#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 -1.42 -0.29 7.83 5.75 -1.26 -5.00 116.55 122.16 2jxn n ASP 2 Ca 0.00 -2.15 0.00 0.00 -0.01 0.00 0.00 54.79 52.63 2jxn n ASP 2 Cb 0.00 1.24 0.00 0.00 -1.03 0.00 0.00 41.12 41.33 2jxn n ASP 2 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 2jxn n PRO 3 N 0.56 0.71 -0.00 0.11 -0.04 -1.26 -3.55 135.00 131.53 2jxn n PRO 3 Ca -0.03 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.26 2jxn n PRO 3 Cb 0.74 -1.20 -0.11 0.00 -0.04 0.00 0.00 33.50 32.89 2jxn n PRO 3 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2jxn h GLU 4 N 0.17 0.42 -0.18 0.54 4.81 -2.00 -2.63 114.58 115.71 2jxn h GLU 4 Ca 0.00 -0.43 -0.06 0.00 -0.13 0.00 0.00 59.36 58.73 2jxn h GLU 4 Cb 0.20 0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 2jxn h GLU 4 CO 0.00 1.10 -0.12 -0.07 -0.73 0.00 0.00 179.01 179.18 2jxn h LEU 5 N -0.09 0.43 -0.79 1.64 3.38 -2.02 -3.14 115.31 114.72 2jxn h LEU 5 Ca -0.07 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.52 2jxn h LEU 5 Cb 1.29 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.86 2jxn h LEU 5 CO 0.12 0.77 0.48 1.56 0.09 0.00 0.00 178.44 181.46 2jxn h GLN 6 N 0.08 0.84 -0.92 1.13 4.20 -1.77 -1.60 115.11 117.07 2jxn h GLN 6 Ca 0.04 -0.05 0.25 0.00 0.06 0.00 0.00 58.65 58.95 2jxn h GLN 6 Cb 0.63 -0.19 -0.14 0.00 0.30 0.00 0.00 27.48 28.08 2jxn h GLN 6 CO 0.03 0.56 0.40 0.00 -0.67 0.00 0.00 178.83 179.15 2jxn h ILE 8 N 0.34 1.30 -0.79 0.00 2.04 -1.36 -2.54 117.51 116.51 2jxn h ILE 8 Ca 0.61 -1.36 0.03 0.00 1.00 0.00 0.00 64.86 65.13 2jxn h ILE 8 Cb 1.23 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 38.82 2jxn h ILE 8 CO -0.58 0.43 0.52 0.03 0.00 0.00 0.00 178.15 178.55 2jxn h ARG 9 N 0.39 0.95 -0.26 2.37 3.08 -0.23 0.62 114.38 121.30 2jxn h ARG 9 Ca 0.05 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 2jxn h ARG 9 Cb 0.77 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 2jxn h ARG 9 CO 0.06 0.63 -0.30 0.93 -1.07 0.00 0.00 179.97 180.22 2jxn h GLU 10 N 0.98 0.52 0.20 0.04 4.39 -0.64 -2.44 114.58 117.64 2jxn h GLU 10 Ca 0.31 -0.22 -0.31 0.00 0.34 0.00 0.00 59.36 59.48 2jxn h GLU 10 Cb 0.02 -0.02 0.02 0.00 -0.10 0.00 0.00 28.75 28.68 2jxn h GLU 10 CO -0.09 0.77 -1.40 0.00 -1.16 0.00 0.00 179.01 177.13 2jxn h ARG 12 N 0.12 1.19 -0.69 0.00 2.43 0.27 0.12 114.38 117.82 2jxn h ARG 12 Ca -0.21 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 58.88 2jxn h ARG 12 Cb 2.10 -0.27 -0.03 0.00 -0.42 0.00 0.00 29.97 31.34 2jxn h ARG 12 CO 0.25 0.79 0.41 1.25 -1.51 0.00 0.00 179.97 181.15 2jxn h LEU 13 N 1.22 0.83 -0.74 3.80 5.85 -1.51 -0.85 115.31 123.91 2jxn h LEU 13 Ca 0.39 -0.07 -0.13 0.00 0.84 0.00 0.00 57.88 58.91 2jxn h LEU 13 Cb 0.01 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 2jxn h LEU 13 CO -0.12 0.66 -0.63 0.00 -0.34 0.00 0.00 178.44 178.01 2jxn h ALA 14 N 1.21 0.96 -0.22 1.25 0.00 -1.39 -3.03 119.26 118.04 2jxn h ALA 14 Ca 0.25 -0.57 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 2jxn h ALA 14 Cb -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2jxn h ALA 14 CO -0.05 0.78 -0.37 1.96 0.00 0.00 0.00 179.25 181.58 2jxn h GLN 15 N 0.00 0.48 0.00 0.00 1.08 -0.13 -3.46 115.11 113.08 2jxn h GLN 15 Ca -0.01 -0.23 0.00 0.00 -1.45 0.00 0.00 58.65 56.97 2jxn h GLN 15 Cb 1.11 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 2jxn h GLN 15 CO 0.08 0.78 0.00 -0.11 -0.95 0.00 0.00 178.83 178.63 2jxn n LEU 16 N -4.05 0.00 0.00 1.46 7.94 -0.39 -3.83 117.00 118.14 2jxn n LEU 16 Ca -0.01 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.89 2jxn n LEU 16 Cb 0.48 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.43 2jxn n LEU 16 CO 0.44 0.00 0.00 1.17 -1.11 0.00 0.00 177.39 177.89 2jxn n LYS 17 N 0.00 0.00 -1.56 1.96 3.00 -1.26 -5.01 118.16 115.29 2jxn n LYS 17 