#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxn n ASP 2 N 0.00 -1.93 0.08 7.83 5.68 -1.26 -4.97 116.55 121.99 2jxn n ASP 2 Ca 0.00 -3.56 0.12 0.00 -0.50 0.00 0.00 54.79 50.85 2jxn n ASP 2 Cb 0.00 1.54 0.45 0.00 -1.14 0.00 0.00 41.12 41.97 2jxn n ASP 2 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 2jxn n PRO 3 N 0.49 0.16 -0.07 0.11 -0.04 -1.26 -3.24 135.00 131.14 2jxn n PRO 3 Ca 0.09 0.28 -0.14 0.00 -0.04 0.00 0.00 63.50 63.69 2jxn n PRO 3 Cb 0.68 -1.74 -0.06 0.00 -0.04 0.00 0.00 33.50 32.35 2jxn n PRO 3 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2jxn h GLU 4 N 0.00 0.61 -0.99 0.54 4.11 -2.00 -2.69 114.58 114.17 2jxn h GLU 4 Ca 0.00 -0.35 0.01 0.00 0.07 0.00 0.00 59.36 59.08 2jxn h GLU 4 Cb 0.47 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.70 2jxn h GLU 4 CO 0.00 0.96 0.64 1.25 0.07 0.00 0.00 179.01 181.93 2jxn h LEU 5 N 0.31 1.14 -0.27 3.06 6.46 -1.98 -1.55 115.31 122.48 2jxn h LEU 5 Ca 0.03 -0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 2jxn h LEU 5 Cb 0.89 -0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 40.52 2jxn h LEU 5 CO 0.07 0.84 0.14 1.56 -0.62 0.00 0.00 178.44 180.43 2jxn h GLN 6 N 1.34 0.38 -0.06 1.25 1.08 -1.66 -1.89 115.11 115.56 2jxn h GLN 6 Ca 0.36 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.49 2jxn h GLN 6 Cb -0.13 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.22 2jxn h GLN 6 CO -0.08 0.36 -0.05 0.00 -0.95 0.00 0.00 178.83 178.11 2jxn h ILE 8 N 0.08 1.35 -0.68 0.00 2.04 -0.67 -3.20 117.51 116.43 2jxn h ILE 8 Ca 0.02 -1.81 0.04 0.00 1.00 0.00 0.00 64.86 64.11 2jxn h ILE 8 Cb 0.14 1.86 -0.05 0.00 -0.74 0.00 0.00 36.82 38.03 2jxn h ILE 8 CO 0.01 0.54 0.41 -0.09 0.00 0.00 0.00 178.15 179.02 2jxn h ARG 9 N 0.23 0.77 -0.35 2.37 2.43 -0.54 0.58 114.38 119.87 2jxn h ARG 9 Ca 0.01 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.08 2jxn h ARG 9 Cb 1.01 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 2jxn h ARG 9 CO 0.09 0.51 0.01 1.05 -1.51 0.00 0.00 179.97 180.11 2jxn h GLU 10 N 0.80 0.54 -0.06 0.20 -0.00 -1.57 -2.41 114.58 112.09 2jxn h GLU 10 Ca 0.28 -0.11 -0.18 0.00 -0.00 0.00 0.00 59.36 59.35 2jxn h GLU 10 Cb 0.07 -0.08 -0.01 0.00 -0.00 0.00 0.00 28.75 28.73 2jxn h GLU 10 CO -0.13 0.56 -0.73 0.00 -0.00 0.00 0.00 179.01 178.71 2jxn h ARG 12 N 0.21 1.02 -0.72 0.00 2.47 -0.40 0.80 114.38 117.77 2jxn h ARG 12 Ca -0.03 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.63 2jxn h ARG 12 Cb 1.30 -0.23 -0.04 0.00 -1.65 0.00 0.00 29.97 29.36 2jxn h ARG 12 CO 0.12 0.68 0.46 -0.07 0.56 0.00 0.00 179.97 181.72 2jxn h LEU 13 N 1.05 0.84 -0.22 3.04 -0.00 -1.49 1.09 115.31 119.62 2jxn h LEU 13 Ca 0.43 -0.04 -0.20 0.00 -0.00 0.00 0.00 57.88 58.07 2jxn h LEU 13 Cb 0.25 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 40.68 2jxn h LEU 13 CO -0.20 0.62 -0.92 0.00 -0.00 0.00 0.00 178.44 177.95 2jxn h ALA 14 N 1.25 0.48 0.00 1.53 0.00 -1.31 -3.15 119.26 118.07 2jxn h ALA 14 Ca 0.26 -0.78 -0.05 0.00 0.00 0.00 0.00 54.91 54.34 2jxn h ALA 14 Cb -0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2jxn h ALA 14 CO -0.05 1.00 -0.25 0.37 0.00 0.00 0.00 179.25 180.32 2jxn h GLN 15 N 0.06 0.00 0.00 0.00 4.15 0.11 -3.47 115.11 115.96 2jxn h GLN 15 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2jxn h GLN 15 Cb 1.58 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.27 2jxn h GLN 15 CO 0.13 0.25 0.00 -0.11 -1.93 0.00 0.00 178.83 177.17 2jxn n LEU 16 N -3.18 0.00 0.00 -2.39 7.94 0.37 -2.94 117.00 116.80 2jxn n LEU 16 Ca 0.03 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.93 2jxn n LEU 16 Cb 0.61 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.56 2jxn n LEU 16 CO 0.37 0.00 0.00 1.17 -1.11 0.00 0.00 177.39 177.82 2jxn n LYS 17 N 0.00 0.00 0.00 1.96 4.81 -1.26 -4.89 118.16 118.78 2jxn n LYS 17 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2jxn n LYS 17 