#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jx2 s PRO 36 N 0.00 3.48 0.05 0.00 0.04 -1.26 -5.06 135.00 132.25 2jx2 s PRO 36 Ca 0.00 1.65 -0.04 0.00 0.04 0.00 0.00 61.00 62.64 2jx2 s PRO 36 Cb 0.00 -2.11 -0.02 0.00 0.04 0.00 0.00 34.50 32.41 2jx2 s PRO 36 CO 0.00 -0.75 0.07 -0.98 0.04 0.00 0.00 177.00 175.38 2jx2 s ARG 37 N -3.13 0.64 0.00 4.56 1.70 -1.26 -5.16 118.95 116.30 2jx2 s ARG 37 Ca 0.70 -0.94 0.00 0.00 -0.47 0.00 0.00 55.73 55.02 2jx2 s ARG 37 Cb -0.25 0.24 0.00 0.00 -0.57 0.00 0.00 34.95 34.37 2jx2 s ARG 37 CO 0.29 -0.16 0.00 1.63 -1.08 0.00 0.00 175.30 175.98 2jx2 n LYS 38 N 0.42 3.41 0.00 3.89 5.02 -1.21 -4.96 118.16 124.74 2jx2 n LYS 38 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 2jx2 n LYS 38 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.61 2jx2 n LYS 38 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jx2 n GLY 39 N 4.26 -2.00 3.64 0.72 0.00 0.55 -4.46 105.19 107.91 2jx2 n GLY 39 Ca 0.00 0.95 -0.43 0.00 0.00 0.00 0.00 46.02 46.55 2jx2 n GLY 39 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jx2 s ASN 40 N 0.00 6.49 0.29 1.61 2.47 0.92 -4.04 114.94 122.68 2jx2 s ASN 40 Ca 0.00 1.89 -0.26 0.00 0.42 0.00 0.00 52.86 54.92 2jx2 s ASN 40 Cb 0.00 -2.53 -0.09 0.00 -1.45 0.00 0.00 41.25 37.17 2jx2 s ASN 40 CO 0.00 -1.12 0.90 -0.89 -3.72 0.00 0.00 177.10 172.28 2jx2 s THR 41 N 4.74 4.25 0.06 -5.21 2.01 -1.22 -0.07 115.64 120.21 2jx2 s THR 41 Ca 0.72 1.78 0.08 0.00 0.31 0.00 0.00 61.69 64.58 2jx2 s THR 41 Cb -0.29 -4.03 -0.03 0.00 0.01 0.00 0.00 72.50 68.16 2jx2 s THR 41 CO 0.29 0.21 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.49 2jx2 s LEU 42 N -1.90 2.65 -0.33 4.42 1.02 0.67 0.25 118.68 125.45 2jx2 s LEU 42 Ca 0.47 -0.46 -0.09 0.00 0.02 0.00 0.00 54.13 54.07 2jx2 s LEU 42 Cb -0.19 -1.54 0.02 0.00 0.02 0.00 0.00 46.19 44.50 2jx2 s LEU 42 CO 0.24 0.23 0.15 -0.47 0.02 0.00 0.00 176.35 176.52 2jx2 s TYR 43 N -1.00 3.21 0.10 0.29 6.14 -0.77 -2.04 117.35 123.29 2jx2 s TYR 43 Ca 0.16 -0.94 0.06 0.00 0.64 0.00 0.00 57.07 56.99 2jx2 s TYR 43 Cb -0.11 -2.35 -0.04 0.00 0.42 0.00 0.00 41.96 39.88 2jx2 s TYR 43 CO 0.07 -0.60 -0.04 0.08 0.64 0.00 0.00 175.55 175.71 2jx2 s VAL 44 N 1.53 3.74 -0.02 3.14 1.01 -0.42 0.38 120.40 129.77 2jx2 s VAL 44 Ca 0.02 -1.14 -0.02 0.00 0.00 0.00 0.00 61.98 60.84 2jx2 s VAL 44 Cb -0.18 -2.78 0.01 0.00 0.00 0.00 0.00 36.38 33.42 2jx2 s VAL 44 CO 0.05 0.09 0.06 -0.47 0.00 0.00 0.00 175.10 174.84 2jx2 s TYR 45 N -1.31 -0.07 -0.68 5.22 5.04 -0.47 -1.54 117.35 123.54 2jx2 s TYR 45 Ca 0.24 0.18 0.00 0.00 -2.44 0.00 0.00 57.07 55.05 2jx2 s TYR 45 Cb -0.11 0.00 0.00 0.00 0.35 0.00 0.00 41.96 42.20 2jx2 s TYR 45 CO 0.17 -0.04 0.00 0.41 -1.34 0.00 0.00 175.55 174.74 2jx2 n GLY 46 N 3.17 -1.11 3.60 8.97 0.00 -1.18 -1.73 105.19 116.92 2jx2 n GLY 46 Ca -0.14 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.27 