#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jd2 s PHE -8 N 0.00 3.20 -0.46 3.69 5.36 -1.26 -4.99 117.98 123.52 1jd2 s PHE -8 Ca 0.00 1.26 -0.04 0.00 -0.96 0.00 0.00 56.93 57.18 1jd2 s PHE -8 Cb 0.00 -3.39 0.12 0.00 -0.34 0.00 0.00 43.02 39.41 1jd2 s PHE -8 CO 0.00 -1.16 0.28 1.21 -1.46 0.00 0.00 175.22 174.09 1jd2 s ASN -7 N 1.47 5.36 0.00 6.13 3.04 -1.26 -4.98 114.94 124.71 1jd2 s ASN -7 Ca 0.54 -2.16 0.00 0.00 0.04 0.00 0.00 52.86 51.28 1jd2 s ASN -7 Cb -0.23 -1.88 0.00 0.00 -1.54 0.00 0.00 41.25 37.61 1jd2 s ASN -7 CO 0.20 -0.54 0.26 -0.81 -3.04 0.00 0.00 177.10 173.16 1jd2 n PRO -6 N 4.46 0.00 -4.50 0.43 -0.04 -1.26 -4.73 135.00 129.35 1jd2 n PRO -6 Ca -0.01 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.21 1jd2 n PRO -6 Cb 0.41 -1.29 -0.11 0.00 -0.04 0.00 0.00 33.50 32.47 1jd2 n PRO -6 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1jd2 s TYR -5 N -1.83 2.20 0.00 0.54 1.51 -1.26 -5.08 117.35 113.43 1jd2 s TYR -5 Ca 0.00 -0.69 0.00 0.00 -1.01 0.00 0.00 57.07 55.37 1jd2 s TYR -5 Cb 0.00 -1.36 0.00 0.00 -0.11 0.00 0.00 41.96 40.49 1jd2 s TYR -5 CO 0.00 0.35 0.00 0.41 -1.11 0.00 0.00 175.55 175.20 1jd2 n GLY -4 N -0.74 3.30 3.13 0.71 0.00 -1.26 -5.15 105.19 105.18 1jd2 n GLY -4 Ca -0.05 -1.35 -0.08 0.00 0.00 0.00 0.00 46.02 44.54 1jd2 n GLY -4 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1jd2 s ASP -3 N -0.66 -0.10 -0.11 1.61 3.68 -1.26 -4.51 116.67 115.32 1jd2 s ASP -3 Ca 0.00 0.70 0.17 0.00 2.13 0.00 0.00 52.55 55.56 1jd2 s ASP -3 Cb 0.00 1.28 0.67 0.00 -1.45 0.00 0.00 42.92 43.42 1jd2 s ASP -3 CO 0.00 -0.26 1.59 0.59 0.13 0.00 0.00 175.17 177.22 1jd2 n ASN -2 N 5.38 4.57 0.00 -0.34 4.13 -0.85 -4.54 115.26 123.61 1jd2 n ASN -2 Ca -0.06 -2.48 0.00 0.00 1.68 0.00 0.00 54.58 53.71 1jd2 n ASN -2 Cb 0.50 -0.55 0.00 0.00 -1.54 0.00 0.00 39.78 38.19 1jd2 n ASN -2 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1jd2 n GLY -1 N 0.90 3.66 0.33 7.41 0.00 -1.25 -3.29 105.19 112.95 1jd2 n GLY -1 Ca 0.24 0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.34 1jd2 n GLY -1 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jd2 n GLY 1 N 0.00 -2.12 3.53 -0.02 0.00 -1.26 -4.27 105.19 101.06 1jd2 n GLY 1 Ca 0.00 -1.41 -0.16 0.00 0.00 0.00 0.00 46.02 44.45 1jd2 n GLY 1 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jd2 s THR 2 N -2.31 0.00 0.19 2.61 2.01 -1.26 -1.35 115.64 115.53 1jd2 s THR 2 Ca 0.00 0.00 -0.02 0.00 0.31 0.00 0.00 61.69 61.98 1jd2 s THR 2 Cb 0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 1jd2 s THR 2 CO 0.00 0.00 0.15 0.27 -0.69 0.00 0.00 174.62 174.35 1jd2 s ILE 3 N -1.23 0.02 -0.26 1.82 -4.36 0.11 -1.89 121.20 115.41 1jd2 s ILE 3 Ca -0.09 -1.91 -0.22 0.00 -0.26 0.00 0.00 60.65 58.18 1jd2 s ILE 3 Cb -0.00 -2.36 0.07 0.00 1.25 0.00 0.00 42.46 41.42 1jd2 s ILE 3 CO 0.08 -0.10 0.68 -0.22 0.24 0.00 0.00 174.94 175.62 1jd2 s LEU 4 N -3.12 -0.69 -0.03 0.37 2.96 0.22 -0.46 118.68 117.93 1jd2 s LEU 4 Ca 0.34 1.41 0.03 0.00 -0.22 0.00 0.00 54.13 55.68 1jd2 s LEU 4 Cb 0.06 2.34 0.00 0.00 0.50 0.00 0.00 46.19 49.10 1jd2 s LEU 4 CO 0.09 -0.24 -0.10 -0.83 -1.32 0.00 0.00 176.35 173.95 1jd2 s GLY 5 N 0.69 0.57 -0.02 7.98 0.00 0.18 -0.11 107.32 116.61 1jd2 s GLY 5 Ca -0.03 -0.39 -0.03 0.00 0.00 0.00 0.00 44.72 44.28 1jd2 s GLY 5 CO -0.04 -0.15 0.08 -0.42 0.00 0.00 0.00 173.10 172.57 1jd2 s ILE 6 N 0.13 0.02 -0.10 0.90 1.01 -0.86 -0.66 121.20 121.63 1jd2 s ILE 6 Ca -0.02 -0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.47 1jd2 s ILE 6 Cb -0.08 -0.19 -0.01 0.00 0.01 0.00 0.00 42.46 42.19 1jd2 s ILE 6 CO 0.01 -0.10 -0.20 0.00 0.00 0.00 0.00 174.94 174.65 1jd2 s ALA 7 N -0.29 2.36 0.48 9.38 0.00 -0.97 0.38 121.76 133.10 1jd2 s ALA 7 Ca -0.04 -0.95 0.07 0.00 0.00 0.00 0.00 51.96 51.04 1jd2 s ALA 7 Cb -0.02 -0.95 0.07 0.00 0.00 0.00 0.00 23.12 22.21 1jd2 s ALA 7 CO 0.00 0.31 0.54 0.41 0.00 0.00 0.00 175.76 177.02 1jd2 n GLY 8 N 3.38 2.29 0.37 0.00 0.00 0.54 -4.95 105.19 106.83 1jd2 n GLY 8 Ca -0.18 -2.24 0.14 0.00 0.00 0.00 0.00 46.02 43.74 1jd2 n GLY 8 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1jd2 h GLU 9 N 0.00 0.65 -0.75 1.61 4.81 -1.92 -3.27 114.58 115.70 1jd2 h GLU 9 Ca -0.25 -0.04 -0.33 0.00 -0.13 0.00 0.00 59.36 58.61 1jd2 h GLU 9 Cb 1.06 -0.15 -0.28 0.00 0.63 0.00 0.00 28.75 30.02 1jd2 h GLU 9 CO 0.38 0.43 -0.80 -0.40 -0.73 0.00 0.00 179.01 177.89 1jd2 n ASP 10 N -4.64 -0.49 0.00 1.04 5.75 -1.26 -3.52 116.55 113.43 1jd2 n ASP 10 Ca 0.21 -2.97 0.00 0.00 -0.01 0.00 0.00 54.79 52.02 1jd2 n ASP 10 Cb 0.58 0.45 0.00 0.00 -1.03 0.00 0.00 41.12 41.12 1jd2 n ASP 10 CO 0.00 0.00 0.00 2.22 -0.11 0.00 0.00 177.20 179.31 1jd2 n PHE 11 N -0.01 0.00 -3.55 2.11 1.16 -1.23 -4.73 117.46 111.21 1jd2 n PHE 11 Ca 0.09 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.56 1jd2 n PHE 11 Cb 0.76 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.60 1jd2 n PHE 11 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1jd2 s ALA 12 N -2.00 -1.31 0.13 1.98 0.00 -1.14 -0.34 121.76 119.09 1jd2 s ALA 12 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.16 1jd2 s ALA 12 Cb 0.00 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 1jd2 s ALA 12 CO 0.00 -0.76 0.01 0.14 0.00 0.00 0.00 175.76 175.15 1jd2 s VAL 13 N -3.79 0.40 -0.24 0.00 -7.23 0.16 -1.79 120.40 107.91 1jd2 s VAL 13 Ca 0.03 -1.92 -0.07 0.00 -1.81 0.00 0.00 61.98 58.21 1jd2 s VAL 13 Cb -0.01 -1.95 0.12 0.00 0.56 0.00 0.00 36.38 35.10 1jd2 s VAL 13 CO -0.10 -0.60 0.49 -0.22 -0.31 0.00 0.00 175.10 174.36 1jd2 s LEU 14 N -3.07 -0.83 0.23 1.32 1.98 -0.60 -2.03 118.68 115.67 1jd2 s LEU 14 Ca 0.20 1.01 0.05 0.00 -2.89 0.00 0.00 54.13 52.51 1jd2 s LEU 14 Cb 0.07 1.62 -0.05 0.00 0.66 0.00 0.00 46.19 48.49 1jd2 s LEU 14 CO -0.00 -0.24 -0.06 0.00 -1.89 0.00 0.00 176.35 174.16 1jd2 s ALA 15 N 2.70 1.95 0.02 5.97 0.00 0.85 -1.47 121.76 131.78 1jd2 s ALA 15 Ca 0.01 -1.75 -0.28 0.00 0.00 0.00 0.00 51.96 49.94 1jd2 s ALA 15 Cb -0.13 0.25 0.08 0.00 0.00 0.00 0.00 23.12 23.32 1jd2 s ALA 15 CO -0.15 -0.13 0.72 0.20 0.00 0.00 0.00 175.76 176.40 1jd2 s GLY 16 N -3.33 -0.54 0.95 0.00 0.00 -1.14 0.69 107.32 103.95 1jd2 s GLY 16 Ca 0.26 1.07 -0.12 0.00 0.00 0.00 0.00 44.72 45.93 1jd2 s GLY 16 CO 0.08 0.60 1.10 0.51 0.00 0.00 0.00 173.10 175.39 1jd2 s ASP 17 N -1.91 3.03 -0.34 1.64 3.84 -0.79 -2.72 116.67 119.43 1jd2 s ASP 17 Ca -0.04 1.26 0.07 0.00 -0.00 0.00 0.00 52.55 53.84 1jd2 s ASP 17 Cb -0.01 -1.92 0.48 0.00 -1.38 0.00 0.00 42.92 40.09 1jd2 s ASP 17 CO -0.02 -2.89 1.45 0.41 -0.00 0.00 0.00 175.17 174.13 1jd2 n THR 18 N -4.02 2.67 -4.20 2.11 -1.04 0.26 -4.79 114.28 105.26 1jd2 n THR 18 Ca 0.06 -3.21 -0.29 0.00 -2.04 0.00 0.00 64.05 58.56 1jd2 n THR 18 Cb 0.57 -0.64 -0.09 0.00 -1.82 0.00 0.00 70.33 68.35 1jd2 n THR 18 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 1jd2 s ARG 19 N -3.42 2.27 -0.12 -2.82 3.52 -1.26 -2.38 118.95 114.73 1jd2 s ARG 19 Ca 0.49 -0.99 -0.04 0.00 -0.13 0.00 0.00 55.73 55.06 1jd2 s ARG 19 Cb 0.42 -2.37 0.05 0.00 -1.56 0.00 0.00 34.95 31.49 1jd2 s ARG 19 CO 0.00 0.51 0.10 1.21 -0.81 0.00 0.00 175.30 176.31 1jd2 s ASN 20 N -2.35 1.72 0.49 -2.12 3.84 -0.52 -4.53 114.94 111.48 1jd2 s ASN 20 Ca 0.23 -0.27 0.04 0.00 0.21 0.00 0.00 52.86 53.08 1jd2 s ASN 20 Cb -0.11 -0.10 -0.01 0.00 -0.55 0.00 0.00 41.25 40.48 1jd2 s ASN 20 CO 0.16 -0.31 0.18 0.27 -2.79 0.00 0.00 177.10 174.61 1jd2 s ILE 21 N 2.18 1.66 -0.24 -5.21 -5.25 -1.21 0.13 121.20 113.26 1jd2 s ILE 21 Ca 0.04 -1.75 -0.05 