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2jxn n LYS 17 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2jxn n ASN 18 N -2.18 0.00 -4.39 3.14 2.85 -1.15 -5.14 115.26 108.39 2jxn n ASN 18 Ca 0.00 0.00 -0.37 0.00 -0.11 0.00 0.00 54.58 54.10 2jxn n ASN 18 Cb 0.00 0.02 0.05 0.00 1.24 0.00 0.00 39.78 41.09 2jxn n ASN 18 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 2jxn n ASN 19 N -0.85 -1.97 0.00 1.20 2.85 -1.26 -4.83 115.26 110.40 2jxn n ASN 19 Ca 0.00 0.60 0.00 0.00 -0.11 0.00 0.00 54.58 55.07 2jxn n ASN 19 Cb 0.00 -1.11 0.00 0.00 1.24 0.00 0.00 39.78 39.91 2jxn n ASN 19 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2jxn n SER 20 N 0.64 0.00 -4.86 1.20 2.88 -1.26 -4.91 113.62 107.31 2jxn n SER 20 Ca 0.09 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.31 2jxn n SER 20 Cb 0.49 0.03 -0.06 0.00 -0.75 0.00 0.00 64.21 63.92 2jxn n SER 20 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2jxn s GLY 21 N -1.14 2.30 0.28 0.46 0.00 -1.26 -5.08 107.32 102.89 2jxn s GLY 21 Ca 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 44.72 44.50 2jxn s GLY 21 CO 0.00 0.04 0.60 -0.32 0.00 0.00 0.00 173.10 173.42 2jxn s GLY 22 N -2.33 2.14 -1.22 0.20 0.00 -1.26 -3.94 107.32 100.91 2jxn s GLY 22 Ca 0.51 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.93 2jxn s GLY 22 CO 0.19 -0.15 0.00 2.41 0.00 0.00 0.00 173.10 175.55 2jxn n THR 23 N -0.51 -0.15 -3.83 0.90 -1.04 -1.26 -2.59 114.28 105.80 2jxn n THR 23 Ca 0.01 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.73 2jxn n THR 23 Cb 0.53 -1.30 0.01 0.00 -1.82 0.00 0.00 70.33 67.75 2jxn n THR 23 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2jxn n ASN 24 N -0.74 -4.80 0.00 8.00 5.15 -1.25 -4.71 115.26 116.90 2jxn n ASN 24 Ca -0.13 -1.02 0.00 0.00 -0.60 0.00 0.00 54.58 52.84 2jxn n ASN 24 Cb 0.45 -1.83 0.00 0.00 -0.53 0.00 0.00 39.78 37.87 2jxn n ASN 24 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jxn n GLY 25 N -1.76 -0.48 3.87 8.20 0.00 -1.07 -5.15 105.19 108.81 2jxn n GLY 25 Ca -0.26 0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 2jxn n GLY 25 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jxn s ASP 26 N -4.00 3.00 0.00 1.61 2.15 -1.26 -4.68 116.67 113.49 2jxn s ASP 26 Ca 0.00 0.44 0.00 0.00 0.43 0.00 0.00 52.55 53.42 2jxn s ASP 26 Cb 0.00 -0.62 0.00 0.00 -0.30 0.00 0.00 42.92 42.00 2jxn s ASP 26 CO 0.00 -2.82 0.00 -2.11 -0.17 0.00 0.00 175.17 170.07 2jxn n ARG 27 N -3.86 0.00 0.00 4.34 1.85 -1.26 -4.52 116.66 113.21 2jxn n ARG 27 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.98 2jxn n ARG 27 Cb 0.60 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.01 2jxn n ARG 27 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2jxn n ASN 28 N -2.12 0.00 0.00 2.89 3.02 -1.26 -5.12 115.26 112.67 2jxn n ASN 28 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2jxn n ASN 28 Cb 0.00 0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 2jxn n ASN 28 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2jxn n SER 29 N -1.96 0.00 -4.58 6.41 2.88 -1.26 -4.86 113.62 110.26 2jxn n SER 29 Ca 0.00 0.00 -0.54 0.00 -1.33 0.00 0.00 58.87 57.00 2jxn n SER 29 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 2jxn n SER 29 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jxn n GLY 30 N -1.26 0.32 0.00 0.46 0.00 -1.26 -4.86 105.19 98.59 2jxn n GLY 30 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.74 2jxn n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jxn n ALA 31 N 2.38 0.00 0.95 4.61 0.00 -1.26 -4.99 120.51 122.21 2jxn n ALA 31 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.76 2jxn n ALA 31 Cb 0.16 0.00 0.51 0.00 0.00 0.00 0.00 19.45 20.12 2jxn n ALA 31 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2jxn n ASN 32 N 0.00 0.21 -3.71 0.00 5.03 -1.26 -4.84 115.26 110.69 2jxn n ASN 32 Ca 0.00 0.34 -0.14 0.00 0.87 0.00 0.00 54.58 55.64 2jxn n ASN 32 Cb 0.00 -0.35 -0.08 