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.35 2jxn n LYS 17 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.01 2jxn n LYS 17 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2jxn n ASN 18 N -1.89 -8.22 -4.04 3.14 3.02 -1.25 -5.01 115.26 101.02 2jxn n ASN 18 Ca 0.00 1.77 -0.13 0.00 -0.03 0.00 0.00 54.58 56.19 2jxn n ASN 18 Cb 0.00 -5.08 -0.12 0.00 -0.61 0.00 0.00 39.78 33.97 2jxn n ASN 18 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2jxn s ASN 19 N -5.82 0.73 0.00 6.41 2.47 -1.26 -5.15 114.94 112.32 2jxn s ASN 19 Ca 0.00 -0.49 0.00 0.00 0.42 0.00 0.00 52.86 52.79 2jxn s ASN 19 Cb 0.00 0.03 0.00 0.00 -1.45 0.00 0.00 41.25 39.83 2jxn s ASN 19 CO 0.00 -0.19 0.00 -0.24 -3.72 0.00 0.00 177.10 172.95 2jxn n SER 20 N 1.65 0.31 0.00 -4.21 2.88 -1.26 -5.14 113.62 107.86 2jxn n SER 20 Ca -0.22 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.32 2jxn n SER 20 Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 2jxn n SER 20 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jxn n GLY 21 N 0.00 -1.96 7.00 0.46 0.00 -1.26 -5.14 105.19 104.29 2jxn n GLY 21 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.61 2jxn n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jxn n GLY 22 N -0.94 2.58 0.75 -0.02 0.00 -1.26 -4.99 105.19 101.31 2jxn n GLY 22 Ca 0.00 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.77 2jxn n GLY 22 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jxn n THR 23 N 0.00 -0.41 -2.06 2.61 -1.04 -1.26 -4.71 114.28 107.41 2jxn n THR 23 Ca 0.00 0.45 -0.01 0.00 -2.04 0.00 0.00 64.05 62.45 2jxn n THR 23 Cb 0.00 -0.71 -0.00 0.00 -1.82 0.00 0.00 70.33 67.80 2jxn n THR 23 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2jxn n ASN 24 N -3.26 -1.06 -2.09 8.00 5.03 -1.26 -3.63 115.26 116.99 2jxn n ASN 24 Ca -0.04 0.34 0.00 0.00 0.87 0.00 0.00 54.58 55.74 2jxn n ASN 24 Cb 0.35 -1.14 0.00 0.00 -1.02 0.00 0.00 39.78 37.98 2jxn n ASN 24 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jxn n GLY 25 N -0.38 -5.42 0.93 7.41 0.00 -1.26 -5.03 105.19 101.44 2jxn n GLY 25 Ca -0.02 -0.12 -0.06 0.00 0.00 0.00 0.00 46.02 45.83 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 1.70 -0.87 -0.26 1.61 -0.08 -1.24 -4.93 116.55 112.49 2jxn n ASP 26 Ca 0.00 -1.77 0.00 0.00 -1.51 0.00 0.00 54.79 51.51 2jxn n ASP 26 Cb 0.00 0.26 0.00 0.00 2.34 0.00 0.00 41.12 43.72 2jxn n ASP 26 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 2jxn n ARG 27 N 0.00 0.00 -1.50 -0.67 -4.01 -1.26 -4.87 116.66 104.35 2jxn n ARG 27 Ca -0.24 0.00 -0.37 0.00 -1.04 0.00 0.00 57.85 56.20 2jxn n ARG 27 Cb 0.65 0.00 0.06 0.00 -3.04 0.00 0.00 32.46 30.13 2jxn n ARG 27 CO 0.00 0.00 0.00 0.09 -3.04 0.00 0.00 177.63 174.68 2jxn n ASN 28 N 0.00 0.24 0.00 2.89 5.03 -1.26 -4.60 115.26 117.56 2jxn n ASN 28 Ca 0.00 0.74 0.00 0.00 0.87 0.00 0.00 54.58 56.19 2jxn n ASN 28 Cb 0.45 -1.35 0.00 0.00 -1.02 0.00 0.00 39.78 37.86 2jxn n ASN 28 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 2jxn n SER 29 N -0.80 0.00 -0.20 6.41 7.64 -1.26 -4.92 113.62 120.49 2jxn n SER 29 Ca 0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2jxn n SER 29 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 2jxn n SER 29 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jxn n GLY 30 N 0.00 -3.26 2.03 0.23 0.00 -1.26 -5.00 105.19 97.94 2jxn n GLY 30 Ca 0.00 -1.07 -0.19 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.87 -3.22 -3.50 4.61 0.00 -1.26 -5.07 120.51 111.21 2jxn n ALA 31 Ca 0.00 -0.98 -0.15 0.00 0.00 0.00 0.00 53.44 52.31 2jxn n ALA 31 Cb 0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.29 2jxn n ALA 31 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2jxn s ASN 32 N -2.77 -0.61 0.14 0.00 2.47 -1.26 -5.17 114.94 107.75 2jxn s ASN 32 Ca 0.43 0.91 -0.05 0.00 0.42 0.00 0.00 52.86 