2.08 -1.77 1.61 2.02 -1.26 -4.63 118.70 116.47 2jx2 s GLU 47 Ca 0.00 -1.62 -0.20 0.00 0.02 0.00 0.00 54.97 53.17 2jx2 s GLU 47 Cb 0.00 -1.99 0.18 0.00 0.10 0.00 0.00 34.13 32.43 2jx2 s GLU 47 CO 0.00 0.26 0.67 -0.25 0.02 0.00 0.00 175.26 175.96 2jx2 n ASP 48 N -0.86 -2.46 -4.75 -0.19 8.00 -1.26 -4.86 116.55 110.17 2jx2 n ASP 48 Ca -0.05 -1.12 -0.40 0.00 0.71 0.00 0.00 54.79 53.93 2jx2 n ASP 48 Cb 0.61 -2.24 -0.05 0.00 -0.02 0.00 0.00 41.12 39.41 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 -7.07 4.77 0.22 -1.24 -1.94 -1.26 -5.05 119.30 107.72 2jx2 s MET 49 Ca 0.73 1.56 0.07 0.00 -1.71 0.00 0.00 55.69 56.34 2jx2 s MET 49 Cb -0.41 -3.28 -0.05 0.00 2.01 0.00 0.00 34.83 33.10 2jx2 s MET 49 CO 0.97 0.38 -0.12 0.95 -0.01 0.00 0.00 175.02 177.20 2jx2 s THR 50 N -0.91 1.63 -0.02 2.05 -4.23 -1.26 -5.06 115.64 107.84 2jx2 s THR 50 Ca 0.43 -2.17 -0.25 0.00 -1.18 0.00 0.00 61.69 58.52 2jx2 s THR 50 Cb -0.27 -2.13 -0.19 0.00 1.34 0.00 0.00 72.50 71.26 2jx2 s THR 50 CO 0.34 -0.53 1.16 1.55 -0.54 0.00 0.00 174.62 176.59 2jx2 h PRO 51 N 2.51 -0.13 -0.89 3.99 0.13 -1.98 -1.58 132.00 134.05 2jx2 h PRO 51 Ca -0.38 0.01 0.02 0.00 -0.87 0.00 0.00 66.00 64.78 2jx2 h PRO 51 Cb 1.22 0.03 -0.05 0.00 0.13 0.00 0.00 31.00 32.33 2jx2 h PRO 51 CO 0.63 0.32 0.58 1.15 -0.23 0.00 0.00 178.00 180.46 2jx2 h THR 52 N -0.64 1.18 -0.39 1.56 2.02 -1.99 0.11 112.91 114.76 2jx2 h THR 52 Ca -0.01 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 2jx2 h THR 52 Cb 0.51 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 2jx2 h THR 52 CO 0.02 0.21 0.08 0.25 0.37 0.00 0.00 175.52 176.45 2jx2 h LEU 53 N 1.16 0.60 -0.31 2.58 6.46 -1.98 -2.59 115.31 121.23 2jx2 h LEU 53 Ca 0.35 -0.25 -0.02 0.00 -0.12 0.00 0.00 57.88 57.84 2jx2 h LEU 53 Cb -0.05 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 39.71 2jx2 h LEU 53 CO -0.10 0.70 0.10 -0.07 -0.62 0.00 0.00 178.44 178.45 2jx2 h LEU 54 N 0.49 0.46 -0.93 2.25 3.38 -0.70 -2.08 115.31 118.18 2jx2 h LEU 54 Ca 0.12 -0.20 0.17 0.00 0.09 0.00 0.00 57.88 58.07 2jx2 h LEU 54 Cb 0.34 -0.12 -0.10 0.00 0.09 0.00 0.00 40.66 40.87 2jx2 h LEU 54 CO 0.00 0.53 0.52 0.03 0.09 0.00 0.00 178.44 179.62 2jx2 h ARG 55 N 0.35 0.65 -0.09 1.13 3.08 -0.67 0.37 114.38 119.20 2jx2 h ARG 55 Ca 0.10 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 60.00 2jx2 h ARG 55 Cb 0.24 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2jx2 h ARG 55 CO -0.00 0.43 -0.44 0.78 -1.07 0.00 0.00 179.97 179.66 2jx2 h GLY 56 N 0.67 0.24 2.00 0.04 0.00 -1.06 1.58 103.07 106.54 2jx2 h GLY 56 Ca 0.53 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.58 2jx2 h GLY 56 CO -0.39 0.21 -0.21 0.00 0.00 0.00 0.00 176.54 176.15 2jx2 h ALA 57 N 1.36 1.02 0.00 3.60 0.00 0.33 -3.08 119.26 122.49 2jx2 h ALA 57 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2jx2 