0.00 -1.02 0.00 0.00 39.78 38.33 2jxn n ASN 32 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 2jxn s ASN 33 N -3.19 -0.35 0.00 6.41 -0.87 -1.26 -5.02 114.94 110.66 2jxn s ASN 33 Ca 0.13 0.41 0.00 0.00 -1.57 0.00 0.00 52.86 51.83 2jxn s ASN 33 Cb 0.18 0.51 0.00 0.00 -0.02 0.00 0.00 41.25 41.92 2jxn s ASN 33 CO 0.58 -0.40 0.00 0.61 -2.57 0.00 0.00 177.10 175.32 2jxn n GLY 34 N 1.63 0.01 0.00 0.66 0.00 -1.26 -4.80 105.19 101.42 2jxn n GLY 34 Ca -0.19 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2jxn n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jxn n GLY 35 N -0.68 5.43 3.04 -0.02 0.00 -1.26 -5.15 105.19 106.56 2jxn n GLY 35 Ca 0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 46.02 45.15 2jxn n GLY 35 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jxn s GLY 36 N 0.00 -0.95 -0.45 -0.02 0.00 -1.26 -5.01 107.32 99.63 2jxn s GLY 36 Ca 0.00 0.72 -0.15 0.00 0.00 0.00 0.00 44.72 45.29 2jxn s GLY 36 CO 0.00 3.39 0.46 1.18 0.00 0.00 0.00 173.10 178.13 2jxn n GLU 37 N 5.39 -1.26 -3.43 2.90 4.71 -1.26 -2.71 120.64 124.98 2jxn n GLU 37 Ca 0.03 0.79 -0.33 0.00 -0.01 0.00 0.00 57.16 57.65 2jxn n GLU 37 Cb 0.52 -1.50 0.03 0.00 -1.01 0.00 0.00 31.44 29.48 2jxn n GLU 37 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 2jxn n ASN 38 N -0.74 -5.77 -0.01 1.62 4.05 -1.26 -4.92 115.26 108.24 2jxn n ASN 38 Ca -0.14 -0.04 -0.08 0.00 0.45 0.00 0.00 54.58 54.76 2jxn n ASN 38 Cb 0.50 -1.83 -0.06 0.00 1.23 0.00 0.00 39.78 39.62 2jxn n ASN 38 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 177.26 174.98 2jxn h SER 39 N 2.30 -0.09 0.00 1.20 4.64 -1.92 -3.47 113.55 116.22 2jxn h SER 39 Ca -0.47 -0.39 0.00 0.00 -0.47 0.00 0.00 61.79 60.46 2jxn h SER 39 Cb 1.33 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2jxn h SER 39 CO 0.20 0.57 0.00 0.00 -0.87 0.00 0.00 176.83 176.72 2jxn n ALA 40 N -2.66 0.00 0.97 5.18 0.00 -1.26 -5.02 120.51 117.72 2jxn n ALA 40 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2jxn n ALA 40 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 2jxn n ALA 40 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jxn n PRO 41 N 0.00 0.97 0.26 0.00 -0.04 -1.26 -4.03 135.00 130.89 2jxn n PRO 41 Ca 0.00 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.56 2jxn n PRO 41 Cb 0.00 -1.46 0.67 0.00 -0.04 0.00 0.00 33.50 32.67 2jxn n PRO 41 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2jxn h VAL 42 N 0.00 0.84 0.46 0.52 -1.51 -2.00 -2.95 116.25 111.61 2jxn h VAL 42 Ca 0.00 -0.36 -0.02 0.00 -1.23 0.00 0.00 66.70 65.09 2jxn h VAL 42 Cb 0.51 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 30.88 2jxn h VAL 42 CO 0.00 0.09 -0.22 1.23 -1.23 0.00 0.00 177.57 177.44 2jxn h GLY 43 N 0.40 -0.65 0.54 5.19 0.00 -2.04 -2.87 103.07 103.64 2jxn h GLY 43 Ca -0.00 0.24 0.14 0.00 0.00 0.00 0.00 47.33 47.71 2jxn h GLY 43 CO 0.01 -0.24 0.60 0.00 0.00 0.00 0.00 176.54 176.91 2jxn h ALA 44 N -0.67 2.21 0.00 3.60 0.00 -1.85 0.70 119.26 123.24 2jxn h ALA 44 Ca -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2jxn h ALA 44 Cb 0.58 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2jxn h ALA 44 CO 0.10 -0.85 0.00 0.00 0.00 0.00 0.00 179.25 178.51 2jxn h ALA 45 N 1.27 1.00 0.00 0.00 0.00 -1.40 -1.18 119.26 118.95 2jxn h ALA 45 Ca 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2jxn h ALA 45 Cb 1.42 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 2jxn h ALA 45 CO -0.00 0.00 -0.18 -0.84 0.00 0.00 0.00 179.25 178.23 2jxn h ILE 46 N 0.00 0.13 0.00 0.00 -0.00 0.31 -3.21 117.51 114.74 2jxn h ILE 46 Ca 0.00 -1.19 -0.03 0.00 -0.00 0.00 0.00 64.86 63.65 2jxn h ILE 46 Cb 0.17 2.02 -0.00 0.00 -0.00 0.00 0.00 36.82 39.00 2jxn h ILE 46 CO 0.00 0.07 -0.14 0.00 -0.00 0.00 0.00 178.15 178.09 2jxn h ALA 47 N 1.92 1.33 0.00 0.16 0.00 -1.33 -1.35 119.26 119.99 2jxn h ALA 47 Ca -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2jxn h ALA 47 Cb 