#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jx2 n PRO 36 N 0.00 0.04 -5.15 0.00 -0.04 -1.26 -4.66 135.00 123.93 2jx2 n PRO 36 Ca 0.00 0.24 -0.29 0.00 -0.04 0.00 0.00 63.50 63.41 2jx2 n PRO 36 Cb 0.00 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 31.80 2jx2 n PRO 36 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2jx2 s ARG 37 N -2.91 1.88 0.00 0.54 0.52 -1.26 -5.14 118.95 112.58 2jx2 s ARG 37 Ca 0.08 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.47 2jx2 s ARG 37 Cb 0.09 -1.81 0.00 0.00 0.52 0.00 0.00 34.95 33.75 2jx2 s ARG 37 CO 0.25 0.49 0.00 1.63 0.02 0.00 0.00 175.30 177.69 2jx2 n LYS 38 N 2.52 2.94 -3.89 3.54 5.02 -1.26 -4.95 118.16 122.08 2jx2 n LYS 38 Ca -0.16 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.16 2jx2 n LYS 38 Cb 0.52 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.54 2jx2 n LYS 38 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2jx2 s GLY 39 N -0.74 -0.22 -0.27 0.72 0.00 0.51 -4.38 107.32 102.94 2jx2 s GLY 39 Ca 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 44.72 44.94 2jx2 s GLY 39 CO 0.00 4.33 0.48 0.21 0.00 0.00 0.00 173.10 178.12 2jx2 s ASN 40 N -3.61 -0.53 0.20 1.64 2.47 0.74 -2.99 114.94 112.86 2jx2 s ASN 40 Ca 0.26 0.56 -0.30 0.00 0.42 0.00 0.00 52.86 53.80 2jx2 s ASN 40 Cb 0.01 1.61 -0.08 0.00 -1.45 0.00 0.00 41.25 41.35 2jx2 s ASN 40 CO -0.02 -0.28 1.13 -0.89 -3.72 0.00 0.00 177.10 173.32 2jx2 s THR 41 N 2.69 3.70 0.24 -5.21 2.01 -1.25 0.99 115.64 118.81 2jx2 s THR 41 Ca 0.16 1.51 0.12 0.00 0.31 0.00 0.00 61.69 63.78 2jx2 s THR 41 Cb -0.15 -3.96 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 2jx2 s THR 41 CO -0.18 0.28 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.06 2jx2 s LEU 42 N -0.58 2.56 -0.20 4.42 1.43 0.71 -3.98 118.68 123.06 2jx2 s LEU 42 Ca 0.49 -0.92 -0.02 0.00 -1.03 0.00 0.00 54.13 52.65 2jx2 s LEU 42 Cb -0.31 -1.18 -0.00 0.00 0.03 0.00 0.00 46.19 44.73 2jx2 s LEU 42 CO 0.37 0.08 -0.09 -0.47 0.23 0.00 0.00 176.35 176.46 2jx2 s TYR 43 N -2.10 2.90 -0.07 0.29 5.04 -0.25 -2.46 117.35 120.70 2jx2 s TYR 43 Ca 0.26 -1.06 0.04 0.00 -2.44 0.00 0.00 57.07 53.86 2jx2 s TYR 43 Cb -0.06 -2.03 -0.02 0.00 0.35 0.00 0.00 41.96 40.20 2jx2 s TYR 43 CO 0.13 -0.56 -0.17 0.08 -1.34 0.00 0.00 175.55 173.68 2jx2 s VAL 44 N 1.28 2.76 -0.07 3.14 1.01 -0.75 0.15 120.40 127.91 2jx2 s VAL 44 Ca 0.03 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.23 2jx2 s VAL 44 Cb -0.14 -2.08 0.01 0.00 0.00 0.00 0.00 36.38 34.17 2jx2 s VAL 44 CO -0.04 0.57 -0.16 -0.47 0.00 0.00 0.00 175.10 175.00 2jx2 s TYR 45 N -0.31 1.75 0.00 5.22 5.04 0.41 -0.97 117.35 128.49 2jx2 s TYR 45 Ca 0.02 -0.65 -0.11 0.00 -2.44 0.00 0.00 57.07 53.89 2jx2 s TYR 45 Cb -0.13 -1.23 0.04 0.00 0.35 0.00 0.00 41.96 40.99 2jx2 s TYR 45 CO 0.03 -0.30 0.50 0.41 -1.34 0.00 0.00 175.55 174.84 2jx2 n GLY 46 N 3.67 0.54 3.55 8.97 0.00 -1.14 -1.87 105.19 118.91 2jx2 n GLY 