLN 99 Cb -0.19 -2.19 -0.06 0.00 -1.09 0.00 0.00 33.01 29.48 2jxp s GLN 99 CO 0.58 -1.76 0.42 -1.83 -1.32 0.00 0.00 175.29 171.38 2jxp s GLU 100 N -5.36 3.96 0.06 9.60 1.03 -1.26 -4.12 118.70 122.60 2jxp s GLU 100 Ca 0.69 0.42 -0.00 0.00 0.03 0.00 0.00 54.97 56.11 2jxp s GLU 100 Cb -0.04 -3.24 -0.04 0.00 -0.80 0.00 0.00 34.13 30.01 2jxp s GLU 100 CO 0.47 0.65 0.21 0.42 -1.33 0.00 0.00 175.26 175.69 2jxp s ILE 101 N -0.96 5.38 -0.14 1.83 1.01 0.48 -4.92 121.20 123.87 2jxp s ILE 101 Ca 0.24 -0.35 -0.04 0.00 0.00 0.00 0.00 60.65 60.50 2jxp s ILE 101 Cb -0.17 -3.62 0.07 0.00 0.01 0.00 0.00 42.46 38.75 2jxp s ILE 101 CO 0.13 0.15 0.26 0.00 0.00 0.00 0.00 174.94 175.48 2jxp s ARG 102 N -2.46 0.16 0.17 2.79 1.70 -1.25 -2.03 118.95 118.01 2jxp s ARG 102 Ca 0.34 0.64 0.07 0.00 -0.47 0.00 0.00 55.73 56.32 2jxp s ARG 102 Cb -0.13 -0.25 -0.04 0.00 -0.57 0.00 0.00 34.95 33.96 2jxp s ARG 102 CO 0.27 -0.36 -0.15 -0.51 -1.08 0.00 0.00 175.30 173.47 2jxp s LEU 103 N 2.40 2.48 -0.04 -1.89 1.43 0.51 -4.97 118.68 118.60 2jxp s LEU 103 Ca 0.03 -0.92 -0.00 0.00 -1.03 0.00 0.00 54.13 52.20 2jxp s LEU 103 Cb -0.13 -0.65 0.03 0.00 0.03 0.00 0.00 46.19 45.47 2jxp s LEU 103 CO -0.09 -0.14 0.01 0.42 0.23 0.00 0.00 176.35 176.77 2jxp s THR 104 N -2.54 0.22 0.01 5.49 -4.23 -1.26 -0.74 115.64 112.60 2jxp s THR 104 Ca 0.16 0.13 0.01 0.00 -1.18 0.00 0.00 61.69 60.81 2jxp s THR 104 Cb -0.03 -0.36 -0.04 0.00 1.34 0.00 0.00 72.50 73.42 2jxp s THR 104 CO 0.05 0.19 0.05 -0.13 -0.54 0.00 0.00 174.62 174.24 2jxp s ARG 105 N 1.48 2.93 -0.47 3.99 1.81 0.46 -4.92 118.95 124.23 2jxp s ARG 105 Ca -0.03 -0.56 -0.18 0.00 -1.72 0.00 0.00 55.73 53.24 2jxp s ARG 105 Cb -0.13 -2.77 0.05 0.00 -0.45 0.00 0.00 34.95 31.65 2jxp s ARG 105 CO -0.03 0.63 0.51 0.42 -0.68 0.00 0.00 175.30 176.15 2jxp s ILE 106 N -1.18 5.02 -0.31 1.52 -1.09 -1.26 -1.64 121.20 122.26 2jxp s ILE 106 Ca 0.22 -0.57 -0.10 0.00 -2.23 0.00 0.00 60.65 57.97 2jxp s ILE 106 Cb -0.12 -4.18 -0.01 0.00 -1.58 0.00 0.00 42.46 36.57 2jxp s ILE 106 CO 0.14 -0.63 0.17 -0.22 -1.23 0.00 0.00 174.94 173.16 2jxp s LEU 107 N 2.25 4.16 0.23 2.97 1.98 -0.64 -4.93 118.68 124.70 2jxp s LEU 107 Ca 0.12 -0.48 -0.30 0.00 -2.89 0.00 0.00 54.13 50.58 2jxp s LEU 107 Cb -0.20 -2.03 -0.09 0.00 0.66 0.00 0.00 46.19 44.54 2jxp s LEU 107 CO 0.11 -0.19 1.07 -2.16 -1.89 0.00 0.00 176.35 173.29 2jxp s PRO 108 N 1.64 4.66 -0.60 0.98 0.04 -1.26 -0.03 135.00 140.43 2jxp s PRO 108 Ca 0.05 1.71 -0.26 0.00 0.04 0.00 0.00 61.00 62.54 2jxp s PRO 108 Cb -0.17 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.08 2jxp s PRO 108 CO 0.07 0.21 2.08 0.12 0.04 0.00 0.00 