#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jd2 s THR 2 N 0.00 0.58 -0.02 12.58 2.01 -1.26 -1.08 115.64 128.45 1jd2 s THR 2 Ca 0.00 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 61.89 1jd2 s THR 2 Cb 0.00 -0.79 -0.01 0.00 0.01 0.00 0.00 72.50 71.72 1jd2 s THR 2 CO 0.00 0.17 -0.14 0.27 -0.69 0.00 0.00 174.62 174.23 1jd2 s ILE 3 N 1.88 1.13 0.11 1.82 -4.36 -0.38 -1.97 121.20 119.44 1jd2 s ILE 3 Ca 0.03 -0.59 0.02 0.00 -0.26 0.00 0.00 60.65 59.86 1jd2 s ILE 3 Cb -0.14 -0.96 -0.04 0.00 1.25 0.00 0.00 42.46 42.57 1jd2 s ILE 3 CO -0.07 0.33 -0.06 0.68 0.24 0.00 0.00 174.94 176.06 1jd2 s VAL 4 N -0.16 0.75 -0.14 8.37 -7.23 -0.35 -0.76 120.40 120.88 1jd2 s VAL 4 Ca 0.02 -1.96 -0.07 0.00 -1.81 0.00 0.00 61.98 58.16 1jd2 s VAL 4 Cb -0.07 -1.75 0.05 0.00 0.56 0.00 0.00 36.38 35.17 1jd2 s VAL 4 CO 0.00 -0.82 0.33 -0.83 -0.31 0.00 0.00 175.10 173.47 1jd2 s GLY 5 N -3.07 -0.23 -0.05 2.32 0.00 -0.07 -0.73 107.32 105.49 1jd2 s GLY 5 Ca 0.14 1.26 0.00 0.00 0.00 0.00 0.00 44.72 46.12 1jd2 s GLY 5 CO -0.03 1.47 -0.02 0.14 0.00 0.00 0.00 173.10 174.66 1jd2 s VAL 6 N 1.34 0.43 0.25 1.40 1.01 -0.49 -0.78 120.40 123.57 1jd2 s VAL 6 Ca -0.09 -0.02 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 1jd2 s VAL 6 Cb -0.09 -0.51 -0.08 0.00 0.00 0.00 0.00 36.38 35.70 1jd2 s VAL 6 CO -0.11 0.22 0.69 -0.75 0.00 0.00 0.00 175.10 175.15 1jd2 s LYS 7 N 1.22 4.07 0.20 2.72 2.20 0.24 -2.20 119.74 128.21 1jd2 s LYS 7 Ca -0.06 0.68 0.01 0.00 -0.36 0.00 0.00 55.97 56.24 1jd2 s LYS 7 Cb -0.14 -2.69 -0.05 0.00 -1.51 0.00 0.00 37.83 33.45 1jd2 s LYS 7 CO -0.02 0.31 0.05 -0.59 -0.36 0.00 0.00 175.35 174.74 1jd2 s PHE 8 N -1.72 1.31 0.29 4.03 -0.12 -1.16 -4.79 117.98 115.82 1jd2 s PHE 8 Ca 0.47 -1.13 0.18 0.00 -0.05 0.00 0.00 56.93 56.41 1jd2 s PHE 8 Cb -0.13 -0.74 1.03 0.00 -0.63 0.00 0.00 43.02 42.54 1jd2 s PHE 8 CO 0.19 -0.32 1.15 0.27 -0.05 0.00 0.00 175.22 176.47 1jd2 n ASN 9 N -0.32 0.22 -2.43 1.98 0.23 -0.78 -2.28 115.26 111.88 1jd2 n ASN 9 Ca -0.03 1.15 0.01 0.00 -0.53 0.00 0.00 54.58 55.17 1jd2 n ASN 9 Cb 0.65 -0.56 0.04 0.00 -2.08 0.00 0.00 39.78 37.83 1jd2 n ASN 9 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1jd2 n ASN 10 N -4.48 1.14 0.00 0.53 5.15 -1.26 -5.09 115.26 111.24 1jd2 n ASN 10 Ca 0.28 -2.03 0.00 0.00 -0.60 0.00 0.00 54.58 52.24 1jd2 n ASN 10 Cb 1.02 -0.33 0.00 0.00 -0.53 0.00 0.00 39.78 39.94 1jd2 n ASN 10 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1jd2 n GLY 11 N -0.36 -0.75 3.50 8.20 0.00 -0.97 -1.41 105.19 113.40 1jd2 n GLY 11 Ca 0.04 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.58 1jd2 n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jd2 s VAL 12 N -3.90 0.00 0.05 1.61 0.11 -0.29 -2.96 120.40 115.02 1jd2 s VAL 12 Ca 0.00 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.00 1jd2 s VAL 12 Cb 0.00 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 1jd2 s VAL 12 CO 0.00 0.00 0.08 0.54 -3.33 0.00 0.00 175.10 172.39 1jd2 s VAL 13 N -2.48 0.16 0.09 2.04 0.11 -0.93 -1.23 120.40 118.15 1jd2 s VAL 13 Ca -0.01 -1.31 -0.04 0.00 -2.93 0.00 0.00 61.98 57.70 1jd2 s VAL 13 Cb -0.01 -1.15 -0.03 0.00 -1.53 0.00 0.00 36.38 33.67 1jd2 s VAL 13 CO -0.04 -0.72 0.09 0.27 -3.33 0.00 0.00 175.10 171.37 1jd2 s ILE 14 N -3.22 0.16 0.21 7.04 -4.36 -0.75 -1.40 121.20 118.87 1jd2 s ILE 14 Ca 0.00 -1.60 -0.17 0.00 -0.26 0.00 0.00 60.65 58.62 1jd2 s ILE 14 Cb 0.03 -1.61 0.02 0.00 1.25 0.00 0.00 42.46 42.14 1jd2 s ILE 14 CO -0.07 -0.71 0.54 0.00 0.24 0.00 0.00 174.94 174.94 1jd2 s ALA 15 N -3.93 -0.88 0.06 2.27 0.00 0.09 -1.90 121.76 117.45 1jd2 s ALA 15 Ca 0.11 -0.31 -0.27 0.00 0.00 0.00 0.00 51.96 51.50 1jd2 s ALA 15 Cb 0.06 0.88 0.09 0.00 0.00 0.00 0.00 23.12 24.15 1jd2 s ALA 15 CO -0.07 -0.83 0.79 0.00 0.00 0.00 0.00 175.76 175.65 1jd2 s ALA 16 N -3.90 -1.74 1.00 0.00 0.00 0.05 -1.20 121.76 115.97 1jd2 s ALA 16 Ca 0.11 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.88 1jd2 s ALA 16 Cb -0.01 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.69 1jd2 s ALA 16 CO -0.00 -0.73 0.00 -0.40 0.00 0.00 0.00 175.76 174.63 1jd2 n ASP 17 N -0.30 0.00 -0.85 0.00 5.75 -0.83 -1.30 116.55 119.02 1jd2 n ASP 17 Ca -0.11 0.00 -0.01 0.00 -0.01 0.00 0.00 54.79 54.66 1jd2 n ASP 17 Cb 0.63 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.71 1jd2 n ASP 17 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1jd2 n THR 18 N -0.19 0.00 -3.78 2.12 -2.24 -1.06 -4.52 114.28 104.61 1jd2 n THR 18 Ca 0.00 -0.23 -0.35 0.00 -2.27 0.00 0.00 64.05 61.20 1jd2 n THR 18 Cb 0.00 0.48 -0.09 0.00 -2.10 0.00 0.00 70.33 68.63 1jd2 n THR 18 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1jd2 s ARG 19 N 0.00 4.13 -0.05 -0.78 3.52 -1.25 -1.06 118.95 123.46 1jd2 s ARG 19 Ca 0.08 -0.25 0.06 0.00 -0.13 0.00 0.00 55.73 55.48 1jd2 s ARG 19 Cb 0.09 -3.39 -0.01 0.00 -1.56 0.00 0.00 34.95 30.09 1jd2 s ARG 19 CO -0.04 0.26 -0.22 0.45 -0.81 0.00 0.00 175.30 174.94 1jd2 s SER 20 N 0.45 2.75 -0.01 -2.12 0.15 -1.06 -4.79 113.70 109.07 1jd2 s SER 20 Ca 0.07 -0.46 -0.04 0.00 0.70 0.00 0.00 55.95 56.22 1jd2 s SER 20 Cb -0.12 -0.74 -0.00 0.00 -1.71 0.00 0.00 66.02 63.45 1jd2 s SER 20 CO -0.01 0.22 0.08 0.42 1.20 0.00 0.00 173.24 175.14 1jd2 s THR 21 N -0.11 0.05 -0.79 6.45 -4.23 -1.26 0.30 115.64 116.06 1jd2 s THR 21 Ca -0.03 -0.45 -0.09 0.00 -1.18 0.00 0.00 61.69 59.94 1jd2 s THR 21 Cb -0.13 -0.26 0.20 0.00 1.34 0.00 0.00 72.50 73.65 1jd2 s THR 21 CO 0.03 -0.25 0.69 -1.10 -0.54 0.00 0.00 174.62 173.45 1jd2 s GLN 22 N -0.79 3.28 7.40 3.99 -0.21 0.17 -4.84 119.66 128.66 1jd2 s GLN 22 Ca -0.09 -2.61 0.00 0.00 0.02 0.00 0.00 55.36 52.68 1jd2 s GLN 22 Cb -0.05 -4.17 0.00 0.00 1.00 0.00 0.00 33.01 29.79 1jd2 s GLN 22 CO 0.00 -1.25 0.00 0.41 -2.12 0.00 0.00 175.29 172.34 1jd2 n GLY 23 N 3.57 1.78 0.84 3.09 0.00 -1.26 -2.57 105.19 110.65 1jd2 n GLY 23 Ca 0.13 -0.50 0.12 0.00 0.00 0.00 0.00 46.02 45.77 1jd2 n GLY 23 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1jd2 n PRO 24 N 12.15 2.11 -4.08 1.61 -0.04 -1.26 -4.89 135.00 140.60 1jd2 n PRO 24 Ca 0.00 -1.66 -0.35 0.00 -0.04 0.00 0.00 63.50 61.45 1jd2 n PRO 24 Cb 0.00 -1.46 -0.11 0.00 -0.04 0.00 0.00 33.50 31.89 1jd2 n PRO 24 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1jd2 s ILE 25 N -1.75 4.45 -0.26 0.52 -1.09 -1.06 -5.06 121.20 116.94 1jd2 s ILE 25 Ca 0.34 -0.15 -0.29 0.00 -2.23 0.00 0.00 60.65 58.32 1jd2 s ILE 25 Cb 0.20 -3.00 -0.02 0.00 -1.58 0.00 0.00 42.46 38.06 1jd2 s ILE 25 CO 0.30 0.45 1.62 -0.69 -1.23 0.00 0.00 174.94 175.38 1jd2 s VAL 26 N 0.58 3.70 -0.01 2.92 1.01 -1.26 -0.66 120.40 126.67 1jd2 s VAL 26 Ca 0.01 0.77 -0.19 0.00 0.00 0.00 0.00 61.98 62.56 1jd2 s VAL 26 Cb -0.13 -3.76 -0.33 0.00 0.00 0.00 0.00 36.38 32.15 1jd2 s VAL 26 CO 0.02 -0.36 0.94 0.00 0.00 0.00 0.00 175.10 175.69 1jd2 h ALA 27 N 11.04 -0.12 -3.25 5.51 0.00 -0.48 -3.45 119.26 128.51 1jd2 h ALA 27 Ca -0.33 -0.76 -0.42 0.00 0.00 0.00 0.00 54.91 53.40 1jd2 h ALA 27 Cb 1.15 0.13 -0.39 0.00 0.00 0.00 0.00 17.79 18.68 1jd2 h ALA 27 CO 1.02 0.51 -0.75 0.34 0.00 0.00 0.00 179.25 180.36 1jd2 s ASP 28 N -7.24 1.65 0.00 0.00 3.68 -1.07 -4.99 116.67 108.70 1jd2 s ASP 28 Ca -0.12 -0.17 0.07 0.00 2.13 0.00 0.00 52.55 54.47 1jd2 s ASP 28 Cb 0.02 -0.31 0.44 0.00 -1.45 0.00 0.00 42.92 41.63 1jd2 s ASP 28 CO 0.88 -0.25 1.02 0.29 0.13 0.00 0.00 175.17 177.24 1jd2 n LYS 29 N 5.22 0.68 -2.68 4.34 5.02 -1.26 -2.55 118.16 126.92 1jd2 n LYS 29 Ca -0.06 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.19 