0.00 -0.99 0.00 0.00 60.65 57.90 1jd2 s ILE 21 Cb -0.14 -2.41 0.13 0.00 2.95 0.00 0.00 42.46 42.99 1jd2 s ILE 21 CO -0.07 0.00 0.46 -0.89 -1.79 0.00 0.00 174.94 172.65 1jd2 s THR 22 N -2.76 -0.73 0.00 8.37 2.01 -0.54 -4.27 115.64 117.71 1jd2 s THR 22 Ca 0.26 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.29 1jd2 s THR 22 Cb 0.01 -0.81 0.00 0.00 0.01 0.00 0.00 72.50 71.71 1jd2 s THR 22 CO 0.15 -0.02 0.00 0.47 -0.69 0.00 0.00 174.62 174.53 1jd2 n ASP 23 N 5.39 0.00 -0.00 3.53 10.43 -1.26 -0.46 116.55 134.18 1jd2 n ASP 23 Ca -0.06 0.00 0.08 0.00 2.57 0.00 0.00 54.79 57.38 1jd2 n ASP 23 Cb 0.50 0.00 -0.11 0.00 1.84 0.00 0.00 41.12 43.35 1jd2 n ASP 23 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1jd2 n TYR 24 N 5.55 0.00 -2.19 1.24 4.02 -1.26 -4.98 117.16 119.54 1jd2 n TYR 24 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.60 1jd2 n TYR 24 Cb 0.00 -0.12 0.02 0.00 -0.02 0.00 0.00 39.34 39.22 1jd2 n TYR 24 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1jd2 s SER 25 N -3.04 5.90 -0.13 7.72 0.01 0.39 -5.06 113.70 119.49 1jd2 s SER 25 Ca 0.03 1.06 -0.03 0.00 1.31 0.00 0.00 55.95 58.31 1jd2 s SER 25 Cb 0.13 -2.10 -0.03 0.00 0.21 0.00 0.00 66.02 64.23 1jd2 s SER 25 CO 0.72 -0.95 -0.03 -0.63 0.41 0.00 0.00 173.24 172.75 1jd2 s ILE 26 N -3.07 3.98 -0.20 1.44 1.01 -1.26 -1.47 121.20 121.64 1jd2 s ILE 26 Ca 0.54 -0.34 -0.14 0.00 0.00 0.00 0.00 60.65 60.71 1jd2 s ILE 26 Cb -0.11 -2.72 -0.20 0.00 0.01 0.00 0.00 42.46 39.44 1jd2 s ILE 26 CO 0.49 0.53 0.14 0.59 0.00 0.00 0.00 174.94 176.69 1jd2 n ASN 27 N 3.08 1.97 -3.73 3.58 3.02 0.34 -4.94 115.26 118.59 1jd2 n ASN 27 Ca -0.18 0.30 -0.13 0.00 -0.03 0.00 0.00 54.58 54.54 1jd2 n ASN 27 Cb 0.53 -0.87 -0.10 0.00 -0.61 0.00 0.00 39.78 38.73 1jd2 n ASN 27 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1jd2 s SER 28 N -6.98 -0.44 0.00 6.41 0.15 -0.73 -4.98 113.70 107.13 1jd2 s SER 28 Ca -0.29 0.83 0.27 0.00 0.70 0.00 0.00 55.95 57.45 1jd2 s SER 28 Cb 0.08 0.81 0.80 0.00 -1.71 0.00 0.00 66.02 65.99 1jd2 s SER 28 CO 0.63 -0.15 1.62 0.54 1.20 0.00 0.00 173.24 177.08 1jd2 n ARG 29 N 3.15 0.08 -3.22 5.44 1.74 -1.26 -1.44 116.66 121.15 1jd2 n ARG 29 Ca -0.15 -0.03 -0.17 0.00 -0.77 0.00 0.00 57.85 56.73 1jd2 n ARG 29 Cb 0.57 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.45 1jd2 n ARG 29 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1jd2 s TYR 30 N -2.94 -0.20 -0.32 -1.55 5.04 -1.00 -4.43 117.35 111.95 1jd2 s TYR 30 Ca 0.14 -1.25 -0.01 0.00 -2.44 0.00 0.00 57.07 53.51 1jd2 s TYR 30 Cb 0.18 -0.38 0.11 0.00 0.35 0.00 0.00 41.96 42.22 1jd2 s TYR 30 CO 0.62 -1.01 0.13 -2.00 -1.34 0.00 0.00 175.55 171.96 1jd2 s GLU 31 N 0.83 0.59 0.65 4.97 2.56 -1.19 -5.06 118.70 122.05 1jd2 s GLU 31 Ca 0.26 -1.02 -0.17 0.00 0.00 0.00 0.00 54.97 54.03 1jd2 s GLU 31 Cb -0.05 -1.70 -0.04 0.00 2.00 0.00 0.00 34.13 34.33 1jd2 s GLU 31 CO -0.09 -1.04 0.75 -2.30 -0.56 0.00 0.00 175.26 172.03 1jd2 n PRO 32 N 4.77 0.58 -0.58 4.30 -0.02 -1.26 -4.71 135.00 138.07 1jd2 n PRO 32 Ca -0.01 0.24 -0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1jd2 n PRO 32 Cb 0.41 -1.99 -0.00 0.00 -0.02 0.00 0.00 33.50 31.90 1jd2 n PRO 32 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1jd2 n LYS 33 N -0.90 0.00 -3.96 -0.52 2.85 -1.26 -5.00 118.16 109.37 1jd2 n LYS 33 Ca 0.12 -0.65 -0.29 0.00 -1.05 0.00 0.00 58.31 56.44 1jd2 n LYS 33 Cb 0.48 -0.22 -0.16 0.00 -0.65 0.00 0.00 35.03 34.48 1jd2 n LYS 33 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1jd2 s VAL 34 N 0.00 1.40 0.35 0.58 1.01 -1.26 -4.16 120.40 118.32 1jd2 s VAL 34 Ca 0.02 -0.76 0.09 0.00 0.00 0.00 0.00 61.98 61.33 1jd2 s VAL 34 Cb 0.02 -1.48 -0.06 0.00 0.00 0.00 0.00 36.38 34.87 1jd2 s VAL 34 CO -0.01 0.22 0.02 -0.36 0.00 0.00 0.00 175.10 174.97 1jd2 s PHE 35 N 1.52 2.55 -0.23 5.22 0.08 -0.14 -4.92 117.98 122.04 1jd2 s PHE 35 Ca 0.01 -0.46 -0.07 0.00 0.12 0.00 0.00 56.93 56.53 1jd2 s PHE 35 Cb -0.15 -1.53 -0.03 0.00 -0.57 0.00 0.00 43.02 40.74 1jd2 s PHE 35 CO -0.08 0.46 0.05 0.34 -0.10 0.00 0.00 175.22 175.89 1jd2 s ASP 36 N -3.73 5.11 -0.01 1.36 3.68 -1.26 -2.01 116.67 119.81 1jd2 s ASP 36 Ca 0.35 -0.18 0.12 0.00 2.13 0.00 0.00 52.55 54.97 1jd2 s ASP 36 Cb 0.01 -1.91 0.35 0.00 -1.45 0.00 0.00 42.92 39.93 1jd2 s ASP 36 CO 0.19 0.00 1.30 0.00 0.13 0.00 0.00 175.17 176.79 1jd2 n GLY 38 N 0.62 0.16 2.13 0.00 0.00 -1.26 -4.88 105.19 101.96 1jd2 n GLY 38 Ca 0.13 -1.87 -0.11 0.00 0.00 0.00 0.00 46.02 44.18 1jd2 n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jd2 n ASP 39 N -0.64 -3.18 -2.83 1.61 9.92 -1.26 -2.00 116.55 118.17 1jd2 n ASP 39 Ca 0.00 0.25 -0.12 0.00 -0.53 0.00 0.00 54.79 54.39 1jd2 n ASP 39 Cb 0.00 -2.88 0.06 0.00 -0.64 0.00 0.00 41.12 37.66 1jd2 n ASP 39 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1jd2 n ASN 40 N -0.99 -2.99 -3.74 -2.24 4.05 -1.26 -4.83 115.26 103.25 1jd2 n ASN 40 Ca -0.12 -0.49 -0.20 0.00 0.45 0.00 0.00 54.58 54.23 1jd2 n ASN 40 Cb 0.47 -4.01 -0.17 0.00 1.23 0.00 0.00 39.78 37.30 1jd2 n ASN 40 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1jd2 s ILE 41 N -3.28 0.11 0.03 -1.44 1.01 -0.85 -4.46 121.20 112.32 1jd2 s ILE 41 Ca 0.10 0.24 0.03 0.00 0.00 0.00 0.00 60.65 61.02 1jd2 s ILE 41 Cb -0.01 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 42.13 1jd2 s ILE 41 CO 0.55 0.19 -0.03 0.68 0.00 0.00 0.00 174.94 176.33 1jd2 s VAL 42 N 1.75 3.90 -0.01 2.92 -7.23 -0.87 -1.50 120.40 119.36 1jd2 s VAL 42 Ca 0.00 -0.79 -0.28 0.00 -1.81 0.00 0.00 61.98 59.11 1jd2 s VAL 42 Cb -0.13 -2.76 0.06 0.00 0.56 0.00 0.00 36.38 34.12 1jd2 s VAL 42 CO -0.03 0.31 0.62 -0.32 -0.31 0.00 0.00 175.10 175.37 1jd2 s MET 43 N -1.72 1.05 -0.02 4.82 0.00 -0.85 -0.75 119.30 121.83 1jd2 s MET 43 Ca 0.20 0.08 -0.05 0.00 0.00 0.00 0.00 55.69 55.92 1jd2 s MET 43 Cb -0.11 0.49 0.00 0.00 0.00 0.00 0.00 34.83 35.21 1jd2 s MET 43 CO 0.11 -0.35 0.11 0.45 0.00 0.00 0.00 175.02 175.35 1jd2 s SER 44 N -1.48 -0.03 -0.40 1.11 0.15 0.05 -0.97 113.70 112.14 1jd2 s SER 44 Ca -0.09 -0.01 0.03 0.00 0.70 0.00 0.00 55.95 56.58 1jd2 s SER 44 Cb -0.01 0.22 0.11 0.00 -1.71 0.00 0.00 66.02 64.64 1jd2 s SER 44 CO 0.05 -0.20 0.13 0.00 1.20 0.00 0.00 173.24 174.42 1jd2 s ALA 45 N -0.68 2.83 -0.20 5.45 0.00 -1.26 -1.37 121.76 126.53 1jd2 s ALA 45 Ca -0.08 -2.67 -0.11 0.00 0.00 0.00 0.00 51.96 49.10 1jd2 s ALA 45 Cb -0.05 -1.98 -0.05 0.00 0.00 0.00 0.00 23.12 21.04 1jd2 s ALA 45 CO 0.01 -1.81 0.16 1.21 0.00 0.00 0.00 175.76 175.33 1jd2 s ASN 46 N 0.58 6.25 0.00 0.00 3.84 -0.43 -4.52 114.94 120.65 1jd2 s ASN 46 Ca 0.13 0.28 0.00 0.00 0.21 0.00 0.00 52.86 53.48 1jd2 s ASN 46 Cb -0.21 -2.11 0.00 0.00 -0.55 0.00 0.00 41.25 38.38 1jd2 s ASN 46 CO -0.07 0.16 0.00 0.61 -2.79 0.00 0.00 177.10 175.01 1jd2 n GLY 47 N 3.54 -0.96 3.54 1.21 0.00 -1.26 -0.26 105.19 111.01 1jd2 n GLY 47 Ca -0.15 0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1jd2 n GLY 47 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1jd2 s PHE 48 N 0.00 3.11 0.09 1.61 5.36 -0.45 -2.00 117.98 125.71 1jd2 s PHE 48 Ca 0.00 0.13 -0.20 0.00 -0.96 0.00 0.00 56.93 55.90 1jd2 s PHE 48 Cb 0.00 -3.21 -0.05 0.00 -0.34 0.00 0.00 43.02 39.42 1jd2 s PHE 48 CO 0.00 -0.73 1.33 0.00 -1.46 0.00 0.00 175.22 174.36 1jd2 h ALA 49 N 8.66 -0.44 -0.50 11.12 0.00 -1.89 0.10 119.26 136.31 1jd2 h ALA 49 Ca -0.26 0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.74 1jd2 h ALA 49 Cb 1.11 1.13 -0.08 0.00 0.00 0.00 0.00 17.79 19.94 1jd2 h ALA 49 CO 0.85 -0.66 -0.49 0.00 0.00 0.00 0.00 179.25 178.95 1jd2 h ALA 50 N -0.26 -0.65 -0.40 0.00 0.00 -1.98 0.70 119.26 116.66 1jd2 h ALA 50 Ca 0.08 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.13 1jd2 h ALA 50 Cb 0.30 1.