h ALA 57 Cb 0.86 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2jx2 h ALA 57 CO 0.07 0.27 -0.00 1.19 0.00 0.00 0.00 179.25 180.77 2jx2 n PHE 58 N -3.38 0.00 -0.01 0.00 3.01 -0.22 -4.65 117.46 112.22 2jx2 n PHE 58 Ca 0.00 -0.49 -0.09 0.00 1.01 0.00 0.00 57.45 57.88 2jx2 n PHE 58 Cb 0.43 -0.05 -0.08 0.00 -0.01 0.00 0.00 39.48 39.77 2jx2 n PHE 58 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2jx2 h SER 59 N 0.00 -0.08 0.01 4.37 0.87 0.24 -3.27 113.55 115.69 2jx2 h SER 59 Ca 0.00 -0.47 -0.14 0.00 -1.23 0.00 0.00 61.79 59.95 2jx2 h SER 59 Cb 0.52 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 2jx2 h SER 59 CO 0.00 0.60 -0.45 1.55 -0.53 0.00 0.00 176.83 178.00 2jx2 h PRO 60 N -0.93 0.52 -0.95 2.24 0.13 -1.81 -3.12 132.00 128.07 2jx2 h PRO 60 Ca -0.01 -0.28 0.04 0.00 -0.87 0.00 0.00 66.00 64.88 2jx2 h PRO 60 Cb 0.55 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.64 2jx2 h PRO 60 CO 0.02 0.87 0.62 0.74 -0.23 0.00 0.00 178.00 180.02 2jx2 h PHE 61 N 0.42 1.15 0.00 1.56 0.04 -1.83 -3.47 116.94 114.82 2jx2 h PHE 61 Ca 0.03 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.83 2jx2 h PHE 61 Cb 0.95 -0.38 0.00 0.00 2.20 0.00 0.00 35.95 38.72 2jx2 h PHE 61 CO 0.04 0.65 0.00 0.41 -0.60 0.00 0.00 178.31 178.81 2jx2 n GLY 62 N -1.39 -0.33 3.76 -1.45 0.00 -1.18 -4.76 105.19 99.85 2jx2 n GLY 62 Ca 0.13 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.83 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 0.00 7.58 -0.19 1.61 2.47 -1.26 -4.34 114.94 120.80 2jx2 s ASN 63 Ca 0.00 1.91 -0.09 0.00 0.42 0.00 0.00 52.86 55.10 2jx2 s ASN 63 Cb 0.00 -2.60 -0.05 0.00 -1.45 0.00 0.00 41.25 37.15 2jx2 s ASN 63 CO 0.00 0.12 0.12 -0.63 -3.72 0.00 0.00 177.10 172.98 2jx2 s ILE 64 N -1.27 5.29 -0.14 -5.21 1.01 -1.26 -2.96 121.20 116.66 2jx2 s ILE 64 Ca 0.43 0.14 0.19 0.00 0.00 0.00 0.00 60.65 61.41 2jx2 s ILE 64 Cb -0.24 -3.40 -0.15 0.00 0.01 0.00 0.00 42.46 38.68 2jx2 s ILE 64 CO 0.30 0.46 0.73 2.30 0.00 0.00 0.00 174.94 178.74 2jx2 n ILE 65 N 3.36 0.89 -3.49 2.92 -5.35 -1.01 -4.84 119.36 111.84 2jx2 n ILE 65 Ca -0.17 -0.65 -0.12 0.00 -0.27 0.00 0.00 62.75 61.55 2jx2 n ILE 65 Cb 0.52 -0.50 -0.10 0.00 -1.74 0.00 0.00 39.64 37.82 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 -5.45 0.38 -0.29 7.28 2.15 -1.26 -5.03 116.67 114.45 2jx2 s ASP 66 Ca -0.04 0.36 -0.09 0.00 0.43 0.00 0.00 52.55 53.21 2jx2 s ASP 66 Cb 0.09 0.94 -0.01 0.00 -0.30 0.00 0.00 42.92 43.64 2jx2 s ASP 66 CO 0.82 -0.28 0.13 -0.22 -0.17 0.00 0.00 175.17 175.45 2jx2 s LEU 67 N 2.49 3.91 0.07 -1.34 1.98 -1.26 -2.22 118.68 122.31 2jx2 s LEU 67 Ca 0.07 -0.41 0.06 0.00 -2.89 0.00 0.00 54.13 50.96 2jx2 s LEU 67 Cb -0.14 -1.98 -0.03 0.00 0.66 0.00 0.00 46.19 44.70 2jx2 s LEU 67 CO -0.13 -0.14 -0.17 -0.55 -1.89 0.00 0.00 176.35 173.47 2jx2 s SER 68 N 1.62 2.00 0.09 3.68 0.15 -0.46 -5.02 