1.06 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 2jxn h ALA 47 CO 0.01 0.17 -0.39 -0.91 0.00 0.00 0.00 179.25 178.13 2jxn h ASN 48 N 0.00 0.00 0.00 0.00 2.35 -1.69 -3.22 115.58 113.03 2jxn h ASN 48 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2jxn h ASN 48 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2jxn h ASN 48 CO 0.02 0.06 0.00 0.49 -1.65 0.00 0.00 177.43 176.35 2jxn n PHE 49 N -2.97 0.00 -3.80 1.19 3.01 -0.51 -4.42 117.46 109.95 2jxn n PHE 49 Ca 0.02 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.19 2jxn n PHE 49 Cb 0.56 -0.01 -0.16 0.00 -0.01 0.00 0.00 39.48 39.87 2jxn n PHE 49 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2jxn s LEU 50 N -0.93 2.10 0.65 4.37 1.43 -1.22 0.10 118.68 125.18 2jxn s LEU 50 Ca 0.00 -1.27 -0.17 0.00 -1.03 0.00 0.00 54.13 51.66 2jxn s LEU 50 Cb 0.00 -0.90 -0.09 0.00 0.03 0.00 0.00 46.19 45.23 2jxn s LEU 50 CO 0.00 -0.33 0.21 -0.62 0.23 0.00 0.00 176.35 175.84 2jxn n GLU 51 N 4.84 0.24 0.29 1.70 -0.58 -0.81 -4.69 120.64 121.63 2jxn n GLU 51 Ca -0.07 0.10 -0.16 0.00 -0.42 0.00 0.00 57.16 56.61 2jxn n GLU 51 Cb 0.44 -1.48 -0.08 0.00 -0.57 0.00 0.00 31.44 29.75 2jxn n GLU 51 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2jxn h PRO 52 N -0.17 -0.69 -0.27 3.49 0.13 -1.94 0.44 132.00 132.99 2jxn h PRO 52 Ca -0.44 0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2jxn h PRO 52 Cb 1.39 0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.66 2jxn h PRO 52 CO 0.42 -0.42 0.17 0.37 -0.23 0.00 0.00 178.00 178.31 2jxn h GLN 53 N -0.83 0.36 0.00 0.86 4.15 -2.00 -1.28 115.11 116.37 2jxn h GLN 53 Ca -0.07 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.32 2jxn h GLN 53 Cb 0.60 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.21 2jxn h GLN 53 CO 0.12 0.27 -0.01 0.00 -1.93 0.00 0.00 178.83 177.29 2jxn h ALA 54 N 1.07 1.85 -0.83 3.38 0.00 -1.92 -1.64 119.26 121.17 2jxn h ALA 54 Ca 0.10 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2jxn h ALA 54 Cb 0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2jxn h ALA 54 CO -0.02 0.01 0.54 1.25 0.00 0.00 0.00 179.25 181.03 2jxn h LEU 55 N 0.00 0.91 -1.14 0.00 6.46 0.33 -1.50 115.31 120.37 2jxn h LEU 55 Ca -0.00 -0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.69 2jxn h LEU 55 Cb 0.01 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 39.71 2jxn h LEU 55 CO 0.00 0.64 0.02 -0.08 -0.62 0.00 0.00 178.44 178.41 2jxn h GLU 56 N 1.07 0.63 0.48 1.25 4.22 -1.19 -2.39 114.58 118.65 2jxn h GLU 56 Ca 0.32 -0.14 -0.02 0.00 0.08 0.00 0.00 59.36 59.61 2jxn h GLU 56 Cb -0.04 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 2jxn h GLU 56 CO -0.10 0.63 -0.29 -0.09 -2.18 0.00 0.00 179.01 176.99 2jxn h ARG 57 N 0.60 -0.70 -0.56 1.92 1.12 -1.22 0.16 114.38 115.70 2jxn h ARG 57 Ca 0.13 0.05 0.05 0.00 -1.11 0.00 0.00 59.98 59.10 2jxn h ARG 57 Cb 0.34 0.16 -0.03 0.00 -0.01 0.00 0.00 29.97 30.43 2jxn h ARG 57 CO 0.01 -0.47 0.37 1.25 -3.11 0.00 0.00 179.97 178.03 2jxn h LEU 58 N -0.72 0.49 -0.38 3.80 5.85 -1.37 -1.62 115.31 121.36 2jxn h LEU 58 Ca -0.06 -0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 2jxn h LEU 58 Cb 0.59 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 2jxn h LEU 58 CO 0.06 0.33 -0.04 0.28 -0.34 0.00 0.00 178.44 178.74 2jxn h SER 59 N 0.57 0.68 -0.47 1.25 0.02 -0.89 -2.58 113.55 112.14 2jxn h SER 59 Ca 0.24 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 2jxn h SER 59 Cb 0.22 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 2jxn h SER 59 CO -0.07 0.85 0.26 -0.09 -1.14 0.00 0.00 176.83 176.65 2jxn h ARG 60 N 0.50 0.65 -0.70 3.45 9.65 0.24 -2.86 114.38 125.32 2jxn h ARG 60 Ca 0.10 -0.07 -0.06 0.00 -1.10 0.00 0.00 59.98 58.85 2jxn h ARG 60 Cb 0.52 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.94 2jxn h ARG 60 CO 0.03 0.51 0.19 -0.24 2.80 0.00 0.00 179.97 183.25 2jxn h VAL 61 N 0.62 1.26 -0.96 0.20 3.04 -1.42 -2.75 116.25 116.23 2jxn h VAL 61 Ca 0.17 -0.93 0.22 0.00 -1.01 0.00 0.00 66.70 65.14 2jxn h VAL 61 Cb 0.04 0.53 -0.08 0.00 -2.01 0.00 0.00 31.29 29.77 2jxn h VAL 61 CO -0.03 0.36 0.62 0.00 -1.01 0.00 0.00 177.57 177.52 2jxn h ALA 62 N 1.09 2.11 0.00 3.17 0.00 -1.22 0.67 119.26 125.08 2jxn h ALA 62 Ca 0.22 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2jxn h ALA 62 Cb 0.34 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2jxn h ALA 62 CO -0.00 -0.44 -0.01 -0.07 0.00 0.00 0.00 179.25 178.73 2jxn h LEU 63 N 0.48 0.00 0.00 0.00 4.07 -1.44 -2.57 115.31 115.86 2jxn h LEU 63 Ca 0.53 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 58.20 2jxn h LEU 63 Cb 1.21 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.90 2jxn h LEU 63 CO -0.25 0.01 -1.98 0.52 -1.08 0.00 0.00 178.44 175.66 2jxn n VAL 64 N -3.27 0.97 -3.53 1.22 0.31 0.19 -4.88 118.33 109.33 2jxn n VAL 64 Ca -0.03 -0.29 -0.27 0.00 -0.01 0.00 0.00 64.34 63.74 2jxn n VAL 64 Cb 0.11 -1.50 -0.11 0.00 -0.91 0.00 0.00 33.84 31.44 2jxn n VAL 64 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2jxn s ARG 65 N -2.33 1.27 0.47 5.55 0.52 0.15 -4.95 118.95 119.64 2jxn s ARG 65 Ca -0.24 -2.37 0.13 0.00 -0.52 0.00 0.00 55.73 52.73 2jxn s ARG 65 Cb 0.08 -1.92 1.10 0.00 0.52 0.00 0.00 34.95 34.73 2jxn s ARG 65 CO 0.34 -1.35 2.10 -0.09 0.02 0.00 0.00 175.30 176.32 2jxn h ARG 66 N 5.67 0.18 -0.29 3.54 2.43 -1.66 -2.08 114.38 122.18 2jxn h ARG 66 Ca 0.22 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 2jxn h ARG 66 Cb 0.88 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 2jxn h ARG 66 CO 0.45 0.14 0.10 0.22 -1.51 0.00 0.00 179.97 179.38 2jxn h ASP 67 N 0.19 0.40 -0.52 -3.80 1.82 -1.92 -1.55 116.42 111.04 2jxn h ASP 67 Ca 0.05 -0.18 -0.07 0.00 -0.39 0.00 0.00 57.03 56.43 2jxn h ASP 67 Cb 0.02 -0.11 -0.02 0.00 0.68 0.00 0.00 39.33 39.90 2jxn h ASP 67 CO -0.01 0.48 0.05 0.03 -1.61 0.00 0.00 179.24 178.18 2jxn h ARG 68 N 0.31 0.89 0.00 0.28 3.08 -1.85 -2.21 114.38 114.86 2jxn h ARG 68 Ca 0.09 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 59.89 2jxn h ARG 68 Cb 0.21 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 2jxn h ARG 68 CO -0.01 0.89 -0.00 0.00 -1.07 0.00 0.00 179.97 179.78 2jxn h ALA 69 N 0.96 1.81 -0.43 0.04 0.00 -1.24 -1.16 119.26 119.25 2jxn h ALA 69 Ca 0.15 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2jxn h ALA 69 Cb 0.46 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2jxn h ALA 69 CO 0.02 0.01 -0.14 0.37 0.00 0.00 0.00 179.25 179.50 2jxn h GLN 70 N 0.00 0.79 -0.43 0.00 4.15 -0.64 -2.79 115.11 116.19 2jxn h GLN 70 Ca -0.00 -0.28 -0.12 0.00 0.77 0.00 0.00 58.65 59.02 2jxn h GLN 70 Cb 0.01 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 2jxn h GLN 70 CO 0.00 0.89 -0.22 0.00 -1.93 0.00 0.00 178.83 177.58 2jxn h ALA 71 N 1.13 0.80 -0.88 3.38 0.00 -1.11 -1.84 119.26 120.74 2jxn h ALA 71 Ca 0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2jxn h ALA 71 Cb 0.64 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2jxn h ALA 71 CO 0.04 0.65 0.52 0.28 0.00 0.00 0.00 179.25 180.75 2jxn h VAL 72 N 0.76 1.24 -0.43 0.00 2.07 -1.34 0.75 116.25 119.29 2jxn h VAL 72 Ca 0.10 -0.53 -0.14 0.00 0.82 0.00 0.00 66.70 66.95 2jxn h VAL 72 Cb 0.76 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 2jxn h VAL 72 CO 0.06 0.26 -0.26 -0.33 0.02 0.00 0.00 177.57 177.31 2jxn h GLU 73 N 1.21 0.94 -0.10 1.57 4.39 -1.29 -2.66 114.58 118.63 2jxn h GLU 73 Ca 0.31 -0.43 -0.08 0.00 0.34 0.00 0.00 59.36 59.51 2jxn h GLU 73 Cb -0.05 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 2jxn h GLU 73 CO -0.06 1.09 -0.29 1.15 -1.16 0.00 0.00 179.01 179.75 2jxn h THR 74 N 0.77 1.24 -0.12 1.13 2.02 -0.75 -0.41 112.91 116.79 2jxn h THR 74 Ca 0.09 -1.