177.00 179.52 2jxp s PHE 109 N -0.78 1.45 -0.36 0.56 5.36 -0.86 -4.92 117.98 118.43 2jxp s PHE 109 Ca 0.46 1.09 0.03 0.00 -0.96 0.00 0.00 56.93 57.55 2jxp s PHE 109 Cb -0.30 -3.89 0.10 0.00 -0.34 0.00 0.00 43.02 38.60 2jxp s PHE 109 CO 0.37 -2.30 0.08 -0.51 -1.46 0.00 0.00 175.22 171.40 2jxp s LEU 110 N 10.48 4.29 0.00 6.12 1.43 -1.26 -5.05 118.68 134.69 2jxp s LEU 110 Ca 0.79 -2.18 0.00 0.00 -1.03 0.00 0.00 54.13 51.71 2jxp s LEU 110 Cb -0.14 -1.50 0.00 0.00 0.03 0.00 0.00 46.19 44.58 2jxp s LEU 110 CO 0.20 -0.37 0.37 -0.67 0.23 0.00 0.00 176.35 176.12 2jxp n ASP 111 N 4.21 0.00 0.27 2.29 2.03 -1.26 -4.14 116.55 119.94 2jxp n ASP 111 Ca 0.03 0.48 0.13 0.00 0.52 0.00 0.00 54.79 55.95 2jxp n ASP 111 Cb 0.41 -0.22 0.74 0.00 -0.72 0.00 0.00 41.12 41.33 2jxp n ASP 111 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jxp h ALA 112 N -2.00 1.35 -1.96 -1.67 0.00 -2.04 -3.41 119.26 109.52 2jxp h ALA 112 Ca 0.00 -0.09 -0.57 0.00 0.00 0.00 0.00 54.91 54.24 2jxp h ALA 112 Cb 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2jxp h ALA 112 CO 0.00 0.13 1.26 -0.65 0.00 0.00 0.00 179.25 179.99 2jxp s GLN 113 N -4.29 3.49 -0.04 0.00 -1.52 -1.26 -4.87 119.66 111.17 2jxp s GLN 113 Ca -0.03 1.66 0.00 0.00 -1.95 0.00 0.00 55.36 55.04 2jxp s GLN 113 Cb 0.14 -4.17 -0.26 0.00 -0.22 0.00 0.00 33.01 28.49 2jxp s GLN 113 CO 0.58 -1.68 0.67 1.05 -0.25 0.00 0.00 175.29 175.67 2jxp h GLU 114 N 12.45 0.18 -0.94 2.91 4.11 -1.89 -3.35 114.58 128.05 2jxp h GLU 114 Ca -0.36 -0.31 0.02 0.00 0.07 0.00 0.00 59.36 58.78 2jxp h GLU 114 Cb 1.18 0.12 -0.05 0.00 0.50 0.00 0.00 28.75 30.50 2jxp h GLU 114 CO 1.01 0.98 0.62 -0.07 0.07 0.00 0.00 179.01 181.61 2jxp h LEU 115 N 0.05 1.06 -2.28 3.06 -0.00 -1.98 -1.92 115.31 113.30 2jxp h LEU 115 Ca -0.30 -0.02 0.04 0.00 -0.00 0.00 0.00 57.88 57.60 2jxp h LEU 115 Cb 2.02 -0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 42.41 2jxp h LEU 115 CO 0.12 0.76 0.17 0.00 -0.00 0.00 0.00 178.44 179.48 2jxp h ALA 116 N 1.36 1.72 0.00 1.53 0.00 -1.95 0.17 119.26 122.09 2jxp h ALA 116 Ca 0.35 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 2jxp h ALA 116 Cb -0.10 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2jxp h ALA 116 CO -0.09 -0.24 -0.17 0.87 0.00 0.00 0.00 179.25 179.62 2jxp h LYS 117 N 0.00 0.00 0.00 0.00 1.79 -1.49 -0.82 116.57 116.06 2jxp h LYS 117 Ca 0.07 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 58.24 2jxp h LYS 117 Cb 0.41 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.01 2jxp h LYS 117 CO -0.00 0.17 -2.00 0.00 -1.08 0.00 0.00 179.45 176.53 2jxp n ALA 118 N -2.30 1.81 -0.32 3.86 0.00 -0.61 -4.03 120.51 118.92 2jxp n ALA 118 Ca -0.02 -0.72 0.08 0.00 0.00 0.00 0.00 53.44 52.78 2jxp n ALA 118 Cb 0.29 0.25 0.24 0.00 0.00 0.00 0.00 19.45 20.22 2jxp n ALA 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jxp h ALA 119 N -0.56 1.37 0.00 0.00 0.00 -0.76 -1.85 119.26 117.46 2jxp h ALA 119 Ca -0.45 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2jxp h ALA 119 Cb 1.