113.70 115.76 2jx2 s SER 68 Ca 0.05 -0.60 0.08 0.00 0.70 0.00 0.00 55.95 56.18 2jx2 s SER 68 Cb -0.16 -0.10 -0.03 0.00 -1.71 0.00 0.00 66.02 64.01 2jx2 s SER 68 CO 0.06 0.00 -0.21 -0.04 1.20 0.00 0.00 173.24 174.25 2jx2 s MET 69 N -1.64 1.20 -0.34 5.44 -1.94 -1.26 0.98 119.30 121.74 2jx2 s MET 69 Ca 0.02 -1.10 0.04 0.00 -1.71 0.00 0.00 55.69 52.94 2jx2 s MET 69 Cb -0.10 -1.43 0.10 0.00 2.01 0.00 0.00 34.83 35.42 2jx2 s MET 69 CO 0.03 0.34 0.05 0.34 -0.01 0.00 0.00 175.02 175.77 2jx2 s ASP 70 N -1.70 4.72 0.28 3.03 2.15 0.20 -4.89 116.67 120.47 2jx2 s ASP 70 Ca 0.07 -2.12 0.14 0.00 0.43 0.00 0.00 52.55 51.06 2jx2 s ASP 70 Cb -0.10 -1.58 0.33 0.00 -0.30 0.00 0.00 42.92 41.28 2jx2 s ASP 70 CO 0.04 -0.38 1.57 1.55 -0.17 0.00 0.00 175.17 177.78 2jx2 h PRO 71 N 7.64 0.00 0.00 4.34 0.13 -1.96 -0.18 132.00 141.97 2jx2 h PRO 71 Ca -0.05 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.94 2jx2 h PRO 71 Cb 1.02 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.13 2jx2 h PRO 71 CO 0.52 0.58 -0.66 -1.00 -0.23 0.00 0.00 178.00 177.20 2jx2 h PRO 72 N 0.00 0.00 -0.02 1.56 0.13 -1.94 -3.24 132.00 128.50 2jx2 h PRO 72 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2jx2 h PRO 72 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2jx2 h PRO 72 CO 0.08 0.66 0.00 0.54 -0.23 0.00 0.00 178.00 179.05 2jx2 n ARG 73 N -3.55 0.77 -3.51 0.86 1.74 -1.23 -4.98 116.66 106.76 2jx2 n ARG 73 Ca -0.00 -1.26 -0.22 0.00 -0.77 0.00 0.00 57.85 55.60 2jx2 n ARG 73 Cb 0.70 -1.24 0.08 0.00 -1.02 0.00 0.00 32.46 30.97 2jx2 n ARG 73 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2jx2 n ASN 74 N 0.71 -5.64 -3.83 0.55 3.02 -0.45 -4.96 115.26 104.66 2jx2 n ASN 74 Ca 0.07 -0.52 -0.13 0.00 -0.03 0.00 0.00 54.58 53.98 2jx2 n ASN 74 Cb 0.32 -4.79 -0.14 0.00 -0.61 0.00 0.00 39.78 34.55 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 0.34 3.67 -0.08 0.00 0.00 -0.59 0.63 121.76 125.73 2jx2 s ALA 76 Ca -0.03 -1.42 0.03 0.00 0.00 0.00 0.00 51.96 50.55 2jx2 s ALA 76 Cb -0.04 -1.35 0.01 0.00 0.00 0.00 0.00 23.12 21.74 2jx2 s ALA 76 CO -0.01 0.22 -0.18 -0.06 0.00 0.00 0.00 175.76 175.73 2jx2 s PHE 77 N -2.13 2.01 -0.07 0.00 0.08 0.28 -1.29 117.98 116.85 2jx2 s PHE 77 Ca 0.34 -0.79 0.05 0.00 0.12 0.00 0.00 56.93 56.65 2jx2 s PHE 77 Cb -0.08 -1.39 -0.00 0.00 -0.57 0.00 0.00 43.02 40.98 2jx2 s PHE 77 CO 0.26 -0.35 -0.22 0.08 -0.10 0.00 0.00 175.22 174.89 2jx2 s VAL 78 N 0.49 1.84 -0.12 -0.44 1.01 -0.86 -1.36 120.40 120.96 2jx2 s VAL 78 Ca -0.17 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 60.85 2jx2 s VAL 78 Cb -0.17 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2jx2 s VAL 78 CO 0.06 0.51 0.02 -0.89 0.00 0.00 0.00 175.10 174.81 2jx2 s THR 79 N 0.13 4.44 -0.10 3.92 2.01 -0.94 0.24 115.64 125.35 2jx2 s THR 79 Ca -0.10 -0.18 0.02 0.00 0.31 0.00 0.00 61.69 61.74 2jx2 s