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 1jd2 h ALA 50 CO -0.49 -0.91 0.30 -0.44 0.00 0.00 0.00 179.25 177.71 1jd2 h ASP 51 N -0.24 0.00 0.10 0.00 3.45 -1.77 -0.29 116.42 117.66 1jd2 h ASP 51 Ca 0.08 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.54 1jd2 h ASP 51 Cb 0.46 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1jd2 h ASP 51 CO -0.60 0.00 -0.05 1.23 -1.57 0.00 0.00 179.24 178.26 1jd2 h GLY 52 N 0.00 -0.13 0.74 2.75 0.00 0.29 -2.76 103.07 103.96 1jd2 h GLY 52 Ca 0.19 0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.61 1jd2 h GLY 52 CO -0.00 -0.05 0.25 -0.55 0.00 0.00 0.00 176.54 176.19 1jd2 h ASP 53 N -0.54 0.36 0.68 0.19 3.45 0.72 -1.99 116.42 119.29 1jd2 h ASP 53 Ca -0.01 0.03 -0.03 0.00 0.43 0.00 0.00 57.03 57.44 1jd2 h ASP 53 Cb 0.45 -0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 39.17 1jd2 h ASP 53 CO 0.02 0.25 -0.46 0.00 -1.57 0.00 0.00 179.24 177.48 1jd2 h ALA 54 N 1.26 -1.23 -0.79 3.45 0.00 -1.35 -0.71 119.26 119.90 1jd2 h ALA 54 Ca 0.21 -0.22 0.18 0.00 0.00 0.00 0.00 54.91 55.09 1jd2 h ALA 54 Cb 0.12 0.60 -0.12 0.00 0.00 0.00 0.00 17.79 18.38 1jd2 h ALA 54 CO -0.15 -1.20 0.18 1.25 0.00 0.00 0.00 179.25 179.33 1jd2 h LEU 55 N -1.08 -0.03 0.40 0.00 5.85 -1.39 0.22 115.31 119.28 1jd2 h LEU 55 Ca -0.09 0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1jd2 h LEU 55 Cb 0.88 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 1jd2 h LEU 55 CO 0.07 -0.09 -0.39 0.58 -0.34 0.00 0.00 178.44 178.27 1jd2 h VAL 56 N 0.24 0.21 -0.25 1.05 2.07 -1.10 -0.97 116.25 117.50 1jd2 h VAL 56 Ca 0.46 0.00 0.03 0.00 0.82 0.00 0.00 66.70 68.01 1jd2 h VAL 56 Cb 0.84 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 30.76 1jd2 h VAL 56 CO -0.57 0.00 -0.35 0.11 0.02 0.00 0.00 177.57 176.78 1jd2 h LYS 57 N -0.81 -0.25 -1.17 1.57 1.57 0.89 0.13 116.57 118.50 1jd2 h LYS 57 Ca -0.03 0.02 0.34 0.00 -1.87 0.00 0.00 60.65 59.10 1jd2 h LYS 57 Cb 0.72 0.06 -0.10 0.00 0.08 0.00 0.00 32.23 32.99 1jd2 h LYS 57 CO -0.06 -0.16 0.77 0.00 -0.57 0.00 0.00 179.45 179.42 1jd2 h ARG 58 N -0.26 0.23 0.34 3.15 3.08 -0.83 -1.52 114.38 118.57 1jd2 h ARG 58 Ca 0.04 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1jd2 h ARG 58 Cb 0.37 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1jd2 h ARG 58 CO -0.37 0.15 -0.16 0.35 -1.07 0.00 0.00 179.97 178.87 1jd2 h PHE 59 N 0.23 -0.42 -0.91 3.04 3.57 0.62 -1.75 116.94 121.32 1jd2 h PHE 59 Ca 0.68 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 62.34 1jd2 h PHE 59 Cb 2.01 0.14 -0.17 0.00 2.79 0.00 0.00 35.95 40.72 1jd2 h PHE 59 CO -0.00 -0.26 -0.26 0.87 -2.23 0.00 0.00 178.31 176.42 1jd2 h LYS 60 N -0.99 -0.01 -0.62 1.11 1.57 -0.56 1.26 116.57 118.33 1jd2 h LYS 60 Ca -0.05 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1jd2 h LYS 60 Cb 0.35 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 1jd2 h LYS 60 CO 0.08 -0.01 0.41 -0.97 -0.57 0.00 0.00 179.45 178.39 1jd2 h ASN 61 N -0.01 0.66 -0.52 0.86 -0.73 -1.36 0.12 115.58 114.60 1jd2 h ASN 61 Ca 0.41 -0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.54 1jd2 h ASN 61 Cb 0.65 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 39.06 1jd2 h ASN 61 CO -0.94 0.47 0.22 -1.28 -0.37 0.00 0.00 177.43 175.53 1jd2 h SER 62 N 0.78 0.72 -0.94 1.15 0.87 0.24 -1.77 113.55 114.60 1jd2 h SER 62 Ca 0.24 -0.16 0.04 0.00 -1.23 0.00 0.00 61.79 60.67 1jd2 h SER 62 Cb 0.00 -0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 61.72 1jd2 h SER 62 CO -0.06 0.68 0.61 0.58 -0.53 0.00 0.00 176.83 178.12 1jd2 h VAL 63 N 0.71 1.15 0.09 2.23 2.07 0.85 0.15 116.25 123.50 1jd2 h VAL 63 Ca 0.18 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 1jd2 h VAL 63 Cb 0.18 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 29.83 1jd2 h VAL 63 CO -0.02 0.21 -0.06 0.50 0.02 0.00 0.00 177.57 178.23 1jd2 h LYS 64 N 1.17 -0.14 0.00 1.57 3.64 -0.42 -2.88 116.57 119.51 1jd2 h LYS 64 Ca 0.37 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.71 1jd2 h LYS 64 Cb 0.03 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1jd2 h LYS 64 CO -0.12 -0.09 -0.28 -1.49 -2.27 0.00 0.00 179.45 175.20 1jd2 h TRP 65 N -0.15 0.00 0.31 1.91 4.06 -0.86 -2.71 115.95 118.51 1jd2 h TRP 65 Ca -0.00 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 1jd2 h TRP 65 Cb 0.13 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.27 1jd2 h TRP 65 CO -0.09 0.28 -0.30 -0.92 -3.56 0.00 0.00 178.44 173.84 1jd2 h TYR 66 N 0.00 -0.82 -0.34 0.49 3.20 -0.76 0.26 116.97 119.00 1jd2 h TYR 66 Ca -0.00 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.95 1jd2 h TYR 66 Cb 0.59 0.32 -0.08 0.00 1.54 0.00 0.00 36.73 39.09 1jd2 h TYR 66 CO 0.00 -0.44 -0.25 0.45 -1.64 0.00 0.00 178.16 176.28 1jd2 h HIS 67 N -0.64 -0.68 0.11 -3.82 3.86 -1.40 0.13 115.15 112.71 1jd2 h HIS 67 Ca -0.01 0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1jd2 h HIS 67 Cb 0.59 0.35 -0.02 0.00 1.06 0.00 0.00 27.41 29.39 1jd2 h HIS 67 CO -0.18 -0.33 -0.25 0.74 0.86 0.00 0.00 177.93 178.77 1jd2 h PHE 68 N -0.21 -0.71 0.00 2.45 -1.00 -1.15 -1.06 116.94 115.25 1jd2 h PHE 68 Ca 0.17 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.96 1jd2 h PHE 68 Cb 0.48 0.29 0.00 0.00 3.61 0.00 0.00 35.95 40.33 1jd2 h PHE 68 CO -0.45 -0.29 0.00 -0.25 -1.61 0.00 0.00 178.31 175.70 1jd2 n ASP 69 N -3.85 0.00 -2.72 2.17 8.00 0.87 -3.63 116.55 117.40 1jd2 n ASP 69 Ca -0.04 -1.01 -0.05 0.00 0.71 0.00 0.00 54.79 54.40 1jd2 n ASP 69 Cb 0.20 0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.38 1jd2 n ASP 69 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1jd2 n HIS 70 N -0.60 -0.55 -3.73 1.24 8.25 0.40 -5.03 115.22 115.22 1jd2 n HIS 70 Ca 0.03 -2.15 -0.26 0.00 -0.26 0.00 0.00 57.72 55.07 1jd2 n HIS 70 Cb 0.01 0.64 0.00 0.00 1.12 0.00 0.00 29.99 31.77 1jd2 n HIS 70 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1jd2 n ASN 70 N -0.68 -3.98 -1.77 0.41 4.05 -0.92 -1.15 115.26 111.22 1jd2 n ASN 70 Ca -0.01 -0.92 -0.04 0.00 0.45 0.00 0.00 54.58 54.06 1jd2 n ASN 70 Cb 0.84 -1.37 -0.01 0.00 1.23 0.00 0.00 39.78 40.47 1jd2 n ASN 70 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1jd2 n ASP 71 N -2.10 -1.43 -4.77 1.20 8.00 -0.47 -4.88 116.55 112.11 1jd2 n ASP 71 Ca -0.24 0.24 -0.40 0.00 0.71 0.00 0.00 54.79 55.10 1jd2 n ASP 71 Cb 0.58 -1.