#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 -1.35 0.28 7.83 8.00 -1.26 -4.98 116.55 125.08 2jxn n ASP 2 Ca 0.00 -2.91 0.14 0.00 0.71 0.00 0.00 54.79 52.73 2jxn n ASP 2 Cb 0.00 0.50 0.66 0.00 -0.02 0.00 0.00 41.12 42.26 2jxn n ASP 2 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 2jxn h PRO 3 N 4.25 0.00 -0.04 -0.24 0.11 -2.07 0.32 132.00 134.32 2jxn h PRO 3 Ca 0.01 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.03 2jxn h PRO 3 Cb 0.96 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 2jxn h PRO 3 CO 0.36 0.00 -0.38 0.93 -0.21 0.00 0.00 178.00 178.71 2jxn h GLU 4 N 0.00 0.09 0.00 1.05 3.07 -2.02 -2.52 114.58 114.25 2jxn h GLU 4 Ca 0.04 -0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 58.76 2jxn h GLU 4 Cb 1.02 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.91 2jxn h GLU 4 CO -0.00 0.46 -0.50 -0.07 -1.40 0.00 0.00 179.01 177.50 2jxn h LEU 5 N 0.08 0.00 -1.20 1.33 3.38 -0.78 -2.88 115.31 115.23 2jxn h LEU 5 Ca 0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2jxn h LEU 5 Cb 0.71 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 2jxn h LEU 5 CO 0.05 0.50 0.10 1.56 0.09 0.00 0.00 178.44 180.74 2jxn h GLN 6 N 0.00 0.65 -0.00 1.13 4.20 -1.52 -2.25 115.11 117.32 2jxn h GLN 6 Ca -0.00 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 2jxn h GLN 6 Cb 0.91 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.59 2jxn h GLN 6 CO 0.06 0.60 -0.00 0.00 -0.67 0.00 0.00 178.83 178.82 2jxn h ILE 8 N -0.40 0.82 -0.63 0.00 2.04 -1.44 -0.63 117.51 117.28 2jxn h ILE 8 Ca 0.00 -0.13 0.02 0.00 1.00 0.00 0.00 64.86 65.75 2jxn h ILE 8 Cb 0.40 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 2jxn h ILE 8 CO 0.00 0.07 0.40 0.03 0.00 0.00 0.00 178.15 178.66 2jxn h ARG 9 N 0.38 0.79 -0.16 2.37 3.08 -1.27 -2.36 114.38 117.21 2jxn h ARG 9 Ca 0.33 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.21 2jxn h ARG 9 Cb 0.76 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2jxn h ARG 9 CO -0.10 0.52 -0.39 0.93 -1.07 0.00 0.00 179.97 179.87 2jxn h GLU 10 N 0.81 0.54 -0.76 0.04 5.08 -1.14 -3.04 114.58 116.11 2jxn h GLU 10 Ca 0.24 -0.37 0.22 0.00 -1.00 0.00 0.00 59.36 58.46 2jxn h GLU 10 Cb -0.03 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 2jxn h GLU 10 CO -0.08 0.99 0.61 0.00 -1.00 0.00 0.00 179.01 179.53 2jxn h ARG 12 N 0.00 0.11 -0.11 0.00 2.47 -1.31 -3.14 114.38 112.40 2jxn h ARG 12 Ca 0.36 -0.07 -0.13 0.00 -1.26 0.00 0.00 59.98 58.88 2jxn h ARG 12 Cb 1.58 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.90 2jxn h ARG 12 CO -0.00 0.64 -0.51 -0.07 0.56 0.00 0.00 179.97 180.58 2jxn h LEU 13 N -0.40 0.33 -1.91 3.04 -0.00 -0.91 -2.87 115.31 112.59 2jxn h LEU 13 Ca 0.00 -0.16 0.11 0.00 -0.00 0.00 0.00 57.88 57.83 2jxn h LEU 13 Cb 0.63 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 41.17 2jxn h LEU 13 CO 0.02 0.78 0.32 0.00 -0.00 0.00 0.00 178.44 179.55 2jxn h ALA 14 N 1.23 2.28 -0.46 1.53 0.00 -0.22 0.22 119.26 123.84 2jxn h ALA 14 Ca 0.01 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2jxn h ALA 14 Cb 0.98 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2jxn h ALA 14 CO 0.08 -0.40 0.06 0.37 0.00 0.00 0.00 179.25 179.36 2jxn h GLN 15 N 0.11 0.76 0.00 0.00 4.15 -1.45 -3.38 115.11 115.30 2jxn h GLN 15 Ca 0.21 -0.21 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2jxn h GLN 15 Cb 0.71 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.31 2jxn h GLN 15 CO -0.02 0.79 0.00 1.28 -1.93 0.00 0.00 178.83 178.95 2jxn n LEU 16 N -4.45 0.68 -4.63 -2.39 4.32 -0.31 -4.87 117.00 105.36 2jxn n LEU 16 Ca 0.00 0.28 -0.59 0.00 -0.02 0.00 0.00 56.01 55.69 2jxn n LEU 16 Cb 0.25 -0.36 -0.08 0.00 -1.62 0.00 0.00 43.42 41.62 2jxn n LEU 16 CO 0.40 -0.36 0.97 1.17 -1.22 0.00 0.00 177.39 178.36 2jxn n LYS 17 N -1.71 0.58 0.00 3.23 4.81 0.62 -4.89 118.16 120.80 2jxn n LYS 17 Ca 0.00 