54.57 2jxn s ASN 32 Cb -0.07 0.87 -0.06 0.00 -1.45 0.00 0.00 41.25 40.54 2jxn s ASN 32 CO 0.35 -0.41 0.38 0.54 -3.72 0.00 0.00 177.10 174.25 2jxn s ASN 33 N -0.49 6.50 0.19 -4.21 4.22 -1.26 -5.10 114.94 114.78 2jxn s ASN 33 Ca -0.06 0.60 -0.03 0.00 -2.14 0.00 0.00 52.86 51.23 2jxn s ASN 33 Cb -0.03 -2.10 -0.03 0.00 1.28 0.00 0.00 41.25 40.37 2jxn s ASN 33 CO 0.05 0.05 0.17 -0.83 -2.04 0.00 0.00 177.10 174.50 2jxn s GLY 34 N -2.42 1.16 0.00 0.45 0.00 -1.26 -5.05 107.32 100.19 2jxn s GLY 34 Ca 0.41 -1.49 0.00 0.00 0.00 0.00 0.00 44.72 43.65 2jxn s GLY 34 CO 0.24 -1.25 0.00 0.61 0.00 0.00 0.00 173.10 172.70 2jxn n GLY 35 N -0.24 0.00 0.00 0.20 0.00 -1.26 -5.11 105.19 98.78 2jxn n GLY 35 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 -2.74 3.13 -0.02 0.00 -1.26 -4.85 105.19 99.44 2jxn n GLY 36 Ca 0.00 0.27 -0.23 0.00 0.00 0.00 0.00 46.02 46.06 2jxn n GLY 36 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jxn n GLU 37 N -0.53 -1.22 -0.09 1.61 2.13 -1.26 -4.54 120.64 116.74 2jxn n GLU 37 Ca 0.00 0.75 0.01 0.00 0.66 0.00 0.00 57.16 58.58 2jxn n GLU 37 Cb 0.00 -1.49 -0.00 0.00 0.27 0.00 0.00 31.44 30.21 2jxn n GLU 37 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2jxn n ASN 38 N -0.84 -0.53 -2.89 4.31 2.85 -1.26 -5.03 115.26 111.86 2jxn n ASN 38 Ca -0.15 0.05 -0.02 0.00 -0.11 0.00 0.00 54.58 54.35 2jxn n ASN 38 Cb 0.49 -0.28 -0.02 0.00 1.24 0.00 0.00 39.78 41.21 2jxn n ASN 38 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2jxn n SER 39 N -2.13 -4.86 0.00 1.20 7.64 -1.26 -5.01 113.62 109.19 2jxn n SER 39 Ca -0.00 1.09 0.00 0.00 1.01 0.00 0.00 58.87 60.97 2jxn n SER 39 Cb 0.04 -3.14 0.00 0.00 -1.01 0.00 0.00 64.21 60.10 2jxn n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jxn n ALA 40 N 2.04 0.00 -1.00 -0.43 0.00 -1.26 -4.93 120.51 114.94 2jxn n ALA 40 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2jxn n ALA 40 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.74 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 0.59 -3.56 0.00 -0.04 -1.26 -2.74 135.00 128.00 2jxn n PRO 41 Ca 0.00 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.28 2jxn n PRO 41 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 2jxn n PRO 41 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2jxn n VAL 42 N -0.79 -0.68 0.00 0.52 0.24 -1.26 -3.66 118.33 112.71 2jxn n VAL 42 Ca 0.00 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 2jxn n VAL 42 Cb 0.00 -0.64 0.00 0.00 -1.47 0.00 0.00 33.84 31.73 2jxn n VAL 42 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jxn n GLY 43 N -1.82 0.67 0.41 7.63 0.00 -1.26 -4.95 105.19 105.87 2jxn n GLY 43 Ca -0.16 -0.02 0.21 0.00 0.00 0.00 0.00 46.02 46.05 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 2.23 0.00 4.61 0.00 -1.58 0.96 119.26 125.47 2jxn h ALA 44 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2jxn h ALA 44 Cb 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2jxn h ALA 44 CO 0.00 -0.86 -0.30 0.00 0.00 0.00 0.00 179.25 178.09 2jxn h ALA 45 N 1.27 1.33 0.00 0.00 0.00 -1.89 -2.95 119.26 117.02 2jxn h ALA 45 Ca 0.24 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2jxn h ALA 45 Cb 1.44 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 2jxn h ALA 45 CO -0.00 0.37 -1.54 0.44 0.00 0.00 0.00 179.25 178.52 2jxn n ILE 46 N -3.93 0.34 0.29 0.00 -5.35 0.26 -4.49 119.36 106.48 2jxn n ILE 46 Ca -0.02 -0.31 0.18 0.00 -0.27 0.00 0.00 62.75 62.33 2jxn n ILE 46 Cb 0.37 -0.30 0.88 0.00 -1.74 0.00 0.00 39.64 38.85 2jxn n ILE 46 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jxn h ALA 47 N 0.64 1.09 0.00 -1.28 0.00 0.44 -0.32 119.26 119.83 2jxn h ALA 47 Ca -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2jxn h ALA 47 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2jxn h ALA 47 CO 0.01 0.05 -0.22 