#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jdz n VAL 4 N 0.00 0.35 -0.05 -1.45 0.24 -1.26 -4.76 118.33 111.40 1jdz n VAL 4 Ca 0.00 -0.67 -0.10 0.00 -2.04 0.00 0.00 64.34 61.52 1jdz n VAL 4 Cb 0.00 0.88 -0.03 0.00 -1.47 0.00 0.00 33.84 33.21 1jdz n VAL 4 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1jdz n HIS 5 N 0.09 0.00 -3.45 6.34 8.25 -1.26 -4.91 115.22 120.29 1jdz n HIS 5 Ca 0.03 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.06 1jdz n HIS 5 Cb 0.17 -0.36 -0.08 0.00 1.12 0.00 0.00 29.99 30.84 1jdz n HIS 5 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1jdz s ILE 6 N -2.24 4.81 -0.28 1.59 1.01 -1.26 -4.58 121.20 120.25 1jdz s ILE 6 Ca -0.15 -1.37 -0.03 0.00 0.00 0.00 0.00 60.65 59.10 1jdz s ILE 6 Cb 0.05 -3.99 0.06 0.00 0.01 0.00 0.00 42.46 38.59 1jdz s ILE 6 CO 0.19 -0.66 2.54 0.18 0.00 0.00 0.00 174.94 177.19 1jdz n LEU 7 N 5.10 6.16 -4.84 2.97 4.77 -1.26 -4.92 117.00 124.98 1jdz n LEU 7 Ca -0.11 -3.46 -0.32 0.00 -0.03 0.00 0.00 56.01 52.08 1jdz n LEU 7 Cb 0.42 -1.19 -0.05 0.00 -2.33 0.00 0.00 43.42 40.28 1jdz n LEU 7 CO 0.46 1.46 0.65 0.00 -1.33 0.00 0.00 177.39 178.63 1jdz s ALA 8 N -1.15 3.08 0.89 -1.18 0.00 -1.26 -4.94 121.76 117.21 1jdz s ALA 8 Ca 0.43 0.24 -0.14 0.00 0.00 0.00 0.00 51.96 52.49 1jdz s ALA 8 Cb 0.28 -3.09 0.15 0.00 0.00 0.00 0.00 23.12 20.46 1jdz s ALA 8 CO -0.08 -0.07 1.25 0.15 0.00 0.00 0.00 175.76 177.01 1jdz s LYS 9 N -3.69 1.17 0.33 0.00 -0.14 -1.26 -5.00 119.74 111.15 1jdz s LYS 9 Ca 0.59 -0.26 -0.29 0.00 -1.36 0.00 0.00 55.97 54.66 1jdz s LYS 9 Cb -0.10 -1.91 -0.10 0.00 -1.68 0.00 0.00 37.83 34.04 1jdz s LYS 9 CO 0.24 -2.07 1.34 0.21 -0.76 0.00 0.00 175.35 174.31 1jdz s LYS 10 N -5.74 4.32 -1.38 1.68 2.20 -1.26 -2.95 119.74 116.62 1jdz s LYS 10 Ca 0.69 2.26 -0.00 0.00 -0.36 0.00 0.00 55.97 58.56 1jdz s LYS 10 Cb -0.07 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.19 1jdz s LYS 10 CO 0.51 -0.24 0.04 0.41 -0.36 0.00 0.00 175.35 175.70 1jdz n GLY 11 N 0.91 -0.30 0.00 5.54 0.00 -1.26 -4.88 105.19 105.20 1jdz n GLY 11 Ca 0.01 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 45.88 1jdz n GLY 11 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jdz n GLU 12 N -2.61 0.42 -3.93 1.61 1.02 -1.15 -4.95 120.64 111.04 1jdz n GLU 12 Ca -0.19 -0.09 -0.35 0.00 -0.02 0.00 0.00 57.16 56.52 1jdz n GLU 12 Cb 0.64 -1.22 -0.09 0.00 -0.02 0.00 0.00 31.44 30.76 1jdz n GLU 12 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1jdz s VAL 13 N -2.64 5.06 0.78 2.62 1.01 -1.26 -4.79 120.40 121.17 1jdz s VAL 13 Ca -0.03 0.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.89 1jdz s VAL 13 Cb 0.06 -3.27 0.06 0.00 0.00 0.00 0.00 36.38 33.23 1jdz s VAL 13 CO 0.40 0.49 1.09 0.00 0.00 0.00 0.00 175.10 177.08 1jdz s ALA 14 N 0.05 2.34 0.23 5.51 0.00 -1.26 -4.65 121.76 123.97 1jdz s ALA 14 Ca 0.07 -0.13 0.03 0.00 0.00 0.00 0.00 51.96 51.93 1jdz s ALA 14 Cb -0.12 -3.13 0.22 0.00 0.00 0.00 0.00 23.12 20.10 1jdz s ALA 14 CO 0.00 -1.62 1.55 0.93 0.00 0.00 0.00 175.76 176.61 1jdz h GLU 15 N -1.01 0.30 -5.39 0.00 5.08 -1.87 -3.34 114.58 108.34 1jdz h GLU 15 Ca -0.46 -0.20 -0.62 0.00 -1.00 0.00 0.00 59.36 57.08 1jdz h GLU 15 Cb 1.25 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 30.43 1jdz h GLU 15 CO 0.59 0.81 -0.48 1.03 -1.00 0.00 0.00 179.01 179.95 1jdz s ARG 16 N -3.79 3.97 -0.02 2.33 3.00 -1.26 -1.48 118.95 121.69 1jdz s ARG 16 Ca -0.05 -0.18 0.01 0.00 0.00 0.00 0.00 55.73 55.51 1jdz s ARG 16 Cb 0.12 -3.35 0.02 0.00 0.00 0.00 0.00 34.95 31.73 1jdz s ARG 16 CO 0.81 0.44 -0.02 0.08 0.00 0.00 0.00 175.30 176.60 1jdz s VAL 17 N -0.05 0.31 -0.29 3.52 1.01 -0.23 -2.15 120.40 122.53 1jdz s VAL 17 Ca 0.10 -0.05 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 1jdz s VAL 17 Cb -0.11 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.88 1jdz s VAL 17 CO 0.00 0.15 0.24 -0.22 0.00 0.00 0.00 175.10 175.27 1jdz s LEU 18 N 0.64 4.08 -0.14 3.92 0.20 0.47 -1.75 118.68 126.10 1jdz s LEU 18 Ca -0.07 0.01 -0.03 0.00 0.69 0.00 0.00 54.13 54.73 1jdz s LEU 18 Cb -0.10 -2.20 -0.03 0.00 -0.43 0.00 0.00 46.19 43.43 1jdz s LEU 18 CO -0.01 -0.11 -0.04 0.68 -0.29 0.00 0.00 176.35 176.58 1jdz s VAL 19 N 1.84 3.87 0.16 1.68 -7.23 -0.81 -0.31 120.40 119.60 1jdz s VAL 19 Ca 0.09 -0.37 0.07 0.00 -1.81 0.00 0.00 61.98 59.95 1jdz s VAL 19 Cb -0.16 -2.68 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 1jdz s VAL 19 CO 0.11 0.51 -0.14 0.68 -0.31 0.00 0.00 175.10 175.94 1jdz s VAL 20 N 0.21 1.52 0.06 1.32 -7.23 0.87 -0.74 120.40 116.41 1jdz s VAL 20 Ca -0.02 -1.97 0.04 0.00 -1.81 0.00 0.00 61.98 58.22 1jdz s VAL 20 Cb -0.14 -1.81 -0.24 0.00 0.56 0.00 0.00 36.38 34.76 1jdz s VAL 20 CO 0.03 -0.52 1.06 1.23 -0.31 0.00 0.00 175.10 176.59 1jdz h GLY 21 N 3.03 0.10 -7.42 2.32 0.00 -1.81 0.15 103.07 99.44 1jdz h GLY 21 Ca -0.39 -0.27 -0.65 0.00 0.00 0.00 0.00 47.33 46.02 1jdz h GLY 21 CO 0.57 0.23 -0.27 -0.35 0.00 0.00 0.00 176.54 176.71 1jdz s ASP 22 N -6.71 6.20 0.40 0.19 2.15 -1.26 -2.19 116.67 115.44 1jdz s ASP 22 Ca -0.03 -0.07 0.19 0.00 0.43 0.00 0.00 52.55 53.07 1jdz s ASP 22 Cb 0.09 -2.20 1.11 0.00 -0.30 0.00 0.00 42.92 41.62 1jdz s ASP 22 CO 0.84 -0.29 1.78 -0.65 -0.17 0.00 0.00 175.17 176.67 1jdz h PRO 23 N 8.39 0.37 -0.70 4.34 0.11 -1.88 0.18 132.00 142.81 1jdz h PRO 23 Ca -0.30 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.84 1jdz h PRO 23 Cb 1.15 -0.08 -0.05 0.00 0.11 0.00 0.00 31.00 32.12 1jdz h PRO 23 CO 0.68 0.25 0.40 0.78 -0.21 0.00 0.00 178.00 179.90 1jdz h GLY 24 N 0.38 1.02 1.47 -0.55 0.00 -1.96 -1.46 103.07 101.98 1jdz h GLY 24 Ca 0.59 -0.29 -0.16 0.00 0.00 0.00 0.00 47.33 47.46 1jdz h GLY 24 CO -0.28 0.19 -0.57 -0.09 0.00 0.00 0.00 176.54 175.79 1jdz h ARG 25 N 0.75 0.55 -0.33 4.80 2.43 -1.09 -1.77 114.38 119.72 1jdz h ARG 25 Ca 0.30 -0.36 0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1jdz h ARG 25 Cb 0.15 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 1jdz h ARG 25 CO -0.17 0.97 0.15 0.00 -1.51 0.00 0.00 179.97 179.41 1jdz h ALA 26 N 0.96 0.40 0.58 2.80 0.00 -0.78 0.27 119.26 123.48 1jdz h ALA 26 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1jdz h ALA 26 Cb 1.12 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.88 1jdz h ALA 26 CO 0.11 -0.23 -0.28 -0.09 0.00 0.00 0.00 179.25 178.76 1jdz h ARG 27 N 0.32 -0.74 -0.56 0.00 2.43 -1.21 -2.00 114.38 112.62 1jdz h ARG 27 Ca 0.14 0.05 0.11 0.00 -0.81 0.00 0.00 59.98 59.47 1jdz h ARG 27 Cb 0.07 0.17 -0.09 0.00 -0.42 0.00 0.00 29.97 29.69 1jdz h ARG 27 CO -0.11 -0.44 0.02 1.25 -1.51 0.00 0.00 179.97 179.18 1jdz h LEU 28 N -0.94 -0.20 -1.61 3.80 5.85 -1.18 -1.54 115.31 119.50 1jdz h LEU 28 Ca -0.08 0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 1jdz h LEU 28 Cb 0.65 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 1jdz h LEU 28 CO 0.13 -0.08 -0.21 -0.07 -0.34 0.00 0.00 178.44 177.88 1jdz h LEU 29 N 0.14 0.00 -0.85 2.25 3.38 -0.42 -2.71 115.31 117.10 1jdz h LEU 29 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1jdz h LEU 29 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1jdz h LEU 29 CO -0.46 0.21 0.00 -1.54 0.09 0.00 0.00 178.44 176.74 1jdz n SER 30 N -3.79 0.44 0.00 -0.43 3.41 -0.58 -1.51 113.62 111.16 1jdz n SER 30 Ca -0.02 0.67 0.07 0.00 -0.26 0.00 0.00 58.87 59.33 1jdz n SER 30 Cb 0.31 -0.74 0.42 0.00 -0.26 0.00 0.00 64.21 63.94 1jdz n SER 30 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1jdz n THR 31 N -2.05 0.00 0.83 6.66 -2.24 -1.02 -2.25 114.28 114.21 1jdz n THR 31 Ca 0.00 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.87 1jdz n THR 31 Cb 0.09 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.06 1jdz n THR 31 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1jdz