#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1js2 s GLU 2 N 0.00 3.57 0.43 3.17 1.03 -1.26 -5.04 118.70 120.60 1js2 s GLU 2 Ca 0.00 -0.18 -0.26 0.00 0.03 0.00 0.00 54.97 54.56 1js2 s GLU 2 Cb 0.00 -2.73 -0.09 0.00 -0.80 0.00 0.00 34.13 30.51 1js2 s GLU 2 CO 0.00 0.28 1.38 1.19 -1.33 0.00 0.00 175.26 176.78 1js2 n PHE 3 N -0.93 2.52 -3.13 4.83 3.72 -1.26 -4.94 117.46 118.28 1js2 n PHE 3 Ca -0.03 0.46 -0.43 0.00 -0.05 0.00 0.00 57.45 57.40 1js2 n PHE 3 Cb 0.54 -2.44 -0.07 0.00 -0.94 0.00 0.00 39.48 36.58 1js2 n PHE 3 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1js2 s MET 4 N -2.33 3.24 0.46 -1.08 -1.94 -1.26 -5.04 119.30 111.35 1js2 s MET 4 Ca 0.60 -0.49 -0.24 0.00 -1.71 0.00 0.00 55.69 53.85 1js2 s MET 4 Cb -0.47 -3.98 -0.08 0.00 2.01 0.00 0.00 34.83 32.31 1js2 s MET 4 CO 0.58 -1.04 1.31 0.43 -0.01 0.00 0.00 175.02 176.29 1js2 n SER 5 N 6.22 2.68 -4.57 3.03 7.64 -1.26 -4.97 113.62 122.37 1js2 n SER 5 Ca -0.03 1.08 -0.41 0.00 1.01 0.00 0.00 58.87 60.52 1js2 n SER 5 Cb 0.47 -1.53 -0.08 0.00 -1.01 0.00 0.00 64.21 62.06 1js2 n SER 5 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1js2 s ALA 6 N -1.23 3.51 0.47 -0.43 0.00 -1.26 -4.98 121.76 117.84 1js2 s ALA 6 Ca 0.63 -0.92 -0.24 0.00 0.00 0.00 0.00 51.96 51.44 1js2 s ALA 6 Cb -0.47 -2.94 -0.08 0.00 0.00 0.00 0.00 23.12 19.63 1js2 s ALA 6 CO 0.56 -1.04 1.32 -0.35 0.00 0.00 0.00 175.76 176.25 1js2 n PRO 7 N 5.63 1.91 0.28 0.00 -0.04 -1.26 -4.90 135.00 136.61 1js2 n PRO 7 Ca -0.05 0.69 0.17 0.00 -0.04 0.00 0.00 63.50 64.26 1js2 n PRO 7 Cb 0.49 -2.49 0.71 0.00 -0.04 0.00 0.00 33.50 32.17 1js2 n PRO 7 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1js2 h ALA 8 N 1.90 1.02 -0.42 0.55 0.00 -2.01 -2.80 119.26 117.50 1js2 h ALA 8 Ca -0.49 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 1js2 h ALA 8 Cb 1.29 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.03 1js2 h ALA 8 CO 0.59 0.05 0.06 0.27 0.00 0.00 0.00 179.25 180.21 1js2 n ASN 9 N -3.16 4.04 -4.78 0.00 6.94 -1.26 -4.99 115.26 112.05 1js2 n ASN 9 Ca 0.00 -3.20 -0.36 0.00 -0.02 0.00 0.00 54.58 51.00 1js2 n ASN 9 Cb 0.30 -0.62 -0.02 0.00 -2.36 0.00 0.00 39.78 37.07 1js2 n ASN 9 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1js2 s ALA 10 N -2.94 2.99 0.21 -2.53 0.00 -1.06 -1.82 121.76 116.61 1js2 s ALA 10 Ca 0.47 0.80 -0.31 0.00 0.00 0.00 0.00 51.96 52.92 1js2 s ALA 10 Cb 0.38 -3.32 -0.11 0.00 0.00 0.00 0.00 23.12 20.07 1js2 s ALA 10 CO 0.09 -0.45 1.61 0.08 0.00 0.00 0.00 175.76 177.09 1js2 s VAL 11 N -1.65 2.33 0.27 0.00 1.01 0.26 -4.81 120.40 117.81 1js2 s VAL 11 Ca 0.62 0.25 0.08 0.00 0.00 0.00 0.00 61.98 62.93 1js2 s VAL 11 Cb -0.24 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 1js2 s VAL 11 CO 0.30 0.03 0.12 0.00 0.00 0.00 0.00 175.10 175.55 1js2 s ALA 12 N 0.81 3.44 0.49 5.51 0.00 -1.26 -4.94 121.76 125.80 1js2 s ALA 12 Ca 0.69 -1.56 0.19 0.00 0.00 0.00 0.00 51.96 51.28 1js2 s ALA 12 Cb -0.46 -1.04 1.27 0.00 0.00 0.00 0.00 23.12 22.88 1js2 s ALA 12 CO 0.36 0.22 2.09 0.00 0.00 0.00 0.00 175.76 178.43 1js2 h ALA 13 N 1.63 1.72 -0.56 0.00 0.00 -1.94 -2.42 119.26 117.69 1js2 h ALA 13 Ca -0.46 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.16 1js2 h ALA 13 Cb 1.25 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.90 1js2 h ALA 13 CO 0.61 0.11 0.26 -0.40 0.00 0.00 0.00 179.25 179.83 1js2 n ASP 14 N -4.24 3.84 -4.66 0.00 5.75 -1.26 -4.76 116.55 111.22 1js2 n ASP 14 Ca -0.03 -2.91 -0.35 0.00 -0.01 0.00 0.00 54.79 51.50 1js2 n ASP 14 Cb 0.17 -0.69 -0.09 0.00 -1.03 0.00 0.00 41.12 39.48 1js2 n ASP 14 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1js2 s ASP 15 N -0.56 5.45 0.40 -1.12 -0.00 -0.91 -5.00 116.67 114.94 1js2 s ASP 15 Ca 0.38 0.12 0.06 0.00 -0.00 0.00 0.00 52.55 53.12 1js2 s ASP 15 Cb 0.31 -1.77 0.82 0.00 -0.00 0.00 0.00 42.92 42.28 1js2 s ASP 15 CO 0.09 0.28 2.04 0.00 -0.00 0.00 0.00 175.17 177.58 1js2 h ALA 16 N 5.91 1.67 -0.27 5.23 0.00 -1.90 -2.44 119.26 127.46 1js2 h ALA 16 Ca -0.43 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1js2 h ALA 16 Cb 1.19 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1js2 h ALA 16 CO 0.62 0.30 0.12 1.79 0.00 0.00 0.00 179.25 182.08 1js2 h THR 17 N 0.58 1.16 -0.99 0.00 1.35 -1.94 0.39 112.91 113.47 1js2 h THR 17 Ca 0.16 -0.49 0.05 0.00 -0.55 0.00 0.00 66.41 65.58 1js2 h THR 17 Cb -0.04 0.98 -0.06 0.00 -1.73 0.00 0.00 68.15 67.30 1js2 h THR 17 CO -0.03 0.17 0.64 0.00 -0.25 0.00 0.00 175.52 176.05 1js2 h ALA 18 N 0.97 1.33 -0.25 6.62 0.00 -1.73 0.15 119.26 126.36 1js2 h ALA 18 Ca 0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1js2 h ALA 18 Cb 0.16 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1js2 h ALA 18 CO -0.01 0.49 0.01 0.82 0.00 0.00 0.00 179.25 180.56 1js2 h ILE 19 N 1.21 1.25 -0.35 0.00 1.08 -1.15 0.74 117.51 120.29 1js2 h ILE 19 Ca 0.41 -0.88 0.01 0.00 -0.39 0.00 0.00 64.86 64.01 1js2 h ILE 19 Cb 0.07 1.35 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 1js2 h ILE 19 CO -0.14 0.28 0.21 0.00 -0.69 0.00 0.00 178.15 177.80 1js2 h ALA 20 N 0.82 0.43 -0.49 1.87 0.00 -0.17 -2.83 119.26 118.89 1js2 h ALA 20 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1js2 h ALA 20 Cb 0.40 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1js2 h ALA 20 CO 0.01 -0.14 0.00 1.28 0.00 0.00 0.00 179.25 180.40 1js2 n LEU 21 N -4.89 2.84 -3.94 0.00 4.77 0.46 -4.94 117.00 111.31 1js2 n LEU 21 Ca -0.00 -1.42 -0.27 0.00 -0.03 0.00 0.00 56.01 54.29 1js2 n LEU 21 Cb 0.05 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 40.77 1js2 n LEU 21 CO 0.33 0.65 -0.13 0.29 -1.33 0.00 0.00 177.39 177.20 1js2 n LYS 22 N 0.90 -3.89 -3.15 3.23 5.02 -0.19 -1.01 118.16 119.07 1js2 n LYS 22 Ca 0.17 0.47 -0.39 0.00 -2.02 0.00 0.00 58.31 56.54 1js2 