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.65 2jxn n LYS 17 Cb 0.00 -1.79 0.00 0.00 0.02 0.00 0.00 35.03 33.26 2jxn n LYS 17 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2jxn n ASN 18 N 3.26 0.00 0.00 3.14 6.94 -1.26 -4.67 115.26 122.67 2jxn n ASN 18 Ca 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.80 2jxn n ASN 18 Cb 0.09 -0.34 0.00 0.00 -2.36 0.00 0.00 39.78 37.17 2jxn n ASN 18 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 2jxn n ASN 19 N -2.25 0.00 0.08 0.53 2.85 -1.26 -4.47 115.26 110.74 2jxn n ASN 19 Ca 0.00 0.00 -0.23 0.00 -0.11 0.00 0.00 54.58 54.24 2jxn n ASN 19 Cb 0.00 0.00 -0.15 0.00 1.24 0.00 0.00 39.78 40.87 2jxn n ASN 19 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2jxn h SER 20 N 0.00 0.66 0.00 1.20 0.02 -1.96 -3.50 113.55 109.97 2jxn h SER 20 Ca 0.00 -0.94 0.00 0.00 -0.84 0.00 0.00 61.79 60.01 2jxn h SER 20 Cb 0.00 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.33 2jxn h SER 20 CO 0.00 1.78 0.00 0.61 -1.14 0.00 0.00 176.83 178.08 2jxn n GLY 21 N 1.84 0.08 3.93 -3.77 0.00 -1.26 -3.97 105.19 102.04 2jxn n GLY 21 Ca -0.24 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 2jxn n GLY 21 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jxn s GLY 22 N 0.00 1.40 -1.03 -0.02 0.00 -1.26 -4.35 107.32 102.06 2jxn s GLY 22 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 43.52 2jxn s GLY 22 CO 0.00 -1.21 0.00 -1.30 0.00 0.00 0.00 173.10 170.59 2jxn n THR 23 N -1.08 -0.51 -3.80 0.90 -2.24 -1.26 -2.42 114.28 103.88 2jxn n THR 23 Ca -0.08 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.44 2jxn n THR 23 Cb 0.56 -1.63 0.00 0.00 -2.10 0.00 0.00 70.33 67.17 2jxn n THR 23 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2jxn n ASN 24 N -1.66 -4.87 0.00 3.42 3.02 -1.26 -4.70 115.26 109.22 2jxn n ASN 24 Ca -0.14 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.44 2jxn n ASN 24 Cb 0.59 -1.78 0.00 0.00 -0.61 0.00 0.00 39.78 37.97 2jxn n ASN 24 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jxn n GLY 25 N -1.70 0.00 0.21 7.41 0.00 -1.04 -5.01 105.19 105.06 2jxn n GLY 25 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2jxn n GLY 25 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jxn n ASP 26 N 0.00 -2.32 -3.46 1.61 2.03 -1.01 -4.64 116.55 108.75 2jxn n ASP 26 Ca 0.00 0.16 -0.38 0.00 0.52 0.00 0.00 54.79 55.09 2jxn n ASP 26 Cb 0.00 0.27 -0.02 0.00 -0.72 0.00 0.00 41.12 40.65 2jxn n ASP 26 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2jxn n ARG 27 N -0.75 3.00 -3.64 -0.67 1.85 -1.25 -4.60 116.66 110.60 2jxn n ARG 27 Ca 0.00 -2.20 -0.27 0.00 -1.00 0.00 0.00 57.85 54.38 2jxn n ARG 27 Cb 0.00 -2.92 -0.16 0.00 -1.05 0.00 0.00 32.46 28.32 2jxn n ARG 27 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 2jxn s ASN 28 N 2.94 2.78 0.00 2.89 3.04 -1.26 -5.02 114.94 120.31 2jxn s ASN 28 Ca 0.57 -0.83 0.00 0.00 0.04 0.00 0.00 52.86 52.64 2jxn s ASN 28 Cb 0.15 -0.38 0.00 0.00 -1.54 0.00 0.00 41.25 39.48 2jxn s ASN 28 CO -0.05 -0.36 0.00 -0.24 -3.04 0.00 0.00 177.10 173.41 2jxn n SER 29 N 5.19 0.00 -3.88 -4.21 2.88 -1.26 -4.63 113.62 107.72 2jxn n SER 29 Ca -0.07 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.36 2jxn n SER 29 Cb 0.47 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.83 2jxn n SER 29 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2jxn s GLY 30 N 0.00 0.05 0.19 0.46 0.00 -1.26 -5.11 107.32 101.65 2jxn s GLY 30 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.60 2jxn s GLY 30 CO 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 173.10 172.86 2jxn n ALA 31 N 1.64 -1.77 -0.16 3.20 0.00 -1.26 -4.81 120.51 117.36 2jxn n ALA 31 Ca -0.22 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2jxn n ALA 31 Cb 0.56 -0.64 0.00 0.00 0.00 0.00 0.00 19.45 19.37 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 -2.88 