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.19 1jd2 n ASP 71 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1jd2 s LYS 72 N -3.61 4.00 0.23 -1.24 2.20 -0.30 -4.95 119.74 116.07 1jd2 s LYS 72 Ca 0.00 2.45 -0.30 0.00 -0.36 0.00 0.00 55.97 57.76 1jd2 s LYS 72 Cb 0.00 -2.87 -0.09 0.00 -1.51 0.00 0.00 37.83 33.37 1jd2 s LYS 72 CO 0.00 -0.58 0.93 0.21 -0.36 0.00 0.00 175.35 175.55 1jd2 s LYS 73 N -2.18 4.84 -0.59 4.03 2.20 -1.26 -4.55 119.74 122.22 1jd2 s LYS 73 Ca 0.55 1.47 -0.28 0.00 -0.36 0.00 0.00 55.97 57.35 1jd2 s LYS 73 Cb -0.44 -3.28 0.03 0.00 -1.51 0.00 0.00 37.83 32.63 1jd2 s LYS 73 CO 0.59 0.52 1.19 -1.17 -0.36 0.00 0.00 175.35 176.12 1jd2 s LEU 74 N -1.17 3.45 0.27 5.43 2.96 -1.26 -5.01 118.68 123.34 1jd2 s LEU 74 Ca 0.41 0.07 -0.29 0.00 -0.22 0.00 0.00 54.13 54.09 1jd2 s LEU 74 Cb -0.26 -3.13 -0.09 0.00 0.50 0.00 0.00 46.19 43.21 1jd2 s LEU 74 CO 0.32 -1.50 1.24 -0.94 -1.32 0.00 0.00 176.35 174.15 1jd2 s SER 75 N 3.00 6.97 0.22 3.68 1.04 -1.26 -4.80 113.70 122.55 1jd2 s SER 75 Ca 0.42 2.46 -0.08 0.00 0.48 0.00 0.00 55.95 59.23 1jd2 s SER 75 Cb -0.08 -2.63 0.35 0.00 0.10 0.00 0.00 66.02 63.77 1jd2 s SER 75 CO 0.25 -0.41 1.69 -0.29 0.98 0.00 0.00 173.24 175.46 1jd2 h ILE 76 N 3.31 0.58 -0.69 -1.02 6.09 -1.94 0.41 117.51 124.26 1jd2 h ILE 76 Ca -0.47 -0.09 0.10 0.00 -1.37 0.00 0.00 64.86 63.04 1jd2 h ILE 76 Cb 1.22 0.31 -0.04 0.00 0.47 0.00 0.00 36.82 38.77 1jd2 h ILE 76 CO 0.70 0.05 0.46 -0.55 -3.07 0.00 0.00 178.15 175.73 1jd2 h ASN 77 N 0.25 0.48 -0.10 2.19 -1.07 -1.91 0.14 115.58 115.57 1jd2 h ASN 77 Ca 0.35 0.01 -0.05 0.00 0.07 0.00 0.00 56.30 56.69 1jd2 h ASN 77 Cb 0.55 -0.09 -0.00 0.00 -2.07 0.00 0.00 38.32 36.72 1jd2 h ASN 77 CO -0.45 0.28 -0.12 0.28 0.07 0.00 0.00 177.43 177.48 1jd2 h SER 78 N 0.53 0.28 -0.92 6.14 0.02 -0.64 -2.49 113.55 116.46 1jd2 h SER 78 Ca 0.32 -0.51 0.13 0.00 -0.84 0.00 0.00 61.79 60.88 1jd2 h SER 78 Cb 0.55 -0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.93 1jd2 h SER 78 CO -0.10 0.73 0.59 0.00 -1.14 0.00 0.00 176.83 176.91 1jd2 h ALA 79 N 0.55 1.71 0.92 3.77 0.00 0.68 0.16 119.26 127.04 1jd2 h ALA 79 Ca 0.01 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1jd2 h ALA 79 Cb 0.67 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.30 1jd2 h ALA 79 CO 0.03 0.07 -0.44 0.00 0.00 0.00 0.00 179.25 178.90 1jd2 h ALA 80 N 1.58 -1.23 -0.84 0.00 0.00 -0.55 0.11 119.26 118.32 1jd2 h ALA 80 Ca 0.45 -0.27 0.18 0.00 0.00 0.00 0.00 54.91 55.27 1jd2 h ALA 80 Cb 0.59 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 1jd2 h ALA 80 CO -0.22 -1.19 0.56 -0.09 0.00 0.00 0.00 179.25 178.31 1jd2 h ARG 81 N -1.24 0.41 0.94 0.00 9.65 -0.87 0.21 114.38 123.47 1jd2 h ARG 81 Ca -0.13 -0.02 -0.05 0.00 -1.10 0.00 0.00 59.98 58.68 1jd2 h ARG 81 Cb 0.95 -0.09 0.01 0.00 -1.39 0.00 0.00 29.97 29.44 1jd2 h ARG 81 CO 0.21 0.27 -0.45 -0.97 2.80 0.00 0.00 179.97 181.82 1jd2 h ASN 82 N 0.42 -1.07 -0.89 -3.80 -0.00 -0.26 -2.48 115.58 107.50 1jd2 h ASN 82 Ca 0.42 0.04 0.20 0.00 -0.00 0.00 0.00 56.30 56.96 1jd2 h ASN 82 Cb 1.02 0.28 -0.06 0.00 -0.00 0.00 0.00 38.32 39.55 1jd2 h ASN 82 CO -0.15 -0.73 0.59 0.40 -0.00 0.00 0.00 177.43 177.54 1jd2 h ILE 83 N -1.33 0.68 -0.54 2.57 2.04 0.18 0.80 117.51 121.90 1jd2 h ILE 83 Ca -0.13 -0.13 0.07 0.00 1.00 0.00 0.00 64.86 65.67 1jd2 h ILE 83 Cb 0.97 0.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.24 1jd2 h ILE 83 CO 0.21 0.07 0.21 -0.61 0.00 0.00 0.00 178.15 178.03 1jd2 h GLN 84 N 0.39 0.39 -0.66 2.37 4.15 -0.30 -0.40 115.11 121.05 1jd2 h GLN 84 Ca 0.46 -0.02 -0.08 0.00 0.77 0.00 0.00 58.65 59.77 1jd2 h GLN 84 Cb 1.16 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.74 1jd2 h GLN 84 CO -0.17 0.26 0.08 0.45 -1.93 0.00 0.00 178.83 177.52 1jd2 h HIS 85 N 0.40 1.19 -0.40 3.99 3.86 0.97 0.01 115.15 125.17 1jd2 h HIS 85 Ca 0.26 -0.18 0.04 0.00 -1.16 0.00 0.00 60.37 59.34 1jd2 h HIS 85 Cb 0.28 -0.32 -0.04 0.00 1.06 0.00 0.00 27.41 28.38 1jd2 h HIS 85 CO -0.15 1.00 0.16 -0.07 0.86 0.00 0.00 177.93 179.73 1jd2 h LEU 86 N 1.03 0.20 0.61 2.43 3.38 -0.55 -1.67 115.31 120.74 1jd2 h LEU 86 Ca 0.20 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 1jd2 h LEU 86 Cb 0.47 0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.24 1jd2 h LEU 86 CO 0.02 0.15 -0.29 -0.07 0.09 0.00 0.00 178.44 178.33 1jd2 h LEU 87 N 0.33 -0.70 -1.54 1.67 3.38 -0.86 -3.10 115.31 114.49 1jd2 h LEU 87 Ca 0.18 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1jd2 h LEU 87 Cb 0.14 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1jd2 h LEU 87 CO -0.16 -0.31 0.10 0.22 0.09 0.00 0.00 178.44 178.37 1jd2 h TYR 88 N -1.17 0.00 0.00 1.13 5.03 -0.95 0.12 116.97 121.14 1jd2 h TYR 88 Ca -0.08 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.21 1jd2 h TYR 88 Cb 0.66 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.94 1jd2 h TYR 88 CO 0.00 0.00 -0.07 0.78 -1.32 0.00 0.00 178.16 177.55 1jd2 h GLY 89 N 0.00 0.00 -3.23 1.82 0.00 -1.22 -2.29 103.07 98.15 1jd2 h GLY 89 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.90 1jd2 h GLY 89 CO 0.00 0.00 0.21 0.28 0.00 0.00 0.00 176.54 177.03 1jd2 n LYS 90 N -3.54 2.39 0.10 4.80 5.02 0.03 -4.76 118.16 122.20 1jd2 n LYS 90 Ca -0.02 -3.32 0.06 0.00 -2.02 0.00 0.00 58.31 53.01 1jd2 n LYS 90 Cb 0.20 -2.08 0.34 0.00 -0.02 0.00 0.00 35.03 33.46 1jd2 n LYS 90 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1jd2 n ARG 91 N -1.02 0.08 -0.14 1.97 3.00 -0.86 -0.38 116.66 119.30 1jd2 n ARG 91 Ca 0.48 0.56 0.09 0.00 -0.00 0.00 0.00 57.85 58.99 1jd2 n ARG 91 Cb 1.10 -1.83 0.15 0.00 0.00 0.00 0.00 32.46 31.88 1jd2 n ARG 91 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1jd2 n PHE 92 N -1.94 0.04 -2.68 -0.14 3.72 -1.26 -4.60 117.46 110.61 1jd2 n PHE 92 Ca -0.01 -1.05 -0.05 0.00 -0.05 0.00 0.00 57.45 56.30 1jd2 n PHE 92 Cb 0.08 -0.17 0.10 0.00 -0.94 0.00 0.00 39.48 38.55 1jd2 n PHE 92 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1jd2 n PHE 93 N -1.37 -1.06 -0.80 1.38 7.35 0.37 -5.17 117.46 118.17 1jd2 n PHE 93 Ca 0.17 -1.10 -0.34 0.00 -0.76 0.00 0.00 57.45 55.42 1jd2 n PHE 93 Cb 0.66 1.30 0.12 0.00 0.35 0.00 0.00 39.48 41.90 1jd2 n PHE 93 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1jd2 n PRO 94 N 0.33 -0.62 -3.19 -7.13 -0.02 0.49 -4.84 135.00 120.02 1jd2 n PRO 94 Ca -0.05 -0.16 -0.42 0.00 -2.02 0.00 0.00 63.50 60.86 1jd2 n PRO 94 Cb 0.74 -1.61 -0.07 0.00 -0.02 0.00 0.00 33.50 32.53 1jd2 n PRO 94 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1jd2 s TYR 95 N -2.26 3.15 -1.07 6.00 4.12 -1.25 -4.94 117.35 121.09 1jd2 s TYR 95 Ca 0.52 0.16 -0.21 0.00 0.02 0.00 0.00 57.07 57.56 1jd2 s TYR 95 Cb -0.15 -3.05 -0.08 0.00 -1.52 0.00 0.00 41.96 37.15 1jd2 s TYR 95 CO 0.69 -0.63 1.93 0.98 0.02 0.00 0.00 175.55 178.55 1jd2 n TYR 96 N 5.90 2.73 -3.72 2.71 9.36 -1.26 -4.74 117.16 128.14 1jd2 n TYR 96 Ca -0.03 -1.89 -0.14 0.00 3.32 0.00 0.00 57.90 59.15 1jd2 n TYR 96 Cb 0.49 -2.28 -0.08 0.00 -0.63 0.00 0.00 39.34 36.83 1jd2 n TYR 96 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1jd2 s VAL 97 N 7.30 0.05 -0.28 2.97 -7.23 -1.26 -1.34 120.40 120.61 1jd2 s VAL 97 Ca 0.61 -0.39 -0.04 0.00 -1.81 0.00 0.00 61.98 60.35 1jd2 s VAL 97 Cb 0.07 -0.67 0.02 0.00 0.56 0.00 0.00 36.38 36.36 1jd2 s VAL 97 CO 0.10 -0.21 0.02 -2.28 -0.31 0.00 0.00 175.10 172.42 1jd2 s HIS 98 N -1.25 3.14 0.13 2.82 2.46 0.65 -3.81 115.29 119.42 1jd2 s HIS 98 Ca -0.13 -1.37 0.06 0.00 0.47 0.00 0.00 55.06 54.09 1jd2 s HIS 98 Cb -0.04 -2.16 -0.04 0.00 -0.13 0.00 0.00 32.58 30.21 1jd2 s HIS 98 CO 0.05 -0.68 -0.02 -0.08 -2.47 0.00 0.00 174.74 171.54 1jd2 s THR 99 N 1.39 3.79 0.04 0.89 -1.32 -1.22 -1.32 115.64 117.89 1jd2 s THR 99 Ca 0.00 -1.20 -0.04 0.00 -1.21 0.00 0.00 61.69 59.24 1jd2 s THR 99 Cb -0.18 -2.84 -0.02 0.00 -1.51 0.00 0.00 72.50 67.95 1jd2 s THR 99 CO -0.01 0.03 0.05 -0.63 -2.21 0.00 0.00 174.62 171.86 1jd2 s ILE 100 N -1.45 0.15 0.04 5.08 1.01 -0.47 -0.67 121.20 124.90 1jd2 s ILE 100 Ca 0.26 -1.27 -0.12 0.00 0.00 0.00 0.00 60.65 59.51 1jd2 s ILE 100 Cb -0.11 -1.03 0.01 0.00 0.01 0.00 0.00 42.46 41.35 1jd2 s ILE 100 CO 0.18 -0.70 0.27 0.27 0.00 0.00 0.00 174.94 174.95 1jd2 s ILE 101 N -2.93 0.09 0.23 2.92 -4.36 -1.04 -0.77 121.20 115.34 1jd2 s ILE 101 Ca -0.02 -0.75 -0.13 0.00 -0.26 0.00 0.00 60.65 59.48 1jd2 s ILE 101 Cb 0.01 -0.93 -0.00 0.00 1.25 0.00 0.00 42.46 42.79 1jd2 s ILE 101 CO -0.06 -0.42 0.46 0.00 0.24 0.00 0.00 174.94 175.17 