n LYS 22 Cb 0.47 -4.87 -0.06 0.00 -0.02 0.00 0.00 35.03 30.56 1js2 n LYS 22 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1js2 s TYR 23 N -3.72 3.83 -0.04 2.13 5.04 0.08 -3.73 117.35 120.94 1js2 s TYR 23 Ca 0.19 1.41 0.01 0.00 -2.44 0.00 0.00 57.07 56.24 1js2 s TYR 23 Cb -0.10 -2.62 0.02 0.00 0.35 0.00 0.00 41.96 39.61 1js2 s TYR 23 CO 0.87 0.53 -0.02 1.21 -1.34 0.00 0.00 175.55 176.79 1js2 s ASN 24 N -0.99 0.84 0.64 4.32 3.84 -0.12 -4.79 114.94 118.68 1js2 s ASN 24 Ca 0.32 -0.09 0.38 0.00 0.21 0.00 0.00 52.86 53.68 1js2 s ASN 24 Cb -0.21 -0.37 2.09 0.00 -0.55 0.00 0.00 41.25 42.21 1js2 s ASN 24 CO 0.22 -0.08 2.24 -0.61 -2.79 0.00 0.00 177.10 176.07 1js2 h GLN 25 N 7.33 0.00 -4.77 0.43 4.15 -1.91 -1.91 115.11 118.42 1js2 h GLN 25 Ca -0.37 0.00 -0.66 0.00 0.77 0.00 0.00 58.65 58.38 1js2 h GLN 25 Cb 1.14 0.00 -0.38 0.00 0.21 0.00 0.00 27.48 28.45 1js2 h GLN 25 CO 0.45 0.00 -0.77 0.34 -1.93 0.00 0.00 178.83 176.92 1js2 s ASP 26 N -5.29 4.54 0.31 -0.69 -1.08 -1.26 -2.71 116.67 110.50 1js2 s ASP 26 Ca -0.05 -1.67 0.04 0.00 -0.52 0.00 0.00 52.55 50.35 1js2 s ASP 26 Cb 0.13 -1.56 0.64 0.00 -1.46 0.00 0.00 42.92 40.67 1js2 s ASP 26 CO 0.43 -0.26 1.85 0.00 0.52 0.00 0.00 175.17 177.71 1js2 h ALA 27 N 7.72 1.62 -0.43 3.66 0.00 -0.63 -1.48 119.26 129.73 1js2 h ALA 27 Ca -0.13 0.02 0.12 0.00 0.00 0.00 0.00 54.91 54.92 1js2 h ALA 27 Cb 1.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1js2 h ALA 27 CO 0.48 0.15 0.35 1.79 0.00 0.00 0.00 179.25 182.01 1js2 h THR 28 N 0.90 0.63 -0.05 0.00 1.35 -1.93 0.89 112.91 114.71 1js2 h THR 28 Ca 0.47 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.33 1js2 h THR 28 Cb 0.53 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 1js2 h THR 28 CO -0.23 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.33 1js2 n LYS 29 N -4.16 2.21 -1.96 4.72 5.02 -0.57 -4.98 118.16 118.45 1js2 n LYS 29 Ca 0.07 -1.76 -0.30 0.00 -2.02 0.00 0.00 58.31 54.30 1js2 n LYS 29 Cb 0.54 -1.47 0.19 0.00 -0.02 0.00 0.00 35.03 34.27 1js2 n LYS 29 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1js2 s SER 30 N -1.97 3.10 -0.26 4.39 1.04 0.31 -4.97 113.70 115.34 1js2 s SER 30 Ca 0.30 0.22 0.09 0.00 0.48 0.00 0.00 55.95 57.05 1js2 s SER 30 Cb 0.20 -0.26 0.64 0.00 0.10 0.00 0.00 66.02 66.70 1js2 s SER 30 CO 0.31 -2.74 1.62 -1.84 0.98 0.00 0.00 173.24 171.56 1js2 n GLU 31 N -3.75 3.51 -0.33 4.02 0.28 -1.26 -4.59 120.64 118.52 1js2 n GLU 31 Ca 0.15 -2.58 0.10 0.00 -0.16 0.00 0.00 57.16 54.67 1js2 n GLU 31 Cb 0.59 -2.09 0.27 0.00 1.43 0.00 0.00 31.44 31.65 1js2 n GLU 31 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 177.13 177.04 1js2 h ARG 32 N 2.49 0.72 -0.62 3.44 0.11 -1.92 0.26 114.38 118.86 1js2 h ARG 32 Ca 0.18 -0.04 -0.03 0.00 0.10 0.00 0.00 59.98 60.18 1js2 h ARG 32 Cb 2.01 -0.16 -0.03 0.00 1.11 0.00 0.00 29.97 32.90 1js2 h ARG 32 CO 0.58 0.47 0.26 0.28 