#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jex h ALA 4 N 0.00 1.20 0.01 1.79 0.00 -2.02 -0.50 119.26 119.74 2jex h ALA 4 Ca 0.00 -0.22 -0.25 0.00 0.00 0.00 0.00 54.91 54.43 2jex h ALA 4 Cb 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.77 2jex h ALA 4 CO 0.00 0.31 -1.03 0.00 0.00 0.00 0.00 179.25 178.53 2jex h GLU 6 N 0.32 0.43 -0.60 0.00 5.08 -1.96 -2.67 114.58 115.17 2jex h GLU 6 Ca -0.12 -0.58 -0.08 0.00 -1.00 0.00 0.00 59.36 57.58 2jex h GLU 6 Cb 1.68 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 31.09 2jex h GLU 6 CO 0.19 1.23 0.05 -0.09 -1.00 0.00 0.00 179.01 179.39 2jex h ARG 7 N 0.19 1.02 -0.49 2.33 2.43 -1.19 -1.83 114.38 116.84 2jex h ARG 7 Ca -0.13 -0.29 0.01 0.00 -0.81 0.00 0.00 59.98 58.76 2jex h ARG 7 Cb 1.81 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 31.23 2jex h ARG 7 CO 0.20 0.97 0.32 1.25 -1.51 0.00 0.00 179.97 181.20 2jex h LEU 8 N 0.94 0.56 -0.67 3.80 5.85 -1.49 -1.56 115.31 122.74 2jex h LEU 8 Ca 0.18 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2jex h LEU 8 Cb 0.48 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2jex h LEU 8 CO 0.02 0.41 0.37 -0.74 -0.34 0.00 0.00 178.44 178.16 2jex h HIS 9 N 0.66 0.91 -0.44 1.25 2.76 -1.12 -1.44 115.15 117.73 2jex h HIS 9 Ca 0.18 -0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.26 2jex h HIS 9 Cb -0.08 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 28.58 2jex h HIS 9 CO -0.04 0.65 -0.01 0.28 -1.30 0.00 0.00 177.93 177.51 2jex h VAL 10 N 0.91 1.26 -0.56 5.26 2.07 -1.22 -0.76 116.25 123.23 2jex h VAL 10 Ca 0.24 -1.05 -0.07 0.00 0.82 0.00 0.00 66.70 66.63 2jex h VAL 10 Cb 0.03 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 2jex h VAL 10 CO -0.04 0.36 0.06 0.00 0.02 0.00 0.00 177.57 177.97 2jex h ALA 11 N 0.90 1.05 -0.13 1.67 0.00 -1.09 0.91 119.26 122.57 2jex h ALA 11 Ca 0.12 -0.26 -0.22 0.00 0.00 0.00 0.00 54.91 54.56 2jex h ALA 11 Cb 0.50 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.08 2jex h ALA 11 CO 0.02 0.60 -0.78 1.96 0.00 0.00 0.00 179.25 181.05 2jex h GLN 12 N 0.86 0.70 -0.25 0.00 4.20 -1.22 -3.03 115.11 116.36 2jex h GLN 12 Ca 0.17 -0.58 -0.10 0.00 0.06 0.00 0.00 58.65 58.20 2jex h GLN 12 Cb 0.43 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 2jex h GLN 12 CO 0.01 1.19 -0.26 1.49 -0.67 0.00 0.00 178.83 180.59 2jex h GLU 13 N 0.47 0.48 -0.45 1.46 4.57 -0.96 -2.21 114.58 117.94 2jex h GLU 13 Ca -0.05 -0.19 -0.03 0.00 -1.18 0.00 0.00 59.36 57.91 2jex h GLU 13 Cb 1.40 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.95 2jex h GLU 13 CO 0.16 0.71 0.16 1.15 -1.18 0.00 0.00 179.01 180.00 2jex h THR 14 N 0.43 1.22 -0.38 0.32 2.02 -0.85 0.22 112.91 115.89 2jex h THR 14 Ca 0.06 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 2jex h THR 14 Cb 0.69 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 2jex h THR 14 CO 0.05 0.25 0.20 1.56 0.37 0.00 0.00 175.52 177.96 2jex h GLN 15 N 0.59 0.53 -0.27 6.66 4.20 -1.44 -1.32 115.11 124.05 2jex h GLN 15 Ca 0.15 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.71 2jex h GLN 15 Cb 0.24 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2jex h GLN 15 CO -0.01 0.44 -0.16 1.98 -0.67 0.00 0.00 178.83 180.41 2jex h MET 16 N 0.48 0.47 -0.27 1.46 4.05 -1.25 -1.17 114.93 118.70 2jex h MET 16 Ca 0.13 -0.15 -0.16 0.00 -0.28 0.00 0.00 59.70 59.24 2jex h MET 16 Cb 0.07 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.82 2jex h MET 16 CO -0.02 0.63 -0.48 1.96 0.23 0.00 0.00 176.91 179.22 2jex h GLN 17 N 0.43 0.74 0.03 0.39 4.20 -0.80 -2.99 115.11 117.12 2jex h GLN 17 Ca 0.08 -0.43 -0.22 0.00 0.06 0.00 0.00 58.65 58.13 2jex h GLN 17 Cb 0.54 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.33 2jex h GLN 17 CO 0.03 1.05 -1.05 -0.07 -0.67 0.00 0.00 178.83 178.12 2jex h LEU 18 N 0.58 0.10 -0.04 1.46 3.38 -0.96 -2.29 115.31 117.54 2jex h LEU 18 Ca 0.03 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 2jex h LEU 18 Cb 1.05 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.76 2jex h LEU 18 CO 0.10 1.08 0.01 0.40 0.09 0.00 0.00 178.44 180.13 2jex h ILE 19 N 0.02 1.17 -0.31 1.22 2.04 -1.31 -1.12 117.51 119.22 2jex h ILE 19 Ca -0.04 -0.52 0.06 0.00 1.00 0.00 0.00 64.86 65.36 2jex h ILE 19 Cb 1.81 1.45 -0.05 0.00 -0.74 0.00 0.00 36.82 39.30 2jex h ILE 19 CO 0.15 0.14 -0.01 -0.33 0.00 0.00 0.00 178.15 178.10 2jex h GLU 20 N -0.14 0.07 -0.83 2.37 5.08 -1.56 -2.43 114.58 117.13 2jex h GLU 20 Ca 0.01 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2jex h GLU 20 Cb 0.22 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.39 2jex h GLU 20 CO -0.00 0.05 0.51 -0.22 -1.00 0.00 0.00 179.01 178.35 2jex h LYS 21 N 0.07 0.90 -6.25 2.33 3.64 -1.38 -3.47 116.57 112.41 2jex h LYS 21 Ca 0.15 -0.05 -0.39 0.00 -1.27 0.00 0.00 60.65 59.08 2jex h LYS 21 Cb 0.21 -0.20 0.05 0.00 -0.41 0.00 0.00 32.23 31.87 2jex h LYS 21 CO -0.26 0.60 -0.84 0.45 -2.27 0.00 0.00 179.45 177.12 2jex n SER 22 N -4.64 -5.53 -4.80 4.20 2.88 -0.43 -4.94 113.62 100.35 2jex n SER 22 Ca 0.12 -0.89 -0.32 0.00 -1.33 0.00 0.00 58.87 56.45 2jex n SER 22 Cb 0.18 -3.20 0.02 0.00 -0.75 0.00 0.00 64.21 60.46 2jex n SER 22 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2jex s SER 23 N -3.30 5.69 -0.04 -3.46 0.15 -1.26 -4.89 113.70 106.59 2jex s SER 23 Ca 0.32 1.80 0.13 0.00 0.70 0.00 0.00 55.95 58.89 2jex s SER 23 Cb -0.12 -2.53 0.39 0.00 -1.71 0.00 0.00 66.02 62.05 2jex s SER 23 CO 0.86 -1.23 1.32 0.47 1.20 0.00 0.00 173.24 175.87 2jex n ASP 24 N -2.21 3.27 -4.74 5.45 8.00 -1.23 -3.91 116.55 121.19 2jex n ASP 24 Ca 0.09 -2.21 -0.35 0.00 0.71 0.00 0.00 54.79 53.02 2jex n ASP 24 Cb 0.53 -0.32 -0.08 0.00 -0.02 0.00 0.00 41.12 41.23 2jex n ASP 24 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2jex s LYS 25 N -1.38 4.15 0.37 -1.24 2.47 -1.21 0.14 119.74 123.05 2jex s LYS 25 Ca 0.30 -0.19 0.10 0.00 -1.56 0.00 0.00 55.97 54.62 2jex s LYS 25 Cb 0.18 -3.41 0.87 0.00 -1.46 0.00 0.00 37.83 34.01 2jex s LYS 25 CO 0.16 0.32 1.89 1.25 0.16 0.00 0.00 175.35 179.13 2jex h LEU 26 N 6.58 0.59 -0.90 5.43 5.85 -1.83 -2.68 115.31 128.35 2jex h LEU 26 Ca -0.42 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.25 2jex h LEU 26 Cb 1.16 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 2jex h LEU 26 CO 0.75 0.31 -0.04 -0.61 -0.34 0.00 0.00 178.44 178.51 2jex h GLN 27 N 0.63 0.76 -0.13 1.25 5.75 -1.94 -0.76 115.11 120.66 2jex h GLN 27 Ca 0.41 -0.22 -0.03 0.00 -0.15 0.00 0.00 58.65 58.66 2jex h GLN 27 Cb 0.70 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.15 2jex h GLN 27 CO -0.17 0.80 -0.07 -0.44 -2.65 0.00 0.00 178.83 176.30 2jex h ASP 28 N 0.71 0.18 