#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 0.00 -0.10 -1.45 0.24 -1.26 -4.76 118.33 111.00 1jdz n VAL 4 Ca 0.00 -0.28 -0.17 0.00 -2.04 0.00 0.00 64.34 61.85 1jdz n VAL 4 Cb 0.00 1.01 -0.06 0.00 -1.47 0.00 0.00 33.84 33.32 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 -1.17 0.00 -3.21 6.34 8.25 -1.26 -4.84 115.22 119.33 1jdz n HIS 5 Ca 0.02 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.04 1jdz n HIS 5 Cb 0.15 -0.66 -0.06 0.00 1.12 0.00 0.00 29.99 30.54 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 -2.63 4.96 -0.34 1.59 1.01 -1.26 -4.56 121.20 119.98 1jdz s ILE 6 Ca -0.30 -0.68 -0.00 0.00 0.00 0.00 0.00 60.65 59.67 1jdz s ILE 6 Cb 0.08 -4.28 0.29 0.00 0.01 0.00 0.00 42.46 38.57 1jdz s ILE 6 CO 0.41 -0.78 1.86 0.18 0.00 0.00 0.00 174.94 176.60 1jdz n LEU 7 N 5.95 6.16 -4.84 2.97 4.77 -1.26 -4.77 117.00 125.97 1jdz n LEU 7 Ca -0.08 -3.21 -0.32 0.00 -0.03 0.00 0.00 56.01 52.37 1jdz n LEU 7 Cb 0.45 -0.93 -0.01 0.00 -2.33 0.00 0.00 43.42 40.60 1jdz n LEU 7 CO 0.53 1.12 0.70 0.00 -1.33 0.00 0.00 177.39 178.40 1jdz s ALA 8 N -2.05 3.01 0.23 -1.18 0.00 -1.25 -4.94 121.76 115.58 1jdz s ALA 8 Ca 0.35 0.12 -0.25 0.00 0.00 0.00 0.00 51.96 52.19 1jdz s ALA 8 Cb 0.28 -3.13 -0.09 0.00 0.00 0.00 0.00 23.12 20.19 1jdz s ALA 8 CO 0.02 -0.51 0.83 0.15 0.00 0.00 0.00 175.76 176.25 1jdz s LYS 9 N -4.46 4.53 0.46 0.00 -0.14 -1.26 -4.98 119.74 113.89 1jdz s LYS 9 Ca 0.58 1.17 -0.25 0.00 -1.36 0.00 0.00 55.97 56.12 1jdz s LYS 9 Cb -0.11 -3.04 -0.08 0.00 -1.68 0.00 0.00 37.83 32.92 1jdz s LYS 9 CO 0.40 0.44 1.42 1.17 -0.76 0.00 0.00 175.35 178.02 1jdz n LYS 10 N 1.06 2.17 -0.19 1.68 4.81 -1.26 -0.74 118.16 125.69 1jdz n LYS 10 Ca -0.02 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 1jdz n LYS 10 Cb 0.49 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 32.93 1jdz n LYS 10 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jdz n GLY 11 N 0.61 0.69 0.08 3.14 0.00 -1.26 -4.86 105.19 103.59 1jdz n GLY 11 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.06 2.19 -4.83 1.61 1.02 0.08 -4.97 120.64 113.68 1jdz n GLU 12 Ca 0.00 -0.41 -0.33 0.00 -0.02 0.00 0.00 57.16 56.40 1jdz n GLU 12 Cb 0.00 -0.89 -0.15 0.00 -0.02 0.00 0.00 31.44 30.38 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 -0.69 2.74 0.61 2.62 1.01 -1.26 -4.73 120.40 120.70 1jdz s VAL 13 Ca 0.03 -0.77 -0.14 0.00 0.00 0.00 0.00 61.98 61.10 1jdz s VAL 13 Cb 0.03 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1jdz s VAL 13 CO 0.07 0.53 1.04 0.00 0.00 0.00 0.00 175.10 176.74 1jdz s ALA 14 N 0.45 2.88 0.38 5.51 0.00 -1.26 -4.68 121.76 125.03 1jdz s ALA 14 