n LEU 32 N -0.73 1.71 -4.97 3.22 4.77 -0.57 -4.96 117.00 115.47 1jdz n LEU 32 Ca 0.11 -0.74 -0.22 0.00 -0.03 0.00 0.00 56.01 55.13 1jdz n LEU 32 Cb 0.05 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.18 1jdz n LEU 32 CO 0.08 0.33 0.40 -0.76 -1.33 0.00 0.00 177.39 176.11 1jdz s LEU 33 N -2.27 3.20 0.00 2.23 1.43 -0.95 -4.88 118.68 117.43 1jdz s LEU 33 Ca 0.15 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 1jdz s LEU 33 Cb 0.15 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 43.47 1jdz s LEU 33 CO 0.50 -1.22 0.09 0.00 0.23 0.00 0.00 176.35 175.95 1jdz n GLN 34 N -2.44 0.00 -3.47 1.70 6.02 0.11 -4.64 117.38 114.66 1jdz n GLN 34 Ca 0.08 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.74 1jdz n GLN 34 Cb 0.60 -0.54 -0.06 0.00 1.02 0.00 0.00 30.24 31.26 1jdz n GLN 34 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1jdz n ASN 35 N -0.43 4.28 -4.75 1.08 3.02 -1.26 -4.91 115.26 112.30 1jdz n ASN 35 Ca 0.00 -3.32 -0.41 0.00 -0.03 0.00 0.00 54.58 50.81 1jdz n ASN 35 Cb 0.00 -0.90 -0.02 0.00 -0.61 0.00 0.00 39.78 38.25 1jdz n ASN 35 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1jdz s PRO 36 N -2.10 4.25 0.04 3.52 0.04 -1.26 -4.64 135.00 134.85 1jdz s PRO 36 Ca 0.33 2.35 0.07 0.00 0.04 0.00 0.00 61.00 63.79 1jdz s PRO 36 Cb 0.04 -3.08 -0.02 0.00 0.04 0.00 0.00 34.50 31.47 1jdz s PRO 36 CO -0.04 -0.43 -0.21 -1.59 0.04 0.00 0.00 177.00 174.77 1jdz s LYS 37 N -0.67 1.45 -0.49 4.56 -2.85 -0.96 -4.95 119.74 115.82 1jdz s LYS 37 Ca 0.58 -0.93 -0.24 0.00 -1.00 0.00 0.00 55.97 54.38 1jdz s LYS 37 Cb -0.43 -1.55 0.03 0.00 -2.06 0.00 0.00 37.83 33.83 1jdz s LYS 37 CO 0.46 0.40 0.86 -1.17 0.10 0.00 0.00 175.35 176.01 1jdz s LEU 38 N -1.11 4.18 0.00 2.77 2.96 -1.26 -2.07 118.68 124.15 1jdz s LEU 38 Ca 0.08 -0.19 0.25 0.00 -0.22 0.00 0.00 54.13 54.04 1jdz s LEU 38 Cb -0.09 -2.94 0.39 0.00 0.50 0.00 0.00 46.19 44.05 1jdz s LEU 38 CO 0.01 -1.06 1.34 0.35 -1.32 0.00 0.00 176.35 175.68 1jdz n THR 39 N 6.20 0.00 -3.64 3.68 -2.24 -0.53 -4.94 114.28 112.81 1jdz n THR 39 Ca 0.02 -0.19 -0.08 0.00 -2.27 0.00 0.00 64.05 61.53 1jdz n THR 39 Cb 0.48 0.82 -0.07 0.00 -2.10 0.00 0.00 70.33 69.46 1jdz n THR 39 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1jdz s ASN 40 N -2.48 -0.49 0.00 3.42 3.84 -1.23 -4.17 114.94 113.83 1jdz s ASN 40 Ca 0.22 0.90 0.00 0.00 0.21 0.00 0.00 52.86 54.19 1jdz s ASN 40 Cb 0.19 0.98 0.00 0.00 -0.55 0.00 0.00 41.25 41.87 1jdz s ASN 40 CO 0.54 -0.15 0.03 -1.84 -2.79 0.00 0.00 177.10 172.89 1jdz n GLU 41 N 2.62 1.63 -1.58 0.43 0.28 -1.26 -2.25 120.64 120.51 1jdz n GLU 41 Ca -0.14 -0.03 -0.45 0.00 -0.16 0.00 0.00 57.16 56.38 1jdz n GLU 41 Cb 0.56 -0.25 -0.02 0.00 1.43 0.00 0.00 31.44 33.16 1jdz n GLU 41 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1jdz n ASN 42 N -0.24 1.23 -0.80 -1.84 5.15 -1.26 -0.98 115.26 116.51 1jdz n ASN 42 Ca 0.00 1.17 -0.08 0.00 -0.60 0.00 0.00 54.58 55.07 1jdz n ASN 42 Cb 0.03 -1.26 -0.04 0.00 -0.53 0.00 0.00 39.78 37.98 1jdz n ASN 42 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1jdz n ARG 43 N 0.95 -1.62 -0.74 1.20 1.74 -1.26 -1.36 116.66 115.57 1jdz n ARG 43 Ca 0.11 0.65 0.00 0.00 -0.77 0.00 0.00 57.85 57.84 1jdz n ARG 43 Cb 0.30 -4.76 0.00 0.00 -1.02 0.00 0.00 32.46 26.98 1jdz n ARG 43 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jdz n GLY 44 N 0.16 0.83 3.52 -0.13 0.00 -0.16 -4.99 105.19 104.42 1jdz n GLY 44 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1jdz n GLY 44 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jdz s PHE 45 N -3.20 2.93 0.14 1.61 2.99 -0.46 -4.80 117.98 117.19 1jdz s PHE 45 Ca 0.00 -1.43 -0.31 0.00 0.00 0.00 0.00 56.93 55.19 1jdz s PHE 45 Cb 0.00 -4.53 -0.08 0.00 0.00 0.00 0.00 43.02 38.41 1jdz s PHE 45 CO 0.00 -1.69 1.38 -0.51 -0.00 0.00 0.00 175.22 174.40 1jdz s LEU 46 N 3.54 4.38 -0.06 -0.37 1.43 -1.26 -4.16 118.68 122.18 1jdz s LEU 46 Ca 0.44 2.37 0.01 0.00 -1.03 0.00 0.00 54.13 55.91 1jdz s LEU 46 Cb -0.01 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.64 1jdz s LEU 46 CO -0.04 -0.63 -0.07 -0.69 0.23 0.00 0.00 176.35 175.15 1jdz s VAL 47 N 0.84 0.76 0.08 -1.59 1.01 -0.95 -1.32 120.40 119.23 1jdz s VAL 47 Ca 0.63 -0.23 0.10 0.00 0.00 0.00 0.00 61.98 62.47 1jdz s VAL 47 Cb -0.37 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 1jdz s VAL 47 CO 0.32 0.28 -0.26 -0.31 0.00 0.00 0.00 175.10 175.14 1jdz s TYR 48 N 1.00 2.24 -0.06 5.22 1.51 0.05 -1.45 117.35 125.85 1jdz s TYR 48 Ca -0.09 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.57 1jdz s TYR 48 Cb -0.14 -1.28 0.02 0.00 -0.11 0.00 0.00 41.96 40.45 1jdz s TYR 48 CO -0.00 0.22 -0.04 0.99 -1.11 0.00 0.00 175.55 175.61 1jdz s THR 49 N -0.94 0.57 0.00 -0.71 2.01 -0.88 -0.49 115.64 115.21 1jdz s THR 49 Ca 0.12 -0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.04 1jdz s THR 49 Cb -0.10 -0.63 0.00 0.00 0.01 0.00 0.00 72.50 71.78 1jdz s THR 49 CO 0.04 0.26 0.00 0.61 -0.69 0.00 0.00 174.62 174.84 1jdz n GLY 50 N 4.50 3.30 3.62 4.40 0.00 -0.75 -2.27 105.19 117.99 1jdz n GLY 50 Ca -0.18 -0.85 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 1jdz n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jdz s LYS 51 N 0.96 2.25 -0.18 1.61 -0.14 -1.26 -1.82 119.74 121.16 1jdz s LYS 51 Ca 0.00 -1.19 -0.09 0.00 -1.36 0.00 0.00 55.97 53.33 1jdz s LYS 51 Cb 0.00 -2.26 0.07 0.00 -1.68 0.00 0.00 37.83 33.96 1jdz s LYS 51 CO 0.00 0.44 0.42 -0.47 -0.76 0.00 0.00 175.35 174.98 1jdz s TYR 52 N -1.75 -0.67 -1.60 3.18 5.04 -0.47 0.07 117.35 121.15 1jdz s TYR 52 Ca 0.27 1.37 -0.17 0.00 -2.44 0.00 0.00 57.07 56.10 1jdz s TYR 52 Cb -0.09 0.28 0.14 0.00 0.35 0.00 0.00 41.96 42.65 1jdz s TYR 52 CO 0.17 -0.39 0.73 0.09 -1.34 0.00 0.00 175.55 174.82 1jdz n ASN 53 N 4.60 -3.38 0.00 4.32 4.13 -1.26 -0.24 115.26 123.42 1jdz n ASN 53 Ca -0.19 -0.88 0.00 0.00 1.68 0.00 0.00 54.58 55.19 1jdz n ASN 53 Cb 0.54 -2.78 0.00 0.00 -1.54 0.00 0.00 39.78 36.00 1jdz n ASN 53 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1jdz n GLY 54 N -1.33 2.73 3.71 7.41 0.00 -1.26 -5.02 105.19 111.43 1jdz n GLY 54 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1jdz n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jdz s GLU 55 N -0.05 2.85 0.26 1.61 0.41 0.66 -5.06 118.70 119.39 1jdz s GLU 55 Ca 0.00 -0.58 -0.30 0.00 -0.41 0.00 0.00 54.97 53.68 1jdz s GLU 55 Cb 0.00 -2.72 -0.09 0.00 -1.78 0.00 0.00 34.13 29.54 1jdz s GLU 55 CO 0.00 0.63 1.14 0.99 -0.49 0.00 0.00 175.26 177.53 1jdz s THR 56 N -1.11 3.46 0.19 3.63 2.01 -1.26 -1.37 115.64 121.19 1jdz s THR 56 Ca 0.20 1.40 -0.22 0.00 0.31 0.00 0.00 61.69 63.39 1jdz s THR 56 Cb -0.12 -3.89 0.05 0.00 0.01 0.00 0.00 72.50 68.55 1jdz s THR 56 CO 0.11 0.31 0.61 0.54 -0.69 0.00 0.00 174.62 175.50 1jdz s VAL 57 N -0.88 0.01 0.13 3.82 0.11 -0.75 -4.71 120.40 118.12 1jdz s VAL 57 Ca 0.47 -0.36 0.05 0.00 -2.93 0.00 0.00 61.98 59.21 1jdz s VAL 57 Cb -0.33 -1.32 -0.04 0.00 -1.53 0.00 0.00 36.38 33.17 1jdz s VAL 57 CO 0.41 -0.03 -0.13 -0.44 -3.33 0.00 0.00 175.10 171.58 1jdz s SER 58 N -2.81 1.89 -0.13 3.54 0.01 -0.91 -1.81 113.70 113.49 1jdz s SER 58 Ca 0.04 -0.87 0.02 0.00 1.31 0.00 0.00 55.95 56.46 1jdz s SER 58 Cb -0.02 -0.05 0.02 0.00 0.21 0.00 0.00 66.02 66.18 1jdz s SER 58 CO -0.07 -0.21 -0.17 -0.63 0.41 0.00 0.00 173.24 172.58 1jdz s ILE 59 N -2.49 1.67 0.07 1.44 1.01 0.36 -0.40 121.20 122.86 1jdz s ILE 59 Ca 0.11 -0.73 0.06 0.00 0.00 0.00 0.00 60.65 60.08 1jdz s ILE 59 Cb -0.03 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 1jdz s ILE 59 CO 0.02 0.47 -0.16 0.00 0.00 0.00 0.00 174.94 175.28 1jdz s ALA 60 N 1.05 1.33 -0.10 9.38 0.00 0.58 -0.77 121.76 133.22 1jdz s ALA 60 Ca -0.04 -1.03 -0.18 0.00 0.00 0.00 