0.44 -0.69 3.45 -1.90 -1.32 116.42 117.29 2jex h ASP 28 Ca 0.13 -0.03 -0.30 0.00 0.43 0.00 0.00 57.03 57.26 2jex h ASP 28 Cb 0.49 -0.05 0.02 0.00 -0.56 0.00 0.00 39.33 39.24 2jex h ASP 28 CO 0.03 0.29 -1.34 0.45 -1.57 0.00 0.00 179.24 177.09 2jex h HIS 29 N 0.19 0.74 -0.40 4.55 3.86 -1.38 -0.44 115.15 122.27 2jex h HIS 29 Ca 0.04 -0.53 0.08 0.00 -1.16 0.00 0.00 60.37 58.80 2jex h HIS 29 Cb 0.26 -0.03 -0.07 0.00 1.06 0.00 0.00 27.41 28.63 2jex h HIS 29 CO 0.00 1.41 -0.04 0.82 0.86 0.00 0.00 177.93 180.98 2jex h ILE 30 N 0.12 0.66 -0.57 2.45 2.04 -1.05 -1.12 117.51 120.04 2jex h ILE 30 Ca -0.19 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 65.67 2jex h ILE 30 Cb 2.05 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 38.68 2jex h ILE 30 CO 0.24 0.01 0.35 -0.07 0.00 0.00 0.00 178.15 178.68 2jex h LEU 31 N 0.06 0.57 -0.49 1.44 4.07 -1.15 -1.52 115.31 118.30 2jex h LEU 31 Ca 0.20 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.16 2jex h LEU 31 Cb 0.29 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 41.88 2jex h LEU 31 CO -0.36 0.40 0.32 0.22 -1.08 0.00 0.00 178.44 177.95 2jex h TYR 32 N 0.69 0.61 0.00 1.13 3.20 -0.78 -2.25 116.97 119.59 2jex h TYR 32 Ca 0.23 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.98 2jex h TYR 32 Cb 0.01 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.05 2jex h TYR 32 CO -0.06 0.38 -0.63 -1.49 -1.64 0.00 0.00 178.16 174.73 2jex h TRP 33 N 0.66 0.00 0.00 -3.82 4.06 -0.93 -1.65 115.95 114.27 2jex h TRP 33 Ca 0.18 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 61.03 2jex h TRP 33 Cb -0.07 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.07 2jex h TRP 33 CO -0.04 0.63 -0.47 1.79 -3.56 0.00 0.00 178.44 176.79 2jex h THR 34 N 0.00 1.33 0.02 1.49 1.35 -1.16 -0.90 112.91 115.05 2jex h THR 34 Ca -0.01 -1.60 -0.22 0.00 -0.55 0.00 0.00 66.41 64.03 2jex h THR 34 Cb 1.16 1.87 -0.01 0.00 -1.73 0.00 0.00 68.15 69.44 2jex h THR 34 CO 0.08 0.46 -0.96 0.00 -0.25 0.00 0.00 175.52 174.85 2jex h ALA 35 N 1.53 0.40 -0.61 6.62 0.00 -1.11 -1.82 119.26 124.27 2jex h ALA 35 Ca -0.00 -0.76 -0.06 0.00 0.00 0.00 0.00 54.91 54.09 2jex h ALA 35 Cb 0.83 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 2jex h ALA 35 CO 0.06 0.91 0.16 0.28 0.00 0.00 0.00 179.25 180.66 2jex h VAL 36 N 0.13 1.25 0.28 0.00 2.07 -1.07 -1.72 116.25 117.19 2jex h VAL 36 Ca -0.07 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 2jex h VAL 36 Cb 1.62 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2jex h VAL 36 CO 0.15 0.34 -0.16 -0.09 0.02 0.00 0.00 177.57 177.84 2jex h ARG 37 N 0.89 -0.39 0.02 1.57 2.43 -1.15 -2.16 114.38 115.59 2jex h ARG 37 Ca 0.19 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.42 2jex h ARG 37 Cb 0.34 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 2jex h ARG 37 CO 0.00 -0.26 -0.27 1.15 -1.51 0.00 0.00 179.97 179.08 2jex h THR 38 N -0.41 0.40 -0.27 0.20 2.02 -1.29 0.38 112.91 113.95 2jex h THR 38 Ca -0.03 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.21 2jex h THR 38 Cb 0.33 0.40 -0.06 0.00 -1.74 0.00 0.00 68.15 67.08 2jex h THR 38 CO 0.04 0.00 -0.14 -0.08 0.37 0.00 0.00 175.52 175.71 2jex h GLU 39 N -0.42 -0.11 0.00 6.66 4.81 -1.23 -0.94 114.58 123.35 2jex h GLU 39 Ca 0.06 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 2jex h GLU 39 Cb 0.50 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2jex h GLU 39 CO -0.22 -0.07 -0.24 -0.91 -0.73 0.00 0.00 179.01 176.83 2jex h ASN 40 N -0.12 0.00 -0.09 1.04 2.35 -1.28 -1.75 115.58 115.73 2jex h ASN 40 Ca 0.14 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.86 2jex h ASN 40 Cb 0.33 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.70 2jex h ASN 40 CO -0.34 0.24 -0.08 0.74 -1.65 0.00 0.00 177.43 176.35 2jex h THR 41 N 0.00 1.35 -0.47 2.81 2.02 -0.41 -1.19 112.91 117.03 2jex h THR 41 Ca -0.00 -1.20 -0.02 0.00 0.77 0.00 0.00 66.41 65.96 2jex h THR 41 Cb 1.00 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 69.34 2jex h THR 41 CO 0.03 0.34 0.20 -0.07 0.37 0.00 0.00 175.52 176.39 2jex h LEU 42 N -0.19 0.63 -0.82 2.58 3.38 -1.09 0.34 115.31 120.14 2jex h LEU 42 Ca 0.02 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 2jex h LEU 42 Cb 0.57 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2jex h LEU 42 CO 0.02 0.61 0.36 -0.07 0.09 0.00 0.00 178.44 179.45 2jex h LEU 43 N 0.61 1.10 -0.34 1.67 3.38 -1.37 0.16 115.31 120.52 2jex h LEU 43 Ca 0.16 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2jex h LEU 43 Cb 0.16 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2jex h LEU 43 CO -0.02 0.95 -0.02 0.22 0.09 0.00 0.00 178.44 179.66 2jex h TYR 44 N 1.17 0.68 -0.60 1.13 3.20 -0.88 -1.34 116.97 120.33 2jex h TYR 44 Ca 0.28 -0.13 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2jex h TYR 44 Cb 0.17 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 2jex h TYR 44 CO 0.02 0.75 0.28 0.00 -1.64 0.00 0.00 178.16 177.56 2jex h ALA 45 N 0.84 1.36 -0.49 1.82 0.00 -0.53 -1.93 119.26 120.33 2jex h ALA 45 Ca 0.09 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2jex h ALA 45 Cb 0.49 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2jex h ALA 45 CO 0.02 0.50 0.17 0.00 0.00 0.00 0.00 179.25 179.93 2jex h ALA 46 N 1.46 0.65 -0.68 0.00 0.00 -0.49 -3.07 119.26 117.13 2jex h ALA 46 Ca 0.21 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.97 2jex h ALA 46 Cb 0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2jex h ALA 46 CO -0.03 0.29 0.43 -0.09 0.00 0.00 0.00 179.25 179.85 2jex h ARG 47 N 0.66 0.82 -0.08 0.00 9.65 -0.71 -0.30 114.38 124.41 2jex h ARG 47 Ca 0.16 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 59.02 2jex h ARG 47 Cb 0.25 -0.18 -0.00 0.00 -1.39 0.00 0.00 29.97 28.64 2jex h ARG 47 CO -0.01 0.54 0.06 0.87 2.80 0.00 0.00 179.97 184.24 2jex h LYS 48 N 0.84 0.00 -0.16 0.20 1.79 -1.32 -0.85 116.57 117.07 2jex h LYS 48 Ca 0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.74 2jex h LYS 48 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2jex h LYS 48 CO -0.10 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.90 2jex n LYS 49 N -4.43 1.89 -0.63 3.15 5.02 -0.79 -4.92 118.16 117.45 2jex n LYS 49 Ca -0.01 -1.33 0.00 0.00 -2.02 0.00 0.00 58.31 54.95 2jex n LYS 49 Cb 0.17 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 2jex n LYS 49 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jex n GLY 50 N 1.22 0.69 3.75 0.72 0.00 -0.32 -5.04 105.19 106.21 2jex n GLY 50 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2jex n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jex s VAL 51 N -2.08 3.58 0.00 1.61 1.01 -0.19 -4.93 120.40 