THR 79 Cb -0.15 -2.92 -0.02 0.00 0.01 0.00 0.00 72.50 69.43 2jx2 s THR 79 CO 0.05 0.55 -0.16 -0.31 -0.69 0.00 0.00 174.62 174.06 2jx2 s TYR 80 N -0.38 2.71 0.59 4.92 2.02 0.90 -2.40 117.35 125.71 2jx2 s TYR 80 Ca 0.08 -0.58 0.29 0.00 -0.37 0.00 0.00 57.07 56.48 2jx2 s TYR 80 Cb -0.12 -1.74 1.48 0.00 -0.40 0.00 0.00 41.96 41.17 2jx2 s TYR 80 CO 0.02 -0.14 1.89 1.49 -1.57 0.00 0.00 175.55 177.24 2jx2 h GLU 81 N 6.29 0.00 -4.20 -0.62 4.81 -1.75 0.27 114.58 119.38 2jx2 h GLU 81 Ca -0.31 0.00 -0.40 0.00 -0.13 0.00 0.00 59.36 58.53 2jx2 h GLU 81 Cb 1.20 0.00 -0.32 0.00 0.63 0.00 0.00 28.75 30.25 2jx2 h GLU 81 CO 0.52 0.00 -0.77 0.15 -0.73 0.00 0.00 179.01 178.18 2jx2 s LYS 82 N -4.61 0.78 0.55 1.92 1.02 -1.26 -3.31 119.74 114.82 2jx2 s LYS 82 Ca -0.04 -0.16 0.32 0.00 0.02 0.00 0.00 55.97 56.11 2jx2 s LYS 82 Cb 0.15 -0.77 1.75 0.00 -0.52 0.00 0.00 37.83 38.45 2jx2 s LYS 82 CO 0.55 -0.00 1.98 0.00 -0.92 0.00 0.00 175.35 176.95 2jx2 h MET 83 N 6.78 0.00 -0.61 1.68 -0.00 -1.88 -0.84 114.93 120.07 2jx2 h MET 83 Ca -0.36 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.25 2jx2 h MET 83 Cb 1.16 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.74 2jx2 h MET 83 CO 0.48 0.00 0.03 0.93 -0.00 0.00 0.00 176.91 178.35 2jx2 h GLU 84 N 0.00 1.04 -0.75 -0.10 5.08 -1.94 -2.59 114.58 115.33 2jx2 h GLU 84 Ca 0.00 -0.31 -0.05 0.00 -1.00 0.00 0.00 59.36 58.00 2jx2 h GLU 84 Cb 0.24 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 2jx2 h GLU 84 CO 0.00 1.00 0.27 1.03 -1.00 0.00 0.00 179.01 180.31 2jx2 h SER 85 N 0.96 1.06 -0.80 1.42 0.87 -1.44 -2.32 113.55 113.29 2jx2 h SER 85 Ca 0.18 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 2jx2 h SER 85 Cb 0.51 -0.28 -0.04 0.00 -0.44 0.00 0.00 62.40 62.16 2jx2 h SER 85 CO 0.02 0.96 0.47 0.00 -0.53 0.00 0.00 176.83 177.76 2jx2 h ALA 86 N 1.14 1.03 -0.43 6.23 0.00 -1.55 -0.38 119.26 125.29 2jx2 h ALA 86 Ca 0.25 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2jx2 h ALA 86 Cb 0.25 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2jx2 h ALA 86 CO -0.01 0.51 0.21 0.22 0.00 0.00 0.00 179.25 180.17 2jx2 h ASP 87 N 1.11 0.55 -0.43 0.00 3.58 -1.09 0.73 116.42 120.87 2jx2 h ASP 87 Ca 0.29 -0.12 -0.07 0.00 0.42 0.00 0.00 57.03 57.55 2jx2 h ASP 87 Cb -0.02 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.87 2jx2 h ASP 87 CO -0.05 0.51 0.01 -0.61 -2.88 0.00 0.00 179.24 176.23 2jx2 h GLN 88 N 0.55 0.82 0.00 0.28 4.15 -1.02 -1.85 115.11 118.05 2jx2 h GLN 88 Ca 0.15 -0.22 -0.11 0.00 0.77 0.00 0.00 58.65 59.24 2jx2 h GLN 88 Cb 0.10 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 27.70 2jx2 h GLN 88 CO -0.02 0.82 -0.43 0.00 -1.93 0.00 0.00 178.83 177.27 2jx2 h ALA 89 N 1.24 0.05 -0.44 3.38 0.00 -0.66 -1.76 119.26 121.06 2jx2 h ALA 89 Ca 0.15 -0.52 0.09 0.00 0.00 0.00 0.00 54.91 54.63 2jx2 h ALA 89 Cb 0.45 