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2jxp h ALA 119 CO -0.25 -0.01 -0.24 0.93 0.00 0.00 0.00 179.25 179.68 2jxp h GLU 120 N 0.73 0.00 0.05 0.00 4.39 -1.35 -3.38 114.58 115.02 2jxp h GLU 120 Ca 0.48 0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.19 2jxp h GLU 120 Cb 0.64 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.25 2jxp h GLU 120 CO -0.34 0.00 -0.39 0.93 -1.16 0.00 0.00 179.01 178.06 2jxp h GLU 121 N -0.57 -0.50 -0.69 2.33 5.08 -1.61 -1.43 114.58 117.18 2jxp h GLU 121 Ca 0.00 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.53 2jxp h GLU 121 Cb 0.24 0.11 -0.09 0.00 0.50 0.00 0.00 28.75 29.51 2jxp h GLU 121 CO 0.00 -0.33 0.21 1.49 -1.00 0.00 0.00 179.01 179.38 2jxp h GLU 122 N -0.52 0.33 -0.37 2.33 4.22 -1.52 0.08 114.58 119.13 2jxp h GLU 122 Ca 0.00 -0.02 -0.15 0.00 0.08 0.00 0.00 59.36 59.27 2jxp h GLU 122 Cb 0.54 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2jxp h GLU 122 CO -0.23 0.22 -0.36 0.52 -2.18 0.00 0.00 179.01 176.98 2jxp h MET 123 N 0.34 0.86 -0.16 1.92 0.00 -1.61 -2.72 114.93 113.56 2jxp h MET 123 Ca 0.37 -0.43 -0.09 0.00 0.00 0.00 0.00 59.70 59.55 2jxp h MET 123 Cb 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.17 2jxp h MET 123 CO -0.42 1.07 -0.31 -0.07 0.00 0.00 0.00 176.91 177.18 2jxp h LEU 124 N 0.71 0.32 -0.25 1.22 -0.00 -0.21 -0.19 115.31 116.91 2jxp h LEU 124 Ca 0.07 -0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 2jxp h LEU 124 Cb 0.92 -0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 41.48 2jxp h LEU 124 CO 0.09 0.62 0.16 1.88 -0.00 0.00 0.00 178.44 181.19 2jxp h TYR 125 N 0.28 0.32 0.00 1.13 0.05 -0.82 -2.69 116.97 115.24 2jxp h TYR 125 Ca 0.04 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.82 2jxp h TYR 125 Cb 0.69 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.32 2jxp h TYR 125 CO 0.02 0.22 0.00 1.57 -1.05 0.00 0.00 178.16 178.91 2jxp h LYS 126 N 0.33 0.00 -0.00 4.88 2.10 -1.33 -3.05 116.57 119.50 2jxp h LYS 126 Ca 0.09 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.74 2jxp h LYS 126 Cb -0.02 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.31 2jxp h LYS 126 CO -0.02 0.00 -0.00 0.22 -2.00 0.00 0.00 179.45 177.65 2jxp h ASP 127 N 0.00 0.00 -0.05 7.07 