119.40 2jex s VAL 51 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.48 2jex s VAL 51 Cb 0.00 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.43 2jex s VAL 51 CO 0.00 0.32 0.00 0.35 0.00 0.00 0.00 175.10 175.77 2jex n THR 52 N 1.65 0.00 -3.73 3.92 -2.24 -1.26 -4.16 114.28 108.45 2jex n THR 52 Ca 0.01 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.58 2jex n THR 52 Cb 0.45 -0.22 -0.18 0.00 -2.10 0.00 0.00 70.33 68.29 2jex n THR 52 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2jex s VAL 53 N -1.96 0.07 -0.43 2.28 1.01 -1.26 -0.84 120.40 119.26 2jex s VAL 53 Ca 0.00 0.29 -0.06 0.00 0.00 0.00 0.00 61.98 62.21 2jex s VAL 53 Cb 0.00 -0.28 0.11 0.00 0.00 0.00 0.00 36.38 36.21 2jex s VAL 53 CO 0.00 0.20 0.26 -0.22 0.00 0.00 0.00 175.10 175.34 2jex s LEU 54 N 1.95 5.44 0.00 3.92 2.96 -0.59 -4.95 118.68 127.39 2jex s LEU 54 Ca 0.03 -1.97 0.00 0.00 -0.22 0.00 0.00 54.13 51.96 2jex s LEU 54 Cb -0.12 -1.91 0.00 0.00 0.50 0.00 0.00 46.19 44.66 2jex s LEU 54 CO -0.04 -0.61 0.00 0.61 -1.32 0.00 0.00 176.35 175.00 2jex n GLY 55 N 4.73 2.01 1.07 7.98 0.00 -1.26 -3.02 105.19 116.69 2jex n GLY 55 Ca -0.05 -0.05 0.05 0.00 0.00 0.00 0.00 46.02 45.96 2jex n GLY 55 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2jex n HIS 56 N 0.00 0.00 -3.81 1.61 -0.00 -1.26 -5.04 115.22 106.72 2jex n HIS 56 Ca 0.00 -0.81 -0.13 0.00 0.46 0.00 0.00 57.72 57.25 2jex n HIS 56 Cb 0.00 -0.17 -0.13 0.00 -0.12 0.00 0.00 29.99 29.57 2jex n HIS 56 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2jex s ARG 58 N 0.21 4.46 -0.22 0.00 0.52 -1.26 -1.55 118.95 121.11 2jex s ARG 58 Ca -0.01 1.77 -0.23 0.00 -0.52 0.00 0.00 55.73 56.74 2jex s ARG 58 Cb -0.02 -2.99 -0.01 0.00 0.52 0.00 0.00 34.95 32.45 2jex s ARG 58 CO -0.01 0.06 0.76 0.08 0.02 0.00 0.00 175.30 176.21 2jex s VAL 59 N -1.29 4.90 0.93 3.52 1.01 -0.02 -4.89 120.40 124.56 2jex s VAL 59 Ca 0.49 1.45 -0.10 0.00 0.00 0.00 0.00 61.98 63.81 2jex s VAL 59 Cb -0.30 -4.06 0.14 0.00 0.00 0.00 0.00 36.38 32.16 2jex s VAL 59 CO 0.39 0.00 1.09 -2.65 0.00 0.00 0.00 175.10 173.93 2jex n PRO 60 N 5.59 -0.49 -1.50 2.72 -0.02 -1.26 -4.89 135.00 135.15 2jex n PRO 60 Ca 0.03 -0.08 -0.46 0.00 -2.02 0.00 0.00 63.50 60.97 2jex n PRO 60 Cb 0.48 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.60 2jex n PRO 60 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 2jex n HIS 61 N -4.23 0.48 -0.33 6.00 -0.00 -1.26 -4.71 115.22 111.17 2jex n HIS 61 Ca 0.11 0.83 0.06 0.00 -0.00 0.00 0.00 57.72 58.72 2jex n HIS 61 Cb 0.52 -2.12 0.25 0.00 -0.00 0.00 0.00 29.99 28.64 2jex n HIS 61 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 2jex h SER 62 N 1.56 0.90 -0.53 0.26 4.64 -1.93 -0.27 113.55 118.18 2jex h SER 62 Ca -0.34 0.02 0.04 0.00 -0.47 0.00 0.00 61.79 61.03 2jex h SER 62 Cb 1.39 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 63.28 2jex h SER 62 CO 0.59 0.54 0.35 0.58 -0.87 0.00 0.00 176.83 178.02 2jex h VAL 63 N 1.00 1.05 0.04 0.95 2.07 -1.98 0.84 116.25 120.22 2jex h VAL 63 Ca 0.43 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.75 2jex h VAL 63 Cb 0.34 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2jex h VAL 63 CO -0.19 0.11 -0.02 0.58 0.02 0.00 0.00 177.57 178.07 2jex h VAL 64 N 0.59 1.36 -0.73 2.57 2.07 -1.42 -2.42 116.25 118.27 2jex h VAL 64 Ca 0.21 -1.49 0.04 0.00 0.82 0.00 0.00 66.70 66.29 2jex h VAL 64 Cb 0.12 2.32 -0.05 0.00 -1.52 0.00 0.00 31.29 32.16 2jex h VAL 64 CO -0.06 0.37 0.45 0.00 0.02 0.00 0.00 177.57 178.35 2jex h GLN 66 N 0.85 1.29 -0.03 0.00 4.15 -0.88 -1.56 115.11 118.93 2jex h GLN 66 Ca 0.31 -0.08 -0.08 0.00 0.77 0.00 0.00 58.65 59.57 2jex h GLN 66 Cb 0.09 -0.29 0.00 0.00 0.21 0.00 0.00 27.48 27.49 2jex h GLN 66 CO -0.14 0.86 -0.28 1.49 -1.93 0.00 0.00 178.83 178.83 2jex h GLU 67 N 1.33 0.25 -0.49 1.69 4.57 -0.99 -2.20 114.58 118.74 2jex h GLU 67 Ca 0.36 -0.22 0.01 0.00 -1.18 0.00 0.00 59.36 58.33 2jex h GLU 67 Cb -0.15 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 2jex h GLU 67 CO -0.08 0.90 0.32 0.00 -1.18 0.00 0.00 179.01 178.97 2jex h ARG 68 N -0.32 0.63 -0.17 1.92 3.08 -1.21 0.00 114.38 118.31 2jex h ARG 68 Ca -0.03 -0.04 -0.20 0.00 0.07 0.00 0.00 59.98 59.79 2jex h ARG 68 Cb 0.97 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.88 2jex h ARG 68 CO 0.06 0.41 -0.67 0.00 -1.07 0.00 0.00 179.97 178.70 2jex h ALA 69 N 1.70 0.31 -0.49 0.04 0.00 -1.31 -2.40 119.26 117.10 2jex h ALA 69 Ca 0.18 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 2jex h ALA 69 Cb -0.06 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2jex h ALA 69 CO -0.04 0.61 0.14 0.87 0.00 0.00 0.00 179.25 180.83 2jex h LYS 70 N 0.47 0.78 -0.64 0.00 1.57 -0.92 0.12 116.57 117.96 2jex h LYS 70 Ca -0.04 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.59 2jex h LYS 70 Cb 1.30 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.46 2jex h LYS 70 CO 0.14 0.74 0.40 1.96 -0.57 0.00 0.00 179.45 182.13 2jex h GLN 71 N 0.67 0.78 -0.34 3.15 4.20 -1.05 -1.79 115.11 120.73 2jex h GLN 71 Ca 0.16 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.67 2jex h GLN 71 Cb 0.30 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2jex h GLN 71 CO -0.00 0.52 -0.39 0.00 -0.67 0.00 0.00 178.83 178.28 2jex h ALA 72 N 1.26 0.67 -0.06 3.87 0.00 -1.17 -0.91 119.26 122.91 2jex h ALA 72 Ca 0.25 -0.45 0.03 0.00 0.00 0.00 0.00 54.91 54.74 2jex h ALA 72 Cb -0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2jex h ALA 72 CO -0.08 0.67 -0.17 0.82 0.00 0.00 0.00 179.25 180.48 2jex h ILE 73 N 0.67 0.57 -0.83 0.00 2.04 -0.56 0.85 117.51 120.24 2jex h ILE 73 Ca 0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.97 2jex h ILE 73 Cb 0.96 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 37.55 2jex h ILE 73 CO 0.09 0.00 0.51 -0.08 0.00 0.00 0.00 178.15 178.67 2jex h GLU 74 N -0.25 0.92 0.03 2.37 4.81 -1.07 -0.68 114.58 120.70 2jex h GLU 74 Ca 0.07 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2jex h GLU 74 Cb 0.35 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.53 2jex h GLU 74 CO -0.21 0.61 -0.01 0.52 -0.73 0.00 0.00 179.01 179.19 2jex h MET 75 N 0.95 -0.04 0.01 1.92 2.86 -0.97 -1.99 114.93 117.67 2jex h MET 75 Ca 0.36 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 58.03 2jex h MET 75 Cb 0.15 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.76 2jex h MET 75 CO -0.16 0.35 -0.39 0.37 1.06 0.00 0.00 176.91 178.14 2jex h GLN 76 N -0.43 -0.53 -0.59 1.72 4.15 -0.50 0.92 115.11 119.84 2jex h GLN 76 Ca -0.00 0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.41 2jex h GLN 76 Cb 0.40 0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.19 