Ca -0.12 0.16 0.13 0.00 0.00 0.00 0.00 51.96 52.13 1jdz s ALA 14 Cb -0.16 -3.16 0.75 0.00 0.00 0.00 0.00 23.12 20.55 1jdz s ALA 14 CO 0.05 -0.77 1.84 0.93 0.00 0.00 0.00 175.76 177.82 1jdz h GLU 15 N 0.07 0.00 -5.05 0.00 5.08 -1.85 -3.35 114.58 109.47 1jdz h GLU 15 Ca -0.45 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.28 1jdz h GLU 15 Cb 1.20 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.30 1jdz h GLU 15 CO 0.59 0.35 -0.38 1.03 -1.00 0.00 0.00 179.01 179.60 1jdz s ARG 16 N -4.23 4.00 -0.03 2.33 0.52 -1.26 -1.53 118.95 118.75 1jdz s ARG 16 Ca -0.03 -0.14 0.03 0.00 -0.52 0.00 0.00 55.73 55.07 1jdz s ARG 16 Cb 0.14 -3.64 0.00 0.00 0.52 0.00 0.00 34.95 31.98 1jdz s ARG 16 CO 0.72 -0.19 -0.10 0.08 0.02 0.00 0.00 175.30 175.83 1jdz s VAL 17 N 1.81 0.85 -0.26 3.52 1.01 0.20 -1.86 120.40 125.68 1jdz s VAL 17 Ca 0.11 -0.40 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 1jdz s VAL 17 Cb -0.16 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 1jdz s VAL 17 CO 0.10 0.26 0.09 -0.22 0.00 0.00 0.00 175.10 175.34 1jdz s LEU 18 N 0.17 3.60 -0.10 3.92 0.20 -0.08 -1.43 118.68 124.96 1jdz s LEU 18 Ca -0.03 -0.24 -0.01 0.00 0.69 0.00 0.00 54.13 54.54 1jdz s LEU 18 Cb -0.09 -1.95 -0.03 0.00 -0.43 0.00 0.00 46.19 43.69 1jdz s LEU 18 CO 0.01 -0.06 -0.06 0.68 -0.29 0.00 0.00 176.35 176.63 1jdz s VAL 19 N 1.63 3.78 0.05 1.68 -7.23 -0.71 -1.16 120.40 118.44 1jdz s VAL 19 Ca 0.06 -0.43 0.04 0.00 -1.81 0.00 0.00 61.98 59.84 1jdz s VAL 19 Cb -0.15 -2.58 -0.03 0.00 0.56 0.00 0.00 36.38 34.18 1jdz s VAL 19 CO 0.05 0.57 -0.11 0.68 -0.31 0.00 0.00 175.10 175.97 1jdz s VAL 20 N -0.42 0.84 0.15 1.32 -7.23 0.28 -1.15 120.40 114.19 1jdz s VAL 20 Ca 0.06 -1.13 -0.07 0.00 -1.81 0.00 0.00 61.98 59.03 1jdz s VAL 20 Cb -0.12 -0.84 -0.11 0.00 0.56 0.00 0.00 36.38 35.87 1jdz s VAL 20 CO 0.02 -0.25 1.40 1.23 -0.31 0.00 0.00 175.10 177.19 1jdz h GLY 21 N 4.52 0.72 -5.98 2.32 0.00 -1.81 0.19 103.07 103.02 1jdz h GLY 21 Ca -0.38 -0.94 -0.59 0.00 0.00 0.00 0.00 47.33 45.42 1jdz h GLY 21 CO 0.41 0.84 0.09 -0.35 0.00 0.00 0.00 176.54 177.53 1jdz s ASP 22 N -7.00 6.68 0.25 0.19 2.15 -1.26 -2.41 116.67 115.26 1jdz s ASP 22 Ca -0.08 0.82 -0.05 0.00 0.43 0.00 0.00 52.55 53.67 1jdz s ASP 22 Cb 0.10 -2.34 0.33 0.00 -0.30 0.00 0.00 42.92 40.71 1jdz s ASP 22 CO 0.87 -0.25 1.87 -0.65 -0.17 0.00 0.00 175.17 176.84 1jdz h PRO 23 N 7.44 1.04 -0.93 4.34 0.11 -1.86 -1.36 132.00 140.78 1jdz h PRO 23 Ca -0.32 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.77 1jdz h PRO 23 Cb 1.15 -0.24 -0.06 0.00 0.11 0.00 0.00 31.00 31.96 1jdz h PRO 23 CO 0.77 0.69 0.60 0.78 -0.21 0.00 0.00 