46 Ca -0.21 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.62 2jx2 n GLY 46 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jx2 s GLU 47 N -2.01 1.96 -1.44 1.61 2.02 -1.26 -4.68 118.70 114.90 2jx2 s GLU 47 Ca 0.12 -1.42 -0.04 0.00 0.02 0.00 0.00 54.97 53.65 2jx2 s GLU 47 Cb -0.00 -2.05 0.00 0.00 0.10 0.00 0.00 34.13 32.18 2jx2 s GLU 47 CO 0.00 0.40 0.27 -0.25 0.02 0.00 0.00 175.26 175.70 2jx2 n ASP 48 N -0.22 -0.26 -4.82 -0.19 8.00 -1.26 -4.91 116.55 112.88 2jx2 n ASP 48 Ca -0.09 -1.15 -0.36 0.00 0.71 0.00 0.00 54.79 53.90 2jx2 n ASP 48 Cb 0.57 -2.34 -0.07 0.00 -0.02 0.00 0.00 41.12 39.26 2jx2 n ASP 48 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2jx2 s MET 49 N -6.95 3.62 0.32 -1.24 -1.94 -1.26 -5.10 119.30 106.75 2jx2 s MET 49 Ca 0.06 -0.18 0.10 0.00 -1.71 0.00 0.00 55.69 53.96 2jx2 s MET 49 Cb -0.03 -3.22 -0.06 0.00 2.01 0.00 0.00 34.83 33.53 2jx2 s MET 49 CO 0.94 0.63 -0.13 0.95 -0.01 0.00 0.00 175.02 177.41 2jx2 s THR 50 N -0.62 2.35 -0.02 2.05 -4.23 -1.26 -5.05 115.64 108.86 2jx2 s THR 50 Ca 0.13 -2.26 -0.23 0.00 -1.18 0.00 0.00 61.69 58.14 2jx2 s THR 50 Cb -0.12 -2.54 -0.16 0.00 1.34 0.00 0.00 72.50 71.02 2jx2 s THR 50 CO 0.02 -0.27 1.05 1.55 -0.54 0.00 0.00 174.62 176.43 2jx2 h PRO 51 N 2.10 -0.28 -0.44 3.99 0.13 -1.98 -1.94 132.00 133.58 2jx2 h PRO 51 Ca -0.41 0.02 0.08 0.00 -0.87 0.00 0.00 66.00 64.81 2jx2 h PRO 51 Cb 1.25 0.06 -0.07 0.00 0.13 0.00 0.00 31.00 32.38 2jx2 h PRO 51 CO 0.67 0.11 0.02 1.15 -0.23 0.00 0.00 178.00 179.72 2jx2 h THR 52 N -0.79 0.69 -0.21 1.56 2.02 -1.99 0.24 112.91 114.42 2jx2 h THR 52 Ca -0.03 -0.05 0.02 0.00 0.77 0.00 0.00 66.41 67.12 2jx2 h THR 52 Cb 0.51 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 2jx2 h THR 52 CO 0.05 0.03 0.09 0.25 0.37 0.00 0.00 175.52 176.30 2jx2 h LEU 53 N 0.14 0.11 -0.56 2.58 5.85 -1.99 -2.20 115.31 119.24 2jx2 h LEU 53 Ca 0.22 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.99 2jx2 h LEU 53 Cb 0.31 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 2jx2 h LEU 53 CO -0.34 0.09 0.32 -0.07 -0.34 0.00 0.00 178.44 178.10 2jx2 h LEU 54 N 0.19 0.49 -1.03 2.25 3.38 -0.45 -1.01 115.31 119.14 2jx2 h LEU 54 Ca 0.09 0.02 0.20 0.00 0.09 0.00 0.00 57.88 58.27 2jx2 h LEU 54 Cb 0.04 -0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.60 2jx2 h LEU 54 CO -0.08 0.33 0.61 0.03 0.09 0.00 0.00 178.44 179.43 2jx2 h ARG 55 N 0.61 0.71 -0.04 1.13 3.08 0.02 0.63 114.38 120.52 2jx2 h ARG 55 Ca 0.24 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 60.14 2jx2 h ARG 55 Cb 0.09 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2jx2 h ARG 55 CO -0.13 0.47 -0.46 0.78 -1.07 0.00 0.00 179.97 179.55 2jx2 h GLY 56 N 0.73 0.09 2.00 0.04 0.00 -0.76 2.08 103.07 107.26 2jx2 h GLY 56 Ca 0.58 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.79 2jx2 h GLY 56 CO -0.38 0.08 -0.15 0.00 0.00 0.00 0.00 176.54 176.09 2jx2 h ALA 57 N 1.46 0.91 -0.03 3.60 0.00 0.68 -3.26 119.26 122.62 2jx2 h ALA 57 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2jx2 h ALA 57 Cb 0.85 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2jx2 h ALA 57 CO 0.06 0.19 0.00 1.19 0.00 0.00 0.00 179.25 180.69 2jx2 n PHE 58 N -3.14 0.04 0.03 0.00 3.01 0.73 -4.61 117.46 113.51 2jx2 n PHE 58 Ca 0.03 -0.40 -0.09 0.00 1.01 0.00 0.00 57.45 58.01 2jx2 n PHE 58 Cb 0.58 -0.04 -0.06 0.00 -0.01 0.00 0.00 39.48 39.95 2jx2 n PHE 58 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2jx2 h SER 59 N 0.20 -0.15 0.49 4.37 0.02 0.33 -3.19 113.55 115.62 2jx2 h SER 59 Ca 0.00 -0.33 -0.09 0.00 -0.84 0.00 0.00 61.79 60.52 2jx2 h SER 59 Cb 0.43 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2jx2 h SER 59 CO 0.00 0.44 -0.45 1.55 -1.14 0.00 0.00 176.83 177.23 2jx2 h PRO 60 N -0.94 0.00 0.00 3.45 0.13 -1.80 -2.89 132.00 129.95 2jx2 h PRO 60 Ca -0.02 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.04 2jx2 h PRO 60 Cb 0.48 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 2jx2 h PRO 60 CO 0.03 0.45 -0.33 0.74 -0.23 0.00 0.00 178.00 178.66 2jx2 h PHE 61 N 0.00 0.00 0.00 1.56 0.04 -1.82 -3.48 116.94 113.25 2jx2 h PHE 61 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2jx2 h PHE 61 Cb 0.82 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.97 2jx2 h PHE 61 CO 0.00 0.33 0.00 0.41 -0.60 0.00 0.00 178.31 178.45 2jx2 n GLY 62 N -0.44 -1.68 3.82 -1.45 0.00 -1.09 -4.66 105.19 99.69 2jx2 n GLY 62 Ca -0.02 -1.10 -0.38 0.00 0.00 0.00 0.00 46.02 44.53 2jx2 n GLY 62 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jx2 s ASN 63 N -0.63 6.71 -0.16 1.61 2.47 -1.26 -4.26 114.94 119.43 2jx2 s ASN 63 Ca 0.00 0.85 -0.08 0.00 0.42 0.00 0.00 52.86 54.05 2jx2 s ASN 63 Cb 0.00 -2.23 -0.04 0.00 -1.45 0.00 0.00 41.25 37.53 2jx2 s ASN 63 CO 0.00 0.29 0.14 -0.63 -3.72 0.00 0.00 177.10 173.17 2jx2 s ILE 64 N -0.79 5.46 -0.05 -5.21 1.01 -1.26 -2.87 121.20 117.49 2jx2 s ILE 64 Ca 0.22 0.20 0.19 0.00 0.00 0.00 0.00 60.65 61.26 2jx2 s ILE 64 Cb -0.16 -3.43 -0.28 0.00 0.01 0.00 0.00 42.46 38.60 2jx2 s ILE 64 CO 0.11 0.54 0.35 2.30 0.00 0.00 0.00 174.94 178.24 2jx2 n ILE 65 N 2.68 0.21 -3.52 2.92 -5.35 -0.80 -4.89 119.36 110.61 2jx2 n ILE 65 Ca -0.18 -0.49 -0.17 0.00 -0.27 0.00 0.00 62.75 61.63 2jx2 n ILE 65 Cb 0.54 -0.04 -0.13 0.00 -1.74 0.00 0.00 39.64 38.27 2jx2 n ILE 65 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2jx2 s ASP 66 N -4.36 1.19 -0.21 7.28 2.15 -1.26 -5.02 116.67 116.43 2jx2 s ASP 66 Ca -0.07 -0.08 -0.05 0.00 0.43 0.00 0.00 52.55 52.77 2jx2 s ASP 66 Cb 0.11 0.43 -0.02 0.00 -0.30 0.00 0.00 42.92 43.13 2jx2 s ASP 66 CO 0.78 -0.31 0.01 -0.22 -0.17 0.00 0.00 175.17 175.26 2jx2 s LEU 67 N 2.34 3.29 -0.00 -1.34 2.96 -1.26 -2.61 118.68 122.06 2jx2 s LEU 67 Ca 0.06 -0.21 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 2jx2 s LEU 67 Cb -0.15 -1.84 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 