2jex h GLN 76 CO 0.01 -0.35 0.21 -0.07 -1.93 0.00 0.00 178.83 176.69 2jex h LEU 77 N -0.55 0.84 -0.15 -2.39 3.38 -1.22 -0.17 115.31 115.04 2jex h LEU 77 Ca 0.05 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2jex h LEU 77 Cb 0.63 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2jex h LEU 77 CO -0.30 0.81 0.09 0.28 0.09 0.00 0.00 178.44 179.41 2jex h SER 78 N 0.83 0.18 -0.30 -0.43 0.02 -1.18 -1.61 113.55 111.06 2jex h SER 78 Ca 0.19 -0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.03 2jex h SER 78 Cb 0.25 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 2jex h SER 78 CO -0.01 0.17 -0.05 -0.07 -1.14 0.00 0.00 176.83 175.73 2jex h LEU 79 N 0.18 0.65 -0.86 5.07 3.38 -0.65 -1.34 115.31 121.74 2jex h LEU 79 Ca 0.06 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 2jex h LEU 79 Cb 0.02 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 2jex h LEU 79 CO -0.01 0.75 0.15 1.56 0.09 0.00 0.00 178.44 180.99 2jex h GLN 80 N 0.63 1.00 -0.25 1.13 4.20 -0.78 -1.84 115.11 119.20 2jex h GLN 80 Ca 0.12 -0.22 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 2jex h GLN 80 Cb 0.46 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 2jex h GLN 80 CO 0.02 0.89 0.09 0.93 -0.67 0.00 0.00 178.83 180.09 2jex h GLU 81 N 0.95 0.38 -0.59 1.46 5.08 -0.96 -3.22 114.58 117.69 2jex h GLU 81 Ca 0.20 -0.08 0.11 0.00 -1.00 0.00 0.00 59.36 58.59 2jex h GLU 81 Cb 0.34 -0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.45 2jex h GLU 81 CO 0.00 0.44 0.13 -0.07 -1.00 0.00 0.00 179.01 178.51 2jex h LEU 82 N 0.24 0.02 -2.29 1.33 3.38 -0.82 -2.04 115.31 115.12 2jex h LEU 82 Ca 0.08 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 2jex h LEU 82 Cb 0.21 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2jex h LEU 82 CO -0.00 0.02 -0.04 0.77 0.09 0.00 0.00 178.44 179.28 2jex h SER 83 N 0.27 0.00 -0.10 -0.43 4.64 -1.36 -0.22 113.55 116.35 2jex h SER 83 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2jex h SER 83 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 2jex h SER 83 CO -0.39 0.04 0.00 0.29 -0.87 0.00 0.00 176.83 175.90 2jex n LYS 84 N -3.82 1.34 -4.03 4.77 4.76 -0.77 -4.47 118.16 115.94 2jex n LYS 84 Ca -0.03 -0.52 -0.27 0.00 -2.87 0.00 0.00 58.31 54.63 2jex n LYS 84 Cb 0.13 -1.27 -0.03 0.00 -1.84 0.00 0.00 35.03 32.03 2jex n LYS 84 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2jex s THR 85 N -1.87 1.69 0.66 -0.18 -4.23 -0.10 -5.00 115.64 106.61 2jex s THR 85 Ca 0.23 -1.58 0.43 0.00 -1.18 0.00 0.00 61.69 59.59 2jex s THR 85 Cb 0.12 -2.28 0.43 0.00 1.34 0.00 0.00 72.50 72.12 2jex s THR 85 CO 0.18 0.00 2.34 1.05 -0.54 0.00 0.00 174.62 177.66 2jex h GLU 86 N 0.93 0.00 0.00 3.99 4.11 -1.90 -2.61 114.58 119.10 2jex h GLU 86 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.04 2jex h GLU 86 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 2jex h GLU 86 CO 0.61 0.00 -0.41 0.74 0.07 0.00 0.00 179.01 180.03 2jex h PHE 87 N 0.00 0.00 0.00 2.06 -1.00 -1.93 -3.34 116.94 112.73 2jex h PHE 87 Ca 0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 2jex h PHE 87 Cb 0.03 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.59 2jex h PHE 87 CO 0.00 0.00 -0.07 0.78 -1.61 0.00 0.00 178.31 177.41 2jex h GLY 88 N 4.36 0.00 1.80 -1.45 0.00 -1.40 -2.70 103.07 103.68 2jex h GLY 88 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2jex h GLY 88 CO 0.00 0.00 -0.28 -0.55 0.00 0.00 0.00 176.54 175.71 2jex h ASP 89 N 0.00 0.24 -4.03 0.19 5.19 -1.78 -3.43 116.42 112.79 2jex h ASP 89 Ca -0.00 -0.08 -0.52 0.00 -0.62 0.00 0.00 57.03 55.81 2jex h ASP 89 Cb 0.13 -0.06 0.20 0.00 0.18 0.00 0.00 39.33 39.78 2jex h ASP 89 CO 0.01 0.52 0.02 -0.62 -3.12 0.00 0.00 179.24 176.05 2jex n GLU 90 N -4.13 -0.36 -2.55 3.56 1.02 -1.02 -4.96 120.64 112.18 2jex n GLU 90 Ca -0.01 -0.04 -0.41 0.00 -0.02 0.00 0.00 57.16 56.67 2jex n GLU 90 Cb 0.38 -2.24 -0.04 0.00 -0.02 0.00 0.00 31.44 29.52 2jex n GLU 90 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 2jex s PRO 91 N -4.32 4.57 -0.10 3.49 0.02 -1.26 -4.66 135.00 132.74 2jex s PRO 91 Ca 0.65 1.65 0.00 0.00 0.02 0.00 0.00 61.00 63.32 2jex s PRO 91 Cb -0.23 -3.33 0.02 0.00 0.02 0.00 0.00 34.50 30.98 2jex s PRO 91 CO 0.60 0.01 -0.08 -1.58 -0.33 0.00 0.00 177.00 175.62 2jex s TRP 92 N 0.23 1.38 0.74 6.54 0.52 0.12 -5.01 118.94 123.46 2jex s TRP 92 Ca 0.51 -0.63 -0.02 0.00 0.02 0.00 0.00 56.10 55.98 2jex s TRP 92 Cb -0.27 -1.14 0.13 0.00 -1.15 0.00 0.00 33.47 31.04 2jex s TRP 92 CO 0.32 -0.44 1.02 -1.54 0.02 0.00 0.00 176.95 176.33 2jex s SER 93 N 1.48 4.27 0.15 2.95 1.04 -1.26 -3.33 113.70 119.00 2jex s SER 93 Ca 0.00 -0.27 -0.16 0.00 0.48 0.00 0.00 55.95 56.01 2jex s SER 93 Cb -0.13 -0.10 0.05 0.00 0.10 0.00 0.00 66.02 65.93 2jex s SER 93 CO -0.05 -1.92 1.77 -0.07 0.98 0.00 0.00 173.24 173.95 2jex h LEU 94 N -0.62 0.24 -0.85 2.42 3.38 -1.90 -2.86 115.31 115.11 2jex h LEU 94 Ca -0.38 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.51 2jex h LEU 94 Cb 1.27 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 2jex h LEU 94 CO 0.41 0.18 -0.27 -0.07 0.09 0.00 0.00 178.44 178.78 2jex h LEU 95 N 0.35 0.56 -1.83 1.67 3.38 -1.95 -2.12 115.31 115.37 2jex h LEU 95 Ca 0.16 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2jex h LEU 95 Cb 0.08 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2jex h LEU 95 CO -0.12 0.81 -0.09 0.44 0.09 0.00 0.00 178.44 179.57 2jex h ASP 96 N 0.48 0.00 -0.34 -0.43 3.32 -1.82 -2.70 116.42 114.93 2jex h ASP 96 Ca 0.07 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.96 2jex h ASP 96 Cb 0.72 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.18 2jex h ASP 96 CO 0.06 0.09 -0.05 0.35 -1.72 0.00 0.00 179.24 177.96 2jex n THR 97 N -4.43 2.51 -3.45 0.35 -2.24 -0.94 -4.21 114.28 101.86 2jex n THR 97 Ca -0.03 -2.59 -0.29 0.00 -2.27 0.00 0.00 64.05 58.87 2jex n THR 97 Cb 0.16 -0.31 -0.04 0.00 -2.10 0.00 0.00 70.33 68.05 2jex n THR 97 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2jex s SER 98 N -2.43 6.47 0.23 3.42 1.04 -0.84 -5.01 113.70 116.58 2jex s SER 98 Ca 0.44 0.68 -0.08 0.00 0.48 0.00 0.00 55.95 57.47 2jex s SER 98 Cb 0.39 -2.13 0.20 0.00 0.10 0.00 0.00 66.02 64.59 2jex s SER 98 CO 0.01 -0.12 1.88 -0.25 0.98 0.00 0.00 173.24 175.75 2jex h TRP 99 N 2.02 1.14 -0.72 5.02 2.91 -1.91 -1.56 115.95 122.86 2jex h TRP 99 Ca -0.47 0.00 -0.06 0.00 1.13 0.00 0.00 58.89 59.49 2jex h TRP 99 Cb 1.18 -0.38 -0.03 0.00 -0.51 0.00 0.00 29.16 29.42 2jex h TRP 99 CO 0.58 0.75 0.22 -0.44 -1.03 0.00 0.00 178.44 178.52 2jex h ASP 100 N 1.20 1.04 -0.37 2.65 3.32 -1.95 0.89 116.42 123.20 2jex h ASP 100 Ca 0.32 