0.10 0.00 0.00 179.97 181.67 1js2 h VAL 33 N 0.74 1.23 -0.14 0.08 2.07 -1.86 -1.49 116.25 116.88 1js2 h VAL 33 Ca 0.52 -0.69 -0.12 0.00 0.82 0.00 0.00 66.70 67.24 1js2 h VAL 33 Cb 0.75 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1js2 h VAL 33 CO -0.36 0.27 -0.43 0.00 0.02 0.00 0.00 177.57 177.07 1js2 h ALA 34 N 1.10 1.02 -0.12 1.67 0.00 -1.59 -3.05 119.26 118.30 1js2 h ALA 34 Ca 0.21 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.53 1js2 h ALA 34 Cb 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1js2 h ALA 34 CO -0.02 0.62 -0.57 0.00 0.00 0.00 0.00 179.25 179.27 1js2 h ALA 35 N 1.29 0.80 -6.50 0.00 0.00 -0.68 -3.47 119.26 110.69 1js2 h ALA 35 Ca 0.02 -0.52 -0.50 0.00 0.00 0.00 0.00 54.91 53.90 1js2 h ALA 35 Cb 0.87 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.51 1js2 h ALA 35 CO 0.07 0.70 -0.87 0.00 0.00 0.00 0.00 179.25 179.15 1js2 n ALA 36 N -2.49 -1.88 -1.75 0.00 0.00 -0.59 -4.90 120.51 108.90 1js2 n ALA 36 Ca -0.03 -0.21 -0.38 0.00 0.00 0.00 0.00 53.44 52.82 1js2 n ALA 36 Cb 0.61 -1.89 0.04 0.00 0.00 0.00 0.00 19.45 18.21 1js2 n ALA 36 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1js2 s ARG 37 N -6.58 3.19 0.50 0.00 1.81 -1.26 -4.98 118.95 111.62 1js2 s ARG 37 Ca 0.13 2.20 -0.17 0.00 -1.72 0.00 0.00 55.73 56.17 1js2 s ARG 37 Cb -0.07 -2.27 -0.08 0.00 -0.45 0.00 0.00 34.95 32.08 1js2 s ARG 37 CO 0.89 -1.14 0.98 -2.14 -0.68 0.00 0.00 175.30 173.20 1js2 s PRO 38 N -2.89 3.99 0.00 3.54 0.02 -1.26 -4.55 135.00 133.85 1js2 s PRO 38 Ca 0.71 0.97 0.00 0.00 0.02 0.00 0.00 61.00 62.70 1js2 s PRO 38 Cb -0.40 -2.15 0.00 0.00 0.02 0.00 0.00 34.50 31.98 1js2 s PRO 38 CO 0.47 -0.23 0.00 0.41 -0.33 0.00 0.00 177.00 177.32 1js2 n GLY 39 N -1.43 3.37 3.04 0.52 0.00 -1.26 -4.65 105.19 104.77 1js2 n GLY 39 Ca 0.07 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 45.21 1js2 n GLY 39 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1js2 s LEU 40 N 0.00 2.26 0.56 0.99 1.02 -1.26 -5.03 118.68 117.22 1js2 s LEU 40 Ca 0.00 -0.67 -0.20 0.00 0.02 0.00 0.00 54.13 53.28 1js2 s LEU 40 Cb 0.00 0.21 -0.05 0.00 0.02 0.00 0.00 46.19 46.36 1js2 s LEU 40 CO 0.00 -0.43 1.11 -0.81 0.02 0.00 0.00 176.35 176.24 1js2 n PRO 41 N 0.98 1.22 -0.35 1.29 -0.04 -1.26 -4.84 135.00 132.01 1js2 n PRO 41 Ca -0.20 0.46 0.15 0.00 -0.04 0.00 0.00 63.50 63.87 1js2 n PRO 41 Cb 0.58 -2.29 0.36 0.00 -0.04 0.00 0.00 33.50 32.10 1js2 n PRO 41 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1js2 h PRO 42 N 0.94 0.62 0.00 0.54 0.13 -1.89 -1.95 132.00 130.39 1js2 h PRO 42 Ca -0.49 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1js2 h PRO 42 Cb 1.34 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1js2 h PRO 42 CO 0.54 0.41 0.00 0.39 -0.23 0.00 0.00 178.00 179.11 1js2 n GLU 43 N -4.85 0.88 0.00 0.86 1.02 -1.26 -2.15 120.64 115.14 1js2 n GLU 43 Ca 0.25 