0.00 0.05 0.00 5.03 -1.26 -5.01 115.26 111.18 2jxn n ASN 32 Ca -0.01 0.37 0.00 0.00 0.87 0.00 0.00 54.58 55.81 2jxn n ASN 32 Cb 0.31 -0.42 0.00 0.00 -1.02 0.00 0.00 39.78 38.65 2jxn n ASN 32 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2jxn n ASN 33 N -1.84 -0.02 0.00 6.41 3.02 -1.26 -5.12 115.26 116.46 2jxn n ASN 33 Ca 0.00 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 2jxn n ASN 33 Cb 0.00 0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 2jxn n ASN 33 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jxn n GLY 34 N 1.72 -0.92 3.52 7.41 0.00 -1.26 -5.08 105.19 110.58 2jxn n GLY 34 Ca 0.00 0.42 -0.28 0.00 0.00 0.00 0.00 46.02 46.16 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 0.00 -0.32 2.62 -0.02 0.00 -1.26 -4.74 105.19 101.46 2jxn n GLY 35 Ca 0.00 0.50 -0.36 0.00 0.00 0.00 0.00 46.02 46.16 2jxn n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jxn n GLY 36 N 6.13 5.75 3.56 -0.02 0.00 -1.26 -4.93 105.19 114.42 2jxn n GLY 36 Ca 0.58 -2.47 -0.22 0.00 0.00 0.00 0.00 46.02 43.92 2jxn n GLY 36 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jxn n GLU 37 N -0.67 -0.94 -4.04 1.61 4.71 -1.26 0.21 120.64 120.26 2jxn n GLU 37 Ca 0.55 0.37 -0.33 0.00 -0.01 0.00 0.00 57.16 57.74 2jxn n GLU 37 Cb 0.47 -1.54 -0.05 0.00 -1.01 0.00 0.00 31.44 29.31 2jxn n GLU 37 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2jxn n ASN 38 N -1.61 -1.99 -3.80 1.62 4.13 -1.26 -4.88 115.26 107.46 2jxn n ASN 38 Ca -0.20 -0.83 -0.12 0.00 1.68 0.00 0.00 54.58 55.11 2jxn n ASN 38 Cb 0.47 -1.73 -0.09 0.00 -1.54 0.00 0.00 39.78 36.89 2jxn n ASN 38 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2jxn s SER 39 N -2.98 -0.13 1.00 6.41 0.15 0.56 -5.15 113.70 113.56 2jxn s SER 39 Ca 0.64 0.04 -0.15 0.00 0.70 0.00 0.00 55.95 57.18 2jxn s SER 39 Cb -0.37 0.31 0.02 0.00 -1.71 0.00 0.00 66.02 64.26 2jxn s SER 39 CO 0.79 -0.37 0.04 0.00 1.20 0.00 0.00 173.24 174.89 2jxn n ALA 40 N 1.55 -3.54 -0.73 5.45 0.00 -1.26 -4.29 120.51 117.69 2jxn n ALA 40 Ca -0.21 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.41 2jxn n ALA 40 Cb 0.56 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2jxn n ALA 40 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2jxn n PRO 41 N -1.00 0.00 -3.15 0.00 -0.02 -1.26 -4.67 135.00 124.89 2jxn n PRO 41 Ca 0.04 0.58 0.04 0.00 -2.02 0.00 0.00 63.50 62.13 2jxn n PRO 41 Cb 0.57 -1.05 -0.00 0.00 -0.02 0.00 0.00 33.50 33.00 2jxn n PRO 41 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2jxn s VAL 42 N -1.44 -0.92 0.00 -1.45 -7.23 -1.26 -4.91 120.40 103.19 2jxn s VAL 42 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.17 2jxn s VAL 42 Cb 0.00 -0.92 0.00 0.00 0.56 0.00 0.00 36.38 36.02 2jxn s VAL 42 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 2jxn n GLY 43 N 5.39 2.30 0.20 2.32 0.00 -1.26 -4.86 105.19 109.28 2jxn n GLY 43 Ca 0.05 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 2jxn n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jxn h ALA 44 N 0.00 1.01 -0.64 4.61 0.00 -1.91 -2.46 119.26 119.87 2jxn h ALA 44 Ca 0.00 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 2jxn h ALA 44 Cb 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2jxn h ALA 44 CO 0.00 0.39 0.08 0.00 0.00 0.00 0.00 179.25 179.71 2jxn h ALA 45 N 1.69 0.93 0.00 0.00 0.00 -1.89 -2.72 119.26 117.27 2jxn h ALA 45 Ca -0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 2jxn h ALA 45 Cb 0.83 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2jxn h ALA 45 CO 0.04 0.66 -0.59 -0.84 0.00 0.00 0.00 179.25 178.51 2jxn h ILE 46 N 0.99 0.77 0.00 0.00 3.07 -1.95 -3.19 117.51 117.20 2jxn h ILE 46 Ca 0.19 -2.12 -0.02 0.00 1.55 0.00 0.00 64.86 64.46 2jxn h ILE 46 Cb 0.46 2.35 -0.00 0.00 -0.27 0.00 0.00 36.82 39.36 2jxn h ILE 46 CO 0.02 0.44 -0.11 0.00 -1.05 0.00 0.00 178.15 177.45 2jxn h ALA 47 N 1.52 