0.09 0.00 0.00 0.00 179.25 179.18 2jxn n ASN 48 N -3.26 0.36 -1.27 0.00 3.02 -1.12 -3.24 115.26 109.76 2jxn n ASN 48 Ca -0.01 0.26 0.07 0.00 -0.03 0.00 0.00 54.58 54.86 2jxn n ASN 48 Cb 0.21 -0.26 0.27 0.00 -0.61 0.00 0.00 39.78 39.39 2jxn n ASN 48 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2jxn n PHE 49 N -1.71 1.15 -3.56 3.10 3.01 -0.13 -4.73 117.46 114.59 2jxn n PHE 49 Ca 0.06 -0.45 -0.24 0.00 1.01 0.00 0.00 57.45 57.83 2jxn n PHE 49 Cb 0.37 -0.22 -0.15 0.00 -0.01 0.00 0.00 39.48 39.47 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 -1.54 0.23 0.79 4.37 1.43 -1.20 0.63 118.68 123.39 2jxn s LEU 50 Ca 0.38 -0.61 -0.15 0.00 -1.03 0.00 0.00 54.13 52.71 2jxn s LEU 50 Cb 0.25 -0.06 -0.03 0.00 0.03 0.00 0.00 46.19 46.38 2jxn s LEU 50 CO 0.17 -0.36 0.41 -0.62 0.23 0.00 0.00 176.35 176.19 2jxn n GLU 51 N 5.29 0.13 -0.14 1.70 -0.58 -1.11 -4.66 120.64 121.26 2jxn n GLU 51 Ca -0.06 0.08 -0.03 0.00 -0.42 0.00 0.00 57.16 56.73 2jxn n GLU 51 Cb 0.48 -1.77 0.05 0.00 -0.57 0.00 0.00 31.44 29.63 2jxn n GLU 51 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 2jxn h PRO 52 N -0.69 0.15 -0.63 3.49 0.11 -1.94 -1.04 132.00 131.44 2jxn h PRO 52 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2jxn h PRO 52 Cb 1.33 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.38 2jxn h PRO 52 CO 0.39 0.10 0.40 0.37 -0.21 0.00 0.00 178.00 179.05 2jxn h GLN 53 N 0.15 0.85 0.00 1.05 5.75 -2.00 -0.96 115.11 119.95 2jxn h GLN 53 Ca 0.23 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.66 2jxn h GLN 53 Cb 0.32 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 28.69 2jxn h GLN 53 CO -0.35 0.59 -0.03 0.00 -2.65 0.00 0.00 178.83 176.40 2jxn h ALA 54 N 1.21 1.86 -0.34 3.38 0.00 -1.67 -2.01 119.26 121.69 2jxn h ALA 54 Ca 0.23 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2jxn h ALA 54 Cb -0.05 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2jxn h ALA 54 CO -0.05 0.03 0.13 1.25 0.00 0.00 0.00 179.25 180.61 2jxn h LEU 55 N 0.00 0.47 -1.22 0.00 5.85 0.08 -2.61 115.31 117.88 2jxn h LEU 55 Ca -0.00 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 2jxn h LEU 55 Cb 0.05 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2jxn h LEU 55 CO 0.00 0.52 0.09 -0.08 -0.34 0.00 0.00 178.44 178.64 2jxn h GLU 56 N 0.40 0.63 -0.60 1.25 4.81 -1.18 -2.64 114.58 117.25 2jxn h GLU 56 Ca 0.11 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2jxn h GLU 56 Cb 0.20 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 2jxn h GLU 56 CO -0.01 0.59 0.37 0.00 -0.73 0.00 0.00 179.01 179.23 2jxn h ARG 57 N 0.61 0.70 -0.55 1.92 2.47 -1.13 0.34 114.38 118.74 2jxn h ARG 57 Ca 0.14 -0.04 -0.05 0.00 -1.26 0.00 0.00 59.98 58.77 2jxn h ARG 57 Cb 0.25 -0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 28.39 2jxn h ARG 57 CO -0.00 0.47 0.14 -0.07 0.56 0.00 0.00 179.97 181.06 2jxn h LEU 58 N 0.72 0.79 -0.34 3.04 3.38 -1.20 -0.04 115.31 121.66 2jxn h LEU 58 Ca 0.24 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 2jxn h LEU 58 Cb 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2jxn h LEU 58 CO -0.10 0.77 -0.01 0.28 0.09 0.00 0.00 178.44 179.47 2jxn h SER 59 N 0.81 0.59 -0.22 -0.43 0.02 -1.12 -0.91 113.55 112.30 2jxn h SER 59 Ca 0.18 -0.32 -0.04 0.00 -0.84 0.00 0.00 61.79 60.77 2jxn h SER 59 Cb 0.29 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2jxn h SER 59 CO -0.00 0.77 -0.04 -0.09 -1.14 0.00 0.00 176.83 176.33 2jxn h ARG 60 N 0.41 0.41 -0.20 3.45 9.65 -0.62 -3.16 114.38 124.32 2jxn h ARG 60 Ca 0.09 -0.15 -0.07 0.00 -1.10 0.00 0.00 59.98 58.75 2jxn h ARG 60 Cb 0.47 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.02 2jxn h ARG 60 CO 0.02 0.64 -0.15 -0.24 2.80 0.00 0.00 179.97 183.04 2jxn h VAL 61 N 0.15 1.32 -1.10 0.20 3.04 -1.04 -3.04 116.25 115.79 2jxn h VAL 61 Ca 0.06 -1.27 0.30 