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.43 1js2 n GLU 43 Cb 0.67 -1.03 0.03 0.00 -0.02 0.00 0.00 31.44 31.09 1js2 n GLU 43 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1js2 n GLU 44 N -0.53 0.67 -3.02 3.49 1.02 -0.73 -5.00 120.64 116.54 1js2 n GLU 44 Ca 0.01 -0.88 -0.40 0.00 -0.02 0.00 0.00 57.16 55.87 1js2 n GLU 44 Cb 0.01 -1.12 -0.05 0.00 -0.02 0.00 0.00 31.44 30.25 1js2 n GLU 44 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1js2 s GLN 45 N -0.81 4.30 0.22 3.49 -0.21 -0.91 -4.92 119.66 120.82 1js2 s GLN 45 Ca 0.09 0.82 -0.20 0.00 0.02 0.00 0.00 55.36 56.09 1js2 s GLN 45 Cb 0.07 -3.54 0.03 0.00 1.00 0.00 0.00 33.01 30.57 1js2 s GLN 45 CO 0.13 -0.18 0.62 -3.38 -2.12 0.00 0.00 175.29 170.35 1js2 s HIS 46 N 1.68 -0.22 0.43 0.91 -3.43 -1.26 -4.84 115.29 108.57 1js2 s HIS 46 Ca 0.34 -0.14 0.22 0.00 -0.80 0.00 0.00 55.06 54.69 1js2 s HIS 46 Cb -0.17 0.55 1.20 0.00 -1.43 0.00 0.00 32.58 32.73 1js2 s HIS 46 CO 0.13 -1.04 1.80 0.00 -2.00 0.00 0.00 174.74 173.64 1js2 h ALA 48 N 1.58 1.63 -0.05 0.00 0.00 -1.67 -2.05 119.26 118.69 1js2 h ALA 48 Ca 0.55 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.44 1js2 h ALA 48 Cb 1.57 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 1js2 h ALA 48 CO -0.21 -0.01 -0.30 0.27 0.00 0.00 0.00 179.25 179.01 1js2 n ASN 49 N -3.98 2.06 -4.88 0.00 0.23 -0.30 -5.03 115.26 103.35 1js2 n ASN 49 Ca -0.03 -3.64 -0.36 0.00 -0.53 0.00 0.00 54.58 50.02 1js2 n ASN 49 Cb 0.09 -0.52 -0.06 0.00 -2.08 0.00 0.00 39.78 37.22 1js2 n ASN 49 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1js2 h GLN 51 N 4.44 0.01 -0.01 0.00 5.75 0.56 -2.60 115.11 123.27 1js2 h GLN 51 Ca -0.52 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 57.98 1js2 h GLN 51 Cb 1.21 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.76 1js2 h GLN 51 CO 0.63 0.00 -0.41 1.19 -2.65 0.00 0.00 178.83 177.59 1js2 n PHE 52 N -4.38 0.00 -2.04 3.99 3.72 -1.26 -4.90 117.46 112.59 1js2 n PHE 52 Ca 0.10 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.08 1js2 n PHE 52 Cb 0.61 -0.15 -0.03 0.00 -0.94 0.00 0.00 39.48 38.97 1js2 n PHE 52 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 1js2 s MET 53 N -2.71 4.27 -0.36 -1.08 1.75 -0.98 -1.18 119.30 119.02 1js2 s MET 53 Ca 0.18 2.25 0.01 0.00 -1.25 0.00 0.00 55.69 56.88 1js2 s MET 53 Cb 0.18 -3.17 0.10 0.00 2.84 0.00 0.00 34.83 34.78 1js2 s MET 53 CO 0.61 -0.48 0.10 -1.14 -0.65 0.00 0.00 175.02 173.46 1js2 s GLN 54 N 0.57 1.79 0.57 4.11 0.74 0.10 -4.92 119.66 122.62 1js2 s GLN 54 Ca 0.64 -1.78 0.34 0.00 0.05 0.00 0.00 55.36 54.61 1js2 s GLN 54 Cb -0.41 -3.33 1.67 0.00 1.10 0.00 0.00 33.01 32.04 1js2 s GLN 54 CO 0.35 -0.95 2.12 0.00 -0.55 0.00 0.00 175.29 176.26 1js2 h ALA 55 N 7.82 1.12 -1.96 1.58 0.00 -1.93 -0.74 119.26 125.14 1js2 h ALA 55 Ca -0.10 -0.05 -0.71 0.00 0.00 0.00 0.00 54.91 54.05 1js2 h ALA 55 Cb 1.03 -0.01 -0.35 0.00 