3.58 -0.75 -1.63 116.42 124.64 2jxp h ASP 127 Ca 0.00 -0.34 -0.05 0.00 0.42 0.00 0.00 57.03 57.06 2jxp h ASP 127 Cb 0.82 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.85 2jxp h ASP 127 CO 0.00 0.34 -0.10 0.00 -2.88 0.00 0.00 179.24 176.59 2jxp h MET 128 N -0.34 0.33 -0.91 0.28 -0.00 -1.53 -1.33 114.93 111.43 2jxp h MET 128 Ca 0.00 -0.08 0.06 0.00 -0.00 0.00 0.00 59.70 59.69 2jxp h MET 128 Cb 0.34 -0.04 -0.06 0.00 -0.00 0.00 0.00 31.60 31.83 2jxp h MET 128 CO 0.00 0.45 0.57 0.37 -0.00 0.00 0.00 176.91 178.30 2jxp h GLN 129 N 0.31 1.01 0.62 -0.10 5.75 -1.43 -0.54 115.11 120.74 2jxp h GLN 129 Ca 0.06 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.48 2jxp h GLN 129 Cb 0.38 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 2jxp h GLN 129 CO 0.02 0.67 -0.42 -0.22 -2.65 0.00 0.00 178.83 176.23 2jxp h LYS 130 N 1.04 -0.95 -0.94 1.69 3.64 -0.25 -2.75 116.57 118.05 2jxp h LYS 130 Ca 0.40 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.84 2jxp h LYS 130 Cb 0.17 0.22 -0.05 0.00 -0.41 0.00 0.00 32.23 32.16 2jxp h LYS 130 CO -0.17 -0.63 0.59 -0.44 -2.27 0.00 0.00 179.45 176.52 2jxp h ASP 131 N -0.99 1.10 -0.13 4.20 3.32 -1.29 -1.90 116.42 120.74 2jxp h ASP 131 Ca -0.08 -0.05 0.04 0.00 0.02 0.00 0.00 57.03 56.96 2jxp h ASP 131 Cb 0.80 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 2jxp h ASP 131 CO 0.06 0.82 -0.13 0.00 -1.72 0.00 0.00 179.24 178.28 2jxp h ALA 132 N 1.33 -0.04 0.00 3.45 0.00 -1.12 -1.07 119.26 121.82 2jxp h ALA 132 Ca 0.34 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.22 2jxp h ALA 132 Cb -0.10 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2jxp h ALA 132 CO -0.07 -0.58 -0.38 -0.24 0.00 0.00 0.00 179.25 177.99 2jxp h VAL 133 N -0.15 1.04 -0.30 0.00 3.04 -1.23 -2.55 116.25 116.11 2jxp h VAL 133 Ca 0.09 -1.40 -0.11 0.00 -1.01 0.00 0.00 66.70 64.27 2jxp h VAL 133 Cb 0.28 1.81 -0.01 0.00 -2.01 0.00 0.00 31.29 31.35 2jxp h VAL 133 CO -0.22 0.37 -0.27 1.56 -1.01 0.00 0.00 177.57 178.01 2jxp h GLN 134 N 0.00 0.59 -0.04 4.17 1.08 -0.76 -0.42 115.11 119.73 2jxp h GLN 134 Ca -0.00 -0.24 -0.00 0.00 -1.45 0.00 0.00 58.65 56.96 2jxp h GLN 134 Cb 0.78 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.18 2jxp h GLN 134 CO 0.05 0.80 0.02 1.96 -0.95 0.00 0.00 178.83 180.71 2jxp h GLN 135 N 0.51 0.05 -0.23 1.46 1.08 -0.82 -2.73 115.11 114.44 2jxp h GLN 135 Ca 0.07 -0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.30 2jxp h GLN 135 Cb 0.73 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.11 2jxp h GLN 135 CO 0.06 0.11 0.02 0.82 -0.95 0.00 0.00 178.83 178.89 2jxp h ILE 136 N -0.01 0.87 -0.59 2.54 