0.00 -1.01 0.00 0.00 66.70 64.77 2jxn h VAL 61 Cb 0.48 1.73 -0.08 0.00 -2.01 0.00 0.00 31.29 31.40 2jxn h VAL 61 CO 0.02 0.39 0.74 0.00 -1.01 0.00 0.00 177.57 177.70 2jxn h ALA 62 N 0.66 2.55 0.00 3.17 0.00 -1.22 1.14 119.26 125.56 2jxn h ALA 62 Ca 0.04 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2jxn h ALA 62 Cb 0.67 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 2jxn h ALA 62 CO 0.04 -0.95 -0.16 -0.07 0.00 0.00 0.00 179.25 178.11 2jxn h LEU 63 N 0.24 0.00 0.00 0.00 3.38 -1.49 -3.15 115.31 114.29 2jxn h LEU 63 Ca 0.60 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 58.24 2jxn h LEU 63 Cb 1.81 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.51 2jxn h LEU 63 CO -0.21 0.16 -2.07 0.52 0.09 0.00 0.00 178.44 176.93 2jxn n VAL 64 N -3.46 1.29 -3.61 1.22 0.31 0.34 -4.89 118.33 109.53 2jxn n VAL 64 Ca -0.01 -0.25 -0.28 0.00 -0.01 0.00 0.00 64.34 63.79 2jxn n VAL 64 Cb 0.33 -1.87 -0.12 0.00 -0.91 0.00 0.00 33.84 31.27 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 -2.47 1.27 0.46 5.55 0.52 0.17 -4.95 118.95 119.50 2jxn s ARG 65 Ca -0.31 -2.18 0.12 0.00 -0.52 0.00 0.00 55.73 52.84 2jxn s ARG 65 Cb 0.11 -2.10 1.04 0.00 0.52 0.00 0.00 34.95 34.52 2jxn s ARG 65 CO 0.40 -1.26 2.08 -0.09 0.02 0.00 0.00 175.30 176.45 2jxn h ARG 66 N 6.20 0.24 -0.28 3.54 2.43 -1.72 -2.06 114.38 122.74 2jxn h ARG 66 Ca 0.11 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 2jxn h ARG 66 Cb 0.90 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 2jxn h ARG 66 CO 0.46 0.19 0.10 -0.44 -1.51 0.00 0.00 179.97 178.77 2jxn h ASP 67 N 0.25 0.39 -0.46 -3.80 5.19 -1.92 -1.12 116.42 114.94 2jxn h ASP 67 Ca 0.07 -0.18 -0.07 0.00 -0.62 0.00 0.00 57.03 56.22 2jxn h ASP 67 Cb 0.02 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.41 2jxn h ASP 67 CO -0.01 0.46 -0.00 0.03 -3.12 0.00 0.00 179.24 176.60 2jxn h ARG 68 N 0.30 0.82 0.00 3.56 -0.00 -1.87 -2.35 114.38 114.84 2jxn h ARG 68 Ca 0.09 -0.26 -0.01 0.00 -0.50 0.00 0.00 59.98 59.30 2jxn h ARG 68 Cb 0.20 -0.07 -0.00 0.00 0.00 0.00 0.00 29.97 30.10 2jxn h ARG 68 CO -0.01 0.87 -0.05 0.00 0.00 0.00 0.00 179.97 180.79 2jxn h ALA 69 N 0.92 1.38 -0.06 0.04 0.00 -1.23 -1.99 119.26 118.31 2jxn h ALA 69 Ca 0.13 -0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.78 2jxn h ALA 69 Cb 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2jxn h ALA 69 CO 0.02 0.06 -0.85 0.37 0.00 0.00 0.00 179.25 178.85 2jxn h GLN 70 N 0.00 0.54 -0.14 0.00 4.15 -0.66 -2.90 115.11 116.09 2jxn h GLN 70 Ca -0.00 -0.50 -0.11 0.00 0.77 0.00 0.00 58.65 58.81 2jxn h GLN 70 Cb 0.15 0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.96 2jxn h GLN 70 CO 0.01 1.13 -0.35 0.00 -1.93 0.00 0.00 178.83 177.68 2jxn h ALA 71 N 0.72 0.24 -0.86 3.38 0.00 -1.18 -2.17 119.26 119.38 2jxn h ALA 71 Ca -0.06 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2jxn h ALA 71 Cb 1.47 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.18 2jxn h ALA 71 CO 0.16 0.30 0.54 -0.39 0.00 0.00 0.00 179.25 179.86 2jxn h VAL 72 N 0.11 1.23 -0.31 0.00 -1.51 -1.55 0.36 116.25 114.58 2jxn h VAL 72 Ca -0.00 -0.48 -0.04 0.00 -1.23 0.00 0.00 66.70 64.95 2jxn h VAL 72 Cb 0.96 -0.00 -0.02 0.00 -2.13 0.00 0.00 31.29 30.10 2jxn h VAL 72 CO 0.08 0.24 0.02 1.05 -1.23 0.00 0.00 177.57 177.73 2jxn h GLU 73 N 1.18 0.46 -0.07 5.19 4.11 -1.51 -2.24 114.58 121.71 2jxn h GLU 73 Ca 0.31 -0.09 -0.20 0.00 0.07 0.00 0.00 59.36 59.46 2jxn h GLU 73 Cb -0.08 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.09 2jxn h GLU 73 CO -0.06 0.48 -0.80 1.15 0.07 0.00 0.00 179.01 179.85 2jxn h THR 74 N 0.45 1.37 -0.57 -1.06 2.02 -0.39 -2.64 112.91 112.09 2jxn h THR 74 Ca 0.10 -2.20 0.08 0.00 0.77 0.00 0.00 66.41 65.17 2jxn h THR 74 Cb 0.26 2.17 -0.07 0.00 -1.74 0.00 0.00 68.15 68.78 2jxn h THR 74 CO 0.00 0.66 0.21 0.22 