0.00 51.96 50.71 1jdz s ALA 60 Cb -0.15 -0.15 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1jdz s ALA 60 CO -0.04 0.22 0.47 0.99 0.00 0.00 0.00 175.76 177.41 1jdz s THR 61 N -1.18 5.16 -0.56 0.00 2.01 -0.44 -0.09 115.64 120.55 1jdz s THR 61 Ca 0.01 0.95 0.05 0.00 0.31 0.00 0.00 61.69 63.01 1jdz s THR 61 Cb -0.10 -3.81 0.03 0.00 0.01 0.00 0.00 72.50 68.63 1jdz s THR 61 CO 0.03 0.35 0.59 0.00 -0.69 0.00 0.00 174.62 174.90 1jdz n HIS 62 N 3.47 0.00 -4.59 4.92 1.44 0.53 -4.71 115.22 116.28 1jdz n HIS 62 Ca -0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.63 1jdz n HIS 62 Cb 0.52 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.63 1jdz n HIS 62 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1jdz n GLY 63 N 0.40 -0.66 3.67 -1.39 0.00 -0.93 -3.39 105.19 102.88 1jdz n GLY 63 Ca 0.03 -1.09 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 1jdz n GLY 63 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jdz s ILE 64 N 0.00 4.39 0.00 -0.61 1.01 -1.26 -4.60 121.20 120.13 1jdz s ILE 64 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.44 1jdz s ILE 64 Cb 0.00 -2.87 0.00 0.00 0.01 0.00 0.00 42.46 39.60 1jdz s ILE 64 CO 0.00 0.58 0.00 0.61 0.00 0.00 0.00 174.94 176.13 1jdz n GLY 65 N 2.42 1.02 0.12 6.18 0.00 -1.26 -4.43 105.19 109.25 1jdz n GLY 65 Ca -0.18 -1.69 -0.09 0.00 0.00 0.00 0.00 46.02 44.06 1jdz n GLY 65 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jdz h GLY 66 N 0.00 0.06 0.66 -0.02 0.00 -1.92 -2.36 103.07 99.48 1jdz h GLY 66 Ca 0.00 0.09 0.12 0.00 0.00 0.00 0.00 47.33 47.54 1jdz h GLY 66 CO 0.00 -0.09 0.56 -2.55 0.00 0.00 0.00 176.54 174.46 1jdz h PRO 67 N -0.06 0.75 0.06 4.80 0.11 -1.96 -1.00 132.00 134.70 1jdz h PRO 67 Ca 0.08 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 1jdz h PRO 67 Cb 0.18 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.12 1jdz h PRO 67 CO -0.18 0.50 -0.03 1.03 -0.21 0.00 0.00 178.00 179.11 1jdz h SER 68 N 0.78 -0.07 0.36 -2.05 0.87 -1.70 -3.12 113.55 108.61 1jdz h SER 68 Ca 0.42 -0.49 -0.06 0.00 -1.23 0.00 0.00 61.79 60.43 1jdz h SER 68 Cb 0.55 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 1jdz h SER 68 CO -0.18 0.48 -0.26 -0.29 -0.53 0.00 0.00 176.83 176.05 1jdz h ILE 69 N -0.64 1.04 -0.08 2.23 2.10 -1.20 -2.35 117.51 118.60 1jdz h ILE 69 Ca -0.01 -0.95 -0.00 0.00 1.08 0.00 0.00 64.86 64.98 1jdz h ILE 69 Cb 0.55 1.53 -0.00 0.00 -1.09 0.00 0.00 36.82 37.81 1jdz h ILE 69 CO 0.01 0.26 0.03 0.00 -1.08 0.00 0.00 178.15 177.37 1jdz h ALA 70 N 1.74 0.10 -0.13 0.18 0.00 -1.24 -0.87 119.26 119.05 1jdz h ALA 70 Ca -0.00 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1jdz h ALA 70 Cb 0.51 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1jdz h ALA 70 CO 0.03 -0.32 0.05 0.82 0.00 0.00 0.00 179.25 179.83 1jdz h ILE 71 N -0.03 0.97 -0.67 0.00 2.04 -1.42 -0.88 117.51 117.54 1jdz h ILE 71 Ca 0.03 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 65.86 1jdz h ILE 71 Cb 0.16 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 1jdz h ILE 71 CO -0.00 0.02 0.44 0.58 0.00 0.00 0.00 178.15 179.18 1jdz h VAL 72 N 0.11 1.15 -0.46 1.67 2.07 -1.35 -1.60 116.25 117.85 1jdz h VAL 72 Ca 0.05 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.21 1jdz h VAL 72 Cb 0.03 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 1jdz h VAL 72 CO -0.05 0.16 0.06 -0.07 0.02 0.00 0.00 177.57 177.68 1jdz h LEU 73 N 0.88 0.74 -0.92 2.57 3.38 -0.95 -1.45 115.31 119.56 1jdz h LEU 73 Ca 0.25 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1jdz h LEU 73 Cb -0.08 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 1jdz h LEU 73 CO -0.06 0.83 0.47 -0.33 0.09 0.00 0.00 178.44 179.43 1jdz h GLU 74 N 0.63 1.23 -0.07 1.13 4.39 -0.91 -1.39 114.58 119.58 1jdz h GLU 74 Ca 0.14 -0.15 -0.21 0.00 0.34 0.00 0.00 59.36 59.48 1jdz h GLU 74 Cb 0.41 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1jdz h GLU 74 CO 0.01 0.91 -0.81 0.93 -1.16 0.00 0.00 179.01 178.90 1jdz h GLU 75 N 1.23 0.52 -0.39 2.33 5.08 -1.15 -2.23 114.58 119.97 1jdz h GLU 75 Ca 0.31 -0.46 -0.09 0.00 -1.00 0.00 0.00 59.36 58.12 1jdz h GLU 75 Cb 0.05 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1jdz h GLU 75 CO -0.05 1.09 -0.14 -0.07 -1.00 0.00 0.00 179.01 178.84 1jdz h LEU 76 N 0.34 0.69 -0.73 1.33 3.38 -1.11 -1.27 115.31 117.94 1jdz h LEU 76 Ca -0.05 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1jdz h LEU 76 Cb 1.41 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 1jdz h LEU 76 CO 0.15 0.85 0.24 0.00 0.09 0.00 0.00 178.44 179.77 1jdz h ALA 77 N 1.21 0.95 -0.05 1.53 0.00 -1.17 -0.20 119.26 121.54 1jdz h ALA 77 Ca 0.11 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1jdz h ALA 77 Cb 0.60 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1jdz h ALA 77 CO 0.04 0.62 -0.35 0.52 0.00 0.00 0.00 179.25 180.08 1jdz h MET 78 N 1.07 0.10 -0.06 0.00 2.86 -1.04 -1.99 114.93 115.87 1jdz h MET 78 Ca 0.24 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1jdz h MET 78 Cb 0.29 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.94 1jdz h MET 78 CO -0.01 0.44 0.00 1.28 1.06 0.00 0.00 176.91 179.68 1jdz n LEU 79 N -4.10 0.43 0.00 1.22 4.77 -0.51 -4.88 117.00 113.92 1jdz n LEU 79 Ca -0.02 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 1jdz n LEU 79 Cb 0.41 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1jdz n LEU 79 CO 0.40 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1jdz n GLY 80 N 0.77 0.72 3.80 -0.72 0.00 -0.75 -4.41 105.19 104.60 1jdz n GLY 80 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1jdz n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jdz s ALA 81 N -2.00 3.27 0.00 4.61 0.00 -0.19 -4.34 121.76 123.10 1jdz s ALA 81 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1jdz s ALA 81 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 20.08 1jdz s ALA 81 CO 0.00 0.23 0.00 0.27 0.00 0.00 0.00 175.76 176.26 1jdz n ASN 82 N 0.45 0.00 -3.98 0.00 2.04 -0.80 -4.09 115.26 108.89 1jdz n ASN 82 Ca 0.01 -0.82 -0.28 0.00 -0.44 0.00 0.00 54.58 53.05 1jdz n ASN 82 Cb 0.51 0.00 -0.17 0.00 -2.53 0.00 0.00 39.78 37.59 1jdz n ASN 82 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1jdz s VAL 83 N 0.00 1.29 -0.06 3.53 1.01 -0.55 -1.82 120.40 123.80 1jdz s VAL 83 Ca 0.00 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1jdz s VAL 83 Cb 0.00 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.15 1jdz s VAL 83 CO 0.00 0.41 -0.12 -0.36 0.00 0.00 0.00 175.10 175.02 1jdz s PHE 84 N 1.45 1.47 -0.29 5.22 0.40 0.22 -1.06 117.98 125.38 1jdz s PHE 84 Ca 0.02 -0.54 0.02 0.00 -0.60 0.00 0.00 56.93 55.83 1jdz s PHE 84 Cb -0.13 -1.07 0.08 0.00 0.51 0.00 0.00 43.02 42.41 1jdz s PHE 84 CO -0.07 -0.27 0.01 0.42 0.70 0.00 0.00 175.22 176.01 1jdz s ILE 85 N 0.63 1.69 0.31 0.64 1.01 -0.72 -1.88 121.20 122.90 1jdz s ILE 85 Ca -0.14 -1.67 -0.28 0.00 0.00 0.00 0.00 60.65 58.55 1jdz s ILE 85 Cb -0.16 -2.11 -0.09 0.00 0.01 0.00 0.00 42.46 40.11 1jdz s ILE 85 CO 0.04 -0.39 1.10 -0.60 0.00 0.00 0.00 174.94 175.09 1jdz s ARG 86 N 1.25 4.49 -0.17 2.79 3.52 -0.74 -1.93 118.95 128.16 1jdz s ARG 86 Ca 0.03 1.76 -0.05 0.00 -0.13 0.00 0.00 55.73 57.35 1jdz s ARG 86 Cb -0.19 -3.02 0.06 0.00 -1.56 0.00 0.00 34.95 30.24 1jdz s ARG 86 CO -0.11 0.09 0.08 -0.47 -0.81 0.00 0.00 175.30 174.08 1jdz s TYR 87 N -1.28 0.30 0.00 5.12 5.04 0.08 -1.97 117.35 124.65 1jdz s TYR 87 Ca 0.48 -0.35 0.00 0.00 -2.44 0.00 0.00 57.07 54.76 1jdz s TYR 87 Cb -0.30 -0.73 0.00 0.00 0.35 0.00 0.00 41.96 41.28 1jdz s TYR 87 CO 0.39 -0.50 0.00 0.41 -1.34 0.00 0.00 175.55 174.50 1jdz n GLY 88 N 5.25 4.13 3.67 8.97 0.00 -1.14 -4.40 105.19 121.66 1jdz n GLY 88 Ca -0.07 -0.98 -0.23 0.00 0.00 0.00 0.00 46.02 44.74 1jdz