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 2jex h ASP 100 Cb -0.07 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.19 2jex h ASP 100 CO -0.06 0.97 0.15 -0.09 -1.72 0.00 0.00 179.24 178.49 2jex h ARG 101 N 1.07 0.56 -0.27 3.56 9.65 -1.73 0.21 114.38 127.43 2jex h ARG 101 Ca 0.23 -0.10 -0.02 0.00 -1.10 0.00 0.00 59.98 58.99 2jex h ARG 101 Cb 0.31 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.79 2jex h ARG 101 CO -0.01 0.54 0.08 -0.92 2.80 0.00 0.00 179.97 182.47 2jex h TYR 102 N 0.45 0.37 0.00 2.20 3.20 -0.80 -3.00 116.97 119.39 2jex h TYR 102 Ca 0.12 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.98 2jex h TYR 102 Cb 0.19 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.35 2jex h TYR 102 CO -0.00 0.31 -1.70 -1.33 -1.64 0.00 0.00 178.16 173.80 2jex n MET 103 N -4.41 0.60 -0.86 1.82 2.81 0.26 -1.08 117.12 116.26 2jex n MET 103 Ca 0.01 -0.12 -0.34 0.00 -1.81 0.00 0.00 57.70 55.44 2jex n MET 103 Cb 0.14 -1.58 0.10 0.00 -0.71 0.00 0.00 33.22 31.17 2jex n MET 103 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2jex n SER 104 N -2.29 -3.40 -4.74 7.83 7.64 0.71 -4.52 113.62 114.86 2jex n SER 104 Ca -0.03 0.26 -0.40 0.00 1.01 0.00 0.00 58.87 59.71 2jex n SER 104 Cb 0.55 -1.04 -0.05 0.00 -1.01 0.00 0.00 64.21 62.66 2jex n SER 104 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2jex s GLU 105 N -3.07 4.60 0.39 1.43 0.41 -1.26 -3.10 118.70 118.10 2jex s GLU 105 Ca 0.51 1.24 -0.23 0.00 -0.41 0.00 0.00 54.97 56.08 2jex s GLU 105 Cb -0.19 -3.35 -0.10 0.00 -1.78 0.00 0.00 34.13 28.70 2jex s GLU 105 CO 0.72 0.30 0.95 -1.25 -0.49 0.00 0.00 175.26 175.50 2jex s PRO 106 N -0.23 4.34 0.47 0.39 0.04 -1.26 -4.90 135.00 133.86 2jex s PRO 106 Ca 0.41 1.21 -0.21 0.00 0.04 0.00 0.00 61.00 62.46 2jex s PRO 106 Cb -0.22 -2.41 -0.08 0.00 0.04 0.00 0.00 34.50 31.83 2jex s PRO 106 CO 0.26 0.07 1.06 0.15 0.04 0.00 0.00 177.00 178.58 2jex s LYS 107 N -2.76 3.81 -0.98 4.56 1.02 -1.18 -4.10 119.74 120.10 2jex s LYS 107 Ca 0.58 1.46 -0.02 0.00 0.02 0.00 0.00 55.97 58.01 2jex s LYS 107 Cb -0.13 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 34.98 2jex s LYS 107 CO 0.17 -0.44 0.83 0.54 -0.92 0.00 0.00 175.35 175.54 2jex n ARG 108 N -0.79 -5.55 -3.71 1.68 1.74 -0.24 -5.02 116.66 104.77 2jex n ARG 108 Ca 0.09 0.67 -0.14 0.00 -0.77 0.00 0.00 57.85 57.69 2jex n ARG 108 Cb 0.51 -5.17 -0.08 0.00 -1.02 0.00 0.00 32.46 26.70 2jex n ARG 108 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jex s PHE 110 N -1.10 3.34 -0.06 0.00 0.40 -0.99 -4.22 117.98 115.37 2jex s PHE 110 Ca -0.11 1.40 -0.03 0.00 -0.60 0.00 0.00 56.93 57.59 2jex s PHE 110 Cb -0.04 -2.68 0.03 0.00 0.51 0.00 0.00 43.02 40.85 2jex s PHE 110 CO 0.05 0.00 0.13 0.15 0.70 0.00 0.00 175.22 176.25 2jex s LYS 111 N -3.07 0.09 0.12 0.44 1.02 -1.26 -0.70 119.74 116.37 2jex s LYS 111 Ca 0.58 0.31 0.05 0.00 0.02 0.00 0.00 55.97 56.93 2jex s LYS 111 Cb -0.10 -0.14 -0.04 0.00 -0.52 0.00 0.00 37.83 37.03 2jex s LYS 111 CO 0.15 -0.14 -0.13 0.15 -0.92 0.00 0.00 175.35 174.46 2jex s LYS 112 N 0.96 0.99 0.00 1.68 1.02 -0.06 -4.71 119.74 119.62 2jex s LYS 112 Ca -0.07 -1.24 0.00 0.00 0.02 0.00 0.00 55.97 54.68 2jex s LYS 112 Cb -0.10 -0.82 0.00 0.00 -0.52 0.00 0.00 37.83 36.39 2jex s LYS 112 CO -0.05 0.15 0.00 0.41 -0.92 0.00 0.00 175.35 174.94 2jex n GLY 113 N 0.49 -0.16 3.79 -3.33 0.00 -1.26 -1.12 105.19 103.60 2jex n GLY 113 Ca -0.15 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 2jex n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jex s ALA 114 N -2.19 3.46 0.09 4.61 0.00 -1.26 -0.04 121.76 126.43 2jex s ALA 114 Ca 0.00 0.29 -0.11 0.00 0.00 0.00 0.00 51.96 52.14 2jex s ALA 114 Cb 0.00 -2.89 0.01 0.00 0.00 0.00 0.00 23.12 20.24 2jex s ALA 114 CO 0.00 0.31 0.25 -0.98 0.00 0.00 0.00 175.76 175.34 2jex s ARG 115 N -1.27 0.89 -0.21 0.00 1.70 0.53 -4.97 118.95 115.62 2jex s ARG 115 Ca 0.36 -0.86 -0.12 0.00 -0.47 0.00 0.00 55.73 54.64 2jex s ARG 115 Cb -0.22 0.37 -0.05 0.00 -0.57 0.00 0.00 34.95 34.49 2jex s ARG 115 CO 0.24 -0.30 0.23 0.08 -1.08 0.00 0.00 175.30 174.48 2jex s VAL 116 N -3.72 5.32 -0.19 4.99 1.01 -1.26 -0.09 120.40 126.46 2jex s VAL 116 Ca 0.03 0.37 -0.10 0.00 0.00 0.00 0.00 61.98 62.29 2jex s VAL 116 Cb 0.04 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 2jex s VAL 116 CO -0.11 0.35 0.13 -0.69 0.00 0.00 0.00 175.10 174.78 2jex s VAL 117 N 0.86 5.39 -0.15 2.92 1.01 0.23 -4.82 120.40 125.84 2jex s VAL 117 Ca 0.12 0.18 -0.03 0.00 0.00 0.00 0.00 61.98 62.26 2jex s VAL 117 Cb -0.13 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.78 2jex s VAL 117 CO 0.04 0.46 -0.07 -0.70 0.00 0.00 0.00 175.10 174.83 2jex s GLU 118 N 0.24 3.57 -0.14 2.72 2.12 -0.42 0.10 118.70 126.89 2jex s GLU 118 Ca 0.08 -0.58 0.01 0.00 0.36 0.00 0.00 54.97 54.84 2jex s GLU 118 Cb -0.11 -2.83 -0.01 0.00 0.26 0.00 0.00 34.13 31.44 2jex s GLU 118 CO -0.01 0.22 -0.15 0.08 -0.54 0.00 0.00 175.26 174.85 2jex s VAL 119 N 0.40 2.74 -0.14 3.70 1.01 0.90 -0.91 120.40 128.10 2jex s VAL 119 Ca -0.06 -0.76 -0.03 0.00 0.00 0.00 0.00 61.98 61.13 2jex s VAL 119 Cb -0.15 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 2jex s VAL 119 CO 0.04 0.52 -0.05 -0.70 0.00 0.00 0.00 175.10 174.91 2jex s GLU 120 N 0.57 3.55 -0.11 2.72 2.12 -0.39 -0.60 118.70 126.56 2jex s GLU 120 Ca -0.09 -0.53 -0.07 0.00 0.36 0.00 0.00 54.97 54.63 2jex s GLU 120 Cb -0.16 -2.85 -0.02 0.00 0.26 0.00 0.00 34.13 31.35 2jex s GLU 120 CO 0.04 0.29 -0.15 1.19 -0.54 0.00 0.00 175.26 176.09 2jex n PHE 121 N 3.37 0.71 -1.52 5.30 3.01 0.17 -1.00 117.46 127.50 2jex n PHE 121 Ca -0.18 0.31 -0.25 0.00 1.01 0.00 0.00 57.45 58.34 2jex n PHE 121 Cb 0.53 -0.65 0.10 0.00 -0.01 0.00 0.00 39.48 39.44 2jex n PHE 121 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2jex n ASP 122 N -4.11 5.47 -1.48 4.37 8.00 -1.26 -3.40 116.55 124.14 2jex n ASP 122 Ca -0.06 -3.76 -0.17 0.00 0.71 0.00 0.00 54.79 51.52 2jex n ASP 122 Cb 0.22 -0.73 -0.05 0.00 -0.02 0.00 0.00 41.12 40.54 2jex n ASP 122 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jex n GLY 123 N -0.94 1.00 3.10 0.44 0.00 -1.26 -4.99 105.19 102.55 2jex n GLY 123 Ca 0.52 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.99 2jex n GLY 123 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jex s ASN 124 N -2.63 4.83 0.64 1.61 3.04 -1.26 -4.98 114.94 116.18 2jex s ASN 124 Ca 0.00 -1.65 0.35 0.00 0.04 0.00 0.00 52.86 51.60 2jex s ASN 124 Cb 0.00 -1.68 1.95 0.00 -1.54 0.00 0.00 41.25 39.98 2jex s ASN 124 CO 0.00 -0.32 2.15 0.00 -3.04 0.00 0.00 177.10 175.89 2jex h ALA 125 N 7.86 1.36 -0.00 1.71 0.00 -1.98 0.59 119.26 128.80 2jex h ALA 125 Ca -0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2jex h ALA 125 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2jex h ALA 125 CO 0.54 -0.19 -0.55 -1.13 0.00 0.00 0.00 179.25 177.92 2jex n SER 126 N -3.27 0.79 -4.25 0.00 3.41 -1.26 -4.62 113.62 104.43 2jex n SER 126 Ca -0.01 -0.60 -0.44 0.00 -0.26 0.00 0.00 58.87 57.56 2jex n SER 126 Cb 0.24 0.39 -0.04 0.00 -0.26 0.00 0.00 64.21 64.54 2jex n SER 126 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2jex s ASN 127 N -2.87 6.31 0.04 4.04 3.04 0.21 -5.03 114.94 120.68 2jex s ASN 127 Ca 0.13 -2.80 0.01 0.00 0.04 0.00 0.00 52.86 50.24 2jex s ASN 127 Cb 0.18 -2.10 -0.03 0.00 -1.54 0.00 0.00 41.25 37.76 2jex s ASN 127 CO 0.69 -0.49 -0.05 -0.89 -3.04 0.00 0.00 177.10 173.32 2jex s THR 128 N 0.01 0.35 0.03 -5.21 2.01 -1.26 0.45 115.64 112.02 2jex s THR 128 Ca 0.18 -1.29 -0.16 0.00 0.31 0.00 0.00 61.69 60.73 2jex s THR 128 Cb -0.13 -0.83 0.03 0.00 0.01 0.00 0.00 72.50 71.58 2jex s THR 128 CO -0.07 -0.62 0.36 0.21 -0.69 0.00 0.00 174.62 173.80 2jex s ASN 129 N -2.02 -0.21 0.05 3.53 3.04 0.24 -4.99 114.94 114.57 2jex s ASN 129 Ca -0.05 -0.05 0.05 0.00 0.04 0.00 0.00 52.86 52.85 2jex s ASN 129 Cb -0.04 0.38 -0.02 0.00 -1.54 0.00 0.00 41.25 40.02 2jex s ASN 129 CO -0.03 -0.60 -0.15 -1.66 -3.04 0.00 0.00 177.10 171.62 2jex s TRP 130 N -2.27 1.28 -0.03 0.43 -2.14 -1.26 -0.07 118.94 114.88 2jex s TRP 130 Ca -0.07 -0.38 0.02 0.00 2.66 0.00 0.00 56.10 58.33 2jex s TRP 130 Cb -0.02 -0.75 0.01 0.00 -3.10 0.00 0.00 33.47 29.62 2jex s TRP 130 CO -0.01 0.05 -0.08 0.71 -2.66 0.00 0.00 176.95 174.96 2jex s TYR 131 N -0.96 0.95 -0.25 1.66 1.51 0.12 -4.96 117.35 115.42 2jex s TYR 131 Ca 0.01 -0.26 -0.21 0.00 -1.01 0.00 0.00 57.07 55.60 2jex s TYR 131 Cb -0.08 -0.71 -0.02 0.00 -0.11 0.00 0.00 41.96 41.04 2jex s TYR 131 CO 0.02 -0.14 0.67 0.99 -1.11 0.00 0.00 175.55 175.97 2jex s THR 132 N 0.41 4.96 -0.01 -0.71 2.01 -1.26 0.74 115.64 121.77 2jex s THR 132 Ca -0.06 1.22 0.06 0.00 0.31 0.00 0.00 61.69 63.21 2jex s THR 132 Cb -0.11 -3.97 -0.03 0.00 0.01 0.00 0.00 72.50 68.41 2jex s THR 132 CO 0.01 0.02 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.08 2jex s VAL 133 N 2.51 2.72 -0.18 3.82 1.01 0.87 -4.94 120.40 126.21 2jex s VAL 133 Ca 0.28 -0.98 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 2jex s VAL 133 Cb -0.15 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 2jex s VAL 133 CO 0.08 0.50 -0.00 -0.31 0.00 0.00 0.00 175.10 175.37 2jex s TYR 134 N -0.77 3.07 0.02 5.22 1.51 -1.26 -0.35 117.35 124.80 2jex s TYR 134 Ca 0.12 -0.28 0.27 0.00 -1.01 0.00 0.00 57.07 56.17 2jex s TYR 134 Cb -0.10 -2.03 0.95 0.00 -0.11 0.00 0.00 41.96 40.67 2jex s TYR 134 CO 0.02 -0.07 1.83 0.66 -1.11 0.00 0.00 175.55 176.87 2jex h SER 135 N 7.00 0.00 -3.26 2.29 4.64 -0.35 -3.21 113.55 120.67 2jex h SER 135 Ca -0.34 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.43 2jex h SER 135 Cb 1.18 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.90 2jex h SER 135 CO 0.63 0.12 -0.80 0.20 -0.87 0.00 0.00 176.83 176.11 2jex s ASN 136 N -6.02 2.61 -0.08 4.97 0.01 -0.27 -3.56 114.94 112.60 2jex s ASN 136 Ca 0.02 -0.52 0.04 0.00 -0.71 0.00 0.00 52.86 51.69 2jex s ASN 136 Cb 0.09 -0.94 0.00 0.00 0.41 0.00 0.00 41.25 40.81 2jex s ASN 136 CO 0.61 -0.14 -0.21 -0.76 -1.51 0.00 0.00 177.10 175.09 2jex s LEU 137 N 1.63 1.96 -0.31 0.60 1.43 0.93 -0.88 118.68 124.03 2jex s LEU 137 Ca 0.03 -0.46 -0.00 0.00 -1.03 0.00 0.00 54.13 52.66 2jex s LEU 137 Cb -0.14 -1.21 0.07 0.00 0.03 0.00 0.00 46.19 44.94 2jex s LEU 137 CO -0.08 0.15 0.02 -0.31 0.23 0.00 0.00 176.35 176.35 2jex s TYR 138 N 0.27 3.39 -0.01 0.29 1.51 0.12 0.62 117.35 123.54 2jex s TYR 138 Ca -0.13 -2.21 0.06 0.00 -1.01 0.00 0.00 57.07 53.78 2jex s TYR 138 Cb -0.16 -2.36 -0.02 0.00 -0.11 0.00 0.00 41.96 39.31 2jex s TYR 138 CO 0.06 -0.87 -0.20 0.00 -1.11 0.00 0.00 175.55 173.43 2jex s MET 139 N 1.15 1.60 -0.15 -0.62 0.23 -0.74 -2.34 119.30 118.44 2jex s MET 139 Ca -0.02 -0.75 -0.29 0.00 -1.03 0.00 0.00 55.69 53.60 2jex s MET 139 Cb -0.20 -1.57 -0.01 0.00 -1.53 0.00 0.00 34.83 31.52 2jex s MET 139 CO -0.03 0.43 1.07 0.50 -2.03 0.00 0.00 175.02 174.95 2jex s ARG 140 N -0.57 4.34 0.51 3.16 3.52 -1.26 -1.27 118.95 127.38 2jex s ARG 140 Ca 0.08 1.44 0.08 0.00 -0.13 0.00 0.00 55.73 57.20 2jex s ARG 140 Cb -0.08 -3.60 0.08 0.00 -1.56 0.00 0.00 34.95 29.79 2jex s ARG 140 CO -0.00 -0.49 0.63 2.41 -0.81 0.00 0.00 175.30 177.04 2jex n THR 141 N 4.92 0.00 0.40 4.11 -1.04 0.72 -4.97 114.28 118.42 2jex n THR 141 Ca 0.11 -1.80 0.07 0.00 -2.04 0.00 0.00 64.05 60.39 2jex n THR 141 Cb 0.47 -0.44 0.32 0.00 -1.82 0.00 0.00 70.33 68.86 2jex n THR 141 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2jex n GLU 142 N -2.01 0.05 -2.90 -2.82 4.07 -1.26 -3.15 120.64 112.61 2jex n GLU 142 Ca 0.10 0.33 -0.34 0.00 -0.06 0.00 0.00 57.16 57.20 2jex n GLU 142 Cb 0.55 -1.60 -0.02 0.00 -0.06 0.00 0.00 31.44 30.31 2jex n GLU 142 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2jex n ASP 143 N -1.68 5.72 -0.07 4.31 9.92 -1.26 -5.07 116.55 128.42 2jex n ASP 143 Ca 0.03 -3.62 0.00 0.00 -0.53 0.00 0.00 54.79 50.66 2jex n ASP 143 Cb 0.16 -0.89 0.00 0.00 -0.64 0.00 0.00 41.12 39.74 2jex n ASP 143 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jex n GLY 144 N 0.16 0.62 3.80 0.44 0.00 -1.19 -4.73 105.19 104.29 2jex n GLY 144 Ca 0.36 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 2jex n GLY 144 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jex s TRP 145 N 0.00 3.60 -0.01 1.61 0.52 -1.26 -0.20 118.94 123.20 2jex s TRP 145 Ca 0.00 1.63 -0.08 0.00 0.02 0.00 0.00 56.10 57.67 2jex s TRP 145 Cb 0.00 -2.82 0.01 0.00 -1.15 0.00 0.00 33.47 29.51 2jex s TRP 145 CO 0.00 0.18 0.17 1.14 0.02 0.00 0.00 176.95 178.46 2jex s GLN 146 N -2.28 0.46 0.00 4.98 -2.07 -0.40 -4.93 119.66 115.43 2jex s GLN 146 Ca 0.51 -0.26 -0.26 0.00 -1.82 0.00 0.00 55.36 53.53 2jex s GLN 146 Cb -0.16 0.20 -0.04 0.00 -1.09 0.00 0.00 33.01 31.91 2jex s GLN 146 CO 0.21 -0.11 0.81 -1.17 -1.32 0.00 0.00 175.29 173.71 2jex s LEU 147 N -1.12 4.39 0.10 2.60 2.96 -1.26 -1.79 118.68 124.56 2jex s LEU 147 Ca -0.12 1.44 0.06 0.00 -0.22 0.00 0.00 54.13 55.29 2jex s LEU 147 Cb -0.06 -3.29 -0.03 0.00 0.50 0.00 0.00 46.19 43.31 2jex s LEU 147 CO 0.02 -0.10 -0.15 0.00 -1.32 0.00 0.00 176.35 174.80 2jex s ALA 148 N 0.47 1.42 -0.08 5.97 0.00 0.20 -4.97 121.76 124.77 2jex s ALA 148 Ca 0.42 -1.17 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 2jex s ALA 148 Cb -0.20 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.78 2jex s ALA 148 CO 0.23 0.17 -0.04 0.15 0.00 0.00 0.00 175.76 176.27 2jex s LYS 149 