0.37 0.00 0.00 175.52 176.99 2jxn h TYR 75 N 0.31 0.36 -0.18 3.16 3.20 0.25 0.11 116.97 124.17 2jxn h TYR 75 Ca -0.05 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.79 2jxn h TYR 75 Cb 1.40 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 39.59 2jxn h TYR 75 CO 0.06 0.10 -0.13 1.25 -1.64 0.00 0.00 178.16 177.79 2jxn h LEU 76 N 0.39 0.43 -1.60 2.82 5.85 -1.50 -2.81 115.31 118.90 2jxn h LEU 76 Ca 0.28 -0.45 0.06 0.00 0.84 0.00 0.00 57.88 58.61 2jxn h LEU 76 Cb 0.34 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 2jxn h LEU 76 CO -0.29 0.78 0.35 0.50 -0.34 0.00 0.00 178.44 179.45 2jxn h LYS 77 N 0.08 0.49 -0.49 1.25 3.64 -1.05 0.17 116.57 120.66 2jxn h LYS 77 Ca 0.04 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 2jxn h LYS 77 Cb 0.64 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 2jxn h LYS 77 CO 0.04 0.32 0.08 0.87 -2.27 0.00 0.00 179.45 178.48 2jxn h LYS 78 N 0.50 0.82 -0.14 1.90 1.79 -0.66 0.97 116.57 121.76 2jxn h LYS 78 Ca 0.23 -0.22 -0.05 0.00 -2.18 0.00 0.00 60.65 58.43 2jxn h LYS 78 Cb 0.26 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 30.82 2jxn h LYS 78 CO -0.06 0.82 -0.09 -0.07 -1.08 0.00 0.00 179.45 178.96 2jxn h LEU 79 N 0.69 0.32 -0.32 2.94 3.38 -0.93 0.59 115.31 121.99 2jxn h LEU 79 Ca 0.15 -0.44 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 2jxn h LEU 79 Cb 0.40 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2jxn h LEU 79 CO 0.01 0.70 -0.06 0.40 0.09 0.00 0.00 178.44 179.58 2jxn h ILE 80 N -0.05 1.27 -0.51 1.22 2.04 -0.64 0.15 117.51 121.00 2jxn h ILE 80 Ca 0.03 -1.08 -0.07 0.00 1.00 0.00 0.00 64.86 64.74 2jxn h ILE 80 Cb 0.59 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 2jxn h ILE 80 CO 0.03 0.35 0.05 0.00 0.00 0.00 0.00 178.15 178.57 2jxn h ALA 81 N 0.81 1.13 -3.00 1.87 0.00 0.97 -3.36 119.26 117.68 2jxn h ALA 81 Ca 0.08 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2jxn h ALA 81 Cb 0.54 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2jxn h ALA 81 CO 0.03 0.56 0.00 0.25 0.00 0.00 0.00 179.25 180.09 2jxn n THR 82 N -4.23 0.00 0.00 0.00 -2.24 0.20 -5.04 114.28 102.97 2jxn n THR 82 Ca 0.03 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2jxn n THR 82 Cb 0.27 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 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 -0.42 0.00 -0.37 3.42 2.04 0.49 -4.99 115.26 115.43 2jxn n ASN 83 Ca 0.00 0.00 0.35 0.00 -0.44 0.00 0.00 54.58 54.49 2jxn n ASN 83 Cb 0.00 0.00 0.70 0.00 -2.53 0.00 0.00 39.78 37.95 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 0.12 -1.96 0.53 2.35 -1.84 -3.43 115.58 111.35 2jxn h ASN 84 Ca 0.00 0.03 -0.56 0.00 -0.55 0.00 0.00 56.30 55.22 2jxn h ASN 84 Cb 0.00 0.01 0.21 0.00 0.05 0.00 0.00 38.32 38.60 2jxn h ASN 84 CO 0.00 0.00 -1.56 0.55 -1.65 0.00 0.00 177.43 174.77 2jxn n VAL 85 N -4.30 0.00 -0.25 2.81 3.14 -1.04 -4.88 118.33 113.81 2jxn n VAL 85 Ca 0.29 -0.49 0.00 0.00 -2.96 0.00 0.00 64.34 61.18 2jxn n VAL 85 Cb 1.27 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 34.05 2jxn n VAL 85 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2jxn n THR 86 N -2.08 0.00 -3.73 1.55 -2.24 -1.26 -5.02 114.28 101.51 2jxn n THR 86 Ca 0.02 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.74 2jxn n THR 86 Cb 0.51 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.73 2jxn n THR 86 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2jxn s HIS 87 N 0.00 -0.21 -0.30 4.78 -3.43 -1.26 -5.14 115.29 109.73 2jxn s HIS 87 Ca 0.00 -0.11 -0.16 0.00 -0.80 0.00 0.00 55.06 53.98 2jxn s HIS 87 Cb 0.00 0.64 -0.02 0.00 -1.43 0.00 0.00 32.58 31.77 2jxn s HIS 87 CO 0.00 -0.94 0.44 -1.59 -2.00 0.00 0.00 174.74 170.66 2jxn s LYS 88 N -3.52 3.84 0.97 -0.38 -2.85 -1.26 -4.96 119.74 111.57 2jxn s LYS 88 Ca 0.10 -0.03 -0.16 0.00 -1.00 0.00 