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.11 2jxn h THR 74 Cb 0.84 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 2jxn h THR 74 CO 0.07 0.34 0.05 0.22 0.37 0.00 0.00 175.52 176.58 2jxn h TYR 75 N 0.16 0.18 -0.26 3.16 5.03 -0.63 -0.34 116.97 124.28 2jxn h TYR 75 Ca 0.02 -0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.23 2jxn h TYR 75 Cb 0.59 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.81 2jxn h TYR 75 CO 0.01 0.27 -0.19 1.25 -1.32 0.00 0.00 178.16 178.19 2jxn h LEU 76 N 0.04 0.61 -1.02 2.82 5.85 -1.27 -2.26 115.31 120.08 2jxn h LEU 76 Ca 0.04 -0.44 0.05 0.00 0.84 0.00 0.00 57.88 58.36 2jxn h LEU 76 Cb 0.17 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 2jxn h LEU 76 CO -0.00 0.92 0.65 0.50 -0.34 0.00 0.00 178.44 180.17 2jxn h LYS 77 N 0.30 1.19 -0.54 1.25 3.64 -1.01 0.46 116.57 121.87 2jxn h LYS 77 Ca 0.05 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 2jxn h LYS 77 Cb 0.72 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 2jxn h LYS 77 CO 0.05 0.79 -0.05 -0.22 -2.27 0.00 0.00 179.45 177.75 2jxn h LYS 78 N 1.23 0.98 -0.22 1.90 3.64 -0.97 -1.42 116.57 121.70 2jxn h LYS 78 Ca 0.41 -0.34 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2jxn h LYS 78 Cb 0.06 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2jxn h LYS 78 CO -0.14 1.01 -0.12 -0.07 -2.27 0.00 0.00 179.45 177.86 2jxn h LEU 79 N 0.85 0.49 -1.07 5.20 4.07 -0.68 -1.72 115.31 122.45 2jxn h LEU 79 Ca 0.15 -0.42 0.02 0.00 0.08 0.00 0.00 57.88 57.71 2jxn h LEU 79 Cb 0.60 -0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.15 2jxn h LEU 79 CO 0.04 0.80 0.63 0.40 -1.08 0.00 0.00 178.44 179.22 2jxn h ILE 80 N 0.18 1.22 0.00 1.22 2.04 -0.04 -0.74 117.51 121.39 2jxn h ILE 80 Ca 0.05 -0.43 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 2jxn h ILE 80 Cb 0.62 -0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.55 2jxn h ILE 80 CO 0.03 0.23 -0.08 0.00 0.00 0.00 0.00 178.15 178.33 2jxn h ALA 81 N 1.42 0.98 0.01 1.87 0.00 -1.16 -3.35 119.26 119.03 2jxn h ALA 81 Ca 0.36 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2jxn h ALA 81 Cb -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2jxn h ALA 81 CO -0.09 0.10 -0.00 1.15 0.00 0.00 0.00 179.25 180.41 2jxn h THR 82 N 0.00 0.00 0.00 0.00 2.02 -0.21 -3.49 112.91 111.22 2jxn h THR 82 Ca -0.00 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.13 2jxn h THR 82 Cb 0.75 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2jxn h THR 82 CO 0.01 0.00 0.00 -0.46 0.37 0.00 0.00 175.52 175.44 2jxn n ASN 83 N -2.17 0.00 -0.05 4.18 2.04 -0.71 -4.98 115.26 113.58 2jxn n ASN 83 Ca -0.00 0.00 0.24 0.00 -0.44 0.00 0.00 54.58 54.38 2jxn n ASN 83 Cb 0.00 0.00 0.61 0.00 -2.53 0.00 0.00 39.78 37.86 2jxn n ASN 83 CO 0.00 0.00 0.00 0.78 -0.44 0.00 0.00 177.26 177.60 2jxn h ASN 84 N 0.00 0.00 0.00 0.53 2.35 -1.81 -3.41 115.58 113.24 2jxn h ASN 84 Ca 0.00 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.42 2jxn h ASN 84 Cb 0.00 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.30 2jxn h ASN 84 CO 0.00 0.00 1.35 1.33 -1.65 0.00 0.00 177.43 178.46 2jxn n VAL 85 N -3.47 0.00 -1.01 2.81 0.24 -1.26 -4.14 118.33 111.50 2jxn n VAL 85 Ca 0.15 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.33 2jxn n VAL 85 Cb 1.04 -0.24 0.00 0.00 -1.47 0.00 0.00 33.84 33.17 2jxn n VAL 85 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2jxn n THR 86 N 4.97 0.00 -3.36 3.34 -1.04 -1.26 -5.13 114.28 111.80 2jxn n THR 86 Ca 0.48 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.49 2jxn n THR 86 Cb 0.05 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.56 2jxn n THR 86 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jxn n HIS 87 N 0.00 -0.03 -3.63 -1.42 1.44 -1.26 -5.16 115.22 105.16 2jxn n HIS 87 Ca 0.00 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.57 2jxn n HIS 87 Cb 0.12 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.10 2jxn n HIS 87 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2jxn s LYS 88 N -0.28 0.15 0.54 -1.40 1.02 -1.26 -4.82 119.74 