n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jdz s THR 89 N -1.44 3.59 0.21 2.61 -4.23 -1.26 0.11 115.64 115.23 1jdz s THR 89 Ca 0.00 -1.80 -0.09 0.00 -1.18 0.00 0.00 61.69 58.62 1jdz s THR 89 Cb 0.00 -2.91 -0.01 0.00 1.34 0.00 0.00 72.50 70.92 1jdz s THR 89 CO 0.00 -0.34 0.35 0.28 -0.54 0.00 0.00 174.62 174.37 1jdz s THR 90 N -2.22 0.02 -0.21 3.99 -1.32 -0.15 -4.79 115.64 110.96 1jdz s THR 90 Ca 0.31 -1.50 -0.02 0.00 -1.21 0.00 0.00 61.69 59.27 1jdz s THR 90 Cb -0.07 -2.13 0.01 0.00 -1.51 0.00 0.00 72.50 68.80 1jdz s THR 90 CO 0.20 -0.10 -0.10 -0.83 -2.21 0.00 0.00 174.62 171.58 1jdz s GLY 91 N -3.03 1.53 0.67 6.08 0.00 -0.82 -1.67 107.32 110.08 1jdz s GLY 91 Ca 0.24 -1.22 -0.17 0.00 0.00 0.00 0.00 44.72 43.57 1jdz s GLY 91 CO 0.06 0.38 1.21 0.00 0.00 0.00 0.00 173.10 174.76 1jdz s ALA 92 N 1.39 2.31 -0.48 3.20 0.00 -0.44 -0.76 121.76 126.98 1jdz s ALA 92 Ca 0.05 0.94 0.04 0.00 0.00 0.00 0.00 51.96 52.99 1jdz s ALA 92 Cb -0.14 -3.47 0.06 0.00 0.00 0.00 0.00 23.12 19.58 1jdz s ALA 92 CO -0.07 -1.58 0.79 1.28 0.00 0.00 0.00 175.76 176.18 1jdz n LEU 93 N -2.25 1.70 -4.29 0.00 4.77 -0.22 -0.92 117.00 115.79 1jdz n LEU 93 Ca 0.14 -1.34 -0.24 0.00 -0.03 0.00 0.00 56.01 54.54 1jdz n LEU 93 Cb 0.50 -0.03 -0.12 0.00 -2.33 0.00 0.00 43.42 41.43 1jdz n LEU 93 CO 0.47 0.40 -0.51 0.68 -1.33 0.00 0.00 177.39 177.09 1jdz s VAL 94 N -0.58 1.74 0.17 4.08 -7.23 -1.26 -4.63 120.40 112.70 1jdz s VAL 94 Ca 0.06 -1.60 -0.11 0.00 -1.81 0.00 0.00 61.98 58.53 1jdz s VAL 94 Cb 0.04 -1.60 0.07 0.00 0.56 0.00 0.00 36.38 35.44 1jdz s VAL 94 CO 0.06 -0.09 1.69 1.55 -0.31 0.00 0.00 175.10 178.00 1jdz h PRO 95 N 3.97 0.94 0.00 4.82 0.13 -1.96 -3.31 132.00 136.59 1jdz h PRO 95 Ca -0.46 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 1jdz h PRO 95 Cb 1.18 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1jdz h PRO 95 CO 0.41 0.86 0.00 2.48 -0.23 0.00 0.00 178.00 181.52 1jdz n TYR 96 N -4.37 0.48 -3.05 1.56 0.18 -1.26 -4.75 117.16 105.95 1jdz n TYR 96 Ca 0.03 0.21 -0.40 0.00 1.88 0.00 0.00 57.90 59.62 1jdz n TYR 96 Cb 0.23 -0.83 -0.05 0.00 -0.38 0.00 0.00 39.34 38.31 1jdz n TYR 96 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 1jdz s ILE 97 N -3.23 5.04 0.29 -3.48 1.01 -1.25 -5.06 121.20 114.52 1jdz s ILE 97 Ca 0.03 1.43 0.00 0.00 0.00 0.00 0.00 60.65 62.12 1jdz s ILE 97 Cb 0.08 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 1jdz s ILE 97 CO 0.28 0.24 0.49 0.20 0.00 0.00 0.00 174.94 176.14 1jdz s ASN 98 N 0.82 6.34 0.35 3.58 0.01 -1.26 -4.94 114.94 119.84 1jdz s ASN 98 Ca 0.37 0.43 -0.28 0.00 -0.71 0.00 0.00 52.86 52.67 1jdz s ASN 98 Cb -0.18 -2.02 -0.10 0.00 0.41 0.00 0.00 41.25 39.36 1jdz s ASN 98 CO 0.17 -0.19 1.32 -0.76 -1.51 0.00 0.00 177.10 176.13 1jdz s LEU 99 N -3.93 4.37 0.00 0.60 1.43 -1.26 -2.58 118.68 117.31 1jdz s LEU 99 Ca 0.39 2.71 0.00 0.00 -1.03 0.00 0.00 54.13 56.20 1jdz s LEU 99 Cb -0.10 -3.71 0.00 0.00 0.03 0.00 0.00 46.19 42.41 1jdz s LEU 99 CO 0.33 -0.63 0.00 0.61 0.23 0.00 0.00 176.35 176.88 1jdz n GLY 100 N 0.74 3.28 3.83 -3.19 0.00 -0.57 -5.02 105.19 104.25 1jdz n GLY 100 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1jdz n GLY 100 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jdz s GLU 101 N -0.77 -0.22 0.14 1.61 2.02 -1.06 -4.73 118.70 115.69 1jdz s GLU 101 Ca 0.00 -0.41 0.09 0.00 0.02 0.00 0.00 54.97 54.66 1jdz s GLU 101 Cb 0.00 -1.75 -0.04 0.00 0.10 0.00 0.00 34.13 32.44 1jdz s GLU 101 CO 0.00 -2.99 -0.20 0.71 0.02 0.00 0.00 175.26 172.81 1jdz s TYR 102 N -3.66 1.85 -0.13 1.61 1.51 0.16 -2.25 117.35 116.43 1jdz s TYR 102 Ca 0.75 -0.44 0.00 0.00 -1.01 0.00 0.00 57.07 56.37 1jdz s TYR 102 Cb -0.04 -0.95 0.02 0.00 -0.11 0.00 0.00 41.96 40.88 1jdz s TYR 102 CO 0.54 0.30 -0.13 0.42 -1.11 0.00 0.00 175.55 175.57 1jdz s ILE 103 N -1.70 1.41 -0.36 2.71 1.01 -0.81 0.36 121.20 123.82 1jdz s ILE 103 Ca 0.13 -0.55 -0.16 0.00 0.00 0.00 0.00 60.65 60.07 1jdz s ILE 103 Cb -0.07 -1.33 -0.01 0.00 0.01 0.00 0.00 42.46 41.06 1jdz s ILE 103 CO 0.06 0.43 0.41 -0.63 0.00 0.00 0.00 174.94 175.21 1jdz s ILE 104 N 1.41 5.12 0.08 2.92 1.01 0.88 -1.47 121.20 131.14 1jdz s ILE 104 Ca 0.02 0.07 -0.31 0.00 0.00 0.00 0.00 60.65 60.43 1jdz s ILE 104 Cb -0.13 -3.89 -0.06 0.00 0.01 0.00 0.00 42.46 38.39 1jdz s ILE 104 CO -0.08 -0.17 1.21 -0.69 0.00 0.00 0.00 174.94 175.21 1jdz s VAL 105 N 2.13 3.95 -0.89 2.92 1.01 -0.95 -2.05 120.40 126.54 1jdz s VAL 105 Ca 0.14 1.42 0.11 0.00 0.00 0.00 0.00 61.98 63.64 1jdz s VAL 105 Cb -0.16 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 1jdz s VAL 105 CO 0.12 0.12 0.61 0.35 0.00 0.00 0.00 175.10 176.31 1jdz n THR 106 N 3.79 0.00 0.00 3.92 -2.24 -0.37 -4.64 114.28 114.74 1jdz n THR 106 Ca 0.09 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1jdz n THR 106 Cb 0.46 1.10 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 1jdz n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jdz n GLY 107 N 1.00 0.90 2.86 3.38 0.00 -1.26 -4.49 105.19 107.57 1jdz n GLY 107 Ca 0.04 -0.81 -0.19 0.00 0.00 0.00 0.00 46.02 45.06 1jdz n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jdz s ALA 108 N -2.00 0.55 0.29 4.61 0.00 -0.52 -1.68 121.76 123.01 1jdz s ALA 108 Ca 0.00 0.02 -0.06 0.00 0.00 0.00 0.00 51.96 51.92 1jdz s ALA 108 Cb 0.00 -0.39 -0.06 0.00 0.00 0.00 0.00 23.12 22.67 1jdz s ALA 108 CO 0.00 -0.05 0.57 -1.12 0.00 0.00 0.00 175.76 175.16 1jdz s SER 109 N 0.98 6.48 0.09 0.00 0.01 0.30 -4.62 113.70 116.94 1jdz s SER 109 Ca -0.10 0.79 -0.26 0.00 1.31 0.00 0.00 55.95 57.69 1jdz s SER 109 Cb -0.14 -2.17 0.08 0.00 0.21 0.00 0.00 66.02 64.00 1jdz s SER 109 CO -0.01 -0.19 0.74 -0.72 0.41 0.00 0.00 173.24 173.47 1jdz s TYR 110 N -2.06 -0.43 -0.01 2.43 1.13 -1.26 -1.21 117.35 115.93 1jdz s TYR 110 Ca 0.45 0.25 -0.18 0.00 -1.41 0.00 0.00 57.07 56.18 1jdz s TYR 110 Cb -0.11 0.56 -0.06 0.00 -1.10 0.00 0.00 41.96 41.25 1jdz s TYR 110 CO 0.29 -0.72 0.52 -0.80 -2.51 0.00 0.00 175.55 172.33 1jdz s ASN 111 N -2.63 6.90 1.01 -0.18 0.01 -1.26 -5.06 114.94 113.72 1jdz s ASN 111 Ca 0.03 1.07 -0.15 0.00 -0.71 0.00 0.00 52.86 53.10 1jdz s ASN 111 Cb -0.01 -2.32 0.20 0.00 0.41 0.00 0.00 41.25 39.52 1jdz s ASN 111 CO -0.10 0.18 1.16 0.00 -1.51 0.00 0.00 177.10 176.83 1jdz s GLN 112 N -0.46 0.30 0.00 -0.60 -2.07 -1.26 -4.95 119.66 110.62 1jdz s GLN 112 Ca 0.28 0.06 0.00 0.00 -1.82 0.00 0.00 55.36 53.88 1jdz s GLN 112 Cb -0.18 -1.76 0.00 0.00 -1.09 0.00 0.00 33.01 29.98 1jdz s GLN 112 CO 0.15 -2.72 0.00 0.41 -1.32 0.00 0.00 175.29 171.81 1jdz n GLY 113 N -2.07 -0.94 6.35 2.60 0.00 -1.26 -5.02 105.19 104.85 1jdz n GLY 113 Ca 0.10 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1jdz n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jdz n GLY 114 N 0.00 1.88 0.32 -0.02 0.00 -1.26 -1.47 105.19 104.64 1jdz n GLY 114 Ca 0.00 0.32 0.02 0.00 0.00 0.00 0.00 46.02 46.36 1jdz n GLY 114 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jdz h LEU 115 N 0.00 0.79 -0.67 0.99 6.46 -1.98 -2.25 115.31 118.66 1jdz h LEU 115 Ca 0.00 0.03 -0.08 0.00 -0.12 0.00 0.00 57.88 57.71 1jdz h LEU 115 Cb 0.00 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 39.78 1jdz h LEU 115 CO 0.00 0.48 0.10 -0.26 -0.62 0.00 0.00 178.44 178.14 1jdz h PHE 116 N 0.91 1.18 -0.39 1.25 -1.00 -1.66 -2.47 116.94 114.76 1jdz h PHE 116 Ca 0.40 -0.17 -0.04 0.00 2.81 0.00 0.00 57.97 60.97 1jdz h PHE 116 Cb 0.28 -0.32 -0.02 0.00 3.61 0.00 0.00 35.95 39.50 1jdz h PHE 116 CO -0.04 0.99 0.10 -0.92 -1.61 0.00 0.00 178.31 176.83 1jdz h TYR 117 N 1.03 0.65 -0.52 -0.55 3.20 -1.09 0.19 116.97 119.87 1jdz h TYR 117 Ca 0.20 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1jdz h TYR 117 Cb 0.45 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 