1jd2 n LYS 29 Cb 0.50 -1.17 0.10 0.00 -0.02 0.00 0.00 35.03 34.43 1jd2 n LYS 29 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1jd2 n ASN 30 N -0.67 -1.50 -4.89 4.39 4.05 -0.64 -4.73 115.26 111.27 1jd2 n ASN 30 Ca 0.06 -2.21 -0.30 0.00 0.45 0.00 0.00 54.58 52.57 1jd2 n ASN 30 Cb 0.03 1.23 -0.04 0.00 1.23 0.00 0.00 39.78 42.23 1jd2 n ASN 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1jd2 s ALA 32 N -2.02 3.51 -2.22 0.00 0.00 -1.26 -4.51 121.76 115.25 1jd2 s ALA 32 Ca 0.46 -0.58 0.22 0.00 0.00 0.00 0.00 51.96 52.06 1jd2 s ALA 32 Cb -0.11 -3.22 0.46 0.00 0.00 0.00 0.00 23.12 20.25 1jd2 s ALA 32 CO 0.27 -1.20 1.41 1.63 0.00 0.00 0.00 175.76 177.87 1jd2 n LYS 33 N 6.09 2.52 -4.26 0.00 5.02 -1.26 -4.88 118.16 121.39 1jd2 n LYS 33 Ca 0.01 -2.34 -0.34 0.00 -2.02 0.00 0.00 58.31 53.62 1jd2 n LYS 33 Cb 0.48 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.88 1jd2 n LYS 33 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1jd2 s LEU 34 N -1.32 3.50 -0.01 -0.35 1.02 -1.26 -1.54 118.68 118.72 1jd2 s LEU 34 Ca 0.40 -0.01 0.06 0.00 0.02 0.00 0.00 54.13 54.59 1jd2 s LEU 34 Cb 0.22 -1.85 -0.01 0.00 0.02 0.00 0.00 46.19 44.57 1jd2 s LEU 34 CO 0.31 0.21 -0.18 -1.00 0.02 0.00 0.00 176.35 175.71 1jd2 s HIS 35 N 0.14 1.60 -0.15 0.29 3.76 0.98 -4.99 115.29 116.92 1jd2 s HIS 35 Ca 0.01 -0.31 -0.22 0.00 -0.15 0.00 0.00 55.06 54.40 1jd2 s HIS 35 Cb -0.13 -1.03 -0.03 0.00 1.11 0.00 0.00 32.58 32.51 1jd2 s HIS 35 CO 0.02 -0.02 0.65 0.50 -0.85 0.00 0.00 174.74 175.04 1jd2 s ARG 36 N -0.46 4.30 -0.26 1.40 3.52 -1.26 -1.11 118.95 125.07 1jd2 s ARG 36 Ca 0.07 0.71 -0.16 0.00 -0.13 0.00 0.00 55.73 56.22 1jd2 s ARG 36 Cb -0.07 -3.52 -0.13 0.00 -1.56 0.00 0.00 34.95 29.66 1jd2 s ARG 36 CO -0.01 -0.11 -0.24 -0.89 -0.81 0.00 0.00 175.30 173.24 1jd2 n ILE 37 N 4.32 1.53 -3.95 4.11 5.41 -0.28 -4.84 119.36 125.65 1jd2 n ILE 37 Ca -0.01 -0.31 -0.09 0.00 1.00 0.00 0.00 62.75 63.34 1jd2 n ILE 37 Cb 0.50 -1.92 -0.08 0.00 -0.71 0.00 0.00 39.64 37.44 1jd2 n ILE 37 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1jd2 s SER 38 N -7.36 0.11 0.28 4.38 1.04 -0.98 -4.56 113.70 106.61 1jd2 s SER 38 Ca -0.37 -0.84 0.10 0.00 0.48 0.00 0.00 55.95 55.32 1jd2 s SER 38 Cb 0.13 0.38 0.89 0.00 0.10 0.00 0.00 66.02 67.52 1jd2 s SER 38 CO 0.51 -0.81 1.30 -2.65 0.98 0.00 0.00 173.24 172.57 1jd2 n PRO 39 N -0.14 -0.06 -1.40 4.02 -0.02 -1.26 -0.55 135.00 135.59 1jd2 n PRO 39 Ca -0.10 1.19 -0.07 0.00 -2.02 0.00 0.00 63.50 62.50 1jd2 n PRO 39 Cb 0.63 -2.01 0.11 0.00 -0.02 0.00 0.00 33.50 32.20 1jd2 n PRO 39 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1jd2 n LYS 40 N -5.02 2.32 -3.51 -0.52 5.02 -1.26 -4.73 118.16 110.46 1jd2 n LYS 40 Ca 0.26 -3.58 -0.20 0.00 -2.02 0.00 0.00 58.31 52.77 1jd2 n LYS 40 Cb 0.86 -1.77 -0.13 0.00 -0.02 0.00 0.00 35.03 33.97 1jd2 n LYS 40 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1jd2 s ILE 41 N -3.60 -0.28 0.16 -0.18 1.01 0.29 -0.72 121.20 117.88 1jd2 s ILE 41 Ca 0.42 -0.16 0.11 0.00 0.00 0.00 0.00 60.65 61.02 1jd2 s ILE 41 Cb 0.38 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 42.13 1jd2 s ILE 41 CO -0.03 -0.24 -0.25 0.26 0.00 0.00 0.00 174.94 174.68 1jd2 s TRP 42 N 2.29 2.24 0.02 3.97 0.52 0.55 -1.13 118.94 127.40 1jd2 s TRP 42 Ca 0.06 -0.38 0.02 0.00 0.02 0.00 0.00 56.10 55.83 1jd2 s TRP 42 Cb -0.16 -1.15 -0.01 0.00 -1.15 0.00 0.00 33.47 31.00 1jd2 s TRP 42 CO -0.13 0.42 -0.07 0.00 0.02 0.00 0.00 176.95 177.18 1jd2 s ALA 44 N -0.63 2.72 0.02 0.00 0.00 0.11 -0.01 121.76 123.98 1jd2 s ALA 44 Ca -0.02 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 50.99 1jd2 s ALA 44 Cb -0.05 -1.00 -0.02 0.00 0.00 0.00 0.00 23.12 22.04 1jd2 s ALA 44 CO 0.00 0.56 -0.09 0.20 0.00 0.00 0.00 175.76 176.43 1jd2 s GLY 45 N -0.80 0.52 0.07 0.00 0.00 -0.59 -0.98 107.32 105.53 1jd2 s GLY 45 Ca 0.12 -0.61 0.03 0.00 0.00 0.00 0.00 44.72 44.26 1jd2 s GLY 45 CO 0.01 -0.60 -0.09 0.00 0.00 0.00 0.00 173.10 172.42 1jd2 s ALA 46 N -0.79 0.80 0.00 3.20 0.00 0.18 -4.91 121.76 120.24 1jd2 s ALA 46 Ca -0.02 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 50.96 1jd2 s ALA 46 Cb -0.07 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1jd2 s ALA 46 CO 0.00 -0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.13 1jd2 n GLY 47 N 1.00 0.22 3.63 0.00 0.00 -1.26 -0.78 105.19 108.00 1jd2 n GLY 47 Ca -0.19 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 1jd2 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jd2 s THR 48 N -1.38 4.00 0.22 2.61 2.01 0.36 -4.90 115.64 118.57 1jd2 s THR 48 Ca 0.00 1.13 -0.18 0.00 0.31 0.00 0.00 61.69 62.95 1jd2 s THR 48 Cb 0.00 -4.02 0.22 0.00 0.01 0.00 0.00 72.50 68.70 1jd2 s THR 48 CO 0.00 -0.43 1.56 0.00 -0.69 0.00 0.00 174.62 175.07 1jd2 h ALA 49 N 9.75 0.13 -0.75 7.40 0.00 -1.94 -1.21 119.26 132.64 1jd2 h ALA 49 Ca -0.28 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1jd2 h ALA 49 Cb 1.11 0.94 -0.04 0.00 0.00 0.00 0.00 17.79 19.80 1jd2 h ALA 49 CO 1.02 -0.63 0.44 0.00 0.00 0.00 0.00 179.25 180.09 1jd2 h ALA 50 N 1.30 0.95 -0.55 0.00 0.00 -1.97 -2.73 119.26 116.26 1jd2 h ALA 50 Ca 0.32 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1jd2 h ALA 50 Cb 0.59 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1jd2 h ALA 50 CO -0.90 0.43 0.09 -0.44 0.00 0.00 0.00 179.25 178.42 1jd2 h ASP 51 N 1.02 0.83 -0.70 0.00 3.45 -1.57 -0.61 116.42 118.85 1jd2 h ASP 51 Ca 0.27 -0.18 0.02 0.00 0.43 0.00 0.00 57.03 57.57 1jd2 h ASP 51 Cb -0.03 -0.22 -0.04 0.00 -0.56 0.00 0.00 39.33 38.48 1jd2 h ASP 51 CO -0.05 0.85 0.44 0.71 -1.57 0.00 0.00 179.24 179.62 1jd2 h THR 52 N 0.84 1.12 -0.36 0.35 1.35 -1.12 -0.24 112.91 114.85 1jd2 h THR 52 Ca 0.17 -0.30 -0.13 0.00 -0.55 0.00 0.00 66.41 65.60 1jd2 h THR 52 Cb 0.37 0.16 -0.01 0.00 -1.73 0.00 0.00 68.15 66.95 1jd2 h THR 52 CO 0.01 0.16 -0.28 -0.08 -0.25 0.00 0.00 175.52 175.08 1jd2 h GLU 53 N 0.88 0.83 0.42 4.72 4.57 -1.21 -2.72 114.58 122.06 1jd2 h GLU 53 Ca 0.27 -0.41 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 1jd2 h GLU 53 Cb -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.57 1jd2 h GLU 53 CO -0.09 1.04 -0.20 0.00 -1.18 0.00 0.00 179.01 178.58 1jd2 h ALA 54 N 0.76 -0.56 0.00 2.92 0.00 -0.81 0.24 119.26 121.82 1jd2 h ALA 54 Ca 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1jd2 h ALA 54 Cb 0.86 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1jd2 h ALA 54 CO 0.07 -0.68 -0.05 -0.24 0.00 0.00 0.00 179.25 178.35 1jd2 h VAL 55 N -0.83 0.25 0.00 0.00 3.04 -1.16 -0.57 116.25 116.98 1jd2 h VAL 55 Ca -0.06 -0.36 -0.10 0.00 -1.01 0.00 0.00 66.70 65.18 1jd2 h VAL 55 Cb 0.55 1.28 0.01 0.00 -2.01 0.00 0.00 31.29 31.12 1jd2 h VAL 55 CO 0.09 0.05 -0.37 0.74 -1.01 0.00 0.00 177.57 177.07 1jd2 h THR 56 N 0.00 1.51 0.32 3.17 2.02 -1.24 -2.94 112.91 115.76 1jd2 h THR 56 Ca -0.00 -2.01 -0.02 0.00 0.77 0.00 0.00 66.41 65.16 1jd2 h THR 56 Cb 0.27 2.73 0.00 0.00 -1.74 0.00 0.00 68.15 69.42 1jd2 h THR 56 CO 0.01 0.56 -0.15 1.56 0.37 0.00 0.00 175.52 177.86 1jd2 h GLN 57 N -0.38 -0.41 -0.86 6.66 4.20 -0.56 -0.07 115.11 123.69 1jd2 h GLN 57 Ca -0.05 0.03 0.10 0.00 0.06 0.00 0.00 58.65 58.79 1jd2 h GLN 57 Cb 1.12 0.09 -0.12 0.00 0.30 0.00 0.00 27.48 28.87 1jd2 h GLN 57 CO 0.07 -0.09 -0.52 1.25 -0.67 0.00 0.00 178.83 178.87 1jd2 h LEU 58 N -0.81 -1.88 -0.47 1.46 5.85 -1.25 0.44 115.31 118.66 1jd2 h LEU 58 Ca -0.04 0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 1jd2 h LEU 58 Cb 0.52 0.85 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 