0.00 55.97 54.88 2jxn s LYS 88 Cb -0.03 -3.72 -0.09 0.00 -2.06 0.00 0.00 37.83 31.93 2jxn s LYS 88 CO 0.01 -0.44 -0.39 -0.89 0.10 0.00 0.00 175.35 173.74 2jxn n ILE 89 N 5.24 0.03 -4.39 3.79 5.41 0.20 -4.72 119.36 124.93 2jxn n ILE 89 Ca -0.07 -0.40 -0.20 0.00 1.00 0.00 0.00 62.75 63.08 2jxn n ILE 89 Cb 0.50 -0.21 -0.10 0.00 -0.71 0.00 0.00 39.64 39.13 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 -2.12 0.65 0.45 1.39 -4.23 -1.26 -2.77 115.64 107.75 2jxn s THR 90 Ca 0.46 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.10 2jxn s THR 90 Cb -0.20 -2.59 0.20 0.00 1.34 0.00 0.00 72.50 71.26 2jxn s THR 90 CO 0.77 0.00 2.02 1.05 -0.54 0.00 0.00 174.62 177.92 2jxn h GLU 91 N 2.16 0.08 -0.08 3.99 4.11 -1.88 -1.30 114.58 121.66 2jxn h GLU 91 Ca -0.37 -0.01 -0.11 0.00 0.07 0.00 0.00 59.36 58.94 2jxn h GLU 91 Cb 1.25 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 2jxn h GLU 91 CO 0.60 0.18 -0.44 0.00 0.07 0.00 0.00 179.01 179.42 2jxn h ALA 92 N 1.83 1.13 -0.07 1.06 0.00 -1.98 -2.69 119.26 118.53 2jxn h ALA 92 Ca 0.02 -0.42 -0.22 0.00 0.00 0.00 0.00 54.91 54.29 2jxn h ALA 92 Cb 0.23 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.95 2jxn h ALA 92 CO 0.01 0.59 -0.81 0.93 0.00 0.00 0.00 179.25 179.98 2jxn h GLU 93 N 0.15 0.67 -0.23 0.00 3.07 -1.65 -1.03 114.58 115.56 2jxn h GLU 93 Ca 0.01 -0.63 -0.01 0.00 -0.50 0.00 0.00 59.36 58.23 2jxn h GLU 93 Cb 0.83 0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.89 2jxn h GLU 93 CO 0.06 1.23 0.09 0.82 -1.40 0.00 0.00 179.01 179.81 2jxn h ILE 94 N 0.34 1.17 -0.43 3.13 5.03 -1.37 0.17 117.51 125.55 2jxn h ILE 94 Ca -0.08 -0.53 -0.14 0.00 -0.12 0.00 0.00 64.86 63.98 2jxn h ILE 94 Cb 1.46 1.10 -0.01 0.00 -3.03 0.00 0.00 36.82 36.34 2jxn h ILE 94 CO 0.16 0.17 -0.29 1.62 -0.68 0.00 0.00 178.15 179.14 2jxn h VAL 95 N 0.21 1.27 -0.30 1.67 3.04 -1.57 0.53 116.25 121.11 2jxn h VAL 95 Ca 0.08 -1.46 -0.02 0.00 -1.01 0.00 0.00 66.70 64.29 2jxn h VAL 95 Cb 0.19 1.27 -0.01 0.00 -2.01 0.00 0.00 31.29 30.73 2jxn h VAL 95 CO -0.01 0.49 0.10 0.28 -1.01 0.00 0.00 177.57 177.43 2jxn h SER 96 N 0.78 0.43 0.12 3.17 0.02 -1.01 -1.44 113.55 115.62 2jxn h SER 96 Ca 0.08 -0.19 -0.19 0.00 -0.84 0.00 0.00 61.79 60.66 2jxn h SER 96 Cb 0.88 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 63.30 2jxn h SER 96 CO 0.08 0.50 -0.71 0.40 -1.14 0.00 0.00 176.83 175.96 2jxn h ILE 97 N 0.33 1.34 -0.41 3.27 2.04 -0.67 -2.77 117.51 120.64 2jxn h ILE 97 Ca 0.10 -2.04 0.07 0.00 1.00 0.00 0.00 64.86 63.98 2jxn h ILE 97 Cb 0.22 2.02 -0.06 0.00 -0.74 0.00 0.00 36.82 38.26 2jxn h ILE 97 CO -0.00 0.63 0.06 0.25 0.00 0.00 0.00 178.15 179.08 2jxn h LEU 98 N 0.37 -0.04 -1.41 1.44 6.46 -0.69 0.55 115.31 121.99 2jxn h LEU 98 Ca -0.03 0.08 -0.04 0.00 -0.12 0.00 0.00 57.88 57.77 2jxn h LEU 98 Cb 1.29 0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 41.32 2jxn h LEU 98 CO 0.13 0.02 0.00 -1.13 -0.62 0.00 0.00 178.44 176.84 2jxn h ASN 99 N 0.18 0.36 0.32 1.25 -0.73 -1.23 0.91 115.58 116.64 2jxn h ASN 99 Ca 0.20 -0.05 -0.14 0.00 1.87 0.00 0.00 56.30 58.18 2jxn h ASN 99 Cb 0.26 -0.09 -0.01 0.00 0.27 0.00 0.00 38.32 38.74 2jxn h ASN 99 CO -0.28 0.42 -0.56 1.23 -0.37 0.00 0.00 177.43 177.86 2jxn h GLY 100 N 0.70 0.28 0.74 1.57 0.00 -0.55 -2.48 103.07 103.33 2jxn h GLY 100 Ca 0.09 -0.32 -0.14 0.00 0.00 0.00 0.00 47.33 46.96 2jxn h GLY 100 CO 0.01 0.29 -0.52 -2.22 0.00 0.00 0.00 176.54 174.10 2jxn h ILE 101 N 0.19 1.43 0.00 2.60 2.04 0.97 -3.12 117.51 121.63 2jxn h ILE 101 Ca -0.00 -2.00 -0.01 0.00 1.00 0.00 0.00 64.86 63.86 2jxn h ILE 101 Cb 1.05 2.54 -0.00 0.00 -0.74 0.00 0.00 36.82 39.67 2jxn h ILE 101 CO 0.09 0.58 -0.04 0.00 0.00 0.00 0.00 178.15 178.77 2jxn h ALA 102 N 0.34 1.79 -0.34 1.87 0.00 -0.85 -0.25 119.26 121.82 2jxn h ALA 102 Ca -0.06 