1jd2 s ALA 102 N -2.56 -0.29 0.00 2.27 0.00 0.07 -2.42 121.76 118.83 1jd2 s ALA 102 Ca -0.05 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.10 1jd2 s ALA 102 Cb -0.01 1.02 0.00 0.00 0.00 0.00 0.00 23.12 24.14 1jd2 s ALA 102 CO -0.04 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.31 1jd2 n GLY 103 N -0.36 -0.63 3.28 0.00 0.00 -0.85 -2.05 105.19 104.57 1jd2 n GLY 103 Ca -0.03 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.52 1jd2 n GLY 103 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jd2 s LEU 104 N 0.00 2.29 0.72 0.99 1.43 -1.26 -1.30 118.68 121.55 1jd2 s LEU 104 Ca 0.00 -0.67 0.02 0.00 -1.03 0.00 0.00 54.13 52.45 1jd2 s LEU 104 Cb 0.00 -0.86 0.14 0.00 0.03 0.00 0.00 46.19 45.49 1jd2 s LEU 104 CO 0.00 0.05 0.98 1.51 0.23 0.00 0.00 176.35 179.13 1jd2 s ASP 105 N -1.86 4.36 0.27 2.29 1.47 0.92 -4.44 116.67 119.68 1jd2 s ASP 105 Ca 0.06 -0.60 -0.02 0.00 1.18 0.00 0.00 52.55 53.17 1jd2 s ASP 105 Cb -0.10 0.28 0.40 0.00 -0.34 0.00 0.00 42.92 43.17 1jd2 s ASP 105 CO 0.04 -1.87 1.90 -0.33 0.68 0.00 0.00 175.17 175.59 1jd2 h GLU 106 N -0.45 1.15 -0.37 2.11 5.08 -2.00 0.24 114.58 120.35 1jd2 h GLU 106 Ca -0.33 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1jd2 h GLU 106 Cb 1.27 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1jd2 h GLU 106 CO 0.38 0.76 0.00 -0.25 -1.00 0.00 0.00 179.01 178.90 1jd2 n ASP 106 N -4.47 0.45 0.00 1.42 10.43 -1.26 -4.84 116.55 118.28 1jd2 n ASP 106 Ca 0.14 -2.01 0.00 0.00 2.57 0.00 0.00 54.79 55.50 1jd2 n ASP 106 Cb 0.15 -0.19 0.00 0.00 1.84 0.00 0.00 41.12 42.92 1jd2 n ASP 106 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1jd2 n GLY 106 N 0.34 2.85 3.80 0.44 0.00 0.86 -5.02 105.19 108.46 1jd2 n GLY 106 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1jd2 n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jd2 s LYS 107 N -0.00 3.25 0.53 1.61 -0.14 -1.26 -4.58 119.74 119.15 1jd2 s LYS 107 Ca 0.00 1.22 -0.17 0.00 -1.36 0.00 0.00 55.97 55.66 1jd2 s LYS 107 Cb 0.00 -2.02 -0.07 0.00 -1.68 0.00 0.00 37.83 34.06 1jd2 s LYS 107 CO 0.00 -0.87 1.01 0.20 -0.76 0.00 0.00 175.35 174.94 1jd2 s GLY 108 N -2.79 2.15 0.13 -3.33 0.00 -1.23 -0.05 107.32 102.20 1jd2 s GLY 108 Ca 0.64 0.31 -0.21 0.00 0.00 0.00 0.00 44.72 45.46 1jd2 s GLY 108 CO 0.38 0.61 0.54 0.00 0.00 0.00 0.00 173.10 174.62 1jd2 s ALA 109 N -2.47 -1.38 -0.02 3.20 0.00 -0.42 -4.80 121.76 115.87 1jd2 s ALA 109 Ca 0.62 0.37 -0.02 0.00 0.00 0.00 0.00 51.96 52.93 1jd2 s ALA 109 Cb -0.13 0.75 0.01 0.00 0.00 0.00 0.00 23.12 23.75 1jd2 s ALA 109 CO 0.31 -0.69 0.05 0.08 0.00 0.00 0.00 175.76 175.51 1jd2 s VAL 110 N -3.53 -0.01 0.02 0.00 1.01 -1.24 -2.01 120.40 114.63 1jd2 s VAL 110 Ca 0.00 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.06 1jd2 s VAL 110 Cb -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 36.38 36.27 1jd2 s VAL 110 CO -0.11 0.01 -0.15 -0.31 0.00 0.00 0.00 175.10 174.54 1jd2 s TYR 111 N 0.18 1.37 0.10 5.22 2.02 -1.01 -0.49 117.35 124.74 1jd2 s TYR 111 Ca -0.01 -0.31 0.05 0.00 -0.37 0.00 0.00 57.07 56.43 1jd2 s TYR 111 Cb -0.02 -0.84 -0.03 0.00 -0.40 0.00 0.00 41.96 40.66 1jd2 s TYR 111 CO -0.01 0.02 -0.12 -1.54 -1.57 0.00 0.00 175.55 172.33 1jd2 s SER 112 N -0.77 1.69 -0.00 2.29 1.04 -1.15 -2.48 113.70 114.32 1jd2 s SER 112 Ca 0.04 -0.76 0.05 0.00 0.48 0.00 0.00 55.95 55.77 1jd2 s SER 112 Cb -0.07 -0.03 -0.01 0.00 0.10 0.00 0.00 66.02 66.00 1jd2 s SER 112 CO 0.00 -0.17 -0.16 -0.36 0.98 0.00 0.00 173.24 173.53 1jd2 s PHE 113 N -2.02 1.45 1.07 5.02 0.40 0.16 -3.33 117.98 120.73 1jd2 s PHE 113 Ca 0.04 -0.29 -0.12 0.00 -0.60 0.00 0.00 56.93 55.96 1jd2 s PHE 113 Cb -0.06 -0.92 0.23 0.00 0.51 0.00 0.00 43.02 42.78 1jd2 s PHE 113 CO 0.02 -0.00 1.06 0.34 0.70 0.00 0.00 175.22 177.34 1jd2 s ASP 114 N -0.56 1.86 0.00 1.36 3.68 -0.16 -3.46 116.67 119.40 1jd2 s ASP 114 Ca 0.06 1.55 0.20 0.00 2.13 0.00 0.00 52.55 56.49 1jd2 s ASP 114 Cb -0.07 -2.24 1.22 0.00 -1.45 0.00 0.00 42.92 40.38 1jd2 s ASP 114 CO -0.00 -3.66 1.64 -2.65 0.13 0.00 0.00 175.17 170.63 1jd2 n PRO 115 N -4.56 0.75 -2.06 4.34 -0.02 -1.25 -2.94 135.00 129.26 1jd2 n PRO 115 Ca 0.05 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.44 1jd2 n PRO 115 Cb 0.55 -1.43 0.05 0.00 -0.02 0.00 0.00 33.50 32.65 1jd2 n PRO 115 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1jd2 n VAL 116 N -0.93 1.79 -0.61 -1.45 0.24 -1.26 -3.97 118.33 112.14 1jd2 n VAL 116 Ca 0.15 -3.30 0.00 0.00 -2.04 0.00 0.00 64.34 59.15 1jd2 n VAL 116 Cb 0.07 0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.49 1jd2 n VAL 116 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jd2 n GLY 117 N -0.60 0.78 3.66 7.63 0.00 -1.15 -4.25 105.19 111.26 1jd2 n GLY 117 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 1jd2 n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jd2 s SER 118 N -2.79 6.81 0.15 1.61 0.15 -1.26 -4.76 113.70 113.60 1jd2 s SER 118 Ca 0.00 1.90 0.07 0.00 0.70 0.00 0.00 55.95 58.62 1jd2 s SER 118 Cb 0.00 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 1jd2 s SER 118 CO 0.00 -0.85 -0.16 -0.72 1.20 0.00 0.00 173.24 172.71 1jd2 s TYR 119 N 3.79 1.59 0.19 3.44 -0.85 -1.26 -0.99 117.35 123.26 1jd2 s TYR 119 Ca 0.63 -0.53 -0.22 0.00 -0.52 0.00 0.00 57.07 56.43 1jd2 s TYR 119 Cb -0.26 -0.80 0.06 0.00 0.38 0.00 0.00 41.96 41.33 1jd2 s TYR 119 CO 0.21 0.23 0.62 -2.00 -1.52 0.00 0.00 175.55 173.09 1jd2 s GLU 120 N -2.84 1.39 -0.22 -3.49 2.56 -1.21 -5.01 118.70 109.89 1jd2 s GLU 120 Ca 0.13 -0.61 -0.11 0.00 0.00 0.00 0.00 54.97 54.37 1jd2 s GLU 120 Cb -0.05 0.59 -0.05 0.00 2.00 0.00 0.00 34.13 36.62 1jd2 s GLU 120 CO 0.05 -0.62 0.19 0.50 -0.56 0.00 0.00 175.26 174.82 1jd2 s ARG 121 N -3.80 4.12 0.22 4.30 3.52 -1.26 -2.92 118.95 123.13 1jd2 s ARG 121 Ca 0.04 -0.17 0.07 0.00 -0.13 0.00 0.00 55.73 55.53 1jd2 s ARG 121 Cb -0.02 -3.50 -0.05 0.00 -1.56 0.00 0.00 34.95 29.82 1jd2 s ARG 121 CO -0.08 0.11 -0.10 -1.21 -0.81 0.00 0.00 175.30 173.21 1jd2 s GLU 122 N 0.89 1.36 0.16 5.12 2.02 0.36 -5.00 118.70 123.61 1jd2 s GLU 122 Ca 0.10 -1.64 -0.03 0.00 0.02 0.00 0.00 54.97 53.42 1jd2 s GLU 122 Cb -0.13 -1.02 -0.00 0.00 0.10 0.00 0.00 34.13 33.07 1jd2 s GLU 122 CO 0.03 0.10 1.39 0.37 0.02 0.00 0.00 175.26 177.18 1jd2 h GLN 123 N 2.50 0.45 -1.84 1.61 5.75 -1.95 -3.30 115.11 118.32 1jd2 h GLN 123 Ca -0.38 -0.39 0.05 0.00 -0.15 0.00 0.00 58.65 57.77 1jd2 h GLN 123 Cb 1.22 0.09 -0.20 0.00 1.07 0.00 0.00 27.48 29.66 1jd2 h GLN 123 CO 0.64 1.03 0.44 0.00 -2.65 0.00 0.00 178.83 178.29 1jd2 s ARG 125 N -1.55 0.70 0.24 0.00 6.06 0.16 -5.00 118.95 119.56 1jd2 s ARG 125 Ca -0.03 0.67 0.11 0.00 -2.50 0.00 0.00 55.73 53.99 1jd2 s ARG 125 Cb -0.00 0.34 -0.05 0.00 0.06 0.00 0.00 34.95 35.30 1jd2 s ARG 125 CO 0.01 -0.11 -0.21 0.00 -2.50 0.00 0.00 175.30 172.49 1jd2 s ALA 126 N 0.01 2.61 0.02 6.12 0.00 -1.26 0.51 121.76 129.78 1jd2 s ALA 126 Ca 0.00 -1.77 -0.22 0.00 0.00 0.00 0.00 51.96 49.96 1jd2 s ALA 126 Cb -0.04 -0.27 0.05 0.00 0.00 0.00 0.00 23.12 22.86 1jd2 s ALA 126 CO -0.01 0.32 0.51 0.20 0.00 0.00 0.00 175.76 176.78 1jd2 s GLY 127 N -3.18 -0.40 0.00 0.00 0.00 0.39 -4.84 107.32 99.29 1jd2 s GLY 127 Ca 0.26 0.65 0.00 0.00 0.00 0.00 0.00 44.72 45.63 1jd2 s GLY 127 CO 0.12 0.36 0.00 0.61 0.00 0.00 0.00 173.10 174.19 1jd2 n GLY 128 N 0.61 -0.06 0.22 0.20 0.00 -1.26 -0.71 105.19 104.18 1jd2 n GLY 128 Ca -0.19 -2.25 -0.03 0.00 0.00 0.00 0.00 46.02 43.56 1jd2 n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jd2 h ALA 129 N 