1.22 0.00 0.16 0.00 -1.14 -1.79 119.26 119.23 2jxn h ALA 47 Ca -0.02 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 2jxn h ALA 47 Cb 1.39 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 2jxn h ALA 47 CO 0.06 0.14 -0.80 -0.91 0.00 0.00 0.00 179.25 177.73 2jxn h ASN 48 N 0.00 0.00 0.00 0.00 4.21 -1.50 -3.26 115.58 115.03 2jxn h ASN 48 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2jxn h ASN 48 Cb 0.36 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.56 2jxn h ASN 48 CO 0.01 0.44 0.00 0.49 -1.29 0.00 0.00 177.43 177.08 2jxn n PHE 49 N -3.05 0.00 -3.80 1.19 3.01 -0.67 -4.28 117.46 109.85 2jxn n PHE 49 Ca -0.02 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.15 2jxn n PHE 49 Cb 0.73 0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 40.05 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 -1.05 1.96 0.63 4.37 1.43 -1.23 -0.29 118.68 124.50 2jxn s LEU 50 Ca 0.01 -1.18 -0.17 0.00 -1.03 0.00 0.00 54.13 51.75 2jxn s LEU 50 Cb 0.00 -0.86 -0.10 0.00 0.03 0.00 0.00 46.19 45.26 2jxn s LEU 50 CO 0.01 -0.32 0.16 -0.62 0.23 0.00 0.00 176.35 175.81 2jxn n GLU 51 N 4.86 0.22 0.20 1.70 -0.58 -0.99 -4.66 120.64 121.40 2jxn n GLU 51 Ca -0.08 0.09 -0.15 0.00 -0.42 0.00 0.00 57.16 56.61 2jxn n GLU 51 Cb 0.45 -1.41 -0.08 0.00 -0.57 0.00 0.00 31.44 29.82 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 -0.13 -0.45 -0.26 3.49 0.13 -1.94 0.10 132.00 132.96 2jxn h PRO 52 Ca -0.44 0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2jxn h PRO 52 Cb 1.39 0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.61 2jxn h PRO 52 CO 0.42 -0.23 0.16 0.37 -0.23 0.00 0.00 178.00 178.49 2jxn h GLN 53 N -0.57 0.35 0.00 0.86 4.15 -2.01 -1.34 115.11 116.56 2jxn h GLN 53 Ca -0.05 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 2jxn h GLN 53 Cb 0.42 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.03 2jxn h GLN 53 CO 0.08 0.27 -0.04 0.00 -1.93 0.00 0.00 178.83 177.20 2jxn h ALA 54 N 1.07 1.83 -0.61 3.38 0.00 -1.90 -1.13 119.26 121.89 2jxn h ALA 54 Ca 0.09 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.99 2jxn h ALA 54 Cb 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2jxn h ALA 54 CO -0.02 0.05 0.40 1.25 0.00 0.00 0.00 179.25 180.94 2jxn h LEU 55 N 0.00 0.65 -0.70 0.00 6.46 0.40 -0.95 115.31 121.18 2jxn h LEU 55 Ca -0.00 -0.01 -0.13 0.00 -0.12 0.00 0.00 57.88 57.62 2jxn h LEU 55 Cb 0.08 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 39.84 2jxn h LEU 55 CO 0.01 0.46 -0.41 -0.33 -0.62 0.00 0.00 178.44 177.55 2jxn h GLU 56 N 0.76 0.53 0.51 1.25 3.07 -1.07 -2.79 114.58 116.84 2jxn h GLU 56 Ca 0.23 -0.27 -0.02 0.00 -0.50 0.00 0.00 59.36 58.80 2jxn h GLU 56 Cb -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2jxn h GLU 56 CO -0.06 0.85 -0.30 -0.09 -1.40 0.00 0.00 179.01 178.01 2jxn h ARG 57 N 0.44 -0.74 -0.42 2.33 1.12 -1.11 0.11 114.38 116.11 2jxn h ARG 57 Ca 0.04 0.05 0.04 0.00 -1.11 0.00 0.00 59.98 59.00 2jxn h ARG 57 Cb 0.90 0.17 -0.02 0.00 -0.01 0.00 0.00 29.97 31.00 2jxn h ARG 57 CO 0.08 -0.49 0.28 1.25 -3.11 0.00 0.00 179.97 177.98 2jxn h LEU 58 N -0.77 0.35 -0.79 3.80 5.85 -1.51 0.32 115.31 122.56 2jxn h LEU 58 Ca -0.06 -0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.56 2jxn h LEU 58 Cb 0.62 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2jxn h LEU 58 CO 0.07 0.23 -0.18 -1.28 -0.34 0.00 0.00 178.44 176.95 2jxn h SER 59 N 0.40 0.72 -0.23 1.25 0.87 -1.12 -2.29 113.55 113.15 2jxn h SER 59 Ca 0.18 -0.24 -0.05 0.00 -1.23 0.00 0.00 61.79 60.45 2jxn h SER 59 Cb 0.21 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2jxn h SER 59 CO -0.04 0.90 -0.04 -0.09 -0.53 0.00 0.00 176.83 177.03 2jxn h ARG 60 N 0.64 0.43 -0.42 2.24 9.65 0.13 -3.18 114.38 123.88 2jxn h ARG 60 Ca 0.10 -0.16 -0.13 0.00 -1.10 0.00 0.00 59.98 58.69 2jxn h ARG 60 Cb 0.66 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.20 