2jx2 s LEU 67 CO -0.11 0.04 -0.08 -0.55 -1.32 0.00 0.00 176.35 174.33 2jx2 s SER 68 N 1.13 0.90 0.13 3.68 0.15 -0.60 -5.00 113.70 114.09 2jx2 s SER 68 Ca 0.03 -0.17 0.08 0.00 0.70 0.00 0.00 55.95 56.59 2jx2 s SER 68 Cb -0.14 -0.09 -0.04 0.00 -1.71 0.00 0.00 66.02 64.03 2jx2 s SER 68 CO 0.02 0.07 -0.10 -0.04 1.20 0.00 0.00 173.24 174.39 2jx2 s MET 69 N -0.28 2.07 -0.31 5.44 -1.94 -1.26 0.12 119.30 123.14 2jx2 s MET 69 Ca 0.02 -1.13 -0.01 0.00 -1.71 0.00 0.00 55.69 52.87 2jx2 s MET 69 Cb -0.03 -2.24 0.10 0.00 2.01 0.00 0.00 34.83 34.67 2jx2 s MET 69 CO -0.00 0.48 0.09 0.34 -0.01 0.00 0.00 175.02 175.92 2jx2 s ASP 70 N -2.44 4.02 0.29 3.03 2.15 -0.04 -4.91 116.67 118.77 2jx2 s ASP 70 Ca 0.22 -1.62 0.14 0.00 0.43 0.00 0.00 52.55 51.71 2jx2 s ASP 70 Cb -0.10 -0.87 0.35 0.00 -0.30 0.00 0.00 42.92 42.00 2jx2 s ASP 70 CO 0.14 -0.41 1.58 1.55 -0.17 0.00 0.00 175.17 177.86 2jx2 h PRO 71 N 8.09 0.00 -0.01 4.34 0.13 -1.96 -1.03 132.00 141.55 2jx2 h PRO 71 Ca -0.14 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.80 2jx2 h PRO 71 Cb 1.02 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 2jx2 h PRO 71 CO 0.47 0.57 -0.84 -1.00 -0.23 0.00 0.00 178.00 176.98 2jx2 h PRO 72 N 0.00 0.20 -0.01 1.56 0.13 -1.94 -3.23 132.00 128.71 2jx2 h PRO 72 Ca -0.01 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2jx2 h PRO 72 Cb 1.17 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2jx2 h PRO 72 CO 0.07 0.93 -0.45 -2.13 -0.23 0.00 0.00 178.00 176.19 2jx2 n ARG 73 N -3.69 1.32 -3.42 0.86 3.00 -1.24 -4.97 116.66 108.53 2jx2 n ARG 73 Ca -0.03 -0.94 -0.19 0.00 -0.00 0.00 0.00 57.85 56.68 2jx2 n ARG 73 Cb 0.78 -1.43 0.08 0.00 0.00 0.00 0.00 32.46 31.89 2jx2 n ARG 73 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2jx2 n ASN 74 N -0.06 -4.49 -3.79 6.15 3.02 -0.49 -4.96 115.26 110.63 2jx2 n ASN 74 Ca 0.08 -0.51 -0.13 0.00 -0.03 0.00 0.00 54.58 53.99 2jx2 n ASN 74 Cb 0.44 -4.63 -0.11 0.00 -0.61 0.00 0.00 39.78 34.87 2jx2 n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jx2 s ALA 76 N -0.27 3.67 -0.08 0.00 0.00 -0.14 -0.86 121.76 124.08 2jx2 s ALA 76 Ca -0.04 -1.61 0.04 0.00 0.00 0.00 0.00 51.96 50.35 2jx2 s ALA 76 Cb -0.03 -1.12 0.00 0.00 0.00 0.00 0.00 23.12 21.97 2jx2 s ALA 76 CO 0.01 0.10 -0.20 -0.06 0.00 0.00 0.00 175.76 175.61 2jx2 s PHE 77 N -2.27 2.18 -0.01 0.00 0.08 0.32 -1.81 117.98 116.47 2jx2 s PHE 77 Ca 0.37 -0.84 0.05 0.00 0.12 0.00 0.00 56.93 56.64 2jx2 s PHE 77 Cb -0.06 -1.48 -0.01 0.00 -0.57 0.00 0.00 43.02 40.89 2jx2 s PHE 77 CO 0.25 -0.34 -0.18 0.08 -0.10 0.00 0.00 175.22 174.93 2jx2 s VAL 78 N 0.36 1.38 -0.27 -0.44 1.01 -1.03 -1.55 120.40 119.86 2jx2 s VAL 78 Ca -0.15 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 2jx2 s VAL 78 Cb -0.17 -1.15 0.04 0.00 0.00 0.00 0.00 36.38 35.10 2jx2 s VAL 78 CO 0.07 0.39 -0.04 -0.89 0.00 0.00 0.00 175.10 174.62 2jx2 s THR 79 N -0.42 2.84 -0.22 3.92 