1jd2 h LEU 58 CO 0.07 -0.28 0.10 0.40 -0.34 0.00 0.00 178.44 178.39 1jd2 h ILE 59 N -0.08 1.24 -0.79 4.05 5.03 -1.57 -0.89 117.51 124.50 1jd2 h ILE 59 Ca 0.19 -0.86 0.19 0.00 -0.12 0.00 0.00 64.86 64.26 1jd2 h ILE 59 Cb 0.50 0.89 -0.14 0.00 -3.03 0.00 0.00 36.82 35.04 1jd2 h ILE 59 CO -0.87 0.31 0.06 1.23 -0.68 0.00 0.00 178.15 178.19 1jd2 h GLY 60 N 0.64 0.97 0.18 5.37 0.00 0.17 0.47 103.07 110.87 1jd2 h GLY 60 Ca 0.15 0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.55 1jd2 h GLY 60 CO 0.00 -0.31 -0.09 0.23 0.00 0.00 0.00 176.54 176.38 1jd2 h SER 61 N 0.13 -0.21 -0.86 0.19 0.87 -0.03 0.11 113.55 113.75 1jd2 h SER 61 Ca 0.45 0.01 0.25 0.00 -1.23 0.00 0.00 61.79 61.27 1jd2 h SER 61 Cb 0.82 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.80 1jd2 h SER 61 CO -0.67 -0.14 0.93 0.78 -0.53 0.00 0.00 176.83 177.20 1jd2 h ASN 62 N -0.27 0.00 0.06 6.23 2.35 -0.36 0.48 115.58 124.07 1jd2 h ASN 62 Ca -0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1jd2 h ASN 62 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1jd2 h ASN 62 CO 0.04 0.00 -0.03 0.40 -1.65 0.00 0.00 177.43 176.19 1jd2 h ILE 63 N 0.00 0.85 -0.88 2.81 1.08 0.43 -2.89 117.51 118.91 1jd2 h ILE 63 Ca 0.41 -1.48 0.23 0.00 -0.39 0.00 0.00 64.86 63.64 1jd2 h ILE 63 Cb 2.27 1.55 -0.15 0.00 -3.07 0.00 0.00 36.82 37.42 1jd2 h ILE 63 CO -0.00 0.27 0.18 -0.08 -0.69 0.00 0.00 178.15 177.82 1jd2 h GLU 64 N -0.96 0.16 0.58 2.37 4.81 0.26 -0.47 114.58 121.33 1jd2 h GLU 64 Ca -0.01 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1jd2 h GLU 64 Cb 0.50 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 29.85 1jd2 h GLU 64 CO 0.01 0.10 -0.28 -0.07 -0.73 0.00 0.00 179.01 178.05 1jd2 h LEU 65 N 0.16 -0.66 -0.82 1.64 3.38 -1.42 -2.89 115.31 114.71 1jd2 h LEU 65 Ca 0.54 0.02 0.34 0.00 0.09 0.00 0.00 57.88 58.87 1jd2 h LEU 65 Cb 1.09 0.17 -0.15 0.00 0.09 0.00 0.00 40.66 41.87 1jd2 h LEU 65 CO -0.69 -0.44 0.42 1.57 0.09 0.00 0.00 178.44 179.40 1jd2 n HIS 66 N -4.32 0.94 0.25 1.13 -0.00 -0.28 -0.15 115.22 112.79 1jd2 n HIS 66 Ca -0.10 0.96 -0.14 0.00 0.46 0.00 0.00 57.72 58.91 1jd2 n HIS 66 Cb 0.31 -1.37 -0.07 0.00 -0.12 0.00 0.00 29.99 28.73 1jd2 n HIS 66 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1jd2 h SER 67 N 0.00 -0.55 -0.69 0.26 0.87 -1.15 -2.22 113.55 110.06 1jd2 h SER 67 Ca 0.69 -0.08 0.15 0.00 -1.23 0.00 0.00 61.79 61.32 1jd2 h SER 67 Cb 1.80 0.14 -0.12 0.00 -0.44 0.00 0.00 62.40 63.79 1jd2 h SER 67 CO -0.63 -0.19 0.03 -0.07 -0.53 0.00 0.00 176.83 175.44 1jd2 h LEU 68 N -0.98 -0.25 -2.72 2.23 4.07 -0.35 0.89 115.31 118.20 1jd2 h LEU 68 Ca -0.07 0.17 -0.00 0.00 0.08 0.00 0.00 57.88 58.06 1jd2 h LEU 68 Cb 0.60 0.29 -0.00 0.00 1.08 0.00 0.00 40.66 42.62 1jd2 h LEU 68 CO 0.11 -0.13 -0.00 0.22 -1.08 0.00 0.00 178.44 177.56 1jd2 h TYR 69 N 0.14 0.00 -0.05 1.13 5.03 -1.25 -2.55 116.97 119.42 1jd2 h TYR 69 Ca 0.38 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.69 1jd2 h TYR 69 Cb 0.64 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.92 1jd2 h TYR 69 CO -0.37 0.00 0.00 0.25 -1.32 0.00 0.00 178.16 176.72 1jd2 n THR 70 N -3.14 0.32 -3.76 1.81 -2.24 0.26 -4.99 114.28 102.54 1jd2 n THR 70 Ca -0.02 -0.66 -0.29 0.00 -2.27 0.00 0.00 64.05 60.81 1jd2 n THR 70 Cb 0.11 0.90 -0.02 0.00 -2.10 0.00 0.00 70.33 69.22 1jd2 n THR 70 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1jd2 n SER 71 N 0.13 -3.28 -4.04 3.42 7.64 0.15 -4.93 113.62 112.70 1jd2 n SER 71 Ca 0.03 -0.66 -0.13 0.00 1.01 0.00 0.00 58.87 59.12 1jd2 n SER 71 Cb 0.18 -2.72 -0.12 0.00 -1.01 0.00 0.00 64.21 60.54 1jd2 n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1jd2 s ARG 72 N -6.42 0.51 0.63 1.43 0.52 -1.22 -5.07 118.95 109.32 1jd2 s ARG 72 Ca 0.56 -0.65 -0.16 0.00 -0.52 0.00 0.00 55.73 54.95 1jd2 s ARG 72 Cb -0.30 -0.31 -0.02 0.00 0.52 0.00 0.00 34.95 34.84 1jd2 s ARG 72 CO 0.68 0.06 1.12 -1.21 0.02 0.00 0.00 175.30 175.98 1jd2 s GLU 73 N -1.32 2.92 0.75 3.54 0.41 -1.26 -4.62 118.70 119.12 1jd2 s GLU 73 Ca -0.08 1.48 -0.11 0.00 -0.41 0.00 0.00 54.97 55.86 1jd2 s GLU 73 Cb -0.09 -1.96 0.04 0.00 -1.78 0.00 0.00 34.13 30.34 1jd2 s GLU 73 CO 0.00 -1.17 1.08 -2.14 -0.49 0.00 0.00 175.26 172.54 1jd2 s PRO 74 N -3.84 2.50 0.00 0.39 0.02 -1.26 -4.92 135.00 127.89 1jd2 s PRO 74 Ca 0.69 0.97 0.08 0.00 0.02 0.00 0.00 61.00 62.76 1jd2 s PRO 74 Cb -0.22 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.33 1jd2 s PRO 74 CO 0.37 -1.41 -0.25 1.03 -0.33 0.00 0.00 177.00 176.42 1jd2 s ARG 75 N -5.01 2.04 0.15 5.54 0.52 -1.26 -4.66 118.95 116.27 1jd2 s ARG 75 Ca 0.60 -0.97 -0.16 0.00 -0.52 0.00 0.00 55.73 54.67 1jd2 s ARG 75 Cb -0.15 -2.06 0.03 0.00 0.52 0.00 0.00 34.95 33.28 1jd2 s ARG 75 CO 0.55 0.55 1.80 0.28 0.02 0.00 0.00 175.30 178.50 1jd2 h VAL 76 N 4.36 1.06 -0.04 3.52 2.07 -1.91 -0.08 116.25 125.23 1jd2 h VAL 76 Ca -0.45 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 66.92 1jd2 h VAL 76 Cb 1.13 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1jd2 h VAL 76 CO 0.46 0.09 0.33 -0.37 0.02 0.00 0.00 177.57 178.10 1jd2 h VAL 77 N 0.48 0.04 0.07 2.57 -1.51 -1.98 0.19 116.25 116.11 1jd2 h VAL 77 Ca 0.15 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.62 1jd2 h VAL 77 Cb -0.01 0.68 0.00 0.00 -2.13 0.00 0.00 31.29 29.83 1jd2 h VAL 77 CO -0.06 0.00 -0.03 0.28 -1.23 0.00 0.00 177.57 176.53 1jd2 h SER 78 N 0.00 -0.08 -1.07 4.19 0.02 -1.43 -1.79 113.55 113.39 1jd2 h SER 78 Ca 0.02 0.00 0.33 0.00 -0.84 0.00 0.00 61.79 61.30 1jd2 h SER 78 Cb 0.68 0.02 -0.13 0.00 0.14 0.00 0.00 62.40 63.11 1jd2 h SER 78 CO -0.00 0.22 0.65 0.00 -1.14 0.00 0.00 176.83 176.56 1jd2 h ALA 79 N -1.40 2.15 0.01 3.77 0.00 -0.96 0.76 119.26 123.59 1jd2 h ALA 79 Ca -0.01 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1jd2 h ALA 79 Cb 0.07 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1jd2 h ALA 79 CO 0.02 -0.72 -0.01 1.25 0.00 0.00 0.00 179.25 179.79 1jd2 h LEU 80 N 0.31 -0.02 -0.93 0.00 5.85 -0.75 0.26 115.31 120.04 1jd2 h LEU 80 Ca 0.72 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 59.17 1jd2 h LEU 80 Cb 1.78 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.80 1jd2 h LEU 80 CO -0.49 0.18 -0.07 -0.61 -0.34 0.00 0.00 178.44 177.10 1jd2 h GLN 81 N -0.21 0.71 -0.26 1.25 5.75 0.13 -0.55 115.11 121.92 1jd2 h GLN 81 Ca -0.00 -0.21 -0.02 0.00 -0.15 0.00 0.00 58.65 58.27 1jd2 h GLN 81 Cb 0.20 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.67 1jd2 h GLN 81 CO 0.00 0.77 0.10 0.52 -2.65 0.00 0.00 178.83 177.57 1jd2 h MET 82 N 0.65 0.39 0.26 1.69 2.86 -0.40 -1.94 114.93 118.43 1jd2 h MET 82 Ca 0.12 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 1jd2 h MET 82 Cb 0.51 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1jd2 h MET 82 CO 0.03 0.44 -0.12 -0.07 1.06 0.00 0.00 176.91 178.24 1jd2 h LEU 83 N 0.27 -0.29 -0.17 1.22 3.38 -0.27 -2.95 115.31 116.50 1jd2 h LEU 83 Ca 0.09 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1jd2 h LEU 83 Cb 0.20 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1jd2 h LEU 83 CO -0.01 -0.05 0.01 0.07 0.09 0.00 0.00 178.44 178.55 1jd2 h LYS 84 N -0.53 0.07 0.00 1.13 2.10 -1.07 -1.04 116.57 117.23 1jd2 h LYS 84 Ca -0.04 -0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.56 1jd2 h LYS 84 Cb 0.39 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.70 1jd2 h LYS 84 CO 0.06 0.04 -0.25 1.96 -2.00 0.00 0.00 179.45 179.27 1jd2 h GLN 85 N 0.07 0.00 0.17 0.07 4.20 -1.44 0.22 115.11 118.40 1jd2 h GLN 