0.00 0.00 0.00 17.79 18.47 1js2 h ALA 55 CO 0.59 0.07 0.16 -0.25 0.00 0.00 0.00 179.25 179.82 1js2 n ASP 56 N -3.33 5.41 -4.44 0.00 8.00 -1.26 -4.85 116.55 116.08 1js2 n ASP 56 Ca -0.01 -3.51 -0.27 0.00 0.71 0.00 0.00 54.79 51.71 1js2 n ASP 56 Cb 0.22 -0.95 -0.12 0.00 -0.02 0.00 0.00 41.12 40.25 1js2 n ASP 56 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1js2 s ALA 57 N -3.02 2.57 0.14 2.24 0.00 -1.24 -5.02 121.76 117.43 1js2 s ALA 57 Ca 0.38 -1.64 -0.33 0.00 0.00 0.00 0.00 51.96 50.37 1js2 s ALA 57 Cb 0.14 -0.36 -0.13 0.00 0.00 0.00 0.00 23.12 22.77 1js2 s ALA 57 CO -0.00 0.43 1.66 0.00 0.00 0.00 0.00 175.76 177.85 1js2 n ALA 58 N 0.23 1.66 -0.57 0.00 0.00 -1.26 -1.50 120.51 119.07 1js2 n ALA 58 Ca -0.12 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1js2 n ALA 58 Cb 0.56 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.59 1js2 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1js2 n GLY 59 N 3.69 1.16 3.76 0.00 0.00 -1.26 -4.97 105.19 107.57 1js2 n GLY 59 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1js2 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1js2 s ALA 60 N -3.30 3.07 0.08 4.61 0.00 -0.56 -4.93 121.76 120.73 1js2 s ALA 60 Ca 0.00 1.16 0.01 0.00 0.00 0.00 0.00 51.96 53.13 1js2 s ALA 60 Cb 0.00 -3.47 -0.00 0.00 0.00 0.00 0.00 23.12 19.64 1js2 s ALA 60 CO 0.00 -0.90 0.03 0.25 0.00 0.00 0.00 175.76 175.15 1js2 n THR 61 N -0.32 0.00 1.30 0.00 -2.24 0.15 -4.97 114.28 108.20 1js2 n THR 61 Ca 0.06 -0.47 0.15 0.00 -2.27 0.00 0.00 64.05 61.52 1js2 n THR 61 Cb 0.45 0.18 0.72 0.00 -2.10 0.00 0.00 70.33 69.58 1js2 n THR 61 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1js2 n ASP 62 N -2.09 0.00 -0.11 3.42 5.68 -1.26 -3.38 116.55 118.81 1js2 n ASP 62 Ca -0.01 0.04 -0.14 0.00 -0.50 0.00 0.00 54.79 54.19 1js2 n ASP 62 Cb 0.12 -0.35 -0.12 0.00 -1.14 0.00 0.00 41.12 39.63 1js2 n ASP 62 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1js2 n GLU 63 N -1.35 0.74 -4.61 0.11 4.07 -1.26 -4.85 120.64 113.50 1js2 n GLU 63 Ca 0.12 0.08 -0.33 0.00 -0.06 0.00 0.00 57.16 56.97 1js2 n GLU 63 Cb 0.27 -1.47 -0.16 0.00 -0.06 0.00 0.00 31.44 30.02 1js2 n GLU 63 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 1js2 s TRP 64 N -2.46 2.74 0.18 4.31 0.52 -1.22 -1.75 118.94 121.27 1js2 s TRP 64 Ca -0.23 -1.12 0.00 0.00 0.02 0.00 0.00 56.10 54.77 1js2 s TRP 64 Cb 0.07 -1.86 -0.04 0.00 -1.15 0.00 0.00 33.47 30.49 1js2 s TRP 64 CO 0.62 -0.50 0.06 0.15 0.02 0.00 0.00 176.95 177.30 1js2 s LYS 65 N 0.78 1.13 0.85 4.98 1.02 -0.66 0.30 119.74 128.13 1js2 s LYS 65 Ca -0.07 -1.57 -0.13 0.00 0.02 0.00 0.00 55.97 54.23 1js2 s LYS 65 Cb -0.15 -0.00 0.11 0.00 -0.52 0.00 0.00 37.83 37.26 1js2 s LYS 65 CO -0.00 -0.25 1.21 0.20 -0.92 0.00 0.00 175.35 175.59 1js2 s GLY 66 N -3.16 1.65 -0.07 -3.33 0.00 -0.28 -0.16 107.32 101.96 1js2 s GLY 66 Ca 0.29 -0.82 -0.03 0.00 0.00 0.00 0.00 44.72 44.17 1js2 s GLY 66 CO 0.07 -0.26 0.16 0.00 0.00 0.00 0.00 173.10 173.07 1js2 h GLN 68 N 7.24 0.00 -0.02 0.00 4.20 -1.50 -2.08 115.11 122.96 1js2 h GLN 68 Ca -0.43 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.28 1js2 h GLN 68 Cb 1.