2.01 -1.07 0.26 115.64 122.95 2jx2 s THR 79 Ca 0.07 -1.22 -0.17 0.00 0.31 0.00 0.00 61.69 60.67 2jx2 s THR 79 Cb -0.07 -2.53 -0.03 0.00 0.01 0.00 0.00 72.50 69.88 2jx2 s THR 79 CO -0.01 0.06 0.46 -0.31 -0.69 0.00 0.00 174.62 174.14 2jx2 s TYR 80 N 1.27 3.34 0.45 4.92 2.02 0.28 -1.90 117.35 127.73 2jx2 s TYR 80 Ca -0.03 0.65 0.35 0.00 -0.37 0.00 0.00 57.07 57.68 2jx2 s TYR 80 Cb -0.18 -2.62 1.48 0.00 -0.40 0.00 0.00 41.96 40.23 2jx2 s TYR 80 CO -0.03 -0.13 1.49 -1.91 -1.57 0.00 0.00 175.55 173.40 2jx2 n GLU 81 N 4.91 -0.03 -4.29 -0.62 2.13 -1.14 0.26 120.64 121.87 2jx2 n GLU 81 Ca -0.06 1.15 -0.17 0.00 0.66 0.00 0.00 57.16 58.74 2jx2 n GLU 81 Cb 0.50 -2.36 -0.10 0.00 0.27 0.00 0.00 31.44 29.75 2jx2 n GLU 81 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2jx2 s LYS 82 N -5.06 1.18 0.45 5.31 1.02 -1.26 0.21 119.74 121.59 2jx2 s LYS 82 Ca -0.06 -1.45 0.26 0.00 0.02 0.00 0.00 55.97 54.73 2jx2 s LYS 82 Cb 0.28 -0.95 0.78 0.00 -0.52 0.00 0.00 37.83 37.43 2jx2 s LYS 82 CO 0.80 0.16 1.76 0.52 -0.92 0.00 0.00 175.35 177.67 2jx2 h MET 83 N 2.90 0.00 -0.14 1.68 2.86 -1.81 -3.19 114.93 117.23 2jx2 h MET 83 Ca -0.38 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.21 2jx2 h MET 83 Cb 1.21 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.86 2jx2 h MET 83 CO 0.59 0.12 -0.07 0.93 1.06 0.00 0.00 176.91 179.54 2jx2 h GLU 84 N 0.00 0.30 -0.73 1.72 4.39 -1.95 -1.87 114.58 116.44 2jx2 h GLU 84 Ca -0.00 -0.13 0.12 0.00 0.34 0.00 0.00 59.36 59.68 2jx2 h GLU 84 Cb 0.83 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.42 2jx2 h GLU 84 CO 0.02 0.64 0.48 0.77 -1.16 0.00 0.00 179.01 179.76 2jx2 h SER 85 N -0.04 0.49 0.87 1.42 0.02 -1.82 0.12 113.55 114.61 2jx2 h SER 85 Ca 0.03 0.02 -0.14 0.00 -0.84 0.00 0.00 61.79 60.86 2jx2 h SER 85 Cb 0.55 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 2jx2 h SER 85 CO 0.02 0.28 -0.68 0.00 -1.14 0.00 0.00 176.83 175.31 2jx2 h ALA 86 N 1.64 0.76 -0.61 3.77 0.00 -1.57 -2.56 119.26 120.69 2jx2 h ALA 86 Ca 0.35 -0.61 -0.10 0.00 0.00 0.00 0.00 54.91 54.54 2jx2 h ALA 86 Cb 0.62 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2jx2 h ALA 86 CO -0.12 0.84 0.00 0.22 0.00 0.00 0.00 179.25 180.20 2jx2 h ASP 87 N 0.00 1.06 0.29 0.00 3.58 0.07 0.77 116.42 122.19 2jx2 h ASP 87 Ca -0.01 -0.31 -0.21 0.00 0.42 0.00 0.00 57.03 56.93 2jx2 h ASP 87 Cb 1.29 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 42.06 2jx2 h ASP 87 CO 0.09 1.11 -0.86 -0.61 -2.88 0.00 0.00 179.24 176.08 2jx2 h GLN 88 N 0.98 0.42 0.08 0.28 4.15 -1.41 -1.91 115.11 117.70 2jx2 h GLN 88 Ca 0.17 -0.41 -0.25 0.00 0.77 0.00 0.00 58.65 58.94 2jx2 h GLN 88 Cb 0.56 0.11 0.02 0.00 0.21 0.00 0.00 27.48 28.38 2jx2 h GLN 88 CO 0.03 1.06 -1.02 0.00 -1.93 0.00 0.00 178.83 176.98 2jx2 h ALA 89 N 0.80 0.01 -0.18 3.38 0.00 -1.27 0.53 119.26 122.53 2jx2 h ALA 89 Ca -0.06 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.12 2jx2 h