2jxn h ARG 60 CO 0.05 0.65 -0.24 -0.24 2.80 0.00 0.00 179.97 182.98 2jxn h VAL 61 N 0.17 1.28 -1.02 0.20 3.04 -1.37 -3.01 116.25 115.55 2jxn h VAL 61 Ca 0.06 -1.40 0.24 0.00 -1.01 0.00 0.00 66.70 64.59 2jxn h VAL 61 Cb 0.48 1.27 -0.10 0.00 -2.01 0.00 0.00 31.29 30.93 2jxn h VAL 61 CO 0.02 0.47 0.63 0.00 -1.01 0.00 0.00 177.57 177.68 2jxn h ALA 62 N 0.81 2.00 0.00 3.17 0.00 -1.43 1.05 119.26 124.86 2jxn h ALA 62 Ca 0.09 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2jxn h ALA 62 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2jxn h ALA 62 CO 0.07 -0.41 0.00 -0.07 0.00 0.00 0.00 179.25 178.84 2jxn h LEU 63 N 0.52 0.00 0.00 0.00 3.38 -1.50 -2.45 115.31 115.25 2jxn h LEU 63 Ca 0.60 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 58.26 2jxn h LEU 63 Cb 1.29 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.00 2jxn h LEU 63 CO -0.36 0.00 -2.04 0.52 0.09 0.00 0.00 178.44 176.65 2jxn n VAL 64 N -2.95 1.03 -3.50 1.22 0.31 0.32 -4.61 118.33 110.16 2jxn n VAL 64 Ca -0.03 -0.29 -0.28 0.00 -0.01 0.00 0.00 64.34 63.74 2jxn n VAL 64 Cb 0.07 -1.64 -0.11 0.00 -0.91 0.00 0.00 33.84 31.25 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 -2.35 0.96 0.51 5.55 3.00 0.96 -4.95 118.95 122.64 2jxn s ARG 65 Ca -0.26 -1.93 0.17 0.00 0.00 0.00 0.00 55.73 53.70 2jxn s ARG 65 Cb 0.09 -1.66 1.26 0.00 0.00 0.00 0.00 34.95 34.65 2jxn s ARG 65 CO 0.34 -1.29 2.13 -0.09 0.00 0.00 0.00 175.30 176.39 2jxn h ARG 66 N 6.22 0.00 -0.41 3.54 2.43 -1.65 -2.62 114.38 121.90 2jxn h ARG 66 Ca 0.15 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.35 2jxn h ARG 66 Cb 0.92 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.44 2jxn h ARG 66 CO 0.38 0.03 0.21 -0.44 -1.51 0.00 0.00 179.97 178.64 2jxn h ASP 67 N 0.00 0.31 -0.02 -3.80 5.19 -1.92 -0.68 116.42 115.50 2jxn h ASP 67 Ca -0.00 0.02 -0.16 0.00 -0.62 0.00 0.00 57.03 56.27 2jxn h ASP 67 Cb 0.05 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.52 2jxn h ASP 67 CO 0.00 0.22 -0.52 0.08 -3.12 0.00 0.00 179.24 175.90 2jxn h ARG 68 N 0.42 0.59 0.00 3.56 0.11 -1.89 -2.87 114.38 114.31 2jxn h ARG 68 Ca 0.17 -0.36 -0.03 0.00 0.10 0.00 0.00 59.98 59.86 2jxn h ARG 68 Cb 0.08 0.04 -0.00 0.00 1.11 0.00 0.00 29.97 31.19 2jxn h ARG 68 CO -0.12 0.97 -0.16 0.00 0.10 0.00 0.00 179.97 180.76 2jxn h ALA 69 N 0.96 1.74 -0.17 0.08 0.00 -1.24 -2.09 119.26 118.54 2jxn h ALA 69 Ca 0.02 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 2jxn h ALA 69 Cb 1.06 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2jxn h ALA 69 CO 0.10 0.19 -0.52 0.37 0.00 0.00 0.00 179.25 179.39 2jxn h GLN 70 N 0.00 0.49 -0.23 0.00 4.15 -0.91 -2.83 115.11 115.78 2jxn h GLN 70 Ca -0.00 -0.29 -0.16 0.00 0.77 0.00 0.00 58.65 58.96 2jxn h GLN 70 Cb 0.28 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.99 2jxn h GLN 70 CO 0.02 0.89 -0.53 0.00 -1.93 0.00 0.00 178.83 177.28 2jxn h ALA 71 N 1.05 0.64 -0.26 3.38 0.00 -1.31 -2.12 119.26 120.65 2jxn h ALA 71 Ca 0.01 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 2jxn h ALA 71 Cb 1.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2jxn h ALA 71 CO 0.09 0.68 0.15 0.28 0.00 0.00 0.00 179.25 180.46 2jxn h VAL 72 N 0.51 1.10 -0.31 0.00 2.07 -1.38 -0.36 116.25 117.87 2jxn h VAL 72 Ca 0.02 -0.25 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 2jxn h VAL 72 Cb 1.09 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 2jxn h VAL 72 CO 0.11 0.10 -0.03 -0.33 0.02 0.00 0.00 177.57 177.43 2jxn h GLU 73 N 0.32 0.49 0.00 1.57 4.39 -1.48 -2.13 114.58 117.75 2jxn h GLU 73 Ca 0.09 -0.11 -0.10 0.00 0.34 0.00 0.00 59.36 59.58 2jxn h GLU 73 Cb 0.03 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 2jxn h GLU 73 CO -0.02 0.55 -0.49 1.15 -1.16 0.00 0.00 179.01 179.04 2jxn h THR 74 N 0.47 1.18 -0.09 1.13 2.02 -0.83 -2.32 112.91 114.47 2jxn h THR 74 Ca 0.10 -1.77 -0.02 0.00 0.77 0.00 0.00 66.41 65.49 2jxn h THR 74 Cb 0.36 2.