0.00 0.32 -0.41 4.61 0.00 -1.47 0.14 119.26 122.46 1jd2 h ALA 129 Ca 0.00 0.20 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1jd2 h ALA 129 Cb 0.00 0.42 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1jd2 h ALA 129 CO 0.00 -0.45 0.09 0.00 0.00 0.00 0.00 179.25 178.88 1jd2 n ALA 130 N -2.92 3.59 -0.08 0.00 0.00 -1.26 -4.38 120.51 115.45 1jd2 n ALA 130 Ca 0.05 -1.31 -0.07 0.00 0.00 0.00 0.00 53.44 52.11 1jd2 n ALA 130 Cb 0.28 -1.12 -0.00 0.00 0.00 0.00 0.00 19.45 18.61 1jd2 n ALA 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jd2 h ALA 131 N 2.85 0.01 -1.00 0.00 0.00 -0.94 -1.22 119.26 118.97 1jd2 h ALA 131 Ca 0.08 0.11 0.11 0.00 0.00 0.00 0.00 54.91 55.22 1jd2 h ALA 131 Cb 1.58 0.46 -0.08 0.00 0.00 0.00 0.00 17.79 19.74 1jd2 h ALA 131 CO 0.39 -0.60 0.63 0.66 0.00 0.00 0.00 179.25 180.33 1jd2 h SER 132 N -0.17 0.93 0.27 0.00 4.64 -1.79 -0.93 113.55 116.50 1jd2 h SER 132 Ca 0.16 0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.51 1jd2 h SER 132 Cb 0.42 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1jd2 h SER 132 CO -0.42 0.51 -0.13 -0.07 -0.87 0.00 0.00 176.83 175.85 1jd2 h LEU 133 N 1.01 -0.31 -0.26 5.97 4.07 -1.55 -3.38 115.31 120.86 1jd2 h LEU 133 Ca 0.49 -0.23 -0.21 0.00 0.08 0.00 0.00 57.88 58.01 1jd2 h LEU 133 Cb 0.45 0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1jd2 h LEU 133 CO -0.25 0.14 -0.85 0.40 -1.08 0.00 0.00 178.44 176.80 1jd2 h ILE 134 N -0.85 1.38 -0.78 1.22 2.04 -1.26 -3.34 117.51 115.92 1jd2 h ILE 134 Ca -0.04 -2.29 0.18 0.00 1.00 0.00 0.00 64.86 63.71 1jd2 h ILE 134 Cb 0.51 2.27 -0.14 0.00 -0.74 0.00 0.00 36.82 38.72 1jd2 h ILE 134 CO 0.06 0.69 -0.01 0.24 0.00 0.00 0.00 178.15 179.13 1jd2 h MET 135 N 0.28 0.08 0.08 2.37 2.86 -1.34 -1.53 114.93 117.72 1jd2 h MET 135 Ca -0.06 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1jd2 h MET 135 Cb 1.46 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 33.07 1jd2 h MET 135 CO 0.15 0.06 -0.23 -1.35 1.06 0.00 0.00 176.91 176.60 1jd2 h PRO 136 N 0.09 -0.39 -0.78 -0.22 0.11 -1.76 -1.22 132.00 127.82 1jd2 h PRO 136 Ca 0.43 0.03 0.16 0.00 0.11 0.00 0.00 66.00 66.73 1jd2 h PRO 136 Cb 0.76 0.09 -0.15 0.00 0.11 0.00 0.00 31.00 31.82 1jd2 h PRO 136 CO -0.71 -0.26 -0.15 0.35 -0.21 0.00 0.00 178.00 177.03 1jd2 h PHE 137 N -0.40 -0.33 -0.39 0.65 3.57 -1.49 0.32 116.94 118.87 1jd2 h PHE 137 Ca 0.04 0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1jd2 h PHE 137 Cb 0.44 0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.43 1jd2 h PHE 137 CO -0.23 -0.32 0.24 -0.07 -2.23 0.00 0.00 178.31 175.69 1jd2 h LEU 138 N 0.02 0.46 -1.99 0.59 -0.00 -0.64 0.14 115.31 113.89 1jd2 h LEU 138 Ca 0.39 -0.05 0.11 0.00 -0.00 0.00 0.00 57.88 58.34 1jd2 h LEU 138 Cb 0.63 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 41.15 1jd2 h LEU 138 CO -0.78 0.38 0.43 0.44 -0.00 0.00 0.00 178.44 178.90 1jd2 h ASP 139 N 0.51 0.00 0.00 -0.43 5.19 0.73 0.15 116.42 122.57 1jd2 h ASP 139 Ca 0.14 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.40 1jd2 h ASP 139 Cb -0.01 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.48 1jd2 h ASP 139 CO -0.03 0.00 -1.03 -3.20 -3.12 0.00 0.00 179.24 171.86 1jd2 n ASN 140 N -3.72 1.84 0.20 6.45 4.05 -0.08 -0.88 115.26 123.12 1jd2 n ASN 140 Ca 0.07 0.50 0.11 0.00 0.45 0.00 0.00 54.58 55.71 1jd2 n ASN 140 Cb 0.60 -0.92 0.13 0.00 1.23 0.00 0.00 39.78 40.82 1jd2 n ASN 140 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 177.26 175.77 1jd2 h GLN 141 N -1.00 0.00 0.00 1.20 1.08 -0.64 -2.95 115.11 112.80 1jd2 h GLN 141 Ca -0.23 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.71 1jd2 h GLN 141 Cb 1.02 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.41 1jd2 h GLN 141 CO -0.14 0.04 -1.80 0.28 -0.95 0.00 0.00 178.83 176.26 1jd2 n VAL 142 N -3.05 1.36 1.05 -0.54 0.31 0.51 -4.60 118.33 113.37 1jd2 n VAL 142 Ca 0.03 -0.15 0.11 0.00 -0.01 0.00 0.00 64.34 64.32 1jd2 n VAL 142 Cb 0.55 -1.97 0.34 0.00 -0.91 0.00 0.00 33.84 31.85 1jd2 n VAL 142 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1jd2 n ASN 143 N -4.15 2.11 -3.90 4.52 3.02 -1.15 -4.96 115.26 110.75 1jd2 n ASN 143 Ca -0.34 -1.77 -0.28 0.00 -0.03 0.00 0.00 54.58 52.16 1jd2 n ASN 143 Cb 0.69 -0.12 0.02 0.00 -0.61 0.00 0.00 39.78 39.76 1jd2 n ASN 143 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1jd2 n PHE 144 N 0.62 -2.08 -2.45 3.10 3.72 -1.11 -4.95 117.46 114.31 1jd2 n PHE 144 Ca 0.17 0.86 -0.39 0.00 -0.05 0.00 0.00 57.45 58.04 1jd2 n PHE 144 Cb 0.41 -3.95 -0.04 0.00 -0.94 0.00 0.00 39.48 34.95 1jd2 n PHE 144 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1jd2 s LYS 144 N -6.48 4.49 0.00 -1.08 -0.14 -0.06 -3.19 119.74 113.28 1jd2 s LYS 144 Ca 0.43 1.78 0.00 0.00 -1.36 0.00 0.00 55.97 56.82 1jd2 s LYS 144 Cb -0.22 -3.03 0.00 0.00 -1.68 0.00 0.00 37.83 32.90 1jd2 s LYS 144 CO 0.84 0.09 0.00 0.09 -0.76 0.00 0.00 175.35 175.61 1jd2 n ASN 144 N 0.86 0.00 -4.83 2.83 5.03 -1.26 -4.67 115.26 113.22 1jd2 n ASN 144 Ca 0.00 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 55.13 1jd2 n ASN 144 Cb 0.46 -0.70 -0.04 0.00 -1.02 0.00 0.00 39.78 38.48 1jd2 n ASN 144 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1jd2 s GLN 144 N 0.00 3.94 0.17 3.52 -0.21 -1.19 -5.06 119.66 120.83 1jd2 s GLN 144 Ca 0.00 1.05 -0.02 0.00 0.02 0.00 0.00 55.36 56.41 1jd2 s GLN 144 Cb 0.00 -2.13 -0.04 0.00 1.00 0.00 0.00 33.01 31.84 1jd2 s GLN 144 CO 0.00 -0.28 0.13 0.71 -2.12 0.00 0.00 175.29 173.73 1jd2 s TYR 144 N -2.45 0.92 -0.18 0.91 2.02 -1.26 -3.50 117.35 113.80 1jd2 s TYR 144 Ca 0.61 -1.23 -0.27 0.00 -0.37 0.00 0.00 57.07 55.80 1jd2 s TYR 144 Cb -0.11 -0.44 -0.00 0.00 -0.40 0.00 0.00 41.96 41.00 1jd2 s TYR 144 CO 0.27 -0.61 0.94 -1.21 -1.57 0.00 0.00 175.55 173.36 1jd2 s GLU 144 N -4.09 4.30 0.20 -0.62 0.41 -0.52 -4.63 118.70 113.75 1jd2 s GLU 144 Ca 0.30 1.20 -0.31 0.00 -0.41 0.00 0.00 54.97 55.75 1jd2 s GLU 144 Cb 0.06 -3.60 -0.16 0.00 -1.78 0.00 0.00 34.13 28.66 1jd2 s GLU 144 CO 0.06 -0.45 1.00 -2.30 -0.49 0.00 0.00 175.26 173.09 1jd2 n PRO 144 N 5.64 0.94 -0.46 0.39 -0.02 -1.26 -1.75 135.00 138.48 1jd2 n PRO 144 Ca 0.08 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1jd2 n PRO 144 Cb 0.48 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 1jd2 n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jd2 n GLY 144 N 1.75 2.04 1.28 -1.23 0.00 -1.26 -4.91 105.19 102.86 1jd2 n GLY 144 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1jd2 n GLY 144 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jd2 n THR 144 N -2.00 1.52 -3.97 2.61 -2.24 -0.72 -4.87 114.28 104.61 1jd2 n THR 144 Ca 0.00 -0.74 -0.32 0.00 -2.27 0.00 0.00 64.05 60.72 1jd2 n THR 144 Cb 0.00 -0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 67.74 1jd2 n THR 144 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1jd2 n ASN 144 N 0.18 -3.21 -3.96 3.42 4.05 -1.26 -1.20 115.26 113.28 1jd2 n ASN 144 Ca 0.17 -0.81 -0.32 0.00 0.45 0.00 0.00 54.58 54.07 1jd2 n ASN 144 Cb 0.79 -2.65 0.01 0.00 1.23 0.00 0.00 39.78 39.16 1jd2 n ASN 144 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1jd2 n GLY 144 N -1.26 -0.49 0.24 8.20 0.00 -1.26 -4.86 105.19 105.77 1jd2 n GLY 144 Ca 0.06 0.17 0.03 0.00 0.00 0.00 0.00 46.02 46.28 1jd2 n GLY 144 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jd2 n LYS 144 N -4.55 1.18 -2.39 1.61 4.76 -0.34 -5.09 118.16 113.34 1jd2 n LYS 144 Ca 0.05 -1.24 -0.04 0.00 -2.87 0.00 0.00 58.31 54.22 1jd2 n LYS 144 Cb 0.52 -1.11 -0.01 0.00 -1.84 0.00 0.00 35.03 32.58 1jd2 n LYS 144 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1jd2 n VAL 144 N 0.14 0.00 -3.64 -0.18 0.31 -1.26 -5.11 118.33 108.59 1jd2 n VAL 144 Ca 0.04 -0.41 -0.36 0.00 -0.01 0.00 0.00 64.34 63.60 1jd2 n VAL 144 Cb 0.22 0.19 -0.08 0.00 -0.91 0.00 0.00 33.84 33.26 1jd2 n VAL 144 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1jd2 s LYS 144 N -2.24 4.18 0.49 5.55 2.20 -1.23 -1.44 119.74 127.25 1jd2 s LYS 144 Ca 0.06 -0.12 -0.23 0.00 -0.36 0.00 0.00 55.97 55.32 1jd2 s LYS 144 Cb 0.00 -3.46 -0.07 0.00 -1.51 0.00 0.00 37.83 32.79 1jd2 s LYS 144 CO 0.04 0.21 1.21 -0.35 -0.36 0.00 0.00 175.35 176.09 1jd2 n PRO 144 N 3.78 1.59 -2.38 4.03 -0.04 -1.26 -4.89 135.00 135.83 1jd2 n PRO 144 Ca -0.14 0.58 -0.43 0.00 -0.04 0.00 0.00 63.50 63.47 1jd2 n PRO 144 Cb 0.52 -2.36 0.00 0.00 -0.04 0.00 0.00 33.50 31.62 1jd2 n PRO 144 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1jd2 n LEU 144 N -0.31 5.78 -4.75 1.53 4.77 -1.26 -4.98 117.00 117.78 1jd2 n LEU 144 Ca 0.09 -4.19 -0.30 0.00 -0.03 0.00 0.00 56.01 51.58 1jd2 n LEU 144 Cb 0.43 -1.66 0.23 0.00 -2.33 0.00 0.00 43.42 40.09 1jd2 n LEU 144 CO 0.55 0.71 0.75 -0.75 -1.33 0.00 0.00 177.39 177.32 1jd2 s LYS 144 N 2.87 -0.66 -0.04 3.23 2.20 -1.26 -5.07 119.74 121.00 1jd2 s LYS 144 Ca 0.48 -0.36 0.03 0.00 -0.36 0.00 0.00 55.97 55.76 1jd2 s LYS 144 Cb 0.06 -1.69 0.01 0.00 -1.51 0.00 0.00 37.83 34.70 1jd2 s LYS 144 CO 0.01 -3.29 -0.12 -0.47 -0.36 0.00 0.00 175.35 171.12 1jd2 s TYR 145 N -3.47 1.29 0.47 4.03 6.14 -1.26 -5.09 117.35 119.46 1jd2 s TYR 145 Ca 0.74 -0.39 -0.24 0.00 0.64 0.00 0.00 57.07 57.82 1jd2 s TYR 145 Cb -0.05 -0.92 -0.08 0.00 0.42 0.00 0.00 41.96 41.34 1jd2 s TYR 145 CO 0.55 -0.17 1.37 1.28 0.64 0.00 0.00 175.55 179.22 1jd2 n LEU 146 N 3.43 4.96 -4.87 6.97 4.77 -1.26 -4.94 117.00 126.07 1jd2 n LEU 146 Ca -0.20 1.07 -0.31 0.00 -0.03 0.00 0.00 56.01 56.54 1jd2 n LEU 146 Cb 0.53 -1.57 -0.05 0.00 -2.33 0.00 0.00 43.42 40.00 1jd2 n LEU 146 CO 0.25 -0.41 0.29 -0.94 -1.33 0.00 0.00 177.39 175.25 1jd2 s SER 147 N -0.62 6.61 0.19 -1.43 1.04 -1.26 -4.40 113.70 113.84 1jd2 s SER 147 Ca 0.64 0.99 -0.14 0.00 0.48 0.00 0.00 55.95 57.92 1jd2 s SER 147 Cb -0.45 -2.26 0.20 0.00 0.10 0.00 0.00 66.02 63.61 1jd2 s SER 147 CO 0.55 -0.17 1.66 1.62 0.98 0.00 0.00 173.24 177.88 1jd2 h VAL 148 N 1.74 0.52 -0.13 5.02 3.04 -1.99 0.79 116.25 125.25 1jd2 h VAL 148 Ca -0.47 -0.02 0.04 0.00 -1.01 0.00 0.00 66.70 65.24 1jd2 h VAL 148 Cb 1.18 0.46 -0.05 0.00 -2.01 0.00 0.00 31.29 30.87 1jd2 h VAL 148 CO 0.67 0.01 -0.17 -0.33 -1.01 0.00 0.00 177.57 176.74 1jd2 h GLU 149 N 0.06 -0.21 -0.57 4.17 3.07 -2.01 0.67 114.58 119.76 1jd2 h GLU 149 Ca 0.26 0.01 0.05 0.00 -0.50 0.00 0.00 59.36 59.19 1jd2 h GLU 149 Cb 0.41 0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.33 1jd2 h GLU 149 CO -0.49 -0.14 0.38 1.49 -1.40 0.00 0.00 179.01 178.85 1jd2 h GLU 150 N -0.21 0.55 -0.06 2.33 4.57 -1.52 -1.72 114.58 118.51 1jd2 h GLU 150 Ca 0.10 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 1jd2 h GLU 150 Cb 0.36 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1jd2 h GLU 150 CO -0.26 0.37 0.02 0.28 -1.18 0.00 0.00 179.01 178.24 1jd2 h VAL 151 N 0.57 1.18 -0.98 0.32 2.07 0.13 -2.30 116.25 117.24 1jd2 h VAL 151 Ca 0.24 -0.53 0.16 0.00 0.82 0.00 0.00 66.70 67.39 1jd2 h VAL 151 Cb 0.24 1.42 -0.10 0.00 -1.52 0.00 0.00 31.29 31.33 1jd2 h VAL 151 CO -0.07 0.15 0.59 0.40 0.02 0.00 0.00 177.57 178.66 1jd2 h ILE 152 N -0.10 0.78 -0.32 4.57 2.04 -0.29 0.39 117.51 124.58 1jd2 h ILE 152 Ca 0.02 -0.28 0.07 0.00 1.00 0.00 0.00 64.86 65.67 1jd2 h ILE 152 Cb 0.22 -0.11 -0.07 0.00 -0.74 0.00 0.00 36.82 36.12 1jd2 h ILE 152 CO -0.00 0.15 -0.16 0.11 0.00 0.00 0.00 178.15 178.25 1jd2 h LYS 153 N 0.82 -0.11 -0.92 2.37 1.57 -1.09 0.18 116.57 119.39 1jd2 h LYS 153 Ca 0.53 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.39 1jd2 h LYS 153 Cb 0.73 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.00 1jd2 h LYS 153 CO -0.34 -0.07 0.60 -0.07 -0.57 0.00 0.00 179.45 178.99 1jd2 h LEU 154 N -0.11 0.93 0.88 2.94 3.38 -0.69 -2.02 115.31 120.61 1jd2 h LEU 154 Ca 0.16 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 1jd2 h LEU 154 Cb 0.36 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.93 1jd2 h LEU 154 CO -0.39 0.59 -0.42 0.58 0.09 0.00 0.00 178.44 178.89 1jd2 h VAL 155 N 1.05 0.11 -0.30 1.22 2.07 0.44 -0.07 116.25 120.78 1jd2 h VAL 155 Ca 0.40 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.94 1jd2 h VAL 155 Cb 0.19 0.12 -0.05 0.00 -1.52 0.00 0.00 31.29 30.03 1jd2 h VAL 155 CO -0.15 0.00 -0.03 0.03 0.02 0.00 0.00 177.57 177.44 1jd2 h ARG 156 N -1.21 0.05 -0.06 1.57 3.08 -0.98 -1.36 114.38 115.47 1jd2 h ARG 156 Ca -0.12 -0.00 0.02 0.00 0.07 0.00 0.00 59.98 59.94 1jd2 h ARG 156 Cb 0.91 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.93 1jd2 h ARG 156 CO 0.20 0.03 -0.04 -0.44 -1.07 0.00 0.00 179.97 178.65 1jd2 h ASP 157 N 0.05 -0.13 -1.09 7.04 3.45 -1.34 0.16 116.42 124.56 1jd2 h ASP 157 Ca 0.15 0.03 0.30 0.00 0.43 0.00 0.00 57.03 57.93 1jd2 h ASP 157 Cb 0.21 0.07 -0.08 0.00 -0.56 0.00 0.00 39.33 38.97 1jd2 h ASP 157 CO -0.27 -0.06 0.73 0.28 -1.57 0.00 0.00 179.24 178.35 1jd2 h SER 158 N -0.04 0.28 0.03 6.45 0.02 -0.14 0.62 113.55 120.75 1jd2 h SER 158 Ca 0.04 0.06 -0.08 0.00 -0.84 0.00 0.00 61.79 60.97 1jd2 h SER 158 Cb 0.10 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1jd2 h SER 158 CO -0.09 0.04 -0.38 -0.26 -1.14 0.00 0.00 176.83 175.01 1jd2 h PHE 159 N 0.24 0.11 -0.37 3.45 -1.00 -0.15 -2.58 116.94 116.64 1jd2 h PHE 159 Ca 0.58 -0.08 0.08 0.00 2.81 0.00 0.00 57.97 61.36 1jd2 h PHE 159 Cb 1.79 -0.00 -0.08 0.00 3.61 0.00 0.00 35.95 41.27 1jd2 h PHE 159 CO -0.00 1.15 -0.15 1.79 -1.61 0.00 0.00 178.31 179.49 1jd2 h THR 160 N -0.86 0.52 0.18 -1.55 1.35 0.57 0.46 112.91 113.58 1jd2 h THR 160 Ca -0.09 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.79 1jd2 h THR 160 Cb 1.19 0.52 -0.04 0.00 -1.73 0.00 0.00 68.15 68.08 1jd2 h THR 160 CO -0.00 0.00 -0.44 0.28 -0.25 0.00 0.00 175.52 175.11 1jd2 h SER 161 N -0.08 -1.27 -0.92 5.36 0.02 -1.07 0.13 113.55 115.72 1jd2 h SER 161 Ca 0.18 0.13 0.18 0.00 -0.84 0.00 0.00 61.79 61.45 1jd2 h SER 161 Cb 0.36 0.47 -0.08 0.00 0.14 0.00 0.00 62.40 63.29 1jd2 h SER 161 CO -0.43 -0.52 0.59 0.00 -1.14 0.00 0.00 176.83 175.34 1jd2 h ALA 162 N -0.30 1.98 -0.59 3.77 0.00 -0.84 0.12 119.26 123.40 1jd2 h ALA 162 Ca 0.01 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1jd2 h ALA 162 Cb 0.71 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1jd2 h ALA 162 CO -0.21 -0.28 0.16 1.15 0.00 0.00 0.00 179.25 180.07 1jd2 h THR 163 N 0.57 1.23 -0.13 0.00 2.02 0.25 0.29 112.91 117.15 1jd2 h THR 163 Ca 0.49 -0.83 -0.07 0.00 0.77 0.00 0.00 66.41 66.77 1jd2 h THR 163 Cb 0.98 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1jd2 h THR 163 CO -0.23 0.31 -0.25 -0.33 0.37 0.00 0.00 175.52 175.40 1jd2 h GLU 164 N 0.88 0.22 0.00 6.66 4.39 0.78 -3.33 114.58 124.18 1jd2 h GLU 164 Ca 0.19 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1jd2 h GLU 164 Cb 0.29 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1jd2 h GLU 164 CO -0.00 0.46 -1.07 0.54 -1.16 0.00 0.00 179.01 177.78 1jd2 n ARG 165 N -4.17 1.69 -4.02 2.33 5.12 -0.92 -4.93 116.66 111.76 1jd2 n ARG 165 Ca -0.01 -0.06 -0.33 0.00 -1.93 0.00 0.00 57.85 55.52 1jd2 n ARG 165 Cb 0.35 -1.19 -0.15 0.00 -1.16 0.00 0.00 32.46 30.32 1jd2 n ARG 165 