ALA 89 Cb 1.48 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 2jx2 h ALA 89 CO 0.15 0.56 0.03 0.28 0.00 0.00 0.00 179.25 180.28 2jx2 h VAL 90 N 0.11 1.22 -0.18 0.00 2.07 0.51 1.37 116.25 121.36 2jx2 h VAL 90 Ca -0.15 -0.72 -0.22 0.00 0.82 0.00 0.00 66.70 66.44 2jx2 h VAL 90 Cb 1.72 1.35 0.01 0.00 -1.52 0.00 0.00 31.29 32.84 2jx2 h VAL 90 CO 0.20 0.22 -0.74 0.00 0.02 0.00 0.00 177.57 177.27 2jx2 h ALA 91 N 0.83 0.36 0.01 1.67 0.00 -1.44 0.78 119.26 121.46 2jx2 h ALA 91 Ca 0.06 -0.59 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 2jx2 h ALA 91 Cb 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2jx2 h ALA 91 CO 0.00 0.69 -0.00 1.49 0.00 0.00 0.00 179.25 181.43 2jx2 h GLU 92 N 0.55 -0.01 -0.61 0.00 4.57 -0.82 -3.28 114.58 114.98 2jx2 h GLU 92 Ca -0.04 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.06 2jx2 h GLU 92 Cb 1.36 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.93 2jx2 h GLU 92 CO 0.15 0.69 0.07 -0.07 -1.18 0.00 0.00 179.01 178.67 2jx2 h LEU 93 N -0.72 0.97 -9.54 1.64 3.38 0.18 -3.42 115.31 107.79 2jx2 h LEU 93 Ca -0.00 -0.24 -0.53 0.00 0.09 0.00 0.00 57.88 57.20 2jx2 h LEU 93 Cb 0.70 -0.26 0.03 0.00 0.09 0.00 0.00 40.66 41.22 2jx2 h LEU 93 CO 0.00 0.99 0.79 0.21 0.09 0.00 0.00 178.44 180.52 2jx2 s ASN 94 N -6.56 6.75 0.00 -0.43 3.84 0.27 -2.73 114.94 116.08 2jx2 s ASN 94 Ca -0.11 2.39 0.00 0.00 0.21 0.00 0.00 52.86 55.35 2jx2 s ASN 94 Cb 0.14 -2.58 0.00 0.00 -0.55 0.00 0.00 41.25 38.26 2jx2 s ASN 94 CO 0.84 -0.71 0.00 0.61 -2.79 0.00 0.00 177.10 175.04 2jx2 n GLY 95 N 3.60 0.97 3.56 1.21 0.00 -1.26 -4.83 105.19 108.44 2jx2 n GLY 95 Ca 0.12 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2jx2 n GLY 95 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jx2 s THR 96 N -2.00 2.99 -0.02 2.61 -4.23 -1.11 -5.06 115.64 108.83 2jx2 s THR 96 Ca 0.00 -2.06 0.07 0.00 -1.18 0.00 0.00 61.69 58.52 2jx2 s THR 96 Cb 0.00 -2.56 -0.02 0.00 1.34 0.00 0.00 72.50 71.26 2jx2 s THR 96 CO 0.00 -0.33 -0.22 -1.58 -0.54 0.00 0.00 174.62 171.95 2jx2 s GLN 97 N -3.42 1.83 0.00 3.99 0.74 -1.26 -2.25 119.66 119.28 2jx2 s GLN 97 Ca 0.29 -0.80 0.00 0.00 0.05 0.00 0.00 55.36 54.90 2jx2 s GLN 97 Cb -0.06 -1.76 0.00 0.00 1.10 0.00 0.00 33.01 32.29 2jx2 s GLN 97 CO 0.17 0.48 0.00 0.28 -0.55 0.00 0.00 175.29 175.66 2jx2 n VAL 98 N 2.55 0.00 -0.26 1.34 0.31 0.40 -4.91 118.33 117.76 2jx2 n VAL 98 Ca -0.16 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.17 2jx2 n VAL 98 Cb 0.52 -1.43 0.19 0.00 -0.91 0.00 0.00 33.84 32.21 2jx2 n VAL 98 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2jx2 h GLU 99 N 0.00 1.08 0.00 5.55 4.39 -2.02 -3.36 114.58 120.22 2jx2 h GLU 99 Ca 0.00 -0.09 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 2jx2 h GLU 99 Cb 0.00 -0.23 -0.08 0.00 -0.10 0.00 0.00 28.75 28.34 2jx2 h GLU 99 CO 0.00 0.75 -0.27 0.45 -1.16 0.00 0.00 179.01 178.78 2jx2 n SER 100 N -4.38 -0.20 -4.02 1.42 