85 Ca 0.08 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1jd2 h GLN 85 Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1jd2 h GLN 85 CO -0.12 0.25 -0.08 1.25 -0.67 0.00 0.00 178.83 179.45 1jd2 h HIS 86 N 0.00 -0.21 -0.10 2.96 2.76 -1.26 -1.78 115.15 117.53 1jd2 h HIS 86 Ca -0.00 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1jd2 h HIS 86 Cb 0.47 0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.48 1jd2 h HIS 86 CO 0.00 0.19 0.01 -0.07 -1.30 0.00 0.00 177.93 176.75 1jd2 h LEU 87 N -0.68 -0.02 -2.00 0.26 3.38 -0.81 -2.01 115.31 113.42 1jd2 h LEU 87 Ca -0.02 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1jd2 h LEU 87 Cb 0.49 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1jd2 h LEU 87 CO 0.04 0.00 0.03 0.15 0.09 0.00 0.00 178.44 178.75 1jd2 h PHE 88 N 0.04 0.00 -0.28 1.13 3.57 -0.61 -1.40 116.94 119.39 1jd2 h PHE 88 Ca 0.05 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.58 1jd2 h PHE 88 Cb 0.05 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 1jd2 h PHE 88 CO -0.12 0.00 0.09 -0.22 -2.23 0.00 0.00 178.31 175.83 1jd2 h LYS 89 N 0.00 0.20 -1.41 1.11 3.64 -0.56 -3.09 116.57 116.46 1jd2 h LYS 89 Ca 0.02 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1jd2 h LYS 89 Cb 0.08 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1jd2 h LYS 89 CO -0.00 0.13 0.05 0.66 -2.27 0.00 0.00 179.45 178.02 1jd2 n TYR 90 N -5.04 0.21 -0.41 1.91 4.01 -0.53 -4.89 117.16 112.42 1jd2 n TYR 90 Ca -0.01 -0.83 0.00 0.00 -0.16 0.00 0.00 57.90 56.90 1jd2 n TYR 90 Cb 0.11 -0.42 0.00 0.00 -0.31 0.00 0.00 39.34 38.72 1jd2 n TYR 90 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1jd2 n GLN 91 N 0.81 -0.84 0.00 -0.72 1.13 -1.17 -0.23 117.38 116.36 1jd2 n GLN 91 Ca 0.04 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.10 1jd2 n GLN 91 Cb 0.55 -2.18 0.00 0.00 0.11 0.00 0.00 30.24 28.72 1jd2 n GLN 91 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1jd2 n GLY 93 N 0.00 0.61 0.00 1.08 0.00 -1.25 -4.94 105.19 100.69 1jd2 n GLY 93 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1jd2 n GLY 93 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1jd2 n HIS 94 N -1.40 0.00 -3.45 1.61 8.25 0.68 -4.30 115.22 116.60 1jd2 n HIS 94 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 1jd2 n HIS 94 Cb 0.00 -0.26 -0.07 0.00 1.12 0.00 0.00 29.99 30.78 1jd2 n HIS 94 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1jd2 s ILE 95 N -2.52 4.64 -0.56 1.59 1.01 -1.26 -4.97 121.20 119.13 1jd2 s ILE 95 Ca 0.26 -1.74 -0.06 0.00 0.00 0.00 0.00 60.65 59.10 1jd2 s ILE 95 Cb 0.18 -4.01 -0.06 0.00 0.01 0.00 0.00 42.46 38.57 1jd2 s ILE 95 CO 0.39 -0.83 1.70 0.61 0.00 0.00 0.00 174.94 176.81 1jd2 n GLY 96 N 4.96 2.47 3.24 6.18 0.00 -1.26 -4.71 105.19 116.06 1jd2 n GLY 96 Ca -0.09 -0.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.99 1jd2 n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jd2 s ALA 97 N 4.23 2.72 -0.24 4.61 0.00 -1.26 -0.49 121.76 131.33 1jd2 s ALA 97 Ca 0.29 -1.33 -0.03 0.00 0.00 0.00 0.00 51.96 50.88 1jd2 s ALA 97 Cb 0.07 -1.67 0.01 0.00 0.00 0.00 0.00 23.12 21.53 1jd2 s ALA 97 CO 0.01 -0.63 -0.03 0.71 0.00 0.00 0.00 175.76 175.81 1jd2 s TYR 98 N 1.39 3.02 0.09 0.00 2.02 0.04 -1.62 117.35 122.29 1jd2 s TYR 98 Ca 0.03 -1.17 0.05 0.00 -0.37 0.00 0.00 57.07 55.61 1jd2 s TYR 98 Cb -0.15 -2.11 -0.03 0.00 -0.40 0.00 0.00 41.96 39.26 1jd2 s TYR 98 CO -0.05 -0.62 -0.14 -0.51 -1.57 0.00 0.00 175.55 172.66 1jd2 s LEU 99 N 1.43 2.32 -0.18 -1.29 1.43 0.77 -0.65 118.68 122.51 1jd2 s LEU 99 Ca 0.03 -0.69 0.01 0.00 -1.03 0.00 0.00 54.13 52.45 1jd2 s LEU 99 Cb -0.16 -0.54 0.02 0.00 0.03 0.00 0.00 46.19 45.55 1jd2 s LEU 99 CO -0.03 -0.10 -0.18 -0.63 0.23 0.00 0.00 176.35 175.64 1jd2 s ILE 100 N -1.59 2.00 -0.13 -0.59 1.01 -0.15 0.65 121.20 122.40 1jd2 s ILE 100 Ca 0.02 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 59.73 1jd2 s ILE 100 Cb -0.08 -1.84 0.01 0.00 0.01 0.00 0.00 42.46 40.56 1jd2 s ILE 100 CO 0.02 0.47 -0.20 0.54 0.00 0.00 0.00 174.94 175.78 1jd2 s VAL 101 N 1.30 1.88 0.21 2.92 0.11 -0.73 0.10 120.40 126.19 1jd2 s VAL 101 Ca 0.04 -0.88 -0.06 0.00 -2.93 0.00 0.00 61.98 58.15 1jd2 s VAL 101 Cb -0.14 -1.68 -0.02 0.00 -1.53 0.00 0.00 36.38 33.01 1jd2 s VAL 101 CO -0.12 0.52 0.27 0.00 -3.33 0.00 0.00 175.10 172.44 1jd2 s ALA 102 N 0.84 0.50 0.00 1.54 0.00 -0.14 -2.10 121.76 122.39 1jd2 s ALA 102 Ca -0.08 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.59 1jd2 s ALA 102 Cb -0.15 1.18 0.00 0.00 0.00 0.00 0.00 23.12 24.15 1jd2 s ALA 102 CO -0.01 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.47 1jd2 n GLY 103 N -0.29 -2.65 3.42 0.00 0.00 -1.12 -0.33 105.19 104.21 1jd2 n GLY 103 Ca -0.01 -1.34 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 1jd2 n GLY 103 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1jd2 s VAL 104 N -2.10 2.44 0.20 1.61 -7.23 0.10 -2.59 120.40 112.82 1jd2 s VAL 104 Ca 0.00 -1.69 -0.18 0.00 -1.81 0.00 0.00 61.98 58.30 1jd2 s VAL 104 Cb 0.00 -2.09 0.03 0.00 0.56 0.00 0.00 36.38 34.88 1jd2 s VAL 104 CO 0.00 0.09 0.54 1.51 -0.31 0.00 0.00 175.10 176.93 1jd2 s ASP 105 N -2.09 -0.28 0.54 4.85 3.84 -0.84 -4.70 116.67 117.98 1jd2 s ASP 105 Ca 0.15 -0.45 0.02 0.00 -0.00 0.00 0.00 52.55 52.27 1jd2 s ASP 105 Cb -0.10 0.59 0.09 0.00 -1.38 0.00 0.00 42.92 42.12 1jd2 s ASP 105 CO 0.07 -1.06 0.97 -0.65 -0.00 0.00 0.00 175.17 174.50 1jd2 h PRO 105 N 2.17 0.00 -0.00 2.11 0.11 -1.91 0.33 132.00 134.81 1jd2 h PRO 105 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1jd2 h PRO 105 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1jd2 h PRO 105 CO 0.37 0.00 -0.67 0.25 -0.21 0.00 0.00 178.00 177.73 1jd2 n THR 106 N -2.25 0.00 0.00 -1.15 -2.24 -1.26 -5.07 114.28 102.31 1jd2 n THR 106 Ca -0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1jd2 n THR 106 Cb 0.87 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 1jd2 n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jd2 n GLY 107 N 1.49 0.93 3.87 3.38 0.00 0.12 -5.08 105.19 109.90 1jd2 n GLY 107 Ca 0.06 -1.92 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 1jd2 n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jd2 s SER 108 N -4.00 6.04 -0.01 1.61 1.04 -1.26 -1.99 113.70 115.13 1jd2 s SER 108 Ca 0.00 0.14 -0.13 0.00 0.48 0.00 0.00 55.95 56.44 1jd2 s SER 108 Cb 0.00 -1.77 0.02 0.00 0.10 0.00 0.00 66.02 64.37 1jd2 s SER 108 CO 0.00 0.14 0.26 -1.00 0.98 0.00 0.00 173.24 173.62 1jd2 s HIS 109 N -1.54 -0.12 -0.09 5.02 3.76 -1.07 -5.02 115.29 116.23 1jd2 s HIS 109 Ca 0.33 0.16 -0.04 0.00 -0.15 0.00 0.00 55.06 55.35 1jd2 s HIS 109 Cb -0.12 0.05 0.05 0.00 1.11 0.00 0.00 32.58 33.67 1jd2 s HIS 109 CO 0.26 -0.36 0.21 -1.17 -0.85 0.00 0.00 174.74 172.84 1jd2 s LEU 110 N -1.32 0.43 0.27 0.89 2.96 -1.26 -2.80 118.68 117.85 1jd2 s LEU 110 Ca -0.14 0.45 -0.08 0.00 -0.22 0.00 0.00 54.13 54.15 1jd2 s LEU 110 Cb -0.06 0.60 -0.01 0.00 0.50 0.00 0.00 46.19 47.22 1jd2 s LEU 110 CO 0.03 -0.17 0.42 -0.36 -1.32 0.00 0.00 176.35 174.96 1jd2 s PHE 111 N 1.37 0.72 0.02 5.38 0.08 -0.89 -3.75 117.98 120.90 1jd2 s PHE 111 Ca -0.08 -1.02 0.01 0.00 0.12 0.00 0.00 56.93 55.96 1jd2 s PHE 111 Cb -0.11 -0.02 -0.02 0.00 -0.57 0.00 0.00 43.02 42.31 1jd2 s PHE 111 CO -0.08 -0.99 -0.04 -1.54 -0.10 0.00 0.00 175.22 172.47 1jd2 s SER 112 N -3.11 0.44 -0.05 1.36 1.04 -0.11 -1.77 113.70 111.50 1jd2 s SER 112 Ca 0.28 -0.45 0.02 0.00 0.48 0.00 0.00 55.95 56.27 1jd2 s SER 112 Cb 0.01 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.21 