1jdz h TYR 117 CO 0.03 0.62 0.27 1.96 -1.64 0.00 0.00 178.16 179.40 1jdz h GLN 118 N 0.49 0.73 0.04 1.82 4.20 -1.30 0.19 115.11 121.27 1jdz h GLN 118 Ca 0.12 -0.08 -0.13 0.00 0.06 0.00 0.00 58.65 58.62 1jdz h GLN 118 Cb 0.30 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1jdz h GLN 118 CO -0.00 0.55 -0.66 1.88 -0.67 0.00 0.00 178.83 179.93 1jdz h TYR 119 N 0.73 0.15 0.00 2.96 0.05 -1.26 -3.38 116.97 116.22 1jdz h TYR 119 Ca 0.19 -0.11 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 1jdz h TYR 119 Cb 0.06 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 37.79 1jdz h TYR 119 CO 0.01 1.26 -0.06 -0.07 -1.05 0.00 0.00 178.16 178.24 1jdz h LEU 120 N -0.79 0.00 0.00 3.88 3.38 -0.63 -3.48 115.31 117.67 1jdz h LEU 120 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1jdz h LEU 120 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1jdz h LEU 120 CO -0.02 0.06 0.00 0.54 0.09 0.00 0.00 178.44 179.12 1jdz n ARG 121 N -3.12 0.00 -2.38 1.13 1.74 0.66 -4.93 116.66 109.76 1jdz n ARG 121 Ca 0.04 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.07 1jdz n ARG 121 Cb 0.54 -2.41 0.01 0.00 -1.02 0.00 0.00 32.46 29.58 1jdz n ARG 121 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1jdz n ASP 122 N 0.00 -1.04 -2.11 0.55 3.85 -1.25 -5.02 116.55 111.53 1jdz n ASP 122 Ca 0.00 -1.78 -0.22 0.00 -0.71 0.00 0.00 54.79 52.08 1jdz n ASP 122 Cb 0.00 1.75 0.18 0.00 -1.35 0.00 0.00 41.12 41.70 1jdz n ASP 122 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1jdz n ASN 123 N -1.34 3.63 -4.76 -1.12 3.02 -1.26 -4.52 115.26 108.91 1jdz n ASN 123 Ca -0.04 -3.63 -0.41 0.00 -0.03 0.00 0.00 54.58 50.47 1jdz n ASN 123 Cb 0.28 -0.82 -0.03 0.00 -0.61 0.00 0.00 39.78 38.61 1jdz n ASN 123 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jdz s ALA 124 N -3.30 3.48 -1.12 5.41 0.00 -1.26 -4.93 121.76 120.04 1jdz s ALA 124 Ca 0.56 1.15 -0.20 0.00 0.00 0.00 0.00 51.96 53.47 1jdz s ALA 124 Cb 0.47 -3.44 0.08 0.00 0.00 0.00 0.00 23.12 20.23 1jdz s ALA 124 CO 0.09 -0.51 1.49 0.00 0.00 0.00 0.00 175.76 176.84 1jdz s VAL 126 N 3.98 3.27 0.01 0.00 1.01 -1.26 -4.93 120.40 122.48 1jdz s VAL 126 Ca 0.46 1.23 -0.30 0.00 0.00 0.00 0.00 61.98 63.37 1jdz s VAL 126 Cb 0.00 -3.78 -0.08 0.00 0.00 0.00 0.00 36.38 32.52 1jdz s VAL 126 CO -0.03 0.27 1.96 0.00 0.00 0.00 0.00 175.10 177.30 1jdz s ALA 127 N -0.91 3.53 -0.90 5.51 0.00 -1.26 -4.92 121.76 122.80 1jdz s ALA 127 Ca 0.48 1.25 -0.10 0.00 0.00 0.00 0.00 51.96 53.59 1jdz s ALA 127 Cb -0.34 -3.85 0.23 0.00 0.00 0.00 0.00 23.12 19.15 1jdz s ALA 127 CO 0.43 -1.64 0.84 0.45 0.00 0.00 0.00 175.76 175.85 1jdz s SER 128 N 4.60 6.71 0.13 0.00 0.15 -1.26 -4.80 113.70 119.24 1jdz s SER 128 Ca 0.88 -3.09 0.05 0.00 0.70 0.00 0.00 55.95 54.50 1jdz s SER 128 Cb -0.41 -2.15 -0.04 0.00 -1.71 0.00 0.00 66.02 61.71 1jdz s SER 128 CO 0.40 -0.43 -0.13 0.42 1.20 0.00 0.00 173.24 174.71 1jdz s THR 129 N -0.44 1.28 0.84 6.45 -4.23 -1.26 -1.43 115.64 116.84 1jdz s THR 129 Ca 0.23 -1.85 -0.12 0.00 -1.18 0.00 0.00 61.69 58.77 1jdz s THR 129 Cb -0.11 -1.64 0.12 0.00 1.34 0.00 0.00 72.50 72.21 1jdz s THR 129 CO -0.08 -0.54 1.20 -2.16 -0.54 0.00 0.00 174.62 172.49 1jdz s PRO 130 N -3.07 1.51 0.08 3.99 0.04 -1.26 -4.77 135.00 131.53 1jdz s PRO 130 Ca 0.12 -0.19 -0.31 0.00 0.04 0.00 0.00 61.00 60.66 1jdz s PRO 130 Cb -0.02 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.48 1jdz s PRO 130 CO 0.02 -1.83 1.44 0.34 0.04 0.00 0.00 177.00 177.01 1jdz s ASP 131 N -4.69 6.79 0.12 6.66 2.15 0.84 -4.92 116.67 123.62 1jdz s ASP 131 Ca 0.66 2.31 -0.26 0.00 0.43 0.00 0.00 52.55 55.70 1jdz s ASP 131 Cb -0.08 -2.58 -0.06 0.00 -0.30 0.00 0.00 42.92 39.90 1jdz s ASP 131 CO 0.50 -0.71 1.64 0.15 -0.17 0.00 0.00 175.17 176.58 1jdz h PHE 132 N 7.24 -0.65 0.12 -5.34 3.57 -1.94 -2.20 116.94 117.74 1jdz h PHE 132 Ca -0.41 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.12 1jdz h PHE 132 Cb 1.20 0.29 -0.02 0.00 2.79 0.00 0.00 35.95 40.21 1jdz h PHE 132 CO 0.70 -0.34 -0.19 0.93 -2.23 0.00 0.00 178.31 177.18 1jdz h GLU 133 N -0.39 -0.36 -0.87 1.11 5.08 -1.97 -2.05 114.58 115.13 1jdz h GLU 133 Ca 0.06 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1jdz h GLU 133 Cb 0.46 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 1jdz h GLU 133 CO -0.21 -0.24 0.56 1.25 -1.00 0.00 0.00 179.01 179.38 1jdz h LEU 134 N -0.37 0.92 -0.75 1.33 5.85 -1.90 -2.01 115.31 118.38 1jdz h LEU 134 Ca 0.02 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 1jdz h LEU 134 Cb 0.38 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 1jdz h LEU 134 CO -0.09 0.63 0.25 0.74 -0.34 0.00 0.00 178.44 179.63 1jdz h THR 135 N 1.08 1.26 0.00 1.05 2.02 -1.15 -1.87 112.91 115.29 1jdz h THR 135 Ca 0.35 -0.89 -0.06 0.00 0.77 0.00 0.00 66.41 66.59 1jdz h THR 135 Cb 0.03 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 1jdz h THR 135 CO -0.13 0.35 -0.28 0.78 0.37 0.00 0.00 175.52 176.62 1jdz h ASN 136 N 1.10 0.00 -0.08 4.18 2.35 -0.82 -2.35 115.58 119.96 1jdz h ASN 136 Ca 0.24 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.86 1jdz h ASN 136 Cb 0.29 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 1jdz h ASN 136 CO -0.01 0.28 -0.38 0.11 -1.65 0.00 0.00 177.43 175.78 1jdz h LYS 137 N 0.00 0.59 -0.43 0.81 1.57 -0.67 -2.60 116.57 115.85 1jdz h LYS 137 Ca -0.00 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.43 1jdz h LYS 137 Cb 0.51 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1jdz h LYS 137 CO 0.04 0.87 0.05 -0.07 -0.57 0.00 0.00 179.45 179.77 1jdz h LEU 138 N 0.49 0.71 -0.72 2.94 3.38 -0.89 -0.88 115.31 120.34 1jdz h LEU 138 Ca 0.05 -0.28 0.06 0.00 0.09 0.00 0.00 57.88 57.80 1jdz h LEU 138 Cb 0.88 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.38 1jdz h LEU 138 CO 0.08 0.81 0.42 0.58 0.09 0.00 0.00 178.44 180.41 1jdz h VAL 139 N 0.58 0.99 -0.38 1.22 2.07 -1.29 -0.69 116.25 118.76 1jdz h VAL 139 Ca 0.13 -0.26 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 1jdz h VAL 139 Cb 0.42 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1jdz h VAL 139 CO 0.01 0.14 -0.02 0.74 0.02 0.00 0.00 177.57 178.46 1jdz h THR 140 N 0.77 1.26 0.39 2.57 2.02 -1.22 -0.83 112.91 117.87 1jdz h THR 140 Ca 0.32 -1.03 -0.02 0.00 0.77 0.00 0.00 66.41 66.44 1jdz h THR 140 Cb 0.17 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1jdz h THR 140 CO -0.17 0.35 -0.21 0.28 0.37 0.00 0.00 175.52 176.13 1jdz h SER 141 N 0.49 -0.51 -0.66 4.18 0.02 -0.71 0.92 113.55 117.28 1jdz h SER 141 Ca 0.10 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.11 1jdz h SER 141 Cb 0.50 0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.14 1jdz h SER 141 CO 0.02 -0.35 0.44 -0.26 -1.14 0.00 0.00 176.83 175.55 1jdz h PHE 142 N -0.56 0.77 -0.34 3.45 -1.00 -1.12 -1.66 116.94 116.48 1jdz h PHE 142 Ca -0.05 0.02 -0.17 0.00 2.81 0.00 0.00 57.97 60.58 1jdz h PHE 142 Cb 0.44 -0.26 -0.00 0.00 3.61 0.00 0.00 35.95 39.74 1jdz h PHE 142 CO -0.07 0.45 -0.45 1.03 -1.61 0.00 0.00 178.31 177.66 1jdz h SER 143 N 0.80 0.99 -0.41 2.17 0.87 -0.86 -1.59 113.55 115.51 1jdz h SER 143 Ca 0.26 -0.50 -0.01 0.00 -1.23 0.00 0.00 61.79 60.32 1jdz h SER 143 Cb 0.06 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 1jdz h SER 143 CO -0.07 1.29 0.22 0.11 -0.53 0.00 0.00 176.83 177.85 1jdz h LYS 144 N 0.71 0.61 -0.77 2.24 1.57 0.05 -1.50 116.57 119.48 1jdz h LYS 144 Ca 0.04 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1jdz h LYS 144 Cb 1.06 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1jdz h LYS 144 CO 0.11 0.46 0.00 0.54 -0.57 0.00 0.00 179.45 179.99 1jdz n ARG 145 N -4.41 2.96 -4.08 3.15 1.74 -0.73 -4.93 116.66 110.37 1jdz n ARG 145 Ca 0.03 -1.61 -0.30 0.00 -0.77 0.00 0.00 