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2jx2 h ALA 89 CO 0.02 0.22 0.31 0.28 0.00 0.00 0.00 179.25 180.07 2jx2 h VAL 90 N -0.31 0.89 0.00 0.00 2.07 0.54 1.90 116.25 121.34 2jx2 h VAL 90 Ca -0.05 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 2jx2 h VAL 90 Cb 1.17 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2jx2 h VAL 90 CO 0.08 0.04 -0.01 0.00 0.02 0.00 0.00 177.57 177.71 2jx2 h ALA 91 N 1.77 0.00 -0.16 1.67 0.00 -1.32 -2.15 119.26 119.07 2jx2 h ALA 91 Ca 0.20 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 2jx2 h ALA 91 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2jx2 h ALA 91 CO -0.04 0.00 -0.36 0.93 0.00 0.00 0.00 179.25 179.78 2jx2 h GLU 92 N -1.00 0.53 -0.69 0.00 4.39 -1.01 -3.19 114.58 113.61 2jx2 h GLU 92 Ca -0.00 -0.36 -0.07 0.00 0.34 0.00 0.00 59.36 59.27 2jx2 h GLU 92 Cb 0.70 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.37 2jx2 h GLU 92 CO -0.00 0.97 0.16 -0.07 -1.16 0.00 0.00 179.01 178.91 2jx2 h LEU 93 N 0.17 1.05 -9.42 1.33 3.38 0.28 -3.41 115.31 108.70 2jx2 h LEU 93 Ca 0.00 -0.24 -0.54 0.00 0.09 0.00 0.00 57.88 57.19 2jx2 h LEU 93 Cb 0.97 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.45 2jx2 h LEU 93 CO 0.08 1.02 0.88 0.21 0.09 0.00 0.00 178.44 180.71 2jx2 s ASN 94 N -6.43 6.76 0.00 -0.43 3.84 -0.81 -2.57 114.94 115.31 2jx2 s ASN 94 Ca -0.12 2.27 0.00 0.00 0.21 0.00 0.00 52.86 55.22 2jx2 s ASN 94 Cb 0.14 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.28 2jx2 s ASN 94 CO 0.84 -0.77 0.00 0.61 -2.79 0.00 0.00 177.10 174.99 2jx2 n GLY 95 N 3.75 1.00 3.68 1.21 0.00 -1.26 -4.85 105.19 108.73 2jx2 n GLY 95 Ca 0.14 -0.32 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 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 3.66 0.04 2.61 -4.23 -1.06 -5.03 115.64 109.63 2jx2 s THR 96 Ca 0.00 -1.79 0.02 0.00 -1.18 0.00 0.00 61.69 58.74 2jx2 s THR 96 Cb 0.00 -2.96 -0.02 0.00 1.34 0.00 0.00 72.50 70.86 2jx2 s THR 96 CO 0.00 -0.36 -0.07 -1.58 -0.54 0.00 0.00 174.62 172.07 2jx2 s GLN 97 N -3.67 0.51 0.00 3.99 0.74 -1.26 -1.64 119.66 118.33 2jx2 s GLN 97 Ca 0.31 -0.70 0.00 0.00 0.05 0.00 0.00 55.36 55.03 2jx2 s GLN 97 Cb -0.07 -0.29 0.00 0.00 1.10 0.00 0.00 33.01 33.75 2jx2 s GLN 97 CO 0.21 0.05 0.00 0.28 -0.55 0.00 0.00 175.29 175.28 2jx2 n VAL 98 N 1.61 0.00 -0.32 1.34 0.31 0.80 -4.92 118.33 117.14 2jx2 n VAL 98 Ca -0.22 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.26 2jx2 n VAL 98 Cb 0.55 -0.18 0.35 0.00 -0.91 0.00 0.00 33.84 33.65 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 0.48 0.00 5.55 5.08 -2.03 -3.35 114.58 120.31 2jx2 h GLU 99 Ca 0.00 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2jx2 h GLU 99 Cb 0.00 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.09 2jx2 h GLU 99 CO 0.00 0.32 -0.12 0.43 -1.00 0.00 0.00 179.01 178.64 2jx2 n SER 100 N -4.96 -0.41 -4.09 1.42 7.64 -1.26 -5.13 113.62 106.83 2jx2 n SER 100 Ca 0.24 -1.11 -0.21 0.00 1.01 0.00 0.00 58.87 58.80 2jx2 n SER 100 Cb 0.70 0.12 -0.15 0.00 -1.01 0.00 0.00 64.21 63.87 2jx2 n SER 100 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2jx2 s VAL 101 N 0.00 1.01 0.15 0.44 0.11 -1.26 -5.12 120.40 115.73 2jx2 s VAL 101 Ca 0.00 -0.56 -0.21 0.00 -2.93 0.00 0.00 61.98 58.28 2jx2 s VAL 101 Cb 0.00 -0.85 -0.08 0.00 -1.53 0.00 0.00 36.38 33.93 2jx2 s VAL 101 CO 0.00 0.28 0.68 -1.10 -3.33 0.00 0.00 175.10 171.62 2jx2 s GLN 102 N -0.33 4.32 -0.11 1.54 -0.21 -1.26 -0.14 119.66 123.47 2jx2 s GLN 102 Ca 0.05 0.89 -0.03 0.00 0.02 0.00 0.00 55.36 56.29 2jx2 s GLN 102 Cb -0.05 -3.12 -0.03 0.00 1.00 0.00 0.00 33.01 30.80 2jx2 s GLN 102 CO -0.00 0.54 0.00 -0.51 -2.12 0.00 0.00 175.29 173.20 2jx2 s LEU 103 N -1.42 3.57 -0.06 2.90 1.43 -0.65 -4.58 118.68 119.86 2jx2 s LEU 103 Ca 0.36 0.11 0.06 0.00 -1.03 0.00 0.00 54.13 53.62 2jx2 s LEU 103 Cb -0.20 -1.83 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 2jx2 s LEU 103 CO 0.22 0.33 -0.24 -0.54 0.23 0.00 0.00 176.35 176.35 2jx2 s LYS 104 N -0.59 2.57 0.05 1.70 1.02 -0.71 -3.98 119.74 119.80 2jx2 s LYS 104 Ca 0.10 -0.88 0.08 0.00 0.02 0.00 0.00 55.97 55.28 2jx2 s LYS 104 Cb -0.12 -2.19 -0.03 0.00 -0.52 0.00 0.00 37.83 34.97 2jx2 s LYS 104 CO 0.02 0.40 -0.22 0.08 -0.92 0.00 0.00 175.35 174.70 2jx2 s VAL 105 N -0.19 1.80 0.03 3.17 1.01 -1.26 -1.37 120.40 123.60 2jx2 s VAL 105 Ca -0.03 -1.30 -0.00 0.00 0.00 0.00 0.00 61.98 60.65 2jx2 s VAL 105 Cb -0.14 -1.57 0.00 0.00 0.00 0.00 0.00 36.38 34.68 2jx2 s VAL 105 CO 0.03 0.21 0.05 0.59 0.00 0.00 0.00 175.10 175.98 2jx2 n ASN 106 N 1.71 -0.13 -4.40 3.32 3.02 0.16 -4.86 115.26 114.09 2jx2 n ASN 106 Ca -0.17 -1.18 -0.34 0.00 -0.03 0.00 0.00 54.58 52.85 2jx2 n ASN 106 Cb 0.53 0.24 -0.13 0.00 -0.61 0.00 0.00 39.78 39.81 2jx2 n ASN 106 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2jx2 s ILE 107 N -2.46 3.49 -0.09 2.41 -1.09 -1.26 -1.85 121.20 120.35 2jx2 s ILE 107 Ca 0.03 -0.48 -0.02 0.00 -2.23 0.00 0.00 60.65 57.95 2jx2 s ILE 107 Cb -0.00 -2.54 -0.03 0.00 -1.58 0.00 0.00 42.46 38.31 2jx2 s ILE 107 CO 0.02 0.47 -0.01 0.00 -1.23 0.00 0.00 174.94 174.19 2jx2 s ALA 108 N 0.77 3.21 -0.37 9.38 0.00 0.14 -4.60 121.76 130.29 2jx2 s ALA 108 Ca -0.02 -0.82 0.16 0.00 0.00 0.00 0.00 51.96 51.27 2jx2 s ALA 108 Cb -0.15 -1.45 0.55 0.00 0.00 0.00 0.00 23.12 22.08 2jx2 s ALA 108 CO 0.02 0.55 1.46 0.54 0.00 0.00 0.00 175.76 178.32 2jx2 n ARG 109 N 2.30 3.25 0.08 0.00 1.74 -1.26 -3.46 116.66 119.31 2jx2 n ARG 109 Ca -0.18 -2.78 -0.13 0.00 -0.77 0.00 0.00 57.85 53.99 2jx2 n ARG 109 Cb 0.53 -1.82 -0.07 0.00 -1.02 0.00 0.00 32.46 30.08 2jx2 n ARG 109 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2jx2 h LYS 110 N 2.30 -0.12 -5.07 5.56 3.64 -1.94 -3.41 116.57 117.54 2jx2 h LYS 110 