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1jd2 s HIS 166 N -2.51 3.15 0.04 -1.55 2.46 0.99 -4.96 115.29 112.90 1jd2 s HIS 166 Ca 0.00 -1.94 0.21 0.00 0.47 0.00 0.00 55.06 53.80 1jd2 s HIS 166 Cb 0.09 -2.00 1.14 0.00 -0.13 0.00 0.00 32.58 31.68 1jd2 s HIS 166 CO 0.52 -0.82 1.60 -0.84 -2.47 0.00 0.00 174.74 172.73 1jd2 h ILE 167 N 6.43 0.00 0.00 0.89 3.07 -1.86 0.67 117.51 126.71 1jd2 h ILE 167 Ca -0.27 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.14 1jd2 h ILE 167 Cb 1.08 0.47 0.00 0.00 -0.27 0.00 0.00 36.82 38.09 1jd2 h ILE 167 CO 0.53 0.00 -0.95 0.00 -1.05 0.00 0.00 178.15 176.68 1jd2 n GLN 168 N -2.31 0.51 -3.84 0.16 6.02 -1.26 -4.88 117.38 111.79 1jd2 n GLN 168 Ca -0.01 0.10 -0.32 0.00 -0.01 0.00 0.00 57.00 56.75 1jd2 n GLN 168 Cb 0.18 -1.77 -0.05 0.00 1.02 0.00 0.00 30.24 29.63 1jd2 n GLN 168 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1jd2 s VAL 169 N -3.31 5.34 -5.00 5.09 1.01 0.23 -4.25 120.40 119.51 1jd2 s VAL 169 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1jd2 s VAL 169 Cb 0.11 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.89 1jd2 s VAL 169 CO 0.78 0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.70 1jd2 n GLY 170 N 0.56 0.02 5.00 4.51 0.00 -1.26 -4.68 105.19 109.33 1jd2 n GLY 170 Ca -0.07 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1jd2 n GLY 170 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jd2 n ASP 171 N 1.35 0.00 -3.52 1.61 8.00 -0.87 -4.13 116.55 118.99 1jd2 n ASP 171 Ca 0.00 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.33 1jd2 n ASP 171 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 1jd2 n ASP 171 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1jd2 s GLY 172 N 0.00 -0.56 -0.16 0.44 0.00 -1.26 -2.65 107.32 103.13 1jd2 s GLY 172 Ca 0.00 1.35 0.01 0.00 0.00 0.00 0.00 44.72 46.08 1jd2 s GLY 172 CO 0.00 0.96 -0.14 -2.27 0.00 0.00 0.00 173.10 171.65 1jd2 s LEU 173 N -1.20 1.88 -0.13 0.66 2.96 -0.49 0.89 118.68 123.24 1jd2 s LEU 173 Ca -0.10 -0.61 0.01 0.00 -0.22 0.00 0.00 54.13 53.20 1jd2 s LEU 173 Cb -0.00 -1.22 -0.01 0.00 0.50 0.00 0.00 46.19 45.46 1jd2 s LEU 173 CO 0.09 -0.08 -0.15 -0.70 -1.32 0.00 0.00 176.35 174.20 1jd2 s GLU 174 N 1.45 3.30 -0.04 1.98 2.12 -1.10 -1.67 118.70 124.73 1jd2 s GLU 174 Ca 0.03 -0.73 0.06 0.00 0.36 0.00 0.00 54.97 54.70 1jd2 s GLU 174 Cb -0.14 -2.58 -0.02 0.00 0.26 0.00 0.00 34.13 31.65 1jd2 s GLU 174 CO -0.10 0.16 -0.23 0.42 -0.54 0.00 0.00 175.26 174.97 1jd2 s ILE 175 N 0.46 2.24 -0.15 -3.70 1.01 -0.10 -2.88 121.20 118.09 1jd2 s ILE 175 Ca -0.11 -1.02 -0.02 0.00 0.00 0.00 0.00 60.65 59.51 1jd2 s ILE 175 Cb -0.16 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.48 1jd2 s ILE 175 CO 0.05 0.58 -0.09 -0.76 0.00 0.00 0.00 174.94 174.71 1jd2 s LEU 176 N -0.42 2.86 -0.05 2.97 1.02 -0.54 -1.78 118.68 122.74 1jd2 s LEU 176 Ca 0.04 -0.30 0.05 0.00 0.02 0.00 0.00 54.13 53.93 1jd2 s LEU 176 Cb -0.12 -1.67 -0.02 0.00 0.02 0.00 0.00 46.19 44.40 1jd2 s LEU 176 CO 0.01 0.13 -0.18 -0.63 0.02 0.00 0.00 176.35 175.70 1jd2 s ILE 177 N 0.60 2.72 -0.08 -0.59 1.09 -0.56 -1.56 121.20 122.81 1jd2 s ILE 177 Ca -0.06 -0.84 0.04 0.00 -1.10 0.00 0.00 60.65 58.69 1jd2 s ILE 177 Cb -0.15 -2.04 0.00 0.00 -1.06 0.00 0.00 42.46 39.21 1jd2 s ILE 177 CO 0.03 0.58 -0.21 -0.69 -0.10 0.00 0.00 174.94 174.54 1jd2 s VAL 178 N -0.53 1.84 0.21 2.92 1.01 -0.74 -1.25 120.40 123.86 1jd2 s VAL 178 Ca 0.07 -0.90 -0.07 0.00 0.00 0.00 0.00 61.98 61.08 1jd2 s VAL 178 Cb -0.11 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 1jd2 s VAL 178 CO 0.01 0.51 0.28 0.42 0.00 0.00 0.00 175.10 176.32 1jd2 s THR 179 N 0.31 0.02 0.65 3.92 -4.23 -1.04 -2.89 115.64 112.38 1jd2 s THR 179 Ca -0.15 -1.68 0.28 0.00 -1.18 0.00 0.00 61.69 58.96 1jd2 s THR 179 Cb -0.17 -2.25 0.29 0.00 1.34 0.00 0.00 72.50 71.71 1jd2 s THR 179 CO 0.07 -0.08 1.85 0.07 -0.54 0.00 0.00 174.62 175.99 1jd2 h LYS 180 N 2.49 0.00 -0.06 3.99 2.10 -1.96 0.64 116.57 123.77 1jd2 h LYS 180 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1jd2 h LYS 180 Cb 1.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 1jd2 h LYS 180 CO 0.46 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.66 1jd2 n ASP 182 N -2.99 1.08 0.00 7.07 8.00 -1.26 -5.03 116.55 123.42 1jd2 n ASP 182 Ca -0.00 -1.47 0.00 0.00 0.71 0.00 0.00 54.79 54.03 1jd2 n ASP 182 Cb 0.47 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 1jd2 n ASP 182 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jd2 n GLY 183 N 1.08 0.30 2.88 0.44 0.00 0.22 -5.03 105.19 105.07 1jd2 n GLY 183 Ca 0.18 -1.67 -0.25 0.00 0.00 0.00 0.00 46.02 44.28 1jd2 n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jd2 s VAL 184 N -1.82 0.83 0.03 1.61 1.01 -1.26 -2.49 120.40 118.31 1jd2 s VAL 184 Ca 0.00 -0.19 0.03 0.00 0.00 0.00 0.00 61.98 61.82 1jd2 s VAL 184 Cb 0.00 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 1jd2 s VAL 184 CO 0.00 0.33 -0.00 -0.60 0.00 0.00 0.00 175.10 174.82 1jd2 s ARG 185 N 1.60 2.68 -0.02 2.72 3.52 -0.38 -4.97 118.95 124.09 1jd2 s ARG 185 Ca 0.02 -0.70 0.07 0.00 -0.13 0.00 0.00 55.73 54.98 1jd2 s ARG 185 Cb -0.13 -2.61 -0.02 0.00 -1.56 0.00 0.00 34.95 30.64 1jd2 s ARG 185 CO -0.06 0.59 -0.22 0.15 -0.81 0.00 0.00 175.30 174.95 1jd2 s LYS 186 N -1.82 1.93 0.03 5.12 1.02 -1.26 -1.50 119.74 123.26 1jd2 s LYS 186 Ca 0.22 -0.80 0.04 0.00 0.02 0.00 0.00 55.97 55.44 1jd2 s LYS 186 Cb -0.12 -1.81 -0.02 0.00 -0.52 0.00 0.00 37.83 35.37 1jd2 s LYS 186 CO 0.13 0.45 -0.12 -1.21 -0.92 0.00 0.00 175.35 173.69 1jd2 s GLU 187 N -0.43 0.77 -0.06 1.68 2.02 -0.73 -5.01 118.70 116.94 1jd2 s GLU 187 Ca 0.06 -0.69 -0.02 0.00 0.02 0.00 0.00 54.97 54.34 1jd2 s GLU 187 Cb -0.10 -0.73 0.04 0.00 0.10 0.00 0.00 34.13 33.45 1jd2 s GLU 187 CO -0.00 0.18 0.12 0.12 0.02 0.00 0.00 175.26 175.69 1jd2 s PHE 188 N -0.88 -0.10 0.02 1.61 5.36 -1.26 -0.92 117.98 121.81 1jd2 s PHE 188 Ca -0.01 0.44 0.08 0.00 -0.96 0.00 0.00 56.93 56.49 1jd2 s PHE 188 Cb -0.08 -0.25 -0.02 0.00 -0.34 0.00 0.00 43.02 42.33 1jd2 s PHE 188 CO 0.01 -0.20 -0.25 0.71 -1.46 0.00 0.00 175.22 174.03 1jd2 s TYR 189 N 1.80 2.18 0.84 10.12 4.12 -0.67 -5.00 117.35 130.74 1jd2 s TYR 189 Ca -0.02 -0.41 -0.12 0.00 0.02 0.00 0.00 57.07 56.55 1jd2 s TYR 189 Cb -0.12 -1.35 0.09 0.00 -1.52 0.00 0.00 41.96 39.07 1jd2 s TYR 189 CO -0.05 0.06 1.11 -1.21 0.02 0.00 0.00 175.55 175.48 1jd2 s GLU 190 N -0.97 1.74 0.18 -0.62 2.02 -1.26 -1.40 118.70 118.39 1jd2 s GLU 190 Ca 0.10 0.55 -0.03 0.00 0.02 0.00 0.00 54.97 55.61 1jd2 s GLU 190 Cb -0.10 -1.89 -0.03 0.00 0.10 0.00 0.00 34.13 32.22 1jd2 s GLU 190 CO 0.01 -1.84 0.17 -0.51 0.02 0.00 0.00 175.26 173.10 1jd2 s LEU 191 N -5.89 1.21 0.18 1.80 1.43 -1.08 -4.69 118.68 111.64 1jd2 s LEU 191 Ca 0.62 -1.22 -0.32 0.00 -1.03 0.00 0.00 54.13 52.18 1jd2 s LEU 191 Cb -0.15 0.61 -0.10 0.00 0.03 0.00 0.00 46.19 46.58 1jd2 s LEU 191 CO 0.54 -0.85 1.59 -0.54 0.23 0.00 0.00 176.35 177.33 1jd2 s LYS 192 N -4.09 4.20 -0.31 1.70 1.02 -1.26 -4.02 119.74 116.97 1jd2 s LYS 192 Ca 0.30 2.41 0.04 0.00 0.02 0.00 0.00 55.97 58.74 1jd2 s LYS 192 Cb 0.06 -3.13 0.49 0.00 -0.52 0.00 0.00 37.83 34.73 1jd2 s LYS 192 CO 0.07 -0.63 1.64 0.54 -0.92 0.00 0.00 175.35 176.06 1jd2 n ARG 193 N 3.85 2.07 0.00 1.68 1.74 -1.26 -2.04 116.66 122.71 1jd2 n ARG 193 Ca 0.14 -2.18 0.11 0.00 -0.77 0.00 0.00 57.85 55.14 1jd2 n ARG 193 Cb 0.38 -1.87 0.09 0.00 -1.02 0.00 0.00 32.46 30.04 1jd2 n ARG 193 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71