57.85 55.21 1jdz n ARG 145 Cb 0.11 -1.87 -0.03 0.00 -1.02 0.00 0.00 32.46 29.65 1jdz n ARG 145 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1jdz n ASN 146 N 0.33 -1.21 -4.81 0.55 3.02 -0.56 -4.96 115.26 107.62 1jdz n ASN 146 Ca 0.14 -1.04 -0.34 0.00 -0.03 0.00 0.00 54.58 53.32 1jdz n ASN 146 Cb 0.72 -2.81 -0.07 0.00 -0.61 0.00 0.00 39.78 37.02 1jdz n ASN 146 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1jdz s LEU 147 N -7.12 4.03 -0.40 3.41 1.43 -0.61 -5.05 118.68 114.37 1jdz s LEU 147 Ca 0.26 0.23 -0.28 0.00 -1.03 0.00 0.00 54.13 53.31 1jdz s LEU 147 Cb -0.14 -2.27 0.02 0.00 0.03 0.00 0.00 46.19 43.83 1jdz s LEU 147 CO 0.91 0.30 1.05 -0.75 0.23 0.00 0.00 176.35 178.10 1jdz s LYS 148 N -1.60 3.85 0.07 1.70 2.47 -1.26 -4.68 119.74 120.29 1jdz s LYS 148 Ca 0.22 0.71 0.01 0.00 -1.56 0.00 0.00 55.97 55.34 1jdz s LYS 148 Cb -0.12 -3.83 -0.04 0.00 -1.46 0.00 0.00 37.83 32.38 1jdz s LYS 148 CO 0.12 -1.11 -0.05 1.52 0.16 0.00 0.00 175.35 175.99 1jdz s TYR 149 N 3.92 0.68 0.11 4.03 -0.85 -1.26 -0.66 117.35 123.32 1jdz s TYR 149 Ca 0.44 -0.85 0.09 0.00 -0.52 0.00 0.00 57.07 56.23 1jdz s TYR 149 Cb -0.10 -0.43 -0.04 0.00 0.38 0.00 0.00 41.96 41.78 1jdz s TYR 149 CO 0.23 -0.21 -0.22 0.71 -1.52 0.00 0.00 175.55 174.54 1jdz s TYR 150 N -3.12 1.87 -0.13 -3.49 1.51 0.16 -4.94 117.35 109.21 1jdz s TYR 150 Ca 0.04 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.70 1jdz s TYR 150 Cb 0.02 -1.02 -0.01 0.00 -0.11 0.00 0.00 41.96 40.85 1jdz s TYR 150 CO -0.05 0.23 -0.17 0.08 -1.11 0.00 0.00 175.55 174.53 1jdz s VAL 151 N -1.18 2.63 -0.73 0.71 1.01 -1.26 -0.09 120.40 121.50 1jdz s VAL 151 Ca 0.08 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1jdz s VAL 151 Cb -0.10 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.20 1jdz s VAL 151 CO 0.05 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.29 1jdz n GLY 152 N 3.76 -1.33 3.89 4.51 0.00 -0.87 -4.97 105.19 110.17 1jdz n GLY 152 Ca -0.19 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.53 1jdz n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jdz s ASN 153 N -1.03 6.37 0.10 1.61 0.01 -1.26 -1.24 114.94 119.50 1jdz s ASN 153 Ca 0.00 1.10 0.03 0.00 -0.71 0.00 0.00 52.86 53.28 1jdz s ASN 153 Cb 0.00 -2.32 -0.04 0.00 0.41 0.00 0.00 41.25 39.30 1jdz s ASN 153 CO 0.00 -0.55 -0.09 0.68 -1.51 0.00 0.00 177.10 175.63 1jdz s VAL 154 N -2.66 0.87 -0.24 1.60 -7.23 -0.68 -1.25 120.40 110.81 1jdz s VAL 154 Ca 0.50 -1.73 -0.12 0.00 -1.81 0.00 0.00 61.98 58.82 1jdz s VAL 154 Cb -0.10 -1.45 -0.05 0.00 0.56 0.00 0.00 36.38 35.33 1jdz s VAL 154 CO 0.41 -0.66 0.23 0.12 -0.31 0.00 0.00 175.10 174.89 1jdz s PHE 155 N -2.81 3.31 -0.74 2.82 5.36 -0.28 -0.54 117.98 125.11 1jdz s PHE 155 Ca 0.07 0.31 -0.19 0.00 -0.96 0.00 0.00 56.93 56.17 1jdz s PHE 155 Cb -0.00 -2.35 0.13 0.00 -0.34 0.00 0.00 43.02 40.45 1jdz s PHE 155 CO -0.01 0.01 0.87 -1.12 -1.46 0.00 0.00 175.22 173.51 1jdz s SER 156 N 1.16 6.40 0.47 6.13 0.01 -0.35 -1.49 113.70 126.03 1jdz s SER 156 Ca 0.10 -1.76 -0.18 0.00 1.31 0.00 0.00 55.95 55.42 1jdz s SER 156 Cb -0.14 -2.33 -0.09 0.00 0.21 0.00 0.00 66.02 63.67 1jdz s SER 156 CO 0.06 -1.05 0.96 -0.55 0.41 0.00 0.00 173.24 173.07 1jdz s SER 157 N 3.40 6.76 -0.01 2.44 0.15 0.22 -4.64 113.70 122.03 1jdz s SER 157 Ca 0.20 1.61 0.13 0.00 0.70 0.00 0.00 55.95 58.59 1jdz s SER 157 Cb -0.15 -2.52 -0.16 0.00 -1.71 0.00 0.00 66.02 61.48 1jdz s SER 157 CO -0.00 -0.48 0.45 0.47 1.20 0.00 0.00 173.24 174.88 1jdz n ASP 158 N -1.15 1.09 -3.76 5.45 8.00 -1.26 -4.40 116.55 120.52 1jdz n ASP 158 Ca 0.07 -0.52 -0.30 0.00 0.71 0.00 0.00 54.79 54.75 1jdz n ASP 158 Cb 0.54 1.21 -0.14 0.00 -0.02 0.00 0.00 41.12 42.71 1jdz n ASP 158 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jdz s ALA 159 N -2.46 1.97 0.29 2.24 0.00 -1.26 -4.98 121.76 117.55 1jdz s ALA 159 Ca 0.01 -2.17 0.01 0.00 0.00 0.00 0.00 51.96 49.82 1jdz s ALA 159 Cb 0.09 -1.78 0.56 0.00 0.00 0.00 0.00 23.12 21.99 1jdz s ALA 159 CO 0.54 -1.84 1.85 0.35 0.00 0.00 0.00 175.76 176.66 1jdz h PHE 160 N 7.47 1.13 -0.58 0.00 3.57 -2.00 -2.98 116.94 123.54 1jdz h PHE 160 Ca -0.07 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1jdz h PHE 160 Cb 0.98 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 39.36 1jdz h PHE 160 CO 0.42 0.46 0.00 0.66 -2.23 0.00 0.00 178.31 177.63 1jdz n TYR 161 N -4.60 0.90 -2.40 0.41 4.02 -1.26 -4.98 117.16 109.25 1jdz n TYR 161 Ca 0.18 -0.53 -0.38 0.00 -0.01 0.00 0.00 57.90 57.16 1jdz n TYR 161 Cb 0.34 -0.06 -0.03 0.00 -0.02 0.00 0.00 39.34 39.57 1jdz n TYR 161 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1jdz s ALA 162 N -1.21 3.19 0.21 -0.72 0.00 -1.13 -5.00 121.76 117.10 1jdz s ALA 162 Ca 0.41 0.88 -0.22 0.00 0.00 0.00 0.00 51.96 53.04 1jdz s ALA 162 Cb 0.23 -3.34 -0.08 0.00 0.00 0.00 0.00 23.12 19.92 1jdz s ALA 162 CO 0.25 -0.37 0.75 -1.21 0.00 0.00 0.00 175.76 175.18 1jdz s GLU 163 N -2.18 4.35 -0.29 0.00 2.02 -1.26 -5.04 118.70 116.30 1jdz s GLU 163 Ca 0.55 0.97 0.03 0.00 0.02 0.00 0.00 54.97 56.54 1jdz s GLU 163 Cb -0.29 -2.98 0.20 0.00 0.10 0.00 0.00 34.13 31.16 1jdz s GLU 163 CO 0.36 0.44 0.65 0.34 0.02 0.00 0.00 175.26 177.07 1jdz s ASP 164 N -1.50 -1.46 0.42 -0.19 -1.08 -1.26 -5.02 116.67 106.58 1jdz s ASP 164 Ca 0.41 0.21 0.29 0.00 -0.52 0.00 0.00 52.55 52.94 1jdz s ASP 164 Cb -0.19 1.94 1.39 0.00 -1.46 0.00 0.00 42.92 44.60 1jdz s ASP 164 CO 0.22 -0.27 1.89 1.05 0.52 0.00 0.00 175.17 178.58 1jdz h GLU 165 N 7.90 0.00 -0.31 4.34 4.11 -2.06 -1.95 114.58 126.61 1jdz h GLU 165 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1jdz h GLU 165 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1jdz h GLU 165 CO 0.12 0.00 0.00 0.39 0.07 0.00 0.00 179.01 179.59 1jdz n GLU 166 N -2.60 2.91 -0.14 1.06 1.02 -1.26 -4.79 120.64 116.83 1jdz n GLU 166 Ca -0.00 -2.38 -0.12 0.00 -0.02 0.00 0.00 57.16 54.64 1jdz n GLU 166 Cb 0.17 -1.51 -0.08 0.00 -0.02 0.00 0.00 31.44 30.00 1jdz n GLU 166 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1jdz h PHE 167 N 1.93 -1.56 0.15 -0.32 3.57 -1.77 0.15 116.94 119.09 1jdz h PHE 167 Ca 0.00 0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 1jdz h PHE 167 Cb 1.03 0.74 0.00 0.00 2.79 0.00 0.00 35.95 40.51 1jdz h PHE 167 CO 0.34 -0.48 -0.07 0.28 -2.23 0.00 0.00 178.31 176.15 1jdz h VAL 168 N -0.37 0.91 -0.10 1.41 2.07 -1.87 -2.41 116.25 115.90 1jdz h VAL 168 Ca 0.10 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.26 1jdz h VAL 168 Cb 0.59 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1jdz h VAL 168 CO -0.60 0.07 -0.27 0.07 0.02 0.00 0.00 177.57 176.85 1jdz h LYS 169 N -0.34 0.18 0.57 1.57 2.10 -1.90 -1.31 116.57 117.45 1jdz h LYS 169 Ca -0.02 -0.06 -0.03 0.00 -2.00 0.00 0.00 60.65 58.54 1jdz h LYS 169 Cb 0.27 -0.02 0.01 0.00 -0.90 0.00 0.00 32.23 31.59 1jdz h LYS 169 CO 0.03 0.45 -0.28 -0.22 -2.00 0.00 0.00 179.45 177.44 1jdz h LYS 170 N 0.17 -0.74 0.00 0.07 3.64 -0.78 -1.01 116.57 117.91 1jdz h LYS 170 Ca 0.03 0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 1jdz h LYS 170 Cb 0.58 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 1jdz h LYS 170 CO 0.04 -0.49 -0.35 -1.49 -2.27 0.00 0.00 179.45 174.89 1jdz h TRP 171 N -0.78 0.00 -0.04 1.91 4.06 -1.46 -2.71 115.95 116.93 1jdz h TRP 171 Ca -0.08 0.00 -0.19 0.00 2.06 0.00 0.00 58.89 60.68 1jdz h TRP 171 Cb 0.59 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.74 1jdz h TRP 171 CO 0.10 0.35 -0.79 0.66 -3.56 0.00 0.00 178.44 175.20 1jdz h SER 172 N 0.00 0.37 0.96 -3.49 4.64 -1.26 -2.24 113.55 112.53 1jdz h SER 172 Ca -0.00 -0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1jdz h SER 172 Cb 0.66 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1jdz h SER 172 CO 0.05 