N -2.16 2.90 0.08 0.00 3.01 -1.25 -0.05 119.74 122.27 2jex s LYS 149 Ca 0.04 -0.50 0.06 0.00 -1.01 0.00 0.00 55.97 54.56 2jex s LYS 149 Cb -0.08 -2.68 -0.04 0.00 -1.01 0.00 0.00 37.83 34.02 2jex s LYS 149 CO 0.03 0.64 -0.07 0.00 0.51 0.00 0.00 175.35 176.46 2jex s ALA 150 N -0.73 3.05 0.31 5.17 0.00 -1.21 -2.44 121.76 125.91 2jex s ALA 150 Ca 0.11 -1.16 -0.09 0.00 0.00 0.00 0.00 51.96 50.82 2jex s ALA 150 Cb -0.11 -1.02 0.04 0.00 0.00 0.00 0.00 23.12 22.02 2jex s ALA 150 CO 0.02 0.65 0.57 0.41 0.00 0.00 0.00 175.76 177.41 2jex n GLY 151 N 0.86 1.47 3.19 0.00 0.00 -0.65 -4.53 105.19 105.53 2jex n GLY 151 Ca -0.13 -1.30 -0.22 0.00 0.00 0.00 0.00 46.02 44.37 2jex n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jex s ALA 152 N -2.04 1.39 0.00 4.61 0.00 -1.26 -1.53 121.76 122.92 2jex s ALA 152 Ca 0.16 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.17 2jex s ALA 152 Cb -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.87 2jex s ALA 152 CO 0.11 0.28 0.00 -0.40 0.00 0.00 0.00 175.76 175.75 2jex n ASP 153 N 1.74 0.24 0.28 0.00 3.85 -0.82 -4.90 116.55 116.94 2jex n ASP 153 Ca -0.18 0.00 0.18 0.00 -0.71 0.00 0.00 54.79 54.08 2jex n ASP 153 Cb 0.54 0.00 0.75 0.00 -1.35 0.00 0.00 41.12 41.06 2jex n ASP 153 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 2jex h GLY 154 N 0.00 0.00 0.31 6.12 0.00 -1.92 -3.27 103.07 104.31 2jex h GLY 154 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.03 2jex h GLY 154 CO 0.00 0.00 -1.67 2.41 0.00 0.00 0.00 176.54 177.28 2jex n THR 155 N -3.06 1.66 -3.48 4.70 -1.04 -1.26 -4.53 114.28 107.27 2jex n THR 155 Ca 0.00 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 2jex n THR 155 Cb 0.27 -1.88 0.00 0.00 -1.82 0.00 0.00 70.33 66.90 2jex n THR 155 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jex n GLY 156 N 1.71 -0.68 3.85 3.41 0.00 -1.24 0.34 105.19 112.59 2jex n GLY 156 Ca -0.33 -0.87 -0.37 0.00 0.00 0.00 0.00 46.02 44.45 2jex n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jex s LEU 157 N 0.00 4.44 0.12 0.99 1.43 -1.03 -1.94 118.68 122.69 2jex s LEU 157 Ca 0.00 0.85 -0.14 0.00 -1.03 0.00 0.00 54.13 53.80 2jex s LEU 157 Cb 0.00 -2.58 0.03 0.00 0.03 0.00 0.00 46.19 43.67 2jex s LEU 157 CO 0.00 0.31 0.35 -0.72 0.23 0.00 0.00 176.35 176.52 2jex s TYR 158 N -1.13 -0.12 0.11 0.29 -0.85 -0.58 -1.29 117.35 113.77 2jex s TYR 158 Ca 0.24 -0.23 0.06 0.00 -0.52 0.00 0.00 57.07 56.62 2jex s TYR 158 Cb -0.15 0.19 -0.04 0.00 0.38 0.00 0.00 41.96 42.34 2jex s TYR 158 CO 0.13 -0.67 -0.15 1.52 -1.52 0.00 0.00 175.55 174.86 2jex s TYR 159 N -3.82 1.38 0.04 -3.49 1.13 -0.02 -1.64 117.35 110.93 2jex s TYR 159 Ca 0.04 -0.52 0.09 0.00 -1.41 0.00 0.00 57.07 55.26 2jex s TYR 159 Cb 0.03 -0.74 -0.03 0.00 -1.10 0.00 0.00 41.96 40.12 2jex s TYR 159 CO -0.12 0.13 -0.25 0.00 -2.51 0.00 0.00 175.55 172.80 2jex s THR 161 N -0.80 0.26 -0.27 0.00 -4.23 -1.26 -3.88 115.64 105.47 2jex s THR 161 Ca 0.11 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.73 2jex s THR 161 Cb -0.10 -2.54 0.52 0.00 1.34 0.00 0.00 72.50 71.72 2jex s THR 161 CO 0.02 0.00 1.47 0.23 -0.54 0.00 0.00 174.62 175.80 2jex n MET 162 N -0.46 2.12 0.04 3.99 2.81 -1.26 -3.98 117.12 120.38 2jex n MET 162 Ca 0.02 -3.08 -0.22 0.00 -1.81 0.00 0.00 57.70 52.60 2jex n MET 162 Cb 0.65 -1.84 -0.14 0.00 -0.71 0.00 0.00 33.22 31.18 2jex n MET 162 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2jex h ALA 163 N 1.18 0.23 -2.38 3.04 0.00 -1.99 -3.43 119.26 115.92 2jex h ALA 163 Ca 0.18 -1.20 -0.53 0.00 0.00 0.00 0.00 54.91 53.36 2jex h ALA 163 Cb 1.66 0.53 -0.37 0.00 0.00 0.00 0.00 17.79 19.61 2jex h ALA 163 CO 0.38 1.06 -0.84 0.20 0.00 0.00 0.00 179.25 180.05 2jex s GLY 164 N -5.21 0.71 -0.15 0.00 0.00 -1.26 -5.12 107.32 96.30 2jex s GLY 164 Ca -0.19 -1.80 -0.37 0.00 0.00 0.00 0.00 44.72 42.36 2jex s GLY 164 CO 0.81 2.26 1.76 0.00 0.00 0.00 0.00 173.10 177.93 2jex n ALA 165 N 3.78 0.27 0.00 3.20 0.00 -1.26 -4.77 120.51 121.73 2jex n ALA 165 Ca 0.16 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.96 2jex n ALA 165 Cb 0.41 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.53 2jex n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jex n GLY 166 N 4.09 3.11 3.70 0.00 0.00 -1.26 -5.08 105.19 109.76 2jex n GLY 166 Ca 0.24 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 2jex n GLY 166 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jex s ARG 167 N -2.20 4.48 -0.31 1.61 0.52 -1.26 -4.15 118.95 117.63 2jex s ARG 167 Ca 0.00 1.53 -0.06 0.00 -0.52 0.00 0.00 55.73 56.69 2jex s ARG 167 Cb 0.00 -3.46 0.03 0.00 0.52 0.00 0.00 34.95 32.04 2jex s ARG 167 CO 0.00 -0.20 0.07 0.42 0.02 0.00 0.00 175.30 175.61 2jex s ILE 168 N 1.36 3.68 -0.06 1.52 1.01 0.15 -4.92 121.20 123.94 2jex s ILE 168 Ca 0.54 -1.00 -0.27 0.00 0.00 0.00 0.00 60.65 59.92 2jex s ILE 168 Cb -0.23 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 2jex s ILE 168 CO 0.26 -0.05 0.86 -0.31 0.00 0.00 0.00 174.94 175.70 2jex s TYR 169 N 1.41 3.58 -0.38 3.97 2.02 -1.26 -0.84 117.35 125.85 2jex s TYR 169 Ca -0.00 1.46 0.15 0.00 -0.37 0.00 0.00 57.07 58.30 2jex s TYR 169 Cb -0.18 -2.99 -0.20 0.00 -0.40 0.00 0.00 41.96 38.19 2jex s TYR 169 CO 0.02 -0.02 0.49 2.48 -1.57 0.00 0.00 175.55 176.95 2jex n TYR 170 N 4.13 0.00 -4.12 2.71 0.18 -0.41 -4.97 117.16 114.69 2jex n TYR 170 Ca 0.03 0.00 -0.15 0.00 1.88 0.00 0.00 57.90 59.67 2jex n TYR 170 Cb 0.51 -0.16 -0.13 0.00 -0.38 0.00 0.00 39.34 39.18 2jex n TYR 170 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2jex s SER 171 N -3.04 0.84 -0.14 9.48 0.15 -1.01 -4.99 113.70 114.99 2jex s SER 171 Ca 0.00 -0.39 0.02 0.00 0.70 0.00 0.00 55.95 56.28 2jex s SER 171 Cb 0.11 -0.01 0.01 0.00 -1.71 0.00 0.00 66.02 64.42 2jex s SER 171 CO 0.62 -0.09 -0.20 0.00 1.20 0.00 0.00 173.24 174.77 2jex s ALA 172 N -0.91 2.15 0.19 5.45 0.00 -1.26 -2.45 121.76 124.92 2jex s ALA 172 Ca -0.05 -1.04 0.29 0.00 0.00 0.00 0.00 51.96 51.15 2jex s ALA 172 Cb -0.07 -0.99 1.21 0.00 0.00 0.00 0.00 23.12 23.27 2jex s ALA 172 CO 0.00 -0.09 1.94 0.74 0.00 0.00 0.00 175.76 178.35 2jex h PHE 173 N 7.45 0.00 -0.07 0.00 0.04 -0.42 -2.45 116.94 121.48 2jex h PHE 173 Ca -0.34 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.36 2jex h PHE 173 Cb 1.18 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.32 2jex h PHE 173 CO 0.47 0.13 -0.26 0.78 -0.60 0.00 0.00 178.31 178.83 2jex h GLY 174 N 1.79 0.13 1.84 -1.45 0.00 -1.88 0.89 103.07 104.39 2jex h GLY 174 Ca -0.00 -0.09 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 2jex h GLY 174 CO 0.02 0.09 -0.65 -0.55 0.00 0.00 0.00 176.54 175.44 2jex h ASP 175 N 0.11 0.19 -0.22 