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.77 2jxn h THR 74 CO 0.01 0.48 0.00 0.22 0.37 0.00 0.00 175.52 176.60 2jxn h TYR 75 N 0.00 0.18 -0.51 3.16 5.03 -0.40 -1.92 116.97 122.51 2jxn h TYR 75 Ca -0.00 -0.03 -0.08 0.00 2.58 0.00 0.00 58.73 61.20 2jxn h TYR 75 Cb 0.96 -0.05 -0.02 0.00 1.55 0.00 0.00 36.73 39.18 2jxn h TYR 75 CO 0.00 0.42 0.02 1.25 -1.32 0.00 0.00 178.16 178.53 2jxn h LEU 76 N -0.11 0.87 -1.04 2.82 5.85 -1.48 -2.50 115.31 119.73 2jxn h LEU 76 Ca 0.03 -0.30 0.05 0.00 0.84 0.00 0.00 57.88 58.50 2jxn h LEU 76 Cb 0.35 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.08 2jxn h LEU 76 CO 0.00 0.95 0.64 0.50 -0.34 0.00 0.00 178.44 180.20 2jxn h LYS 77 N 0.76 1.17 -0.69 1.25 3.64 -1.38 0.32 116.57 121.65 2jxn h LYS 77 Ca 0.15 -0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 2jxn h LYS 77 Cb 0.49 -0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2jxn h LYS 77 CO 0.02 0.77 0.18 0.87 -2.27 0.00 0.00 179.45 179.02 2jxn h LYS 78 N 1.20 1.09 -0.11 1.90 1.79 -1.10 0.90 116.57 122.24 2jxn h LYS 78 Ca 0.41 -0.26 -0.04 0.00 -2.18 0.00 0.00 60.65 58.58 2jxn h LYS 78 Cb 0.08 -0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 30.58 2jxn h LYS 78 CO -0.14 0.96 -0.08 -0.07 -1.08 0.00 0.00 179.45 179.03 2jxn h LEU 79 N 1.02 0.26 -0.25 2.94 4.07 -0.82 -0.81 115.31 121.73 2jxn h LEU 79 Ca 0.22 -0.46 -0.09 0.00 0.08 0.00 0.00 57.88 57.64 2jxn h LEU 79 Cb 0.35 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.01 2jxn h LEU 79 CO -0.00 0.66 -0.18 0.40 -1.08 0.00 0.00 178.44 178.25 2jxn h ILE 80 N -0.13 1.31 0.00 1.22 2.04 -0.29 -2.20 117.51 119.45 2jxn h ILE 80 Ca 0.02 -1.31 -0.03 0.00 1.00 0.00 0.00 64.86 64.54 2jxn h ILE 80 Cb 0.58 1.62 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 2jxn h ILE 80 CO 0.02 0.41 -0.16 0.00 0.00 0.00 0.00 178.15 178.42 2jxn h ALA 81 N 0.70 1.25 -1.28 1.87 0.00 0.79 -3.32 119.26 119.27 2jxn h ALA 81 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2jxn h ALA 81 Cb 0.71 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2jxn h ALA 81 CO 0.05 0.21 0.00 0.25 0.00 0.00 0.00 179.25 179.75 2jxn n THR 82 N -3.65 0.00 0.00 0.00 -2.24 -0.31 -5.02 114.28 103.06 2jxn n THR 82 Ca -0.01 0.40 0.00 0.00 -2.27 0.00 0.00 64.05 62.17 2jxn n THR 82 Cb 0.29 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 67.49 2jxn n THR 82 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2jxn n ASN 83 N -1.36 0.00 0.03 3.42 2.04 -0.85 -4.98 115.26 113.56 2jxn n ASN 83 Ca 0.00 0.00 0.22 0.00 -0.44 0.00 0.00 54.58 54.36 2jxn n ASN 83 Cb 0.00 0.00 0.73 0.00 -2.53 0.00 0.00 39.78 37.98 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 -0.26 -1.80 -3.43 115.58 110.62 2jxn h ASN 84 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2jxn h ASN 84 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 2jxn h ASN 84 CO 0.00 0.00 0.00 0.52 -1.06 0.00 0.00 177.43 176.89 2jxn n VAL 85 N -3.82 0.00 -3.96 2.81 0.31 -1.14 -4.68 118.33 107.85 2jxn n VAL 85 Ca 0.10 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.10 2jxn n VAL 85 Cb 0.71 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.64 2jxn n VAL 85 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2jxn n THR 86 N 0.00 -1.67 -3.84 2.52 -2.24 -1.26 -4.92 114.28 102.87 2jxn n THR 86 Ca 0.00 -0.41 -0.11 0.00 -2.27 0.00 0.00 64.05 61.26 2jxn n THR 86 Cb 0.00 -1.44 -0.08 0.00 -2.10 0.00 0.00 70.33 66.70 2jxn n THR 86 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2jxn s HIS 87 N -3.96 0.03 -0.43 4.78 5.04 -1.26 -5.11 115.29 114.38 2jxn s HIS 87 Ca 0.30 -0.21 0.05 0.00 -1.54 0.00 0.00 55.06 53.66 2jxn s HIS 87 Cb -0.17 -0.01 0.17 0.00 0.04 0.00 0.00 32.58 32.61 2jxn s HIS 87 CO 0.70 -0.42 0.42 0.15 -2.34 0.00 0.00 174.74 173.26 2jxn s LYS 88 N -2.37 0.92 0.47 