2.88 -1.26 -5.12 113.62 102.94 2jx2 n SER 100 Ca 0.09 -1.55 -0.08 0.00 -1.33 0.00 0.00 58.87 55.99 2jx2 n SER 100 Cb 0.06 0.03 -0.10 0.00 -0.75 0.00 0.00 64.21 63.45 2jx2 n SER 100 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2jx2 s VAL 101 N 0.00 0.17 -0.03 2.46 1.01 -1.26 -5.13 120.40 117.61 2jx2 s VAL 101 Ca 0.03 -1.37 -0.07 0.00 0.00 0.00 0.00 61.98 60.58 2jx2 s VAL 101 Cb 0.04 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 2jx2 s VAL 101 CO -0.02 -0.76 0.23 -1.10 0.00 0.00 0.00 175.10 173.46 2jx2 s GLN 102 N -2.90 3.54 -0.08 2.72 -0.21 -1.26 0.15 119.66 121.63 2jx2 s GLN 102 Ca -0.02 -0.09 -0.04 0.00 0.02 0.00 0.00 55.36 55.22 2jx2 s GLN 102 Cb 0.01 -3.12 -0.04 0.00 1.00 0.00 0.00 33.01 30.85 2jx2 s GLN 102 CO -0.06 0.69 0.11 -0.51 -2.12 0.00 0.00 175.29 173.41 2jx2 s LEU 103 N -1.53 4.17 -0.03 2.90 1.43 -0.95 -4.67 118.68 120.00 2jx2 s LEU 103 Ca 0.24 0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.71 2jx2 s LEU 103 Cb -0.13 -2.15 0.01 0.00 0.03 0.00 0.00 46.19 43.95 2jx2 s LEU 103 CO 0.13 0.36 -0.10 -0.54 0.23 0.00 0.00 176.35 176.43 2jx2 s LYS 104 N -1.27 1.12 -0.06 1.70 1.02 -0.78 -4.17 119.74 117.31 2jx2 s LYS 104 Ca 0.18 -0.32 0.05 0.00 0.02 0.00 0.00 55.97 55.90 2jx2 s LYS 104 Cb -0.12 -1.02 -0.01 0.00 -0.52 0.00 0.00 37.83 36.16 2jx2 s LYS 104 CO 0.08 0.09 -0.22 0.08 -0.92 0.00 0.00 175.35 174.46 2jx2 s VAL 105 N 0.33 2.34 0.33 3.17 1.01 -1.26 -0.44 120.40 125.88 2jx2 s VAL 105 Ca -0.06 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.01 2jx2 s VAL 105 Cb -0.11 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 2jx2 s VAL 105 CO 0.01 0.57 0.18 0.59 0.00 0.00 0.00 175.10 176.45 2jx2 n ASN 106 N 2.87 0.43 -4.55 3.32 5.03 0.38 -4.97 115.26 117.77 2jx2 n ASN 106 Ca -0.17 -2.91 -0.34 0.00 0.87 0.00 0.00 54.58 52.02 2jx2 n ASN 106 Cb 0.52 1.14 -0.11 0.00 -1.02 0.00 0.00 39.78 40.31 2jx2 n ASN 106 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2jx2 s ILE 107 N -3.02 3.96 0.29 2.41 1.01 -1.26 -1.09 121.20 123.50 2jx2 s ILE 107 Ca 0.25 -0.35 0.09 0.00 0.00 0.00 0.00 60.65 60.64 2jx2 s ILE 107 Cb 0.01 -2.70 -0.04 0.00 0.01 0.00 0.00 42.46 39.74 2jx2 s ILE 107 CO 0.18 0.54 0.03 0.00 0.00 0.00 0.00 174.94 175.68 2jx2 s ALA 108 N -0.13 3.24 0.39 9.38 0.00 -1.26 -4.79 121.76 128.59 2jx2 s ALA 108 Ca 0.03 -1.72 -0.23 0.00 0.00 0.00 0.00 51.96 50.04 2jx2 s ALA 108 Cb -0.13 -0.73 -0.13 0.00 0.00 0.00 0.00 23.12 22.13 2jx2 s ALA 108 CO 0.02 0.20 0.56 -2.13 0.00 0.00 0.00 175.76 174.41 2jx2 n ARG 109 N -0.96 0.56 -1.97 0.00 0.63 -1.26 -4.82 116.66 108.84 2jx2 n ARG 109 Ca -0.06 0.20 -0.36 0.00 -0.92 0.00 0.00 57.85 56.72 2jx2 n ARG 109 Cb 0.60 -1.47 0.04 0.00 0.45 0.00 0.00 32.46 32.08 2jx2 n ARG 109 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2jx2 s LYS 110 N -1.50 2.91 0.53 -0.14 1.02 -1.26 -4.72 119.74 116.59 2jx2 s LYS 110 Ca 0.63 1.82 -0.20 0.00 0.02 0.00 0.00 55.97 