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2jxn h ALA 102 Cb 1.22 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2jxn h ALA 102 CO 0.10 0.05 -0.14 0.87 0.00 0.00 0.00 179.25 180.13 2jxn h LYS 103 N 0.00 0.70 0.06 0.00 1.79 -1.43 -3.27 116.57 114.42 2jxn h LYS 103 Ca -0.00 -0.30 -0.00 0.00 -2.18 0.00 0.00 60.65 58.17 2jxn h LYS 103 Cb 0.08 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2jxn h LYS 103 CO 0.01 0.90 -0.03 1.96 -1.08 0.00 0.00 179.45 181.20 2jxn h GLN 104 N 0.48 -0.07 -1.66 3.15 1.08 -1.31 -3.50 115.11 113.27 2jxn h GLN 104 Ca 0.08 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2jxn h GLN 104 Cb 0.67 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.12 2jxn h GLN 104 CO 0.05 0.47 -0.42 0.94 -0.95 0.00 0.00 178.83 178.92 2jxn n GLN 105 N -4.85 -1.98 -0.27 1.46 7.27 -0.17 -4.96 117.38 113.88 2jxn n GLN 105 Ca -0.09 1.49 0.00 0.00 0.07 0.00 0.00 57.00 58.48 2jxn n GLN 105 Cb 0.29 -1.74 0.00 0.00 2.41 0.00 0.00 30.24 31.20 2jxn n GLN 105 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 2jxn n ASN 106 N -1.31 0.06 -0.77 1.69 5.15 -1.26 -5.08 115.26 113.74 2jxn n ASN 106 Ca 0.00 -1.57 0.00 0.00 -0.60 0.00 0.00 54.58 52.41 2jxn n ASN 106 Cb 0.07 -0.11 0.00 0.00 -0.53 0.00 0.00 39.78 39.21 2jxn n ASN 106 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 2jxn n SER 107 N -0.03 -5.04 0.00 1.20 2.88 -1.26 -4.96 113.62 106.41 2jxn n SER 107 Ca 0.00 0.55 0.00 0.00 -1.33 0.00 0.00 58.87 58.09 2jxn n SER 107 Cb 0.61 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 2jxn n SER 107 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2jxn n GLN 108 N -0.06 0.00 -3.05 -1.46 7.27 -1.26 -4.98 117.38 113.85 2jxn n GLN 108 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.06 2jxn n GLN 108 Cb 0.00 -0.71 0.00 0.00 2.41 0.00 0.00 30.24 31.94 2jxn n GLN 108 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2jxn n ASN 109 N -0.36 -7.02 -0.44 1.69 5.03 -1.26 -4.95 115.26 107.94 2jxn n ASN 109 Ca 0.00 0.72 0.01 0.00 0.87 0.00 0.00 54.58 56.17 2jxn n ASN 109 Cb 0.00 -2.82 0.01 0.00 -1.02 0.00 0.00 39.78 35.95 2jxn n ASN 109 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2jxn n ASN 110 N 1.04 0.13 -4.75 6.41 4.13 -1.26 -5.09 115.26 115.88 2jxn n ASN 110 Ca -0.00 -1.99 -0.38 0.00 1.68 0.00 0.00 54.58 53.89 2jxn n ASN 110 Cb 0.35 -0.20 0.04 0.00 -1.54 0.00 0.00 39.78 38.43 2jxn n ASN 110 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2jxn s SER 111 N -1.03 5.14 0.00 6.41 1.04 -1.26 -2.34 113.70 121.66 2jxn s SER 111 Ca 0.02 2.67 0.00 0.00 0.48 0.00 0.00 55.95 59.11 2jxn s SER 111 Cb 0.01 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2jxn s SER 111 CO 0.00 -1.65 0.00 1.17 0.98 0.00 0.00 173.24 173.75 2jxn n LYS 112 N -1.27 0.00 -0.26 4.02 4.81 -1.26 -4.67 118.16 119.53 2jxn n LYS 112 Ca 0.12 0.00 0.10 0.00 -0.87 0.00 0.00 58.31 57.66 2jxn n LYS 112 Cb 0.46 0.00 0.26 0.00 0.02 0.00 0.00 35.03 35.77 2jxn n LYS 112 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2jxn n ILE 113 N 0.00 0.70 0.28 3.15 5.41 -0.99 -4.13 119.36 123.78 2jxn n ILE 113 Ca 0.00 -0.74 0.18 0.00 1.00 0.00 0.00 62.75 63.19 2jxn n ILE 113 Cb 0.00 0.46 0.73 0.00 -0.71 0.00 0.00 39.64 40.12 2jxn n ILE 113 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 2jxn h ILE 114 N 3.42 0.01 -0.57 1.39 2.04 -1.81 -3.16 117.51 118.82 2jxn h ILE 114 Ca 0.00 -0.48 0.11 0.00 1.00 0.00 0.00 64.86 65.49 2jxn h ILE 114 Cb 0.78 1.47 -0.11 0.00 -0.74 0.00 0.00 36.82 38.22 2jxn h ILE 114 CO 0.00 0.00 -0.25 -0.26 0.00 0.00 0.00 178.15 177.65 2jxn h PHE 115 N 0.00 -0.63 0.00 1.37 -1.00 -1.92 -3.47 116.94 111.28 2jxn h PHE 115 Ca -0.00 0.06 0.00 0.00 2.81 0.00 0.00 57.97 60.84 2jxn h PHE 115 Cb 0.47 0.36 0.00 0.00 3.61 0.00 0.00 35.95 40.40 2jxn h PHE 115 CO 0.00 -0.33 0.00 -1.91 -1.61 0.00 0.00 178.31 174.46