1jd2 s SER 112 CO 0.13 -0.23 -0.08 -0.63 0.98 0.00 0.00 173.24 173.42 1jd2 s ILE 113 N -1.24 0.81 0.01 -1.02 1.01 0.21 -1.36 121.20 119.61 1jd2 s ILE 113 Ca -0.12 -0.29 -0.04 0.00 0.00 0.00 0.00 60.65 60.20 1jd2 s ILE 113 Cb -0.09 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 1jd2 s ILE 113 CO -0.00 0.28 0.22 -1.00 0.00 0.00 0.00 174.94 174.44 1jd2 s HIS 114 N 0.73 3.55 -0.33 3.97 3.76 -0.93 -0.16 115.29 125.87 1jd2 s HIS 114 Ca -0.12 0.42 0.05 0.00 -0.15 0.00 0.00 55.06 55.26 1jd2 s HIS 114 Cb -0.15 -1.88 0.25 0.00 1.11 0.00 0.00 32.58 31.92 1jd2 s HIS 114 CO 0.02 0.62 0.97 0.00 -0.85 0.00 0.00 174.74 175.49 1jd2 n ALA 115 N 0.90 0.57 1.27 -1.40 0.00 -0.64 0.11 120.51 121.31 1jd2 n ALA 115 Ca -0.10 0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.51 1jd2 n ALA 115 Cb 0.52 -0.63 0.35 0.00 0.00 0.00 0.00 19.45 19.70 1jd2 n ALA 115 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1jd2 n HIS 116 N -1.57 0.00 -1.26 0.00 8.25 -1.26 -3.80 115.22 115.58 1jd2 n HIS 116 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1jd2 n HIS 116 Cb 0.27 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.31 1jd2 n HIS 116 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jd2 n GLY 117 N 1.30 1.03 3.60 -1.41 0.00 0.29 -4.30 105.19 105.70 1jd2 n GLY 117 Ca 0.14 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1jd2 n GLY 117 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jd2 s SER 118 N -2.54 4.54 0.21 1.61 1.04 -1.24 -4.77 113.70 112.55 1jd2 s SER 118 Ca 0.00 -0.29 0.10 0.00 0.48 0.00 0.00 55.95 56.24 1jd2 s SER 118 Cb 0.00 -0.95 -0.05 0.00 0.10 0.00 0.00 66.02 65.12 1jd2 s SER 118 CO 0.00 0.21 -0.20 0.42 0.98 0.00 0.00 173.24 174.65 1jd2 s THR 119 N -1.17 2.11 0.09 2.02 -4.23 -1.26 -2.20 115.64 111.01 1jd2 s THR 119 Ca 0.21 -2.11 -0.02 0.00 -1.18 0.00 0.00 61.69 58.58 1jd2 s THR 119 Cb -0.11 -2.06 -0.03 0.00 1.34 0.00 0.00 72.50 71.64 1jd2 s THR 119 CO 0.13 -0.32 0.05 -1.81 -0.54 0.00 0.00 174.62 172.12 1jd2 s ASP 120 N -2.97 0.35 -0.05 3.99 1.01 -0.46 -4.96 116.67 113.58 1jd2 s ASP 120 Ca 0.21 -1.03 -0.05 0.00 0.71 0.00 0.00 52.55 52.40 1jd2 s ASP 120 Cb -0.05 0.27 0.01 0.00 1.01 0.00 0.00 42.92 44.15 1jd2 s ASP 120 CO 0.10 -0.68 0.13 0.54 0.21 0.00 0.00 175.17 175.47 1jd2 s VAL 121 N -3.96 0.00 0.01 -1.27 0.11 -1.26 -0.93 120.40 113.09 1jd2 s VAL 121 Ca 0.14 -0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.91 1jd2 s VAL 121 Cb 0.07 -0.19 0.09 0.00 -1.53 0.00 0.00 36.38 34.82 1jd2 s VAL 121 CO -0.05 -0.00 1.26 -0.83 -3.33 0.00 0.00 175.10 172.14 1jd2 s GLY 122 N 0.06 -0.11 0.15 6.54 0.00 -1.25 -5.04 107.32 107.68 1jd2 s GLY 122 Ca -0.00 0.02 0.25 0.00 0.00 0.00 0.00 44.72 44.99 1jd2 s GLY 122 CO 0.00 5.04 1.50 -1.72 0.00 0.00 0.00 173.10 177.92 1jd2 n TYR 123 N -0.86 0.68 -3.64 1.90 4.02 -1.26 -4.72 117.16 113.27 1jd2 n TYR 123 Ca 0.02 0.20 -0.15 0.00 -0.01 0.00 0.00 57.90 57.97 1jd2 n TYR 123 Cb 0.59 -0.75 -0.08 0.00 -0.02 0.00 0.00 39.34 39.08 1jd2 n TYR 123 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 176.86 177.37 1jd2 s TYR 124 N -3.14 -0.64 0.19 -0.72 1.13 -1.26 0.81 117.35 113.73 1jd2 s TYR 124 Ca 0.08 1.45 -0.20 0.00 -1.41 0.00 0.00 57.07 56.99 1jd2 s TYR 124 Cb 0.13 0.26 0.04 0.00 -1.10 0.00 0.00 41.96 41.30 1jd2 s TYR 124 CO 0.67 -0.40 0.59 -0.51 -2.51 0.00 0.00 175.55 173.39 1jd2 s LEU 125 N -0.13 -0.24 0.17 -3.49 1.43 0.04 -4.99 118.68 111.48 1jd2 s LEU 125 Ca -0.03 -0.30 -0.19 0.00 -1.03 0.00 0.00 54.13 52.57 1jd2 s LEU 125 Cb -0.03 2.43 0.04 0.00 0.03 0.00 0.00 46.19 48.66 1jd2 s LEU 125 CO 0.03 -1.07 0.52 -0.94 0.23 0.00 0.00 176.35 175.12 1jd2 s SER 126 N -2.83 -0.35 0.11 2.29 1.04 -1.26 -0.89 113.70 111.82 1jd2 s SER 126 Ca 0.06 -0.29 -0.19 0.00 0.48 0.00 0.00 55.95 56.00 1jd2 s SER 126 Cb -0.02 0.56 0.05 0.00 0.10 0.00 0.00 66.02 66.71 1jd2 s SER 126 CO -0.05 -0.98 0.48 -0.76 0.98 0.00 0.00 173.24 172.90 1jd2 s LEU 127 N -2.82 0.06 0.00 2.42 1.43 0.06 -4.94 118.68 114.89 1jd2 s LEU 127 Ca 0.05 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1jd2 s LEU 127 Cb -0.00 2.08 0.00 0.00 0.03 0.00 0.00 46.19 48.30 1jd2 s LEU 127 CO -0.08 -0.83 0.00 0.61 0.23 0.00 0.00 176.35 176.27 1jd2 n GLY 128 N -0.05 1.78 0.00 -3.19 0.00 -1.26 -1.25 105.19 101.22 1jd2 n GLY 128 Ca -0.17 -2.20 0.04 0.00 0.00 0.00 0.00 46.02 43.68 1jd2 n GLY 128 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jd2 n SER 129 N 0.00 0.00 -0.68 1.61 3.41 -0.24 0.22 113.62 117.95 1jd2 n SER 129 Ca 0.00 0.49 0.08 0.00 -0.26 0.00 0.00 58.87 59.18 1jd2 n SER 129 Cb 0.00 -0.50 0.09 0.00 -0.26 0.00 0.00 64.21 63.54 1jd2 n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jd2 n GLY 130 N -0.68 0.47 0.37 5.00 0.00 -0.79 -4.68 105.19 104.87 1jd2 n GLY 130 Ca 0.02 -0.47 -0.04 0.00 0.00 0.00 0.00 46.02 45.53 1jd2 n GLY 130 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1jd2 h SER 131 N 3.12 -1.32 -0.20 1.61 0.87 -0.40 -2.49 113.55 114.75 1jd2 h SER 131 Ca 0.00 0.26 0.03 0.00 -1.23 0.00 0.00 61.79 60.85 1jd2 h SER 131 Cb 0.69 0.66 -0.03 0.00 -0.44 0.00 0.00 62.40 63.28 1jd2 h SER 131 CO 0.00 -0.30 0.01 -0.07 -0.53 0.00 0.00 176.83 175.94 1jd2 h LEU 132 N -0.11 -0.06 -0.16 2.23 4.07 -1.83 -0.26 115.31 119.18 1jd2 h LEU 132 Ca 0.26 0.04 0.05 0.00 0.08 0.00 0.00 57.88 58.31 1jd2 h LEU 132 Cb 0.57 0.07 -0.05 0.00 1.08 0.00 0.00 40.66 42.32 1jd2 h LEU 132 CO -0.79 -0.00 -0.17 0.00 -1.08 0.00 0.00 178.44 176.39 1jd2 h ALA 133 N 1.17 -0.08 0.27 1.53 0.00 -1.79 -0.73 119.26 119.62 1jd2 h ALA 133 Ca 0.09 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1jd2 h ALA 133 Cb 0.11 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1jd2 h ALA 133 CO -0.15 -0.62 -0.13 0.00 0.00 0.00 0.00 179.25 178.35 1jd2 h ALA 134 N 0.85 -0.36 -1.12 0.00 0.00 -1.37 -2.47 119.26 114.80 1jd2 h ALA 134 Ca 0.11 -0.16 0.31 0.00 0.00 0.00 0.00 54.91 55.17 1jd2 h ALA 134 Cb 0.36 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 1jd2 h ALA 134 CO -0.28 -0.58 0.77 1.98 0.00 0.00 0.00 179.25 181.14 1jd2 h MET 135 N -0.61 0.17 0.94 0.00 -1.53 -0.83 0.48 114.93 113.55 1jd2 h MET 135 Ca -0.04 -0.01 -0.05 0.00 -3.44 0.00 0.00 59.70 56.17 1jd2 h MET 135 Cb 0.44 -0.04 0.01 0.00 -0.55 0.00 0.00 31.60 31.46 1jd2 h MET 135 CO 0.06 0.11 -0.45 0.00 0.14 0.00 0.00 176.91 176.77 1jd2 h ALA 136 N 1.52 -1.28 -0.63 0.39 0.00 -0.67 0.31 119.26 118.90 1jd2 h ALA 136 Ca 0.59 -0.28 0.13 0.00 0.00 0.00 0.00 54.91 55.35 1jd2 h ALA 136 Cb 1.93 0.49 -0.12 0.00 0.00 0.00 0.00 17.79 20.09 1jd2 h ALA 136 CO -0.16 -1.18 -0.10 0.28 0.00 0.00 0.00 179.25 178.09 1jd2 h VAL 137 N -1.32 0.40 -0.92 0.00 2.07 -0.04 0.74 116.25 117.19 1jd2 h VAL 137 Ca -0.13 -0.01 0.09 0.00 0.82 0.00 0.00 66.70 67.47 1jd2 h VAL 137 Cb 0.96 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 31.02 1jd2 h VAL 137 CO 0.21 0.01 0.57 -0.07 0.02 0.00 0.00 177.57 178.31 1jd2 h LEU 138 N 0.04 0.87 -0.56 2.57 3.38 -0.03 0.67 115.31 122.25 1jd2 h LEU 138 Ca 0.32 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1jd2 h LEU 138 Cb 0.50 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1jd2 h LEU 138 CO -0.61 0.52 0.00 -0.33 0.09 0.00 0.00 178.44 178.10 1jd2 h GLU 139 N 0.98 0.00 0.00 1.13 4.39 0.43 -3.01 114.58 118.50 1jd2 h GLU 139 Ca 0.43 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.88 1jd2 h GLU 139 Cb 0.30 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.91 1jd2 h GLU 139 CO -0.22 0.00 -1.45 0.77 -1.16 0.00 0.00 179.01 176.95 1jd2 h SER 140 N 0.00 0.00 0.00 1.42 0.02 0.24 -3.41 113.55 111.82 1jd2 h SER 140 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1jd2 h SER 140 Cb 0.