0.19 3.45 -1.81 -2.58 116.42 115.74 2jex h ASP 175 Ca 0.02 -0.12 -0.12 0.00 0.43 0.00 0.00 57.03 57.25 2jex h ASP 175 Cb 0.52 -0.05 -0.00 0.00 -0.56 0.00 0.00 39.33 39.24 2jex h ASP 175 CO 0.04 0.79 -0.31 -0.33 -1.57 0.00 0.00 179.24 177.85 2jex h GLU 176 N 0.11 0.61 0.00 3.56 4.39 -1.23 -3.19 114.58 118.83 2jex h GLU 176 Ca -0.01 -0.35 -0.04 0.00 0.34 0.00 0.00 59.36 59.30 2jex h GLU 176 Cb 1.17 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.84 2jex h GLU 176 CO 0.10 0.96 -0.18 0.00 -1.16 0.00 0.00 179.01 178.72 2jex h ALA 177 N 0.64 1.18 0.00 3.43 0.00 -0.89 -0.96 119.26 122.67 2jex h ALA 177 Ca 0.02 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2jex h ALA 177 Cb 0.89 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2jex h ALA 177 CO 0.07 0.23 -0.02 0.00 0.00 0.00 0.00 179.25 179.53 2jex h ALA 178 N 1.82 1.01 0.05 0.00 0.00 -1.45 -1.59 119.26 119.10 2jex h ALA 178 Ca -0.00 -0.02 -0.37 0.00 0.00 0.00 0.00 54.91 54.52 2jex h ALA 178 Cb 0.52 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 2jex h ALA 178 CO 0.02 0.02 -2.14 0.54 0.00 0.00 0.00 179.25 177.70 2jex n ARG 179 N -3.13 0.67 0.00 0.00 1.74 -0.65 -4.76 116.66 110.53 2jex n ARG 179 Ca 0.00 0.27 0.04 0.00 -0.77 0.00 0.00 57.85 57.40 2jex n ARG 179 Cb 0.30 -1.62 0.01 0.00 -1.02 0.00 0.00 32.46 30.14 2jex n ARG 179 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2jex n PHE 180 N -3.67 0.00 -4.45 -1.55 0.99 -0.46 -4.99 117.46 103.34 2jex n PHE 180 Ca -0.40 0.00 -0.24 0.00 -0.00 0.00 0.00 57.45 56.80 2jex n PHE 180 Cb 0.95 0.00 -0.10 0.00 -1.00 0.00 0.00 39.48 39.33 2jex n PHE 180 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2jex s SER 181 N -1.09 3.66 -0.06 4.37 1.04 -0.60 -4.86 113.70 116.17 2jex s SER 181 Ca 0.08 -0.97 0.16 0.00 0.48 0.00 0.00 55.95 55.70 2jex s SER 181 Cb 0.07 -0.35 -0.25 0.00 0.10 0.00 0.00 66.02 65.60 2jex s SER 181 CO 0.18 0.05 0.29 0.35 0.98 0.00 0.00 173.24 175.09 2jex n THR 182 N -0.53 0.29 -0.10 2.02 -2.24 -1.26 -4.68 114.28 107.78 2jex n THR 182 Ca -0.06 -0.46 -0.12 0.00 -2.27 0.00 0.00 64.05 61.13 2jex n THR 182 Cb 0.59 -0.07 -0.11 0.00 -2.10 0.00 0.00 70.33 68.64 2jex n THR 182 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2jex n THR 183 N -2.22 1.17 0.00 4.28 -2.24 -1.26 -5.04 114.28 108.97 2jex n THR 183 Ca -0.09 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 2jex n THR 183 Cb 0.60 -0.98 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 2jex n THR 183 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jex n GLY 184 N 2.30 1.96 3.88 3.38 0.00 -1.26 -4.91 105.19 110.53 2jex n GLY 184 Ca -0.33 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 2jex n GLY 184 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jex s HIS 185 N -2.29 3.49 0.13 1.61 3.76 -1.26 -1.99 115.29 118.74 2jex s HIS 185 Ca 0.00 1.00 -0.25 0.00 -0.15 0.00 0.00 55.06 55.66 2jex s HIS 185 Cb 0.00 -2.41 0.07 0.00 1.11 0.00 0.00 32.58 31.35 2jex s HIS 185 CO 0.00 -0.13 0.82 1.52 -0.85 0.00 0.00 174.74 176.10 2jex s TYR 186 N -2.43 -0.29 0.01 1.40 -0.85 -0.78 -4.21 117.35 110.20 2jex s TYR 186 Ca 0.50 0.02 0.03 0.00 -0.52 0.00 0.00 57.07 57.10 2jex s TYR 186 Cb -0.10 0.61 -0.01 0.00 0.38 0.00 0.00 41.96 42.83 2jex s TYR 186 CO 0.34 -0.82 -0.08 -1.54 -1.52 0.00 0.00 175.55 171.92 2jex s SER 187 N -2.76 0.96 -0.17 -0.18 1.04 -0.17 -1.81 113.70 110.60 2jex s SER 187 Ca 0.08 -0.22 0.01 0.00 0.48 0.00 0.00 55.95 56.29 2jex s SER 187 Cb -0.02 -0.08 0.01 0.00 0.10 0.00 0.00 66.02 66.03 2jex s SER 187 CO -0.03 0.05 -0.18 -0.69 0.98 0.00 0.00 173.24 173.36 2jex s VAL 188 N -0.40 2.30 -0.25 5.02 1.01 0.42 -1.26 120.40 127.24 2jex s VAL 188 Ca 0.01 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.06 2jex s VAL 188 Cb -0.04 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 2jex s VAL 188 CO -0.00 0.53 0.03 -0.60 0.00 0.00 0.00 175.10 175.06 2jex s ARG 189 N 1.06 3.40 -0.24 2.72 3.52 -0.09 -0.25 118.95 129.07 2jex s ARG 189 Ca -0.01 -0.63 -0.16 0.00 -0.13 0.00 0.00 55.73 54.80 2jex s ARG 189 Cb -0.14 -3.22 -0.10 0.00 -1.56 0.00 0.00 34.95 29.93 2jex s ARG 189 CO -0.06 -0.26 -0.35 -3.47 -0.81 0.00 0.00 175.30 170.35 2jex n ASP 190 N 4.86 1.95 0.00 -2.12 2.03 -1.07 -1.30 116.55 120.90 2jex n ASP 190 Ca -0.16 0.34 0.00 0.00 0.52 0.00 0.00 54.79 55.48 2jex n ASP 190 Cb 0.50 -0.79 0.00 0.00 -0.72 0.00 0.00 41.12 40.11 2jex n ASP 190 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jex n GLN 191 N -4.34 0.00 -0.01 -0.67 6.02 -1.26 -4.60 117.38 112.52 2jex n GLN 191 Ca -0.37 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.62 2jex n GLN 191 Cb 0.73 0.00 0.01 0.00 1.02 0.00 0.00 30.24 32.00 2jex n GLN 191 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2jex n ASP 192 N -1.42 1.84 -4.41 1.08 5.75 -1.26 -5.02 116.55 113.11 2jex n ASP 192 Ca 0.00 -1.79 -0.32 0.00 -0.01 0.00 0.00 54.79 52.67 2jex n ASP 192 Cb 0.00 -0.01 -0.14 0.00 -1.03 0.00 0.00 41.12 39.94 2jex n ASP 192 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2jex s ARG 193 N -0.80 2.30 -0.11 0.11 0.52 -1.26 -5.12 118.95 114.59 2jex s ARG 193 Ca 0.01 -0.82 0.02 0.00 -0.52 0.00 0.00 55.73 54.42 2jex s ARG 193 Cb 0.01 -2.23 -0.01 0.00 0.52 0.00 0.00 34.95 33.24 2jex s ARG 193 CO 0.01 0.59 -0.16 0.08 0.02 0.00 0.00 175.30 175.83 2jex s VAL 194 N -0.70 2.76 0.15 3.52 1.01 -1.26 -2.58 120.40 123.29 2jex s VAL 194 Ca 0.11 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.39 2jex s VAL 194 Cb -0.10 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2jex s VAL 194 CO 0.00 0.54 -0.07 -0.31 0.00 0.00 0.00 175.10 175.26 2jex s TYR 195 N 0.20 2.73 0.21 5.22 1.51 0.65 -4.94 117.35 122.94 2jex s TYR 195 Ca -0.10 -0.17 0.08 0.00 -1.01 0.00 0.00 57.07 55.87 2jex s TYR 195 Cb -0.16 -1.37 -0.04 0.00 -0.11 0.00 0.00 41.96 40.28 2jex s TYR 195 CO 0.06 0.48 0.03 0.00 -1.11 0.00 0.00 175.55 175.01 2jex s ALA 196 N -1.50 3.26 0.17 3.71 0.00 -1.26 -0.43 121.76 125.71 2jex s ALA 196 Ca 0.24 -1.45 -0.21 0.00 0.00 0.00 0.00 51.96 50.54 2jex s ALA 196 Cb -0.10 -0.99 0.06 0.00 0.00 0.00 0.00 23.12 22.08 2jex s ALA 196 CO 0.15 0.39 0.58 0.20 0.00 0.00 0.00 175.76 177.08 2jex s GLY 197 N -3.28 -0.47 0.06 0.00 0.00 -0.75 -4.49 107.32 98.39 2jex s GLY 197 Ca 0.29 0.27 -0.04 0.00 0.00 0.00 0.00 44.72 45.25 2jex s GLY 197 CO 0.20 0.03 0.05 0.14 0.00 0.00 0.00 173.10 173.52 2jex s VAL 198 N -3.79 0.19 0.00 1.40 1.01 -1.26 -1.86 120.40 116.10 2jex s VAL 198 Ca 0.03 -1.58 0.00 0.00 0.00 0.00 0.00 61.98 60.43 2jex s VAL 198 Cb -0.01 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.92 2jex s VAL 198 CO -0.10 -0.87 0.30 -1.20 0.00 0.00 0.00 175.10 173.23