178.00 180.63 1jdz h GLY 24 N 1.07 1.39 1.34 -0.55 0.00 -1.96 -1.51 103.07 102.85 1jdz h GLY 24 Ca 0.38 -0.45 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 1jdz h GLY 24 CO -0.15 0.35 -0.05 -0.09 0.00 0.00 0.00 176.54 176.59 1jdz h ARG 25 N 1.12 0.79 -0.42 4.80 2.43 -1.68 -2.05 114.38 119.37 1jdz h ARG 25 Ca 0.39 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1jdz h ARG 25 Cb 0.09 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1jdz h ARG 25 CO -0.15 0.83 0.17 0.00 -1.51 0.00 0.00 179.97 179.32 1jdz h ALA 26 N 1.21 0.55 -0.47 2.80 0.00 -0.67 -0.85 119.26 121.84 1jdz h ALA 26 Ca 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1jdz h ALA 26 Cb 0.52 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1jdz h ALA 26 CO 0.03 0.15 0.24 -0.09 0.00 0.00 0.00 179.25 179.58 1jdz h ARG 27 N 0.54 0.66 -0.59 0.00 2.43 -1.16 -2.38 114.38 113.88 1jdz h ARG 27 Ca 0.14 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.14 1jdz h ARG 27 Cb 0.19 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1jdz h ARG 27 CO -0.01 0.55 0.03 1.25 -1.51 0.00 0.00 179.97 180.28 1jdz h LEU 28 N 0.61 0.97 -0.00 3.80 5.85 -1.21 -2.90 115.31 122.43 1jdz h LEU 28 Ca 0.16 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1jdz h LEU 28 Cb 0.09 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.86 1jdz h LEU 28 CO -0.02 1.00 0.00 0.18 -0.34 0.00 0.00 178.44 179.26 1jdz n LEU 29 N -4.20 0.01 0.22 2.25 4.77 -0.34 -3.23 117.00 116.48 1jdz n LEU 29 Ca 0.03 0.50 0.11 0.00 -0.03 0.00 0.00 56.01 56.62 1jdz n LEU 29 Cb 0.32 -0.50 0.41 0.00 -2.33 0.00 0.00 43.42 41.31 1jdz n LEU 29 CO 0.43 -0.01 0.80 0.77 -1.33 0.00 0.00 177.39 178.04 1jdz h SER 30 N 0.00 0.00 0.47 -1.43 4.64 -1.21 -2.65 113.55 113.37 1jdz h SER 30 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jdz h SER 30 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1jdz h SER 30 CO 0.00 0.19 0.00 0.35 -0.87 0.00 0.00 176.83 176.50 1jdz n THR 31 N -3.28 1.07 0.66 2.95 -2.24 -1.20 -1.42 114.28 110.83 1jdz n THR 31 Ca 0.01 0.27 0.13 0.00 -2.27 0.00 0.00 64.05 62.19 1jdz n THR 31 Cb 0.46 -1.05 0.32 0.00 -2.10 0.00 0.00 70.33 67.97 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 -1.53 0.68 -4.95 3.22 4.77 -1.00 -4.88 117.00 113.33 1jdz n LEU 32 Ca 0.03 0.40 -0.24 0.00 -0.03 0.00 0.00 56.01 56.18 1jdz n LEU 32 Cb 0.16 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 40.98 1jdz n LEU 32 CO 0.13 -0.10 0.28 -0.76 -1.33 0.00 0.00 177.39 175.61 1jdz s LEU 33 N -4.20 3.72 -0.18 2.23 1.43 -0.51 -4.98 118.68 116.19 1jdz s LEU 33 Ca 0.09 0.39 -0.15 0.00 -1.03 0.00 0.00 54.13 53.43 1jdz s LEU 33 