1.02 0.00 -1.54 -0.87 0.00 0.00 176.83 175.48 1jdz n SER 173 N -3.77 0.62 -1.22 4.97 3.41 -0.39 -2.47 113.62 114.78 1jdz n SER 173 Ca -0.04 0.62 0.07 0.00 -0.26 0.00 0.00 58.87 59.25 1jdz n SER 173 Cb 0.74 -0.76 0.26 0.00 -0.26 0.00 0.00 64.21 64.19 1jdz n SER 173 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1jdz n ARG 174 N -2.15 2.96 -0.75 4.33 1.74 -1.02 -4.91 116.66 116.87 1jdz n ARG 174 Ca 0.04 -2.06 0.00 0.00 -0.77 0.00 0.00 57.85 55.06 1jdz n ARG 174 Cb 0.29 -1.71 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 1jdz n ARG 174 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jdz n GLY 175 N 0.91 0.61 3.79 -0.13 0.00 -1.03 -5.06 105.19 104.28 1jdz n GLY 175 Ca 0.19 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1jdz n GLY 175 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jdz s ASN 176 N -2.15 6.17 0.00 1.61 0.01 -0.87 -4.12 114.94 115.58 1jdz s ASN 176 Ca 0.00 0.33 0.17 0.00 -0.71 0.00 0.00 52.86 52.65 1jdz s ASN 176 Cb 0.00 -2.03 0.10 0.00 0.41 0.00 0.00 41.25 39.74 1jdz s ASN 176 CO 0.00 0.31 1.01 2.30 -1.51 0.00 0.00 177.10 179.21 1jdz n ILE 177 N 2.66 0.00 -3.63 0.60 -5.35 -0.38 -4.02 119.36 109.24 1jdz n ILE 177 Ca -0.18 -0.46 -0.07 0.00 -0.27 0.00 0.00 62.75 61.77 1jdz n ILE 177 Cb 0.54 1.32 -0.02 0.00 -1.74 0.00 0.00 39.64 39.74 1jdz n ILE 177 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1jdz s ALA 178 N -1.57 -1.67 -0.02 -1.28 0.00 -1.25 -1.05 121.76 114.91 1jdz s ALA 178 Ca 0.19 0.45 0.05 0.00 0.00 0.00 0.00 51.96 52.65 1jdz s ALA 178 Cb 0.14 0.61 -0.01 0.00 0.00 0.00 0.00 23.12 23.86 1jdz s ALA 178 CO 0.27 -0.88 -0.18 0.54 0.00 0.00 0.00 175.76 175.50 1jdz s VAL 179 N -3.35 1.44 0.00 0.00 0.11 0.06 -1.12 120.40 117.54 1jdz s VAL 179 Ca 0.08 -0.76 0.00 0.00 -2.93 0.00 0.00 61.98 58.37 1jdz s VAL 179 Cb -0.02 -1.21 0.00 0.00 -1.53 0.00 0.00 36.38 33.62 1jdz s VAL 179 CO -0.03 0.41 0.00 -1.84 -3.33 0.00 0.00 175.10 170.31 1jdz n GLU 180 N 2.78 0.00 0.00 1.54 -0.00 -0.55 -1.95 120.64 122.46 1jdz n GLU 180 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.00 1jdz n GLU 180 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.97 1jdz n GLU 180 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1jdz n MET 181 N 0.00 2.11 0.00 3.44 2.81 -1.26 -0.61 117.12 123.61 1jdz n MET 181 Ca 0.00 -0.13 0.00 0.00 -1.81 0.00 0.00 57.70 55.76 1jdz n MET 181 Cb 0.00 -0.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.99 1jdz n MET 181 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1jdz n GLU 182 N -0.34 -0.24 -0.30 0.03 0.00 -1.26 -3.93 120.64 114.60 1jdz n GLU 182 Ca 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 57.16 56.87 1jdz n GLU 182 Cb 0.04 -0.70 0.09 0.00 0.00 0.00 0.00 31.44 30.88 1jdz n GLU 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1jdz h ALA 184 N 1.32 0.74 -0.10 0.00 0.00 -1.88 0.12 119.26 119.47 1jdz h ALA 184 Ca 0.31 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1jdz h ALA 184 Cb -0.04 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1jdz h ALA 184 CO -0.10 -0.01 0.03 1.15 0.00 0.00 0.00 179.25 180.32 1jdz h THR 185 N 0.60 1.18 0.16 0.00 2.02 -1.83 -0.82 112.91 114.22 1jdz h THR 185 Ca 0.25 -0.55 0.01 0.00 0.77 0.00 0.00 66.41 66.88 1jdz h THR 185 Cb 0.12 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 1jdz h THR 185 CO -0.15 0.16 -0.19 0.25 0.37 0.00 0.00 175.52 175.96 1jdz h LEU 186 N -0.04 -0.52 -0.06 2.58 5.85 -0.97 -1.19 115.31 120.96 1jdz h LEU 186 Ca 0.03 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1jdz h LEU 186 Cb 0.23 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 1jdz h LEU 186 CO -0.00 -0.28 0.03 -0.26 -0.34 0.00 0.00 178.44 177.59 1jdz h PHE 187 N -0.40 0.09 -0.21 1.25 0.05 -0.74 -1.46 116.94 115.52 1jdz h PHE 187 Ca 0.01 -0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.77 1jdz h PHE 187 Cb 0.39 -0.03 -0.01 0.00 2.00 0.00 0.00 35.95 38.30 1jdz h PHE 187 CO -0.16 0.15 0.05 1.15 -0.18 0.00 0.00 178.31 179.32 1jdz h THR 188 N 0.00 1.21 -0.42 -1.55 2.02 -1.13 -1.95 112.91 111.10 1jdz h THR 188 Ca 0.02 -0.69 -0.05 0.00 0.77 0.00 0.00 66.41 66.46 1jdz h THR 188 Cb 0.09 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 1jdz h THR 188 CO -0.00 0.21 0.05 0.25 0.37 0.00 0.00 175.52 176.40 1jdz h LEU 189 N 0.14 0.60 -0.40 2.58 5.85 -1.24 -2.04 115.31 120.81 1jdz h LEU 189 Ca 0.06 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1jdz h LEU 189 Cb 0.28 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1jdz h LEU 189 CO 0.00 0.64 0.14 0.28 -0.34 0.00 0.00 178.44 179.16 1jdz h SER 190 N 0.62 0.57 -0.82 1.25 0.02 -1.08 0.13 113.55 114.24 1jdz h SER 190 Ca 0.13 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1jdz h SER 190 Cb 0.32 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.67 1jdz h SER 190 CO 0.01 0.61 0.46 0.11 -1.14 0.00 0.00 176.83 176.88 1jdz h LYS 191 N 0.50 1.13 -0.33 3.45 1.79 -0.97 0.46 116.57 122.60 1jdz h LYS 191 Ca 0.13 -0.12 -0.13 0.00 -2.18 0.00 0.00 60.65 58.35 1jdz h LYS 191 Cb 0.23 -0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 1jdz h LYS 191 CO -0.01 0.82 -0.29 0.28 -1.08 0.00 0.00 179.45 179.17 1jdz h VAL 192 N 1.13 1.29 0.00 0.50 2.07 -1.18 -3.26 116.25 116.81 1jdz h VAL 192 Ca 0.29 -1.45 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1jdz h VAL 192 Cb 0.00 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1jdz h VAL 192 CO -0.05 0.47 -0.48 0.29 0.02 0.00 0.00 177.57 177.83 1jdz n LYS 193 N -4.22 0.16 -1.65 1.57 4.76 0.43 -4.97 118.16 114.25 1jdz n LYS 193 Ca -0.03 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 1jdz n LYS 193 Cb 0.48 -1.61 0.00 0.00 -1.84 0.00 0.00 35.03 32.06 1jdz n LYS 193 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1jdz n GLY 194 N 1.41 0.72 3.95 0.72 0.00 0.14 -5.05 105.19 107.09 1jdz n GLY 194 Ca 0.05 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.14 1jdz n GLY 194 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1jdz s TRP 195 N -2.09 3.47 -0.37 1.61 0.51 -0.21 -5.03 118.94 116.84 1jdz s TRP 195 Ca 0.00 0.16 -0.12 0.00 -2.12 0.00 0.00 56.10 54.02 1jdz s TRP 195 Cb 0.00 -1.72 0.01 0.00 -0.81 0.00 0.00 33.47 30.95 1jdz s TRP 195 CO 0.00 0.34 0.23 0.15 -0.51 0.00 0.00 176.95 177.16 1jdz s LYS 196 N -3.92 3.06 0.23 4.98 1.02 -0.76 -4.56 119.74 119.80 1jdz s LYS 196 Ca 0.36 -0.93 0.07 0.00 0.02 0.00 0.00 55.97 55.50 1jdz s LYS 196 Cb -0.10 -3.78 -0.05 0.00 -0.52 0.00 0.00 37.83 33.38 1jdz s LYS 196 CO 0.31 -0.62 -0.10 -1.12 -0.92 0.00 0.00 175.35 172.90 1jdz s SER 197 N 1.63 2.54 0.21 2.83 0.01 -1.26 -0.61 113.70 119.05 1jdz s SER 197 Ca 0.04 -1.09 -0.23 0.00 1.31 0.00 0.00 55.95 55.98 1jdz s SER 197 Cb -0.18 -0.13 0.04 0.00 0.21 0.00 0.00 66.02 65.96 1jdz s SER 197 CO 0.08 -0.26 0.76 0.00 0.41 0.00 0.00 173.24 174.23 1jdz s ALA 198 N -3.04 -1.43 -0.07 1.44 0.00 -0.79 -0.11 121.76 117.77 1jdz s ALA 198 Ca 0.25 0.03 -0.07 0.00 0.00 0.00 0.00 51.96 52.17 1jdz s ALA 198 Cb 0.01 0.78 0.02 0.00 0.00 0.00 0.00 23.12 23.94 1jdz s ALA 198 CO 0.08 -0.96 0.20 0.99 0.00 0.00 0.00 175.76 176.07 1jdz s THR 199 N -3.70 0.01 -0.04 0.00 2.01 -1.26 -1.80 115.64 110.87 1jdz s THR 199 Ca 0.09 -0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.03 1jdz s THR 199 Cb -0.04 -0.32 0.01 0.00 0.01 0.00 0.00 72.50 72.17 1jdz s THR 199 CO 0.01 -0.04 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.12 1jdz s VAL 200 N -0.07 0.81 0.07 3.82 1.01 -0.83 -2.23 120.40 122.98 1jdz s VAL 200 Ca -0.02 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 61.72 1jdz s VAL 200 Cb -0.02 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.58 1jdz s VAL 200 CO 0.01 0.27 -0.25 -0.76 0.00 0.00 0.00 175.10 174.37 1jdz s LEU 201 N 0.47 2.22 -0.21 3.92 1.43 -0.54 -2.89 118.68 123.08 1jdz s LEU 201 Ca -0.08 -0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 52.28 1jdz s LEU 201 Cb -0.12 -1.