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.92 1js2 h GLN 68 CO 0.42 0.00 -0.26 1.28 -0.67 0.00 0.00 178.83 179.59 1js2 n LEU 69 N -2.32 2.02 -3.42 1.46 4.77 -1.26 -4.49 117.00 113.76 1js2 n LEU 69 Ca -0.00 -0.69 -0.26 0.00 -0.03 0.00 0.00 56.01 55.02 1js2 n LEU 69 Cb 0.12 -0.02 -0.08 0.00 -2.33 0.00 0.00 43.42 41.10 1js2 n LEU 69 CO 0.15 0.36 -0.06 0.49 -1.33 0.00 0.00 177.39 177.00 1js2 n PHE 70 N 0.22 2.30 -1.66 -1.77 3.72 -0.78 -5.11 117.46 114.39 1js2 n PHE 70 Ca 0.12 -3.98 -0.45 0.00 -0.05 0.00 0.00 57.45 53.10 1js2 n PHE 70 Cb 0.47 -0.46 -0.03 0.00 -0.94 0.00 0.00 39.48 38.52 1js2 n PHE 70 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1js2 n PRO 71 N 1.26 1.94 -1.18 -1.08 -0.04 -1.26 -2.07 135.00 132.56 1js2 n PRO 71 Ca 0.26 0.69 -0.06 0.00 -0.04 0.00 0.00 63.50 64.35 1js2 n PRO 71 Cb 0.44 -2.32 -0.03 0.00 -0.04 0.00 0.00 33.50 31.56 1js2 n PRO 71 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1js2 n GLY 72 N 1.99 0.78 2.20 0.55 0.00 -1.26 -4.99 105.19 104.46 1js2 n GLY 72 Ca 0.11 -0.27 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 1js2 n GLY 72 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1js2 n LYS 73 N -1.82 1.08 -3.78 1.61 4.76 -0.88 -4.94 118.16 114.19 1js2 n LYS 73 Ca -0.06 -2.24 -0.14 0.00 -2.87 0.00 0.00 58.31 53.00 1js2 n LYS 73 Cb 0.33 0.78 -0.15 0.00 -1.84 0.00 0.00 35.03 34.15 1js2 n LYS 73 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1js2 s LEU 74 N 0.00 1.12 0.38 -0.35 1.43 -0.76 -4.56 118.68 115.95 1js2 s LEU 74 Ca 0.04 0.15 0.08 0.00 -1.03 0.00 0.00 54.13 53.37 1js2 s LEU 74 Cb 0.00 0.16 -0.03 0.00 0.03 0.00 0.00 46.19 46.35 1js2 s LEU 74 CO 0.03 -0.11 0.32 0.27 0.23 0.00 0.00 176.35 177.09 1js2 s ILE 75 N 0.85 2.93 -0.04 -0.59 -5.25 0.77 -0.57 121.20 119.30 1js2 s ILE 75 Ca -0.07 -1.41 -0.16 0.00 -0.99 0.00 0.00 60.65 58.02 1js2 s ILE 75 Cb -0.09 -3.05 -0.05 0.00 2.95 0.00 0.00 42.46 42.21 1js2 s ILE 75 CO -0.03 -0.07 0.43 0.21 -1.79 0.00 0.00 174.94 173.69 1js2 s ASN 76 N -4.05 6.77 0.62 4.36 3.84 -1.26 -1.66 114.94 123.56 1js2 s ASN 76 Ca 0.45 0.91 0.31 0.00 0.21 0.00 0.00 52.86 54.74 1js2 s ASN 76 Cb -0.03 -2.27 1.68 0.00 -0.55 0.00 0.00 41.25 40.08 1js2 s ASN 76 CO 0.27 0.21 2.02 -0.37 -2.79 0.00 0.00 177.10 176.43 1js2 h VAL 77 N 4.06 0.24 -0.44 -5.21 -1.51 -1.67 0.20 116.25 111.92 1js2 h VAL 77 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1js2 h VAL 77 Cb 1.20 0.74 0.00 0.00 -2.13 0.00 0.00 31.29 31.11 1js2 h VAL 77 CO 0.67 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 177.60 1js2 n ASN 78 N -3.40 2.92 -2.88 4.19 3.02 -1.26 -1.92 