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1jd2 h SER 140 CO 0.00 0.93 0.00 1.41 -1.14 0.00 0.00 176.83 178.03 1jd2 n HIS 141 N -3.11 0.00 -2.08 3.45 8.25 -0.34 -5.06 115.22 116.33 1jd2 n HIS 141 Ca -0.11 -0.05 -0.32 0.00 -0.26 0.00 0.00 57.72 56.98 1jd2 n HIS 141 Cb 0.99 -0.00 -0.00 0.00 1.12 0.00 0.00 29.99 32.09 1jd2 n HIS 141 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 1jd2 s TRP 142 N -0.10 3.27 -0.06 4.41 -0.00 -1.14 -5.06 118.94 120.26 1jd2 s TRP 142 Ca 0.00 1.45 -0.30 0.00 -0.00 0.00 0.00 56.10 57.25 1jd2 s TRP 142 Cb 0.00 -2.87 0.09 0.00 -0.00 0.00 0.00 33.47 30.69 1jd2 s TRP 142 CO 0.00 -0.79 0.79 -1.59 -0.00 0.00 0.00 176.95 175.36 1jd2 s LYS 143 N -4.37 0.92 0.67 5.86 -2.85 -1.26 -5.05 119.74 113.66 1jd2 s LYS 143 Ca 0.60 0.09 -0.14 0.00 -1.00 0.00 0.00 55.97 55.52 1jd2 s LYS 143 Cb -0.13 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.08 1jd2 s LYS 143 CO 0.40 -0.31 1.09 -1.14 0.10 0.00 0.00 175.35 175.49 1jd2 s GLN 144 N -1.64 2.80 -0.60 1.78 0.74 -1.26 -4.16 119.66 117.32 1jd2 s GLN 144 Ca -0.05 1.28 -0.02 0.00 0.05 0.00 0.00 55.36 56.61 1jd2 s GLN 144 Cb -0.00 -1.96 0.00 0.00 1.10 0.00 0.00 33.01 32.15 1jd2 s GLN 144 CO 0.03 -1.23 0.52 -0.25 -0.55 0.00 0.00 175.29 173.80 1jd2 n ASP 145 N -2.62 -3.11 -4.80 6.67 10.43 -1.26 -5.02 116.55 116.84 1jd2 n ASP 145 Ca 0.10 -0.27 -0.34 0.00 2.57 0.00 0.00 54.79 56.84 1jd2 n ASP 145 Cb 0.52 -2.65 -0.05 0.00 1.84 0.00 0.00 41.12 40.78 1jd2 n ASP 145 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1jd2 s LEU 146 N -4.01 3.97 0.00 0.64 1.43 -1.26 -4.78 118.68 114.68 1jd2 s LEU 146 Ca 0.15 1.85 -0.09 0.00 -1.03 0.00 0.00 54.13 55.01 1jd2 s LEU 146 Cb -0.06 -4.44 0.16 0.00 0.03 0.00 0.00 46.19 41.87 1jd2 s LEU 146 CO 0.34 -0.51 0.98 0.35 0.23 0.00 0.00 176.35 177.74 1jd2 n THR 147 N -0.56 0.00 -0.01 5.49 -2.24 -1.26 -1.87 114.28 113.84 1jd2 n THR 147 Ca 0.07 -0.97 -0.13 0.00 -2.27 0.00 0.00 64.05 60.75 1jd2 n THR 147 Cb 0.52 -1.38 -0.08 0.00 -2.10 0.00 0.00 70.33 67.29 1jd2 n THR 147 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1jd2 h LYS 148 N 0.00 0.05 -0.18 -0.78 3.64 -1.97 -1.58 116.57 115.75 1jd2 h LYS 148 Ca -0.32 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 58.92 1jd2 h LYS 148 Cb 0.98 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1jd2 h LYS 148 CO 0.26 0.36 -0.40 0.93 -2.27 0.00 0.00 179.45 178.34 1jd2 h GLU 149 N -0.27 0.41 -0.14 1.90 3.07 -2.00 -2.05 114.58 115.50 1jd2 h GLU 149 Ca 0.01 -0.20 -0.03 0.00 -0.50 0.00 0.00 59.36 58.63 1jd2 h GLU 149 Cb 0.34 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1jd2 h GLU 149 CO 0.00 0.74 -0.05 0.93 -1.40 0.00 0.00 179.01 179.24 1jd2 h GLU 150 N 0.34 0.28 0.34 2.33 5.08 -1.93 -2.90 114.58 118.13 1jd2 h GLU 150 Ca 0.03 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1jd2 h GLU 150 Cb 0.85 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.06 1jd2 h GLU 150 CO 0.07 0.59 -0.46 0.00 -1.00 0.00 0.00 179.01 178.20 1jd2 h ALA 151 N 0.68 -0.97 -0.48 3.43 0.00 -1.16 -1.33 119.26 119.44 1jd2 h ALA 151 Ca 0.03 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.86 1jd2 h ALA 151 Cb 0.49 0.71 -0.09 0.00 0.00 0.00 0.00 17.79 18.90 1jd2 h ALA 151 CO 0.02 -1.09 -0.56 0.82 0.00 0.00 0.00 179.25 178.44 1jd2 h ILE 152 N -0.85 0.00 -0.63 0.00 2.04 -1.42 0.12 117.51 116.78 1jd2 h ILE 152 Ca -0.03 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.96 1jd2 h ILE 152 Cb 0.78 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.75 1jd2 h ILE 152 CO -0.13 0.00 -0.19 0.50 0.00 0.00 0.00 178.15 178.32 1jd2 h LYS 153 N -0.35 -0.03 -0.00 2.37 3.11 -1.27 0.63 116.57 121.03 1jd2 h LYS 153 Ca 0.09 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.93 1jd2 h LYS 153 Cb 0.58 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 31.81 1jd2 h LYS 153 CO -0.64 -0.02 -0.01 1.25 -2.81 0.00 0.00 179.45 177.22 1jd2 h LEU 154 N -0.04 -0.03 -1.52 5.20 5.85 0.27 0.68 115.31 125.72 1jd2 h LEU 154 Ca 0.30 0.00 0.23 0.00 0.84 0.00 0.00 57.88 59.25 1jd2 h LEU 154 Cb 0.49 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.46 1jd2 h LEU 154 CO -0.67 -0.01 0.63 0.00 -0.34 0.00 0.00 178.44 178.05 1jd2 h ALA 155 N -1.40 2.29 -0.03 1.25 0.00 0.66 0.15 119.26 122.17 1jd2 h ALA 155 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1jd2 h ALA 155 Cb 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1jd2 h ALA 155 CO -0.01 -0.61 -0.01 1.03 0.00 0.00 0.00 179.25 179.65 1jd2 h SER 156 N 0.36 0.07 -0.08 0.00 0.87 0.27 -2.84 113.55 112.19 1jd2 h SER 156 Ca 0.51 -0.39 0.04 0.00 -1.23 0.00 0.00 61.79 60.71 1jd2 h SER 156 Cb 1.35 -0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 63.23 1jd2 h SER 156 CO -0.19 0.44 -0.41 0.44 -0.53 0.00 0.00 176.83 176.58 1jd2 h ASP 157 N -0.31 -1.28 -0.97 6.23 3.45 0.30 -2.06 116.42 121.79 1jd2 h ASP 157 Ca 0.01 0.17 0.24 0.00 0.43 0.00 0.00 57.03 57.87 1jd2 h ASP 157 Cb 0.41 0.52 -0.13 0.00 -0.56 0.00 0.00 39.33 39.57 1jd2 h ASP 157 CO 0.00 -0.43 0.52 0.00 -1.57 0.00 0.00 179.24 177.76 1jd2 h ALA 158 N 0.07 1.68 -0.18 3.45 0.00 -1.14 0.52 119.26 123.65 1jd2 h ALA 158 Ca 0.07 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1jd2 h ALA 158 Cb 0.63 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1jd2 h ALA 158 CO -0.36 -0.31 -0.06 0.82 0.00 0.00 0.00 179.25 179.33 1jd2 h ILE 159 N 0.50 1.30 -0.63 0.00 1.08 -1.24 -1.79 117.51 116.74 1jd2 h ILE 159 Ca 0.62 -1.08 0.17 0.00 -0.39 0.00 0.00 64.86 64.18 1jd2 h ILE 159 Cb 1.19 1.63 -0.03 0.00 -3.07 0.00 0.00 36.82 36.55 1jd2 h ILE 159 CO -0.50 0.32 0.45 1.56 -0.69 0.00 0.00 178.15 179.29 1jd2 h GLN 160 N 0.06 0.09 0.68 2.37 4.20 0.63 0.45 115.11 123.59 1jd2 h GLN 160 Ca 0.04 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1jd2 h GLN 160 Cb 0.53 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 1jd2 h GLN 160 CO 0.02 0.06 -0.42 0.00 -0.67 0.00 0.00 178.83 177.82 1jd2 h ALA 161 N 1.69 -1.07 -0.30 3.87 0.00 -0.10 -2.66 119.26 120.69 1jd2 h ALA 161 Ca 0.30 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1jd2 h ALA 161 Cb 1.07 0.52 -0.06 0.00 0.00 0.00 0.00 17.79 19.33 1jd2 h ALA 161 CO -0.03 -1.12 -0.07 0.78 0.00 0.00 0.00 179.25 178.81 1jd2 h GLY 162 N -1.04 0.22 -0.05 0.00 0.00 0.34 -1.79 103.07 100.75 1jd2 h GLY 162 Ca -0.09 0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.42 1jd2 h GLY 162 CO 0.08 -0.11 -0.24 -2.22 0.00 0.00 0.00 176.54 174.05 1jd2 h ILE 163 N 0.00 0.35 -0.01 2.60 2.04 -0.56 -0.79 117.51 121.14 1jd2 h ILE 163 Ca 0.14 0.00 -0.22 0.00 1.00 0.00 0.00 64.86 65.79 1jd2 h ILE 163 Cb 0.22 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1jd2 h ILE 163 CO -0.30 0.00 -0.90 -0.50 0.00 0.00 0.00 178.15 176.45 1jd2 h TRP 164 N -0.17 0.57 -0.44 1.37 -0.00 -1.14 -3.35 115.95 112.79 1jd2 h TRP 164 Ca 0.19 -0.30 0.00 0.00 -0.00 0.00 0.00 58.89 58.78 1jd2 h TRP 164 Cb 0.47 -0.07 0.00 0.00 -0.00 0.00 0.00 29.16 29.56 1jd2 h TRP 164 CO -0.47 1.11 0.00 0.09 -0.00 0.00 0.00 178.44 179.17 1jd2 n ASN 165 N -3.75 4.08 -3.66 -3.49 5.03 -0.70 -4.91 115.26 107.86 1jd2 n ASN 165 Ca -0.06 -2.56 -0.16 0.00 0.87 0.00 0.00 54.58 52.67 1jd2 n ASN 165 Cb 0.81 -0.49 -0.15 0.00 -1.02 0.00 0.00 39.78 38.93 1jd2 n ASN 165 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1jd2 s ASP 166 N -1.27 0.69 0.54 6.41 2.15 -0.32 -5.00 116.67 