2.88 1.02 -1.26 -4.82 119.74 116.60 2jxn s LYS 88 Ca -0.07 -1.84 -0.20 0.00 0.02 0.00 0.00 55.97 53.88 2jxn s LYS 88 Cb -0.02 -1.10 -0.13 0.00 -0.52 0.00 0.00 37.83 36.06 2jxn s LYS 88 CO -0.03 -1.37 0.31 -0.89 -0.92 0.00 0.00 175.35 172.45 2jxn n ILE 89 N 2.92 1.29 -4.21 2.17 5.41 0.60 -4.78 119.36 122.76 2jxn n ILE 89 Ca 0.27 -0.50 -0.15 0.00 1.00 0.00 0.00 62.75 63.36 2jxn n ILE 89 Cb 0.49 -0.36 -0.06 0.00 -0.71 0.00 0.00 39.64 39.01 2jxn n ILE 89 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2jxn n THR 90 N -1.25 0.00 0.23 1.39 -2.24 -1.26 -2.33 114.28 108.82 2jxn n THR 90 Ca 0.11 -1.89 0.07 0.00 -2.27 0.00 0.00 64.05 60.06 2jxn n THR 90 Cb 0.43 0.96 0.58 0.00 -2.10 0.00 0.00 70.33 70.20 2jxn n THR 90 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2jxn h GLU 91 N 0.00 0.03 0.04 -0.78 -0.00 -1.93 -0.07 114.58 111.88 2jxn h GLU 91 Ca -0.19 -0.00 -0.24 0.00 -0.00 0.00 0.00 59.36 58.94 2jxn h GLU 91 Cb 0.94 -0.01 -0.02 0.00 -0.00 0.00 0.00 28.75 29.67 2jxn h GLU 91 CO 0.27 0.09 -1.12 0.00 -0.00 0.00 0.00 179.01 178.25 2jxn h ALA 92 N 1.92 0.29 -0.04 1.06 0.00 -1.97 -2.99 119.26 117.53 2jxn h ALA 92 Ca 0.01 -0.93 -0.13 0.00 0.00 0.00 0.00 54.91 53.85 2jxn h ALA 92 Cb 0.11 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.84 2jxn h ALA 92 CO 0.01 1.18 -0.49 1.49 0.00 0.00 0.00 179.25 181.45 2jxn h GLU 93 N 0.02 0.40 -0.26 0.00 4.57 -1.70 -2.90 114.58 114.71 2jxn h GLU 93 Ca -0.07 -0.38 -0.01 0.00 -1.18 0.00 0.00 59.36 57.73 2jxn h GLU 93 Cb 1.85 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 30.52 2jxn h GLU 93 CO 0.15 1.03 0.11 0.82 -1.18 0.00 0.00 179.01 179.94 2jxn h ILE 94 N -0.11 1.17 -0.96 2.32 2.04 -1.16 -2.41 117.51 118.41 2jxn h ILE 94 Ca -0.05 -0.50 0.06 0.00 1.00 0.00 0.00 64.86 65.37 2jxn h ILE 94 Cb 1.17 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 38.21 2jxn h ILE 94 CO 0.10 0.17 0.62 -0.37 0.00 0.00 0.00 178.15 178.67 2jxn h VAL 95 N 0.27 1.09 -0.49 1.67 -1.51 -1.63 -0.38 116.25 115.27 2jxn h VAL 95 Ca 0.09 -0.39 0.04 0.00 -1.23 0.00 0.00 66.70 65.21 2jxn h VAL 95 Cb 0.16 -0.13 -0.04 0.00 -2.13 0.00 0.00 31.29 29.15 2jxn h VAL 95 CO -0.01 0.21 0.25 0.77 -1.23 0.00 0.00 177.57 177.56 2jxn h SER 96 N 1.13 0.37 -0.29 4.19 4.64 -1.23 0.35 113.55 122.71 2jxn h SER 96 Ca 0.41 0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.66 2jxn h SER 96 Cb 0.16 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 2jxn h SER 96 CO -0.16 0.26 -0.19 0.40 -0.87 0.00 0.00 176.83 176.28 2jxn h ILE 97 N 0.50 1.30 -0.34 0.95 2.04 -0.89 -2.07 117.51 119.00 2jxn h ILE 97 Ca 0.21 -1.32 0.05 0.00 1.00 0.00 0.00 64.86 64.81 2jxn h ILE 97 Cb 0.10 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 2jxn h ILE 97 CO -0.14 0.42 0.06 0.25 0.00 0.00 0.00 178.15 178.74 2jxn h LEU 98 N 0.38 -0.01 -1.65 1.44 5.85 -0.63 1.02 115.31 121.73 2jxn h LEU 98 Ca 0.06 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.87 2jxn h LEU 98 Cb 0.73 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 2jxn h LEU 98 CO 0.05 0.03 0.29 0.78 -0.34 0.00 0.00 178.44 179.25 2jxn h ASN 99 N 0.17 0.40 0.74 1.25 2.35 -0.22 0.50 115.58 120.77 2jxn h ASN 99 Ca 0.16 -0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.65 2jxn h ASN 99 Cb 0.18 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 2jxn h ASN 99 CO -0.22 0.27 -1.21 1.23 -1.65 0.00 0.00 177.43 175.85 2jxn h GLY 100 N 0.46 0.18 1.53 2.83 0.00 -0.30 -3.25 103.07 104.52 2jxn h GLY 100 Ca 0.18 -0.45 -0.22 0.00 0.00 0.00 0.00 47.33 46.83 2jxn h GLY 100 CO -0.04 0.40 -0.90 -2.22 0.00 0.00 0.00 176.54 173.78 2jxn h ILE 101 N 0.04 1.39 0.00 2.60 2.04 0.20 -3.05 117.51 120.73 2jxn h ILE 101 Ca -0.11 -2.37 -0.02 0.00 1.00 0.00 0.00 64.86 63.36 2jxn h ILE 101 Cb 1.91 2.35 -0.00 0.00 -0.74 0.00 0.00 36.82 40.33 2jxn h ILE 101 CO 0.17 0.71 -0.09 0.00 0.00 0.00 0.00 178.15 178.93 