58.24 2jx2 s LYS 110 Cb -0.64 -1.92 -0.06 0.00 -0.52 0.00 0.00 37.83 34.69 2jx2 s LYS 110 CO 0.58 -1.25 1.11 1.14 -0.92 0.00 0.00 175.35 176.02 2jx2 s GLN 111 N -3.39 3.44 0.40 1.68 -2.07 -1.26 -4.73 119.66 113.73 2jx2 s GLN 111 Ca 0.77 1.56 0.22 0.00 -1.82 0.00 0.00 55.36 56.09 2jx2 s GLN 111 Cb -0.30 -2.02 0.66 0.00 -1.09 0.00 0.00 33.01 30.26 2jx2 s GLN 111 CO 0.34 -0.77 1.72 -1.00 -1.32 0.00 0.00 175.29 174.25 2jx2 h PRO 112 N 1.26 0.00 -0.22 9.60 0.13 -1.95 1.27 132.00 142.09 2jx2 h PRO 112 Ca -0.50 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.70 2jx2 h PRO 112 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2jx2 h PRO 112 CO 0.57 0.28 0.32 0.52 -0.23 0.00 0.00 178.00 179.46 2jx2 h MET 113 N 0.00 0.00 0.00 0.86 2.86 -1.99 -3.33 114.93 113.33 2jx2 h MET 113 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 2jx2 h MET 113 Cb 0.92 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.56 2jx2 h MET 113 CO 0.04 0.00 -0.06 -0.11 1.06 0.00 0.00 176.91 177.84 2jx2 n LEU 114 N -3.53 -0.20 -3.57 1.22 0.00 -1.20 -4.96 117.00 104.77 2jx2 n LEU 114 Ca 0.03 -0.39 -0.26 0.00 0.00 0.00 0.00 56.01 55.38 2jx2 n LEU 114 Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 43.42 43.85 2jx2 n LEU 114 CO 0.24 0.70 -0.03 0.47 0.00 0.00 0.00 177.39 178.76 2jx2 n ASP 115 N 0.00 -3.48 0.00 1.96 8.00 0.44 -3.29 116.55 120.17 2jx2 n ASP 115 Ca -0.05 -0.53 0.00 0.00 0.71 0.00 0.00 54.79 54.92 2jx2 n ASP 115 Cb 0.33 -2.88 0.00 0.00 -0.02 0.00 0.00 41.12 38.55 2jx2 n ASP 115 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jx2 n ALA 116 N -3.71 0.00 -3.00 2.24 0.00 -1.08 -4.62 120.51 110.34 2jx2 n ALA 116 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2jx2 n ALA 116 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 2jx2 n ALA 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jx2 n ALA 117 N 0.84 0.00 -2.43 0.00 0.00 -1.16 0.19 120.51 117.94 2jx2 n ALA 117 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2jx2 n ALA 117 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2jx2 n ALA 117 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2jx2 s THR 118 N -2.65 2.00 -0.02 0.00 -4.23 -1.26 -5.04 115.64 104.44 2jx2 s THR 118 Ca 0.00 -2.08 -0.08 0.00 -1.18 0.00 0.00 61.69 58.35 2jx2 s THR 118 Cb 0.00 -2.01 0.03 0.00 1.34 0.00 0.00 72.50 71.86 2jx2 s THR 118 CO 0.00 -0.36 0.38 0.61 -0.54 0.00 0.00 174.62 174.71 2jx2 n GLY 119 N -0.01 0.42 0.35 3.99 0.00 -1.26 -4.99 105.19 103.69 2jx2 n GLY 119 Ca -0.11 -0.88 0.05 0.00 0.00 0.00 0.00 46.02 45.09 2jx2 n GLY 119 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2jx2 h LYS 120 N 0.00 0.77 0.00 1.61 1.63 -2.08 -3.56 116.57 114.94 2jx2 h LYS 120 Ca -0.06 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.70 2jx2 h LYS 120 Cb 0.33 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 31.79 2jx2 h LYS 120 CO 0.09 0.51 0.00 -1.13 -3.45 0.00 0.00 179.45 175.46