2.04 -1.33 -2.26 117.51 118.77 2jxp h ILE 136 Ca 0.01 -0.04 0.12 0.00 1.00 0.00 0.00 64.86 65.96 2jxp h ILE 136 Cb 0.07 0.76 -0.11 0.00 -0.74 0.00 0.00 36.82 36.79 2jxp h ILE 136 CO -0.00 0.02 -0.17 0.25 0.00 0.00 0.00 178.15 178.24 2jxp h LEU 137 N 0.10 -0.63 -0.20 1.44 5.85 -1.00 0.66 115.31 121.53 2jxp h LEU 137 Ca 0.11 0.18 -0.11 0.00 0.84 0.00 0.00 57.88 58.90 2jxp h LEU 137 Cb 0.12 0.40 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 2jxp h LEU 137 CO -0.16 -0.22 -0.32 -0.09 -0.34 0.00 0.00 178.44 177.32 2jxp h ARG 138 N -0.03 0.57 -0.06 1.25 2.43 -1.28 -3.15 114.38 114.11 2jxp h ARG 138 Ca 0.28 -0.35 -0.23 0.00 -0.81 0.00 0.00 59.98 58.87 2jxp h ARG 138 Cb 0.46 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.05 2jxp h ARG 138 CO -0.62 0.95 -0.88 1.96 -1.51 0.00 0.00 179.97 179.87 2jxp h GLN 139 N 0.25 0.60 0.00 0.20 1.08 -1.12 -0.34 115.11 115.78 2jxp h GLN 139 Ca 0.02 -0.57 -0.02 0.00 -1.45 0.00 0.00 58.65 56.63 2jxp h GLN 139 Cb 0.90 0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 28.47 2jxp h GLN 139 CO 0.07 1.19 -0.11 0.28 -0.95 0.00 0.00 178.83 179.31 2jxp h VAL 140 N 0.38 0.44 0.00 -0.54 2.07 -0.96 -0.46 116.25 117.18 2jxp h VAL 140 Ca -0.08 -0.58 -0.34 0.00 0.82 0.00 0.00 66.70 66.52 2jxp h VAL 140 Cb 1.51 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 32.63 2jxp h VAL 140 CO 0.17 0.11 -1.84 -1.54 0.02 0.00 0.00 177.57 174.49 2jxp n SER 141 N -3.48 1.91 -0.64 0.57 3.41 -1.19 -4.52 113.62 109.68 2jxp n SER 141 Ca -0.01 0.38 0.06 0.00 -0.26 0.00 0.00 58.87 59.03 2jxp n SER 141 Cb 0.26 -0.90 0.17 0.00 -0.26 0.00 0.00 64.21 63.49 2jxp n SER 141 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jxp n ALA 142 N -3.76 2.45 -0.26 7.33 0.00 -0.14 -4.28 120.51 121.85 2jxp n ALA 142 Ca -0.42 -0.61 0.10 0.00 0.00 0.00 0.00 53.44 52.51 2jxp n ALA 142 Cb 0.78 -0.98 0.36 0.00 0.00 0.00 0.00 19.45 19.61 2jxp n ALA 142 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2jxp h PHE 143 N 2.06 0.84 0.00 0.00 -0.00 -1.28 0.40 116.94 118.96 2jxp h PHE 143 Ca 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 57.98 2jxp h PHE 143 Cb 0.47 -0.27 -0.00 0.00 -0.00 0.00 0.00 35.95 36.15 2jxp h PHE 143 CO 0.23 0.35 -0.06 0.00 -0.00 0.00 0.00 178.31 178.82 2jxp h THR 144 N 0.74 0.80 -0.43 0.88 1.03 -1.86 0.21 112.91 114.28 2jxp h THR 144 Ca 0.42 -0.24 -0.27 0.00 -0.01 0.00 0.00 66.41 66.31 2jxp h THR 144 Cb 0.58 1.14 -0.11 0.00 -1.07 0.00 0.00 68.15 68.69 2jxp h THR 144 CO -0.18 0.06 0.24 -0.24 -0.01 0.00 0.00 175.52 175.39 2jxp n SER 145 N -4.11 6.10 -2.83 0.00 2.88 0.13 -4.73 113.62 111.06 2jxp n SER 145 Ca -0.03 -2.89 -0.18 0.00 -1.33 0.00 0.00 58.87 54.44 2jxp n SER 145 Cb 0.15 -1.15 0.06 0.00 -0.75 0.00 0.00 64.21 62.52 2jxp n SER 145 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jxp n ALA 146 N 0.93 -0.98 0.17 -1.46 0.00 -0.99 -4.93 120.51 113.25 2jxp n ALA 146 Ca 0.29 0.30 0.06 0.00 0.00 0.00 0.00 53.44 54.09 2jxp n ALA 146 Cb 0.59 -4.23 0.07 0.00 0.00 0.00 0.00 19.45 15.89 2jxp n ALA 146 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2jxp h GLY 147 N -1.96 0.00 0.45 0.00 0.00 -0.99 -3.29 103.07 97.27 2jxp h GLY 147 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2jxp h GLY 147 CO 0.43 0.00 0.00 1.47 0.00 0.00 0.00 176.54 178.44 2jxp n LEU 148 N -3.19 0.00 -0.15 3.11 -0.00 -1.24 -3.59 117.00 111.94 2jxp n LEU 148 Ca 0.03 0.00 0.20 0.00 -0.00 0.00 0.00 56.01 56.24 2jxp n LEU 148 Cb 0.67 0.00 0.59 0.00 -0.00 0.00 0.00 43.42 44.68 2jxp n LEU 148 CO 0.38 0.00 1.22 -0.33 -0.00 0.00 0.00 177.39 178.66 2jxp h GLU 149 N 0.00 0.23 -6.39 1.47 4.39 -1.92 -3.42 114.58 108.93 2jxp h GLU 149 Ca 0.00 -0.01 -0.54 0.00 0.34 0.00 0.00 59.36 59.15 2jxp h GLU 149 Cb 0.00 -0.05 0.02 0.00 -0.10 0.00 0.00 28.75 28.61 2jxp h GLU 149 CO 0.00 0.15 1.08 -1.01 -1.16 0.00 0.00 179.01 178.07 2jxp s HIS 150 N -5.24 2.04 -1.13 4.33 3.76 -1.24 -4.91 115.29 112.90 2jxp s HIS 150 Ca -0.07 0.08 -0.20 0.00 -0.15 0.00 0.00 55.06 54.72 2jxp s HIS 150 Cb 0.21 -4.04 0.07 0.00 1.11 0.00 0.00 32.58 29.93 2jxp s HIS 150 CO 0.76 -4.34 1.55 -3.38 -0.85 0.00 0.00 174.74 168.48 2jxp s HIS 151 N 3.38 2.70 0.14 1.40 -3.43 -1.26 -4.81 115.29 113.41 2jxp s HIS 151 Ca 0.78 -1.24 -0.32 0.00 -0.80 0.00 0.00 55.06 53.48 2jxp s HIS 151 Cb -0.40 -4.69 -0.12 0.00 -1.43 0.00 0.00 32.58 25.95 2jxp s HIS 151 CO 0.34 -1.84 1.74 -2.39 -2.00 0.00 0.00 174.74 170.59 2jxp n HIS 152 N 8.43 2.55 -4.48 0.38 1.44 -1.26 -4.94 115.22 117.35 2jxp n HIS 152 Ca 0.39 0.03 -0.23 0.00 -2.01 0.00 0.00 57.72 55.89 2jxp n HIS 152 Cb 0.49 -2.66 -0.10 0.00 0.12 0.00 0.00 29.99 27.83 2jxp n HIS 152 CO 0.00 0.00 0.00 -3.38 -2.81 0.00 0.00 176.34 170.15 2jxp s HIS 153 N 1.91 2.16 -2.40 -1.40 -3.43 -1.26 -5.02 115.29 105.84 2jxp s HIS 153 Ca 0.80 -0.59 0.23 0.00 -0.80 0.00 0.00 55.06 54.71 2jxp s HIS 153 Cb -0.56 -1.21 0.76 0.00 -1.43 0.00 0.00 32.58 30.15 2jxp s HIS 153 CO 0.37 0.44 1.57 0.72 -2.00 0.00 0.00 174.74 175.84 2jxp n HIS 154 N -0.67 0.17 -0.63 0.38 8.25 -1.26 -4.83 115.22 116.64 2jxp n HIS 154 Ca -0.05 -0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 2jxp n HIS 154 Cb 0.63 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.74 2jxp n HIS 154 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70