119.87 1jd2 s ASP 166 Ca 0.41 0.37 0.22 0.00 0.43 0.00 0.00 52.55 53.99 1jd2 s ASP 166 Cb 0.29 0.36 1.47 0.00 -0.30 0.00 0.00 42.92 44.73 1jd2 s ASP 166 CO 0.16 -0.25 2.17 -0.07 -0.17 0.00 0.00 175.17 177.02 1jd2 h LEU 167 N 8.35 0.00 0.00 -1.34 3.38 -1.86 -1.73 115.31 122.11 1jd2 h LEU 167 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1jd2 h LEU 167 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1jd2 h LEU 167 CO 0.14 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.31 1jd2 n GLY 168 N -1.33 -0.89 3.14 0.83 0.00 -1.26 -4.81 105.19 100.87 1jd2 n GLY 168 Ca -0.03 -0.15 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 1jd2 n GLY 168 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jd2 s SER 169 N -1.84 0.85 0.00 1.61 0.01 -0.65 0.48 113.70 114.16 1jd2 s SER 169 Ca 0.35 -1.01 0.00 0.00 1.31 0.00 0.00 55.95 56.60 1jd2 s SER 169 Cb 0.16 0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.53 1jd2 s SER 169 CO 0.27 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 174.00 1jd2 n GLY 170 N 0.02 -1.10 7.00 3.44 0.00 -1.26 -4.71 105.19 108.58 1jd2 n GLY 170 Ca -0.13 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1jd2 n GLY 170 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1jd2 n SER 171 N 0.61 0.00 -4.99 1.61 7.64 -1.26 -2.58 113.62 114.65 1jd2 n SER 171 Ca 0.00 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.69 1jd2 n SER 171 Cb 0.00 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.23 1jd2 n SER 171 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1jd2 s ASN 172 N -4.00 5.43 -0.19 6.43 0.02 -1.26 -4.51 114.94 116.85 1jd2 s ASN 172 Ca 0.00 -0.41 -0.01 0.00 -1.02 0.00 0.00 52.86 51.42 1jd2 s ASN 172 Cb 0.00 -0.51 0.01 0.00 0.02 0.00 0.00 41.25 40.77 1jd2 s ASN 172 CO 0.00 -0.99 -0.13 -0.69 0.02 0.00 0.00 177.10 175.31 1jd2 s VAL 173 N -2.52 2.65 -0.15 1.60 1.01 -0.58 -2.97 120.40 119.43 1jd2 s VAL 173 Ca 0.57 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 1jd2 s VAL 173 Cb -0.09 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1jd2 s VAL 173 CO 0.36 0.49 0.09 -1.81 0.00 0.00 0.00 175.10 174.23 1jd2 s ASP 174 N 1.25 5.93 0.01 3.32 1.01 -0.42 -1.06 116.67 126.71 1jd2 s ASP 174 Ca 0.03 0.24 0.02 0.00 0.71 0.00 0.00 52.55 53.55 1jd2 s ASP 174 Cb -0.14 -1.95 -0.01 0.00 1.01 0.00 0.00 42.92 41.83 1jd2 s ASP 174 CO -0.07 0.28 -0.07 -0.69 0.21 0.00 0.00 175.17 174.83 1jd2 s VAL 175 N -0.26 0.53 -0.02 -1.27 1.01 -0.02 -0.77 120.40 119.60 1jd2 s VAL 175 Ca 0.09 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.61 1jd2 s VAL 175 Cb -0.12 -0.48 0.01 0.00 0.00 0.00 0.00 36.38 35.79 1jd2 s VAL 175 CO 0.01 0.01 -0.05 0.00 0.00 0.00 0.00 175.10 175.08 1jd2 s VAL 177 N 0.24 2.35 -0.14 0.00 1.01 -0.69 -1.81 120.40 121.37 1jd2 s VAL 177 Ca -0.03 -1.18 -0.03 0.00 0.00 0.00 0.00 61.98 60.75 1jd2 s VAL 177 Cb -0.06 -1.90 0.05 0.00 0.00 0.00 0.00 36.38 34.47 1jd2 s VAL 177 CO -0.00 0.46 0.05 -0.04 0.00 0.00 0.00 175.10 175.57 1jd2 s MET 178 N -1.00 0.31 0.03 2.72 -1.94 -0.37 -1.66 119.30 117.38 1jd2 s MET 178 Ca 0.12 -0.07 0.05 0.00 -1.71 0.00 0.00 55.69 54.07 1jd2 s MET 178 Cb -0.10 -1.55 -0.03 0.00 2.01 0.00 0.00 34.83 35.15 1jd2 s MET 178 CO 0.01 -0.54 -0.10 -2.00 -0.01 0.00 0.00 175.02 172.38 1jd2 s GLU 179 N 2.03 2.37 0.42 2.03 2.12 -1.26 -1.13 118.70 125.28 1jd2 s GLU 179 Ca 0.02 -0.83 0.25 0.00 0.36 0.00 0.00 54.97 54.77 1jd2 s GLU 179 Cb -0.15 -2.39 1.28 0.00 0.26 0.00 0.00 34.13 33.13 1jd2 s GLU 179 CO -0.07 0.57 1.69 0.82 -0.54 0.00 0.00 175.26 177.73 1jd2 h ILE 180 N 3.72 0.30 -0.01 -3.70 2.04 -1.63 -2.73 117.51 115.50 1jd2 h ILE 180 Ca -0.48 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.30 1jd2 h ILE 180 Cb 1.16 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1jd2 h ILE 180 CO 0.52 0.04 0.00 0.61 0.00 0.00 0.00 178.15 179.32 1jd2 n GLY 181 N -1.50 -0.83 3.69 5.37 0.00 -1.26 -5.00 105.19 105.65 1jd2 n GLY 181 Ca 0.32 -0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 1jd2 n GLY 181 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jd2 s LYS 182 N -0.34 2.12 0.69 1.61 1.02 -1.03 -5.11 119.74 118.70 1jd2 s LYS 182 Ca 0.04 -1.92 -0.14 0.00 0.02 0.00 0.00 55.97 53.96 1jd2 s LYS 182 Cb 0.03 -1.86 0.02 0.00 -0.52 0.00 0.00 37.83 35.50 1jd2 s LYS 182 CO 0.04 -0.07 1.13 -0.51 -0.92 0.00 0.00 175.35 175.03 1jd2 s ASP 183 N -3.82 4.78 0.19 2.83 -0.00 -1.26 -4.53 116.67 114.87 1jd2 s ASP 183 Ca 0.38 2.06 -0.21 0.00 -0.00 0.00 0.00 52.55 54.79 1jd2 s ASP 183 Cb 0.06 -2.56 -0.08 0.00 -0.00 0.00 0.00 42.92 40.34 1jd2 s ASP 183 CO 0.21 -1.85 0.72 0.00 -0.00 0.00 0.00 175.17 174.24 1jd2 s ALA 184 N -2.33 3.44 -0.18 5.23 0.00 -1.26 -4.70 121.76 121.96 1jd2 s ALA 184 Ca 0.68 0.20 -0.01 0.00 0.00 0.00 0.00 51.96 52.82 1jd2 s ALA 184 Cb -0.22 -2.83 -0.01 0.00 0.00 0.00 0.00 23.12 20.06 1jd2 s ALA 184 CO 0.44 0.33 -0.11 -1.83 0.00 0.00 0.00 175.76 174.59 1jd2 s GLU 185 N -1.69 3.31 -0.42 0.00 -1.05 -0.67 -4.99 118.70 113.19 1jd2 s GLU 185 Ca 0.40 -0.69 -0.18 0.00 -0.15 0.00 0.00 54.97 54.35 1jd2 s GLU 185 Cb -0.18 -2.78 0.02 0.00 -0.44 0.00 0.00 34.13 30.75 1jd2 s GLU 185 CO 0.22 -0.04 0.47 -0.47 0.95 0.00 0.00 175.26 176.40 1jd2 s TYR 186 N 0.99 3.15 -0.54 4.83 5.04 -1.26 -1.70 117.35 127.87 1jd2 s TYR 186 Ca -0.01 -0.30 -0.11 0.00 -2.44 0.00 0.00 57.07 54.20 1jd2 s TYR 186 Cb -0.15 -2.97 0.14 0.00 0.35 0.00 0.00 41.96 39.33 1jd2 s TYR 186 CO -0.01 -0.72 0.44 -0.51 -1.34 0.00 0.00 175.55 173.41 1jd2 s LEU 187 N 2.26 5.92 -0.23 6.97 1.43 0.66 -5.02 118.68 130.66 1jd2 s LEU 187 Ca 0.14 -2.05 -0.15 0.00 -1.03 0.00 0.00 54.13 51.04 1jd2 s LEU 187 Cb -0.16 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 1jd2 s LEU 187 CO 0.14 -0.70 0.35 -0.60 0.23 0.00 0.00 176.35 175.77 1jd2 s ARG 189 N 1.17 4.10 -0.44 1.70 3.52 -1.26 -0.84 118.95 126.89 1jd2 s ARG 189 Ca 0.07 0.05 -0.00 0.00 -0.13 0.00 0.00 55.73 55.73 1jd2 s ARG 189 Cb -0.25 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.56 1jd2 s ARG 189 CO -0.01 -0.11 0.37 0.09 -0.81 0.00 0.00 175.30 174.83 1jd2 n ASN 190 N 4.76 -2.09 -0.19 -2.12 4.13 -1.24 -4.95 115.26 113.56 1jd2 n ASN 190 Ca -0.10 -0.23 -0.07 0.00 1.68 0.00 0.00 54.58 55.87 1jd2 n ASN 190 Cb 0.51 -2.20 0.02 0.00 -1.54 0.00 0.00 39.78 36.58 1jd2 n ASN 190 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 1jd2 h TYR 191 N -0.71 0.73 -3.90 3.10 -0.00 -1.27 -3.41 116.97 111.50 1jd2 h TYR 191 Ca -0.22 -0.01 -0.53 0.00 -0.00 0.00 0.00 58.73 57.97 1jd2 h TYR 191 Cb 1.13 -0.24 -0.31 0.00 -0.00 0.00 0.00 36.73 37.31 1jd2 h TYR 191 CO 0.16 0.51 -0.83 -0.51 -0.00 0.00 0.00 178.16 177.49 1jd2 s LEU 192 N -10.03 1.89 -0.53 2.82 1.43 -1.18 -5.00 118.68 108.08 1jd2 s LEU 192 Ca -0.13 -0.32 0.07 0.00 -1.03 0.00 0.00 54.13 52.72 1jd2 s LEU 192 Cb 0.12 -0.88 0.28 0.00 0.03 0.00 0.00 46.19 45.74 1jd2 s LEU 192 CO 0.76 0.14 0.72 0.35 0.23 0.00 0.00 176.35 178.54 1jd2 n THR 193 N 3.16 1.41 0.77 5.49 -2.24 -1.26 -1.53 114.28 120.07 1jd2 n THR 193 Ca -0.18 -4.90 0.02 0.00 -2.27 0.00 0.00 64.05 56.73 1jd2 n THR 193 Cb 0.53 -1.75 0.11 0.00 -2.10 0.00 0.00 70.33 67.12 1jd2 n THR 193 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1jd2 n PRO 194 N 0.74 1.88 -2.57 -0.78 -0.04 -1.26 -4.33 135.00 128.65 1jd2 n PRO 194 Ca 0.27 -0.83 -0.15 0.00 -0.04 0.00 0.00 63.50 62.75 1jd2 n PRO 194 Cb 0.47 -1.53 0.02 0.00 -0.04 0.00 0.00 33.50 32.42 1jd2 n PRO 194 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1jd2 n ASN 195 N 0.15 2.78 -4.77 3.54 3.02 -1.26 -5.08 115.26 113.64 1jd2 n ASN 195 Ca 0.07 -3.02 -0.38 0.00 -0.03 0.00 0.00 54.58 51.22 1jd2 n ASN 195 Cb 0.40 -0.48 -0.06 0.00 -0.61 0.00 0.00 39.78 39.03 1jd2 n ASN 195 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1jd2 s VAL 196 N -4.10 4.06 0.10 2.41 1.01 -1.26 -4.99 120.40 117.63 1jd2 s VAL 196 Ca 0.36 1.81 -0.31 0.00 0.00 0.00 0.00 61.98 63.84 1jd2 s VAL 196 Cb 0.42 -4.05 -0.07 0.00 0.00 0.00 0.00 36.38 32.68 1jd2 s VAL 196 CO -0.04 0.24 1.26 -0.60 0.00 0.00 0.00 175.10 175.95 1jd2 s ARG 197 N -1.82 4.41 0.60 2.72 3.52 -1.26 -4.99 118.95 122.12 1jd2 s ARG 197 Ca 0.48 1.89 -0.18 0.00 -0.13 0.00 0.00 55.73 57.78 1jd2 s ARG 197 Cb -0.22 -3.29 -0.03 0.00 -1.56 0.00 0.00 34.95 29.84 1jd2 s ARG 197 CO 0.28 -0.28 1.18 -1.83 -0.81 0.00 0.00 175.30 173.84 1jd2 s GLU 198 N 0.82 2.97 0.32 5.12 -1.05 -1.26 -4.88 118.70 120.73 1jd2 s GLU 198 Ca 0.59 1.74 -0.29 0.00 -0.15 0.00 0.00 54.97 56.87 1jd2 s GLU 198 Cb -0.32 -1.94 -0.13 0.00 -0.44 0.00 0.00 34.13 31.30 1jd2 s GLU 198 CO 0.31 -1.19 1.28 -1.91 0.95 0.00 0.00 175.26 174.70 1jd2 n GLU 199 N -1.69 2.02 -1.88 -4.83 2.13 -1.26 -4.90 120.64 110.23 1jd2 n GLU 199 Ca 0.13 0.71 -0.35 0.00 0.66 0.00 0.00 57.16 58.31 1jd2 n GLU 199 Cb 0.50 -2.28 0.04 0.00 0.27 0.00 0.00 31.44 29.97 1jd2 n GLU 199 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1jd2 s LYS 200 N -1.55 2.83 0.35 5.31 1.02 -1.26 -4.94 119.74 121.50 1jd2 s LYS 200 Ca 0.58 1.68 0.13 0.00 0.02 0.00 0.00 55.97 58.38 1jd2 s LYS 200 Cb -0.60 -1.93 0.64 0.00 -0.52 0.00 0.00 37.83 35.42 1jd2 s LYS 200 CO 0.60 -1.28 1.77 0.37 -0.92 0.00 0.00 175.35 175.89 1jd2 h GLN 201 N 0.51 0.00 -4.48 1.68 5.75 -2.05 -3.46 115.11 113.06 1jd2 h GLN 201 Ca -0.49 0.00 -0.26 0.00 -0.15 0.00 0.00 58.65 57.75 1jd2 h GLN 201 Cb 1.28 0.00 -0.13 0.00 1.07 0.00 0.00 27.48 29.70 1jd2 h GLN 201 CO 0.54 0.43 -0.50 0.21 -2.65 0.00 0.00 178.83 176.86 1jd2 s LYS 202 N -3.99 1.39 -0.08 1.69 2.20 -1.26 -5.16 119.74 114.53 1jd2 s LYS 202 Ca -0.02 -1.65 0.05 0.00 -0.36 0.00 0.00 55.97 53.98 1jd2 s LYS 202 Cb 0.14 0.32 -0.00 0.00 -1.51 0.00 0.00 37.83 36.77 1jd2 s LYS 202 CO 0.73 -0.49 -0.23 0.45 -0.36 0.00 0.00 175.35 175.45 1jd2 s SER 203 N -3.18 2.89 -0.34 1.43 0.15 -1.26 -5.03 113.70 108.37 1jd2 s SER 203 Ca 0.36 -0.50 0.09 0.00 0.70 0.00 0.00 55.95 56.60 1jd2 s SER 203 Cb 0.05 -1.11 0.67 0.00 -1.71 0.00 0.00 66.02 63.92 1jd2 s SER 203 CO 0.15 0.18 1.75 -1.22 1.20 0.00 0.00 173.24 175.29 1jd2 n TYR 204 N 3.33 2.25 -1.55 3.44 4.01 -1.26 -4.92 117.16 122.47 1jd2 n TYR 204 Ca -0.19 -1.38 -0.37 0.00 -0.16 0.00 0.00 57.90 55.80 1jd2 n TYR 204 Cb 0.53 -0.69 -0.04 0.00 -0.31 0.00 0.00 39.34 38.83 1jd2 n TYR 204 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1jd2 n LYS 205 N -0.57 1.01 -2.17 -0.72 4.81 -1.26 -4.87 118.16 114.39 1jd2 n LYS 205 Ca 0.42 0.03 -0.41 0.00 -0.87 0.00 0.00 58.31 57.49 1jd2 n LYS 205 Cb 1.36 -3.25 -0.03 0.00 0.02 0.00 0.00 35.03 33.13 1jd2 n LYS 205 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1jd2 s PHE 206 N 11.64 3.19 0.35 5.64 0.08 -1.26 -4.96 117.98 132.66 1jd2 s PHE 206 Ca 1.02 1.23 -0.29 0.00 0.12 0.00 0.00 56.93 59.01 1jd2 s PHE 206 Cb -0.29 -3.64 -0.11 0.00 -0.57 0.00 0.00 43.02 38.40 1jd2 s PHE 206 CO 0.29 -1.98 1.53 -0.35 -0.10 0.00 0.00 175.22 174.62 1jd2 n PRO 207 N 2.24 2.70 -1.77 0.24 -0.04 -1.26 -4.87 135.00 132.25 1jd2 n PRO 207 Ca 0.05 0.95 -0.41 0.00 -0.04 0.00 0.00 63.50 64.05 1jd2 n PRO 207 Cb 0.42 -2.71 -0.01 0.00 -0.04 0.00 0.00 33.50 31.16 1jd2 n PRO 207 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1jd2 s ARG 208 N -1.54 4.12 0.00 0.54 0.52 -1.26 -2.70 118.95 118.62 1jd2 s ARG 208 Ca 0.57 2.59 0.00 0.00 -0.52 0.00 0.00 55.73 58.37 1jd2 s ARG 208 Cb -0.48 -3.02 0.00 0.00 0.52 0.00 0.00 34.95 31.97 1jd2 s ARG 208 CO 0.58 -0.64 0.00 0.41 0.02 0.00 0.00 175.30 175.67 1jd2 n GLY 209 N 2.14 1.82 0.33 -3.53 0.00 -1.26 -4.95 105.19 99.74 1jd2 n GLY 209 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.25 1jd2 n GLY 209 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1jd2 h THR 210 N 0.00 0.54 -3.45 2.61 2.02 -1.87 -3.41 112.91 109.34 1jd2 h THR 210 Ca 0.00 -0.18 -0.54 0.00 0.77 0.00 0.00 66.41 66.46 1jd2 h THR 210 Cb 0.00 -0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 66.35 1jd2 h THR 210 CO 0.00 0.09 0.15 -0.89 0.37 0.00 0.00 175.52 175.24 1jd2 s THR 211 N -5.85 4.56 -0.38 3.16 2.01 -1.26 -5.03 115.64 112.85 1jd2 s THR 211 Ca -0.11 1.62 -0.22 0.00 0.31 0.00 0.00 61.69 63.28 1jd2 s THR 211 Cb 0.26 -4.10 0.01 0.00 0.01 0.00 0.00 72.50 68.68 1jd2 s THR 211 CO 0.79 0.46 0.75 0.00 -0.69 0.00 0.00 174.62 175.92 1jd2 s ALA 212 N -0.69 3.41 0.10 7.40 0.00 -1.26 -5.05 121.76 125.68 1jd2 s ALA 212 Ca 0.36 -0.76 0.03 0.00 0.00 0.00 0.00 51.96 51.59 1jd2 s ALA 212 Cb -0.22 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 1jd2 s ALA 212 CO 0.24 -1.52 0.11 0.08 0.00 0.00 0.00 175.76 174.67 1jd2 s VAL 213 N 3.03 4.66 -0.11 0.00 1.01 -1.26 -5.06 120.40 122.66 1jd2 s VAL 213 Ca 0.29 -0.78 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 1jd2 s VAL 213 Cb -0.13 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 1jd2 s VAL 213 CO 0.17 0.07 -0.14 0.18 0.00 0.00 0.00 175.10 175.39 1jd2 n LEU 214 N 0.24 1.06 -4.17 3.92 4.77 -1.26 -5.06 117.00 116.50 1jd2 n LEU 214 Ca -0.08 0.11 -0.17 0.00 -0.03 0.00 0.00 56.01 55.85 1jd2 n LEU 214 Cb 0.52 -0.34 -0.12 0.00 -2.33 0.00 0.00 43.42 41.16 1jd2 n LEU 214 CO 0.45 0.29 -0.44 -0.75 -1.33 0.00 0.00 177.39 175.61 1jd2 s LYS 215 N -2.21 0.81 -0.14 3.23 2.20 -1.26 -5.16 119.74 117.21 1jd2 s LYS 215 Ca -0.16 -1.01 -0.08 0.00 -0.36 0.00 0.00 55.97 54.37 1jd2 s LYS 215 Cb 0.06 -0.71 0.05 0.00 -1.51 0.00 0.00 37.83 35.72 1jd2 s LYS 215 CO 0.20 0.14 0.35 -2.00 -0.36 0.00 0.00 175.35 173.68 1jd2 s GLU 216 N -2.05 0.32 0.27 4.03 2.12 -1.26 -5.17 118.70 116.95 1jd2 s GLU 216 Ca -0.00 0.69 -0.06 0.00 0.36 0.00 0.00 54.97 55.96 1jd2 s GLU 216 Cb -0.08 -0.06 -0.01 0.00 0.26 0.00 0.00 34.13 34.24 1jd2 s GLU 216 CO 0.02 -0.16 0.40 -1.54 -0.54 0.00 0.00 175.26 173.44 1jd2 s SER 217 N 1.37 0.36 0.32 -1.70 1.04 -1.26 -5.17 113.70 108.66 1jd2 s SER 217 Ca -0.09 -1.24 0.07 0.00 0.48 0.00 0.00 55.95 55.17 1jd2 s SER 217 Cb -0.09 0.57 -0.02 0.00 0.10 0.00 0.00 66.02 66.58 1jd2 s SER 217 CO -0.11 -1.14 0.32 -0.63 0.98 0.00 0.00 173.24 172.66 1jd2 s ILE 218 N -3.68 3.78 0.09 -1.02 1.01 -1.26 -5.13 121.20 114.99 1jd2 s ILE 218 Ca 0.29 -1.29 0.10 0.00 0.00 0.00 0.00 60.65 59.76 1jd2 s ILE 218 Cb 0.01 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.17 1jd2 s ILE 218 CO 0.14 -0.19 -0.26 -0.69 0.00 0.00 0.00 174.94 173.94 1jd2 s VAL 219 N -2.25 2.13 -0.29 2.92 1.01 -1.26 -5.12 120.40 117.54 1jd2 s VAL 219 Ca 0.41 -1.58 -0.12 0.00 0.00 0.00 0.00 61.98 60.69 1jd2 s VAL 219 Cb -0.07 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 1jd2 s VAL 219 CO 0.27 0.18 0.21 0.21 0.00 0.00 0.00 175.10 175.97 1jd2 s ASN 220 N -1.72 6.04 0.00 3.32 2.47 -1.26 -4.99 114.94 118.81 1jd2 s ASN 220 Ca 0.12 -0.09 0.00 0.00 0.42 0.00 0.00 52.86 53.31 1jd2 s ASN 220 Cb -0.10 -2.13 0.00 0.00 -1.45 0.00 0.00 41.25 37.57 1jd2 s ASN 220 CO 0.04 -0.10 0.00 -0.38 -3.72 0.00 0.00 177.10 172.94 1jd2 n ILE 221 N 5.08 0.00 -1.40 -5.21 -0.00 -1.26 -5.00 119.36 111.57 1jd2 n ILE 221 Ca -0.13 0.40 -0.35 0.00 -0.00 0.00 0.00 62.75 62.66 1jd2 n ILE 221 Cb 0.51 -1.33 0.09 0.00 -0.00 0.00 0.00 39.64 38.92 1jd2 n ILE 221 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55