Ca 0.00 0.01 -0.47 0.00 -1.27 0.00 0.00 60.65 58.92 2jx2 h LYS 110 Cb 1.42 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 33.18 2jx2 h LYS 110 CO 0.23 -0.08 1.75 0.94 -2.27 0.00 0.00 179.45 180.02 2jx2 n GLN 111 N -5.14 0.12 0.07 1.90 -0.06 -1.26 -4.70 117.38 108.30 2jx2 n GLN 111 Ca -0.08 -0.02 0.06 0.00 -2.00 0.00 0.00 57.00 54.97 2jx2 n GLN 111 Cb 0.08 -1.68 -0.04 0.00 -4.06 0.00 0.00 30.24 24.54 2jx2 n GLN 111 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 2jx2 n PRO 112 N 8.18 0.61 -0.31 3.69 -0.04 -1.26 -0.88 135.00 144.98 2jx2 n PRO 112 Ca 0.63 0.15 0.25 0.00 -0.04 0.00 0.00 63.50 64.49 2jx2 n PRO 112 Cb 0.10 -1.80 0.56 0.00 -0.04 0.00 0.00 33.50 32.32 2jx2 n PRO 112 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jx2 h MET 113 N 0.00 0.29 0.00 0.54 -0.00 -1.97 -3.12 114.93 110.67 2jx2 h MET 113 Ca -0.08 -0.02 -0.11 0.00 -0.00 0.00 0.00 59.70 59.50 2jx2 h MET 113 Cb 1.26 -0.07 -0.17 0.00 -0.00 0.00 0.00 31.60 32.62 2jx2 h MET 113 CO 0.02 0.20 -0.51 -0.11 -0.00 0.00 0.00 176.91 176.50 2jx2 n LEU 114 N -4.53 -0.05 -3.79 -0.10 0.00 -1.26 -4.99 117.00 102.28 2jx2 n LEU 114 Ca 0.25 -1.69 -0.26 0.00 0.00 0.00 0.00 56.01 54.31 2jx2 n LEU 114 Cb 0.94 0.00 0.03 0.00 0.00 0.00 0.00 43.42 44.40 2jx2 n LEU 114 CO 0.29 0.92 0.05 0.47 0.00 0.00 0.00 177.39 179.12 2jx2 n ASP 115 N 0.16 -3.48 0.00 1.96 8.00 -0.80 -3.59 116.55 118.80 2jx2 n ASP 115 Ca -0.08 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.65 2jx2 n ASP 115 Cb 0.81 -4.08 0.00 0.00 -0.02 0.00 0.00 41.12 37.83 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 -4.54 0.00 -3.64 2.24 0.00 -0.06 -4.60 120.51 109.90 2jx2 n ALA 116 Ca -0.10 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.30 2jx2 n ALA 116 Cb 0.59 0.00 -0.07 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 s ALA 117 N -1.00 -2.22 0.28 0.00 0.00 -1.24 0.21 121.76 117.79 2jx2 s ALA 117 Ca 0.00 2.10 0.03 0.00 0.00 0.00 0.00 51.96 54.10 2jx2 s ALA 117 Cb 0.00 -1.67 -0.06 0.00 0.00 0.00 0.00 23.12 21.40 2jx2 s ALA 117 CO 0.00 -0.31 0.04 0.95 0.00 0.00 0.00 175.76 176.44 2jx2 s THR 118 N 1.03 1.06 0.34 0.00 -4.23 -1.26 -4.81 115.64 107.76 2jx2 s THR 118 Ca -0.06 -2.02 0.02 0.00 -1.18 0.00 0.00 61.69 58.46 2jx2 s THR 118 Cb -0.04 -2.61 0.23 0.00 1.34 0.00 0.00 72.50 71.42 2jx2 s THR 118 CO -0.13 -0.12 1.96 1.23 -0.54 0.00 0.00 174.62 177.02 2jx2 h GLY 119 N 2.28 0.81 -5.57 3.99 0.00 -2.01 -3.40 103.07 99.18 2jx2 h GLY 119 Ca -0.39 -0.36 -0.66 0.00 0.00 0.00 0.00 47.33 45.92 2jx2 h GLY 119 CO 0.66 0.35 -0.67 1.25 0.00 0.00 0.00 176.54 178.13 2jx2 s LYS 120 N -5.48 3.32 0.00 4.80 2.20 -1.26 -5.25 119.74 118.08 2jx2 s LYS 120 Ca -0.09 -0.51 0.00 0.00 -0.36 0.00 0.00 55.97 55.01 2jx2 s LYS 120 Cb 0.17 -2.81 0.00 0.00 -1.51 0.00 0.00 37.83 33.68 2jx2 s LYS 120 CO 0.77 0.43 0.22 0.43 -0.36 0.00 0.00 175.35 176.84