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.90 1jdz s LEU 201 CO 0.01 0.19 0.19 -0.69 0.23 0.00 0.00 176.35 176.29 1jdz s VAL 202 N -0.91 5.36 -0.30 -1.59 1.01 0.30 -1.92 120.40 122.34 1jdz s VAL 202 Ca 0.11 0.29 -0.29 0.00 0.00 0.00 0.00 61.98 62.09 1jdz s VAL 202 Cb -0.10 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.76 1jdz s VAL 202 CO 0.03 0.38 1.24 -0.69 0.00 0.00 0.00 175.10 176.07 1jdz s VAL 203 N 0.71 4.23 -0.94 2.92 1.01 -0.96 -0.98 120.40 126.40 1jdz s VAL 203 Ca 0.10 1.41 0.15 0.00 0.00 0.00 0.00 61.98 63.64 1jdz s VAL 203 Cb -0.13 -4.21 -0.11 0.00 0.00 0.00 0.00 36.38 31.93 1jdz s VAL 203 CO 0.02 -0.47 0.70 -1.54 0.00 0.00 0.00 175.10 173.81 1jdz n SER 204 N 7.39 0.99 -3.61 3.32 3.41 -0.67 -1.51 113.62 122.95 1jdz n SER 204 Ca 0.14 -1.00 -0.07 0.00 -0.26 0.00 0.00 58.87 57.68 1jdz n SER 204 Cb 0.47 0.83 -0.02 0.00 -0.26 0.00 0.00 64.21 65.22 1jdz n SER 204 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1jdz s ASP 205 N -2.22 -0.33 -0.17 4.04 -4.77 -1.23 -4.98 116.67 107.00 1jdz s ASP 205 Ca 0.08 -0.21 -0.02 0.00 -3.30 0.00 0.00 52.55 49.10 1jdz s ASP 205 Cb 0.12 0.51 0.05 0.00 -1.09 0.00 0.00 42.92 42.50 1jdz s ASP 205 CO 0.54 -0.88 0.01 0.21 0.70 0.00 0.00 175.17 175.75 1jdz s ASN 206 N -2.74 2.65 0.09 2.11 3.84 -1.26 -1.33 114.94 118.30 1jdz s ASN 206 Ca 0.07 -0.65 0.22 0.00 0.21 0.00 0.00 52.86 52.71 1jdz s ASN 206 Cb -0.02 -0.64 0.90 0.00 -0.55 0.00 0.00 41.25 40.95 1jdz s ASN 206 CO -0.04 -0.26 1.70 0.18 -2.79 0.00 0.00 177.10 175.89 1jdz n LEU 207 N 5.03 0.27 -0.00 3.21 4.77 -0.10 -4.91 117.00 125.26 1jdz n LEU 207 Ca -0.09 0.55 0.09 0.00 -0.03 0.00 0.00 56.01 56.52 1jdz n LEU 207 Cb 0.48 -0.49 -0.12 0.00 -2.33 0.00 0.00 43.42 40.96 1jdz n LEU 207 CO 0.13 -0.23 -0.24 0.00 -1.33 0.00 0.00 177.39 175.72 1jdz n ALA 208 N -1.60 3.92 0.00 -1.18 0.00 -1.26 -5.00 120.51 115.39 1jdz n ALA 208 Ca 0.05 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1jdz n ALA 208 Cb 0.27 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1jdz n ALA 208 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1jdz n GLU 217 N -1.65 0.00 0.27 0.00 2.13 -1.26 -4.16 120.64 115.98 1jdz n GLU 217 Ca 0.01 0.00 0.16 0.00 0.66 0.00 0.00 57.16 57.99 1jdz n GLU 217 Cb 0.35 0.00 0.74 0.00 0.27 0.00 0.00 31.44 32.79 1jdz n GLU 217 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 1jdz h GLU 218 N 0.00 0.00 0.00 5.31 4.11 -2.05 -2.18 114.58 119.77 1jdz h GLU 218 Ca 0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.19 1jdz h GLU 218 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1jdz h GLU 218 CO 0.00 0.07 -1.33 1.25 0.07 0.00 0.00 179.01 179.06 1jdz h LEU 219 N 0.00 0.00 -0.08 3.06 5.85 -2.00 -2.80 115.31 119.34 1jdz h LEU 219 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1jdz h LEU 219 Cb 0.44 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1jdz h LEU 219 CO 0.01 0.96 0.00 -0.08 -0.34 0.00 0.00 178.44 178.98 1jdz h GLU 220 N 0.00 0.00 0.18 1.25 4.81 -1.89 -1.70 114.58 117.23 1jdz h GLU 220 Ca -0.15 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.81 1jdz h GLU 220 Cb 1.86 0.00 0.02 0.00 0.63 0.00 0.00 28.75 31.26 1jdz h GLU 220 CO 0.10 0.00 -1.29 -0.22 -0.73 0.00 0.00 179.01 176.87 1jdz h LYS 221 N 0.00 0.37 -0.65 1.92 3.11 -1.43 -1.72 116.57 118.17 1jdz h LYS 221 Ca 0.00 -0.64 -0.01 0.00 -2.81 0.00 0.00 60.65 57.19 1jdz h LYS 221 Cb 0.80 0.24 -0.03 0.00 -1.00 0.00 0.00 32.23 32.23 1jdz h LYS 221 CO 0.00 1.31 0.39 1.03 -2.81 0.00 0.00 179.45 179.36 1jdz h SER 222 N -0.13 0.79 -0.11 4.20 0.87 -1.42 0.27 113.55 118.02 1jdz h SER 222 Ca -0.24 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1jdz h SER 222 Cb 1.89 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 63.65 1jdz h SER 222 CO 0.17 0.63 0.05 0.58 -0.53 0.00 0.00 176.83 177.73 1jdz h VAL 223 N 0.89 1.12 -0.32 2.23 2.07 -1.36 -2.26 116.25 118.61 1jdz h VAL 223 Ca 0.23 -0.35 0.04 0.00 0.82 0.00 0.00 66.70 67.45 1jdz h VAL 223 Cb -0.01 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 1jdz h VAL 223 CO -0.04 0.11 0.08 0.24 0.02 0.00 0.00 177.57 177.97 1jdz h MET 224 N 0.05 0.20 -0.28 1.57 2.07 -0.83 -1.22 114.93 116.49 1jdz h MET 224 Ca 0.04 -0.01 0.00 0.00 -2.07 0.00 0.00 59.70 57.66 1jdz h MET 224 Cb 0.12 -0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 29.80 1jdz h MET 224 CO -0.00 0.13 0.17 -0.44 1.07 0.00 0.00 176.91 177.84 1jdz h ASP 225 N 0.20 0.33 -0.65 1.22 3.32 -0.90 -2.88 116.42 117.06 1jdz h ASP 225 Ca 0.15 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 1jdz h ASP 225 Cb 0.15 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1jdz h ASP 225 CO -0.18 0.27 0.34 1.23 -1.72 0.00 0.00 179.24 179.18 1jdz h GLY 226 N 0.36 1.00 1.26 2.75 0.00 -1.16 -2.64 103.07 104.64 1jdz h GLY 226 Ca 0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 1jdz h GLY 226 CO -0.02 0.44 0.43 0.00 0.00 0.00 0.00 176.54 177.39 1jdz h ALA 227 N 1.44 1.39 -0.45 3.60 0.00 -1.02 -1.41 119.26 122.82 1jdz h ALA 227 Ca 0.24 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1jdz h ALA 227 Cb 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1jdz h ALA 227 CO -0.03 0.52 0.22 0.87 0.00 0.00 0.00 179.25 180.83 1jdz h LYS 228 N 1.00 0.65 -0.48 0.00 1.57 -1.32 0.75 116.57 118.73 1jdz h LYS 228 Ca 0.26 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 1jdz h LYS 228 Cb -0.03 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1jdz h LYS 228 CO -0.05 0.55 0.25 0.00 -0.57 0.00 0.00 179.45 179.63 1jdz h ALA 229 N 1.07 0.61 -0.35 3.86 0.00 -1.35 -0.53 119.26 122.57 1jdz h ALA 229 Ca 0.16 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1jdz h ALA 229 Cb 0.11 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1jdz h ALA 229 CO -0.02 0.15 0.20 0.28 0.00 0.00 0.00 179.25 179.86 1jdz h VAL 230 N 0.63 1.13 -0.25 0.00 2.07 -0.88 -1.94 116.25 117.01 1jdz h VAL 230 Ca 0.17 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.33 1jdz h VAL 230 Cb 0.07 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1jdz h VAL 230 CO -0.03 0.13 -0.03 -0.07 0.02 0.00 0.00 177.57 177.59 1jdz h LEU 231 N 0.44 0.35 -0.84 2.57 3.38 -0.61 -0.42 115.31 120.19 1jdz h LEU 231 Ca 0.12 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1jdz h LEU 231 Cb 0.03 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1jdz h LEU 231 CO -0.02 0.44 0.28 0.44 0.09 0.00 0.00 178.44 179.67 1jdz h ASP 232 N 0.37 1.05 -0.26 -0.43 3.32 -0.67 -1.90 116.42 117.91 1jdz h ASP 232 Ca 0.08 -0.17 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 1jdz h ASP 232 Cb 0.30 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1jdz h ASP 232 CO 0.01 0.95 -0.08 0.74 -1.72 0.00 0.00 179.24 179.14 1jdz h THR 233 N 1.10 1.29 0.00 0.35 2.02 -0.47 -1.81 112.91 115.39 1jdz h THR 233 Ca 0.25 -1.12 -0.05 0.00 0.77 0.00 0.00 66.41 66.26 1jdz h THR 233 Cb 0.24 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1jdz h THR 233 CO -0.02 0.35 -0.24 -0.07 0.37 0.00 0.00 175.52 175.92 1jdz h LEU 234 N 0.25 0.00 -3.36 2.58 3.38 -0.96 -2.51 115.31 114.69 1jdz h LEU 234 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1jdz h LEU 234 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1jdz h LEU 234 CO 0.03 0.24 0.00 0.35 0.09 0.00 0.00 178.44 179.15 1jdz n THR 235 N -4.06 2.35 1.95 0.22 -2.24 -0.73 -4.95 114.28 106.82 1jdz n THR 235 Ca -0.02 -1.51 0.16 0.00 -2.27 0.00 0.00 64.05 60.40 1jdz n THR 235 Cb 0.31 -0.16 0.90 0.00 -2.10 0.00 0.00 70.33 69.28 1jdz n THR 235 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96