115.26 115.93 1js2 n ASN 78 Ca 0.01 -1.94 -0.11 0.00 -0.03 0.00 0.00 54.58 52.52 1js2 n ASN 78 Cb 0.40 -0.29 0.07 0.00 -0.61 0.00 0.00 39.78 39.35 1js2 n ASN 78 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1js2 n GLY 79 N 1.39 -0.37 3.56 7.41 0.00 0.71 -0.09 105.19 117.80 1js2 n GLY 79 Ca 0.19 -1.82 -0.15 0.00 0.00 0.00 0.00 46.02 44.24 1js2 n GLY 79 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1js2 s TRP 80 N -1.68 -0.58 0.15 1.61 -0.00 -0.72 -0.64 118.94 117.07 1js2 s TRP 80 Ca 0.29 1.10 -0.02 0.00 -0.00 0.00 0.00 56.10 57.46 1js2 s TRP 80 Cb -0.01 0.40 -0.04 0.00 -0.00 0.00 0.00 33.47 33.82 1js2 s TRP 80 CO 0.20 -0.48 0.10 -1.54 -0.00 0.00 0.00 176.95 175.22 1js2 s SER 81 N -0.86 0.25 0.00 5.86 1.04 -1.26 -0.94 113.70 117.78 1js2 s SER 81 Ca -0.06 -1.19 0.12 0.00 0.48 0.00 0.00 55.95 55.31 1js2 s SER 81 Cb -0.01 0.33 0.74 0.00 0.10 0.00 0.00 66.02 67.18 1js2 s SER 81 CO 0.05 -0.77 1.18 0.00 0.98 0.00 0.00 173.24 174.69 1js2 n ALA 82 N -0.14 2.10 -0.25 5.32 0.00 -0.18 -1.73 120.51 125.63 1js2 n ALA 82 Ca -0.05 -0.08 0.10 0.00 0.00 0.00 0.00 53.44 53.42 1js2 n ALA 82 Cb 0.64 -1.20 0.27 0.00 0.00 0.00 0.00 19.45 19.16 1js2 n ALA 82 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1js2 n SER 83 N -0.87 3.65 -4.65 0.00 7.64 -1.26 -4.99 113.62 113.13 1js2 n SER 83 Ca 0.09 -1.99 -0.52 0.00 1.01 0.00 0.00 58.87 57.46 1js2 n SER 83 Cb 0.04 -0.40 -0.06 0.00 -1.01 0.00 0.00 64.21 62.78 1js2 n SER 83 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 1js2 n TRP 84 N 1.37 1.91 -3.82 1.43 -0.00 -0.71 -4.96 117.44 112.66 1js2 n TRP 84 Ca 0.21 0.46 -0.18 0.00 -0.00 0.00 0.00 57.50 57.99 1js2 n TRP 84 Cb 0.57 -2.45 -0.17 0.00 -0.00 0.00 0.00 31.31 29.27 1js2 n TRP 84 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1js2 s THR 85 N 1.99 0.09 0.18 5.87 2.01 -1.26 -4.91 115.64 119.61 1js2 s THR 85 Ca 0.89 0.20 -0.33 0.00 0.31 0.00 0.00 61.69 62.75 1js2 s THR 85 Cb -0.91 -0.24 -0.14 0.00 0.01 0.00 0.00 72.50 71.22 1js2 s THR 85 CO 0.52 0.16 1.45 -0.11 -0.69 0.00 0.00 174.62 175.95 1js2 n LEU 86 N 4.54 2.75 -4.72 4.42 7.94 -1.26 0.11 117.00 130.77 1js2 n LEU 86 Ca -0.19 1.11 -0.42 0.00 -1.11 0.00 0.00 56.01 55.40 1js2 n LEU 86 Cb 0.50 -1.37 -0.03 0.00 0.53 0.00 0.00 43.42 43.05 1js2 n LEU 86 CO 0.17 -0.55 1.14 -1.59 -1.11 0.00 0.00 177.39 175.45 1js2 s LYS 87 N 0.31 4.27 -1.00 1.96 -2.85 -1.13 -4.31 119.74 116.99 1js2 s LYS 87 Ca 0.76 2.23 -0.23 0.00 -1.00 0.00 0.00 55.97 57.72 1js2 s LYS 87 Cb -0.72 -3.19 0.04 0.00 -2.06 0.00 0.00 37.83 31.90 1js2 s LYS 87 CO 0.44 -0.51 1.50 0.00 0.10 0.00 0.00 175.35 176.89 1js2 s ALA 88 N 0.95 2.60 -2.00 0.59 0.00 -1.26 -4.91 121.76 117.73 1js2 s ALA 88 Ca 0.66 -2.15 0.10 0.00 0.00 0.00 0.00 51.96 50.57 1js2 s ALA 88 Cb -0.41 -4.53 0.61 0.00 0.00 0.00 0.00 23.12 18.80 1js2 s ALA 88 CO 0.32 -3.74 1.06 0.41 0.00 0.00 0.00 175.76 173.81