113.68 2jxn s LYS 88 Ca 0.00 0.64 -0.18 0.00 0.02 0.00 0.00 55.97 56.45 2jxn s LYS 88 Cb 0.00 -0.26 -0.13 0.00 -0.52 0.00 0.00 37.83 36.93 2jxn s LYS 88 CO 0.00 -0.36 0.11 -0.89 -0.92 0.00 0.00 175.35 173.29 2jxn n ILE 89 N 5.34 0.83 -4.41 2.17 5.41 0.28 -4.68 119.36 124.31 2jxn n ILE 89 Ca -0.06 -0.50 -0.22 0.00 1.00 0.00 0.00 62.75 62.97 2jxn n ILE 89 Cb 0.50 -0.25 -0.08 0.00 -0.71 0.00 0.00 39.64 39.09 2jxn n ILE 89 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2jxn s THR 90 N -1.90 0.39 0.52 1.39 -4.23 -1.26 -1.93 115.64 108.63 2jxn s THR 90 Ca 0.61 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.30 2jxn s THR 90 Cb -0.47 -2.43 0.30 0.00 1.34 0.00 0.00 72.50 71.23 2jxn s THR 90 CO 0.62 0.00 2.12 1.05 -0.54 0.00 0.00 174.62 177.87 2jxn h GLU 91 N 1.99 0.00 0.01 3.99 4.11 -1.93 0.28 114.58 123.03 2jxn h GLU 91 Ca -0.32 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 58.91 2jxn h GLU 91 Cb 1.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 2jxn h GLU 91 CO 0.51 0.00 -0.89 0.00 0.07 0.00 0.00 179.01 178.70 2jxn h ALA 92 N 1.95 0.51 -0.04 1.06 0.00 -1.97 -2.78 119.26 117.99 2jxn h ALA 92 Ca 0.05 -0.75 -0.18 0.00 0.00 0.00 0.00 54.91 54.03 2jxn h ALA 92 Cb 0.19 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.91 2jxn h ALA 92 CO -0.00 0.95 -0.69 0.93 0.00 0.00 0.00 179.25 180.44 2jxn h GLU 93 N 0.08 0.54 -0.21 0.00 4.39 -1.46 -0.99 114.58 116.93 2jxn h GLU 93 Ca -0.04 -0.53 -0.01 0.00 0.34 0.00 0.00 59.36 59.12 2jxn h GLU 93 Cb 1.53 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 30.31 2jxn h GLU 93 CO 0.13 1.15 0.08 0.82 -1.16 0.00 0.00 179.01 180.04 2jxn h ILE 94 N 0.12 1.17 -0.48 3.13 2.04 -1.09 -1.61 117.51 120.78 2jxn h ILE 94 Ca -0.08 -0.50 -0.13 0.00 1.00 0.00 0.00 64.86 65.15 2jxn h ILE 94 Cb 1.37 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 2jxn h ILE 94 CO 0.14 0.16 -0.23 1.62 0.00 0.00 0.00 178.15 179.85 2jxn h VAL 95 N 0.18 1.27 -0.50 1.67 3.04 -1.59 -2.24 116.25 118.08 2jxn h VAL 95 Ca 0.07 -1.39 0.04 0.00 -1.01 0.00 0.00 66.70 64.41 2jxn h VAL 95 Cb 0.18 1.13 -0.04 0.00 -2.01 0.00 0.00 31.29 30.55 2jxn h VAL 95 CO -0.01 0.48 0.26 0.28 -1.01 0.00 0.00 177.57 177.57 2jxn h SER 96 N 0.86 0.38 -0.36 3.17 0.02 -1.01 -1.22 113.55 115.39 2jxn h SER 96 Ca 0.11 0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.95 2jxn h SER 96 Cb 0.81 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.29 2jxn h SER 96 CO 0.07 0.26 -0.26 0.40 -1.14 0.00 0.00 176.83 176.16 2jxn h ILE 97 N 0.51 1.27 -0.52 3.27 2.04 -1.25 -3.01 117.51 119.83 2jxn h ILE 97 Ca 0.22 -1.41 0.07 0.00 1.00 0.00 0.00 64.86 64.74 2jxn h ILE 97 Cb 0.11 1.23 -0.06 0.00 -0.74 0.00 0.00 36.82 37.36 2jxn h ILE 97 CO -0.14 0.47 0.19 -0.07 0.00 0.00 0.00 178.15 178.60 2jxn h LEU 98 N 0.74 0.19 -1.66 1.44 3.38 -0.75 0.19 115.31 118.85 2jxn h LEU 98 Ca 0.09 0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.19 2jxn h LEU 98 Cb 0.81 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 2jxn h LEU 98 CO 0.07 0.13 0.34 -1.13 0.09 0.00 0.00 178.44 177.95 2jxn h ASN 99 N 0.37 0.36 0.65 -0.43 -0.73 -1.12 0.44 115.58 115.13 2jxn h ASN 99 Ca 0.25 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 58.20 2jxn h ASN 99 Cb 0.27 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.78 2jxn h ASN 99 CO -0.25 0.23 -0.99 1.23 -0.37 0.00 0.00 177.43 177.28 2jxn h GLY 100 N 0.41 0.22 1.53 1.57 0.00 -0.88 -3.21 103.07 102.72 2jxn h GLY 100 Ca 0.23 -0.45 -0.22 0.00 0.00 0.00 0.00 47.33 46.89 2jxn h GLY 100 CO -0.06 0.40 -0.90 -2.22 0.00 0.00 0.00 176.54 173.76 2jxn h ILE 101 N 0.09 1.39 -0.04 2.60 2.04 0.86 -2.98 117.51 121.47 2jxn h ILE 101 Ca -0.06 -2.37 -0.01 0.00 1.00 0.00 0.00 64.86 63.42 2jxn h ILE 101 Cb 1.67 2.35 -0.00 0.00 -0.74 0.00 0.00 36.82 40.09 2jxn h ILE 101 CO 0.15 0.71 -0.01 0.00 0.00 0.00 0.00 178.15 179.01 2jxn h ALA 102 N 0.76 1.91 0.07 1.87 0.00 -0.24 0.49 119.26 