2jxn h ALA 102 N 0.76 1.72 -0.06 1.87 0.00 -0.12 0.20 119.26 123.63 2jxn h ALA 102 Ca -0.07 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.59 2jxn h ALA 102 Cb 1.52 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.31 2jxn h ALA 102 CO 0.16 0.12 -0.62 -0.22 0.00 0.00 0.00 179.25 178.68 2jxn h LYS 103 N 0.00 0.52 0.32 0.00 1.63 -1.57 -3.36 116.57 114.11 2jxn h LYS 103 Ca -0.00 -0.48 -0.02 0.00 -0.85 0.00 0.00 60.65 59.30 2jxn h LYS 103 Cb 0.18 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.93 2jxn h LYS 103 CO 0.01 1.12 -0.15 1.96 -3.45 0.00 0.00 179.45 178.94 2jxn h GLN 104 N 0.10 -0.41 -6.89 1.90 1.08 -1.33 -3.45 115.11 106.11 2jxn h GLN 104 Ca -0.06 0.03 -0.49 0.00 -1.45 0.00 0.00 58.65 56.67 2jxn h GLN 104 Cb 1.29 0.09 0.01 0.00 -0.05 0.00 0.00 27.48 28.82 2jxn h GLN 104 CO 0.13 -0.13 0.14 -0.65 -0.95 0.00 0.00 178.83 177.36 2jxn s GLN 105 N -3.50 3.74 0.00 1.46 -1.52 0.64 -4.90 119.66 115.59 2jxn s GLN 105 Ca -0.10 0.46 0.00 0.00 -1.95 0.00 0.00 55.36 53.76 2jxn s GLN 105 Cb 0.01 -2.37 0.00 0.00 -0.22 0.00 0.00 33.01 30.43 2jxn s GLN 105 CO 0.35 -0.09 0.00 -1.71 -0.25 0.00 0.00 175.29 173.60 2jxn n ASN 106 N -1.49 0.00 0.00 5.90 5.15 -1.26 -4.52 115.26 119.03 2jxn n ASN 106 Ca 0.02 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.00 2jxn n ASN 106 Cb 0.54 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.79 2jxn n ASN 106 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2jxn n SER 107 N 0.00 0.00 -0.93 1.20 3.41 -1.26 -4.99 113.62 111.05 2jxn n SER 107 Ca 0.00 0.86 0.00 0.00 -0.26 0.00 0.00 58.87 59.47 2jxn n SER 107 Cb 0.00 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.59 2jxn n SER 107 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2jxn n GLN 108 N -2.08 -2.62 -3.61 4.33 7.27 -1.26 -5.03 117.38 114.38 2jxn n GLN 108 Ca 0.00 1.91 -0.21 0.00 0.07 0.00 0.00 57.00 58.77 2jxn n GLN 108 Cb 0.00 -2.12 -0.16 0.00 2.41 0.00 0.00 30.24 30.37 2jxn n GLN 108 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 2jxn s ASN 109 N -1.94 1.58 -0.46 1.69 0.01 -1.26 -5.10 114.94 109.46 2jxn s ASN 109 Ca 0.00 -0.20 -0.44 0.00 -0.71 0.00 0.00 52.86 51.51 2jxn s ASN 109 Cb 0.00 0.00 -0.18 0.00 0.41 0.00 0.00 41.25 41.48 2jxn s ASN 109 CO 0.00 -0.30 1.84 -0.46 -1.51 0.00 0.00 177.10 176.67 2jxn n ASN 110 N 5.30 1.29 0.00 -1.22 6.94 -1.26 -4.86 115.26 121.45 2jxn n ASN 110 Ca -0.05 0.95 0.00 0.00 -0.02 0.00 0.00 54.58 55.46 2jxn n ASN 110 Cb 0.49 -0.95 0.00 0.00 -2.36 0.00 0.00 39.78 36.97 2jxn n ASN 110 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2jxn n SER 111 N 5.76 0.00 0.00 0.53 7.64 -1.26 -4.98 113.62 121.31 2jxn n SER 111 Ca 0.39 0.00 0.07 0.00 1.01 0.00 0.00 58.87 60.34 2jxn n SER 111 Cb -0.01 0.00 0.38 0.00 -1.01 0.00 0.00 64.21 63.57 2jxn n SER 111 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2jxn n LYS 112 N 0.00 0.26 0.00 1.43 5.02 -1.26 -2.49 118.16 121.12 2jxn n LYS 112 Ca 0.00 0.12 0.06 0.00 -2.02 0.00 0.00 58.31 56.47 2jxn n LYS 112 Cb 0.00 -1.50 0.30 0.00 -0.02 0.00 0.00 35.03 33.81 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 -1.22 0.86 0.51 -0.18 5.41 -1.26 -2.21 119.36 121.26 2jxn n ILE 113 Ca 0.08 0.21 0.07 0.00 1.00 0.00 0.00 62.75 64.11 2jxn n ILE 113 Cb 0.10 -1.00 0.30 0.00 -0.71 0.00 0.00 39.64 38.33 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 -1.37 0.96 -0.08 1.39 5.41 -1.04 -2.53 119.36 122.10 2jxn n ILE 114 Ca 0.05 0.24 -0.08 0.00 1.00 0.00 0.00 62.75 63.96 2jxn n ILE 114 Cb 0.12 -1.01 0.08 0.00 -0.71 0.00 0.00 39.64 38.12 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 0.88 0.00 1.39 3.57 -1.73 -3.53 116.94 117.51 2jxn h PHE 115 Ca 0.00 -0.21 0.00 0.00 3.53 0.00 0.00 57.97 61.29 2jxn h PHE 115 Cb 0.21 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.75 2jxn h PHE 115 CO 0.00 0.94 0.00 -1.91 -2.23 0.00 0.00 178.31 175.11