124.12 2jxn h ALA 102 Ca -0.07 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.55 2jxn h ALA 102 Cb 1.52 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.30 2jxn h ALA 102 CO 0.16 0.07 -1.10 0.87 0.00 0.00 0.00 179.25 179.24 2jxn h LYS 103 N 0.06 0.43 0.11 0.00 1.57 -1.54 -3.36 116.57 113.83 2jxn h LYS 103 Ca 0.01 -0.55 -0.01 0.00 -1.87 0.00 0.00 60.65 58.24 2jxn h LYS 103 Cb 0.05 0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2jxn h LYS 103 CO 0.00 1.21 -0.05 1.96 -0.57 0.00 0.00 179.45 182.00 2jxn h GLN 104 N 0.20 -0.14 -3.49 3.15 1.08 -1.19 -3.50 115.11 111.22 2jxn h GLN 104 Ca -0.12 0.01 0.28 0.00 -1.45 0.00 0.00 58.65 57.37 2jxn h GLN 104 Cb 1.77 0.03 -0.16 0.00 -0.05 0.00 0.00 27.48 29.07 2jxn h GLN 104 CO 0.19 0.12 -1.21 0.94 -0.95 0.00 0.00 178.83 177.93 2jxn n GLN 105 N -4.85 -3.42 -1.51 1.46 7.27 0.16 -4.37 117.38 112.13 2jxn n GLN 105 Ca -0.04 2.78 -0.29 0.00 0.07 0.00 0.00 57.00 59.51 2jxn n GLN 105 Cb 0.16 -3.86 -0.18 0.00 2.41 0.00 0.00 30.24 28.78 2jxn n GLN 105 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40 2jxn n ASN 106 N -4.02 -0.34 0.00 1.69 0.23 -1.26 -3.70 115.26 107.87 2jxn n ASN 106 Ca -0.08 -0.34 0.00 0.00 -0.53 0.00 0.00 54.58 53.63 2jxn n ASN 106 Cb 0.64 -0.82 0.00 0.00 -2.08 0.00 0.00 39.78 37.52 2jxn n ASN 106 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 2jxn n SER 107 N 9.00 0.00 -4.69 0.53 2.88 -1.26 -5.14 113.62 114.95 2jxn n SER 107 Ca 0.64 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.86 2jxn n SER 107 Cb 0.14 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.75 2jxn n SER 107 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jxn s GLN 108 N 0.00 1.30 -0.04 -1.46 -2.07 -1.24 -4.91 119.66 111.24 2jxn s GLN 108 Ca 0.00 1.61 -0.30 0.00 -1.82 0.00 0.00 55.36 54.85 2jxn s GLN 108 Cb 0.00 -1.75 -0.04 0.00 -1.09 0.00 0.00 33.01 30.12 2jxn s GLN 108 CO 0.00 -2.43 1.33 0.54 -1.32 0.00 0.00 175.29 173.41 2jxn s ASN 109 N -2.50 6.91 0.50 12.60 2.20 -1.26 -5.01 114.94 128.39 2jxn s ASN 109 Ca 0.69 1.97 -0.17 0.00 -0.94 0.00 0.00 52.86 54.40 2jxn s ASN 109 Cb -0.25 -2.55 -0.08 0.00 -2.00 0.00 0.00 41.25 36.37 2jxn s ASN 109 CO 0.55 -0.70 0.99 0.20 -2.94 0.00 0.00 177.10 175.20 2jxn s ASN 110 N 1.86 6.61 -0.13 3.54 0.01 -1.26 -5.06 114.94 120.50 2jxn s ASN 110 Ca 0.61 1.62 -0.33 0.00 -0.71 0.00 0.00 52.86 54.05 2jxn s ASN 110 Cb -0.28 -2.52 0.13 0.00 0.41 0.00 0.00 41.25 38.99 2jxn s ASN 110 CO 0.24 -0.60 1.14 -0.94 -1.51 0.00 0.00 177.10 175.43 2jxn s SER 111 N -2.85 -0.18 -0.37 -1.22 1.04 -1.26 -4.96 113.70 103.89 2jxn s SER 111 Ca 0.60 -0.02 -0.05 0.00 0.48 0.00 0.00 55.95 56.97 2jxn s SER 111 Cb -0.10 0.21 0.05 0.00 0.10 0.00 0.00 66.02 66.27 2jxn s SER 111 CO 0.28 -0.34 0.12 0.29 0.98 0.00 0.00 173.24 174.57 2jxn n LYS 112 N -0.16 -1.97 0.00 4.02 5.02 -1.26 -4.43 118.16 119.39 2jxn n LYS 112 Ca -0.02 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2jxn n LYS 112 Cb 0.59 -3.25 0.00 0.00 -0.02 0.00 0.00 35.03 32.36 2jxn n LYS 112 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2jxn n ILE 113 N -2.13 0.00 0.51 -0.18 5.41 -1.26 -4.76 119.36 116.95 2jxn n ILE 113 Ca 0.02 0.00 0.07 0.00 1.00 0.00 0.00 62.75 63.84 2jxn n ILE 113 Cb 0.35 -0.19 0.30 0.00 -0.71 0.00 0.00 39.64 39.39 2jxn n ILE 113 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 2jxn n ILE 114 N -0.85 0.97 -0.33 1.39 5.41 -1.26 -3.59 119.36 121.10 2jxn n ILE 114 Ca 0.00 0.24 -0.05 0.00 1.00 0.00 0.00 62.75 63.94 2jxn n ILE 114 Cb 0.10 -1.01 -0.01 0.00 -0.71 0.00 0.00 39.64 38.01 2jxn n ILE 114 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 2jxn h PHE 115 N 0.00 -1.30 -0.01 1.39 3.57 -1.93 -3.53 116.94 115.12 2jxn h PHE 115 Ca 0.00 0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2jxn h PHE 115 Cb 0.21 0.69 0.00 0.00 2.79 0.00 0.00 35.95 39.64 2jxn h PHE 115 CO 0.00 -0.40 0.00 -0.85 -2.23 0.00 0.00 178.31 174.83