Cb 0.14 -3.26 -0.04 0.00 0.03 0.00 0.00 46.19 43.05 1jdz s LEU 33 CO 0.64 -0.61 0.35 -1.10 0.23 0.00 0.00 176.35 175.86 1jdz s GLN 34 N -4.53 4.23 -1.28 1.70 -0.21 0.18 -4.40 119.66 115.35 1jdz s GLN 34 Ca 0.47 0.15 -0.03 0.00 0.02 0.00 0.00 55.36 55.97 1jdz s GLN 34 Cb -0.10 -3.48 0.01 0.00 1.00 0.00 0.00 33.01 30.44 1jdz s GLN 34 CO 0.38 0.11 0.97 -1.71 -2.12 0.00 0.00 175.29 172.92 1jdz n ASN 35 N 3.97 -2.85 -4.74 5.90 4.05 -1.26 -2.06 115.26 118.28 1jdz n ASN 35 Ca -0.10 -0.66 -0.42 0.00 0.45 0.00 0.00 54.58 53.85 1jdz n ASN 35 Cb 0.52 -4.78 -0.00 0.00 1.23 0.00 0.00 39.78 36.74 1jdz n ASN 35 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 1jdz n PRO 36 N -4.37 2.41 -4.36 1.20 -0.02 -1.26 -4.67 135.00 123.93 1jdz n PRO 36 Ca -0.21 0.84 -0.20 0.00 -2.02 0.00 0.00 63.50 61.91 1jdz n PRO 36 Cb 0.64 -2.51 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 1jdz n PRO 36 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1jdz s LYS 37 N -1.89 0.88 -0.36 -0.52 -0.14 -0.59 -4.96 119.74 112.16 1jdz s LYS 37 Ca 0.55 -0.29 -0.26 0.00 -1.36 0.00 0.00 55.97 54.61 1jdz s LYS 37 Cb -0.52 -0.83 0.01 0.00 -1.68 0.00 0.00 37.83 34.81 1jdz s LYS 37 CO 0.62 0.11 0.95 -1.17 -0.76 0.00 0.00 175.35 175.11 1jdz s LEU 38 N 0.15 3.98 0.00 3.17 2.96 -1.26 -1.09 118.68 126.58 1jdz s LEU 38 Ca -0.02 0.69 0.22 0.00 -0.22 0.00 0.00 54.13 54.79 1jdz s LEU 38 Cb -0.08 -3.32 -0.12 0.00 0.50 0.00 0.00 46.19 43.18 1jdz s LEU 38 CO 0.00 -0.86 0.98 0.35 -1.32 0.00 0.00 176.35 175.51 1jdz n THR 39 N 5.95 0.00 -3.62 3.68 -2.24 0.53 -4.99 114.28 113.59 1jdz n THR 39 Ca 0.08 -0.04 -0.10 0.00 -2.27 0.00 0.00 64.05 61.72 1jdz n THR 39 Cb 0.48 0.97 -0.06 0.00 -2.10 0.00 0.00 70.33 69.61 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 -2.91 -0.44 0.00 3.42 3.84 -1.17 -3.89 114.94 113.79 1jdz s ASN 40 Ca 0.10 0.74 0.00 0.00 0.21 0.00 0.00 52.86 53.91 1jdz s ASN 40 Cb 0.16 0.72 0.00 0.00 -0.55 0.00 0.00 41.25 41.58 1jdz s ASN 40 CO 0.80 -0.22 0.10 -1.84 -2.79 0.00 0.00 177.10 173.15 1jdz n GLU 41 N 1.76 -0.05 -1.71 0.43 0.28 -1.26 -1.54 120.64 118.56 1jdz n GLU 41 Ca -0.12 -0.10 -0.43 0.00 -0.16 0.00 0.00 57.16 56.35 1jdz n GLU 41 Cb 0.56 -0.54 -0.02 0.00 1.43 0.00 0.00 31.44 32.87 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 -0.00 3.50 -1.79 -1.84 5.15 -1.26 -1.56 115.26 117.45 1jdz n ASN 42 Ca 0.00 1.13 -0.21 0.00 -0.60 0.00 0.00 54.58 54.90 1jdz n ASN 42 Cb 0.26 -1.53 -0.07 0.00 -0.53 0.00 0.00 39.78 37.91 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 2.45 -1.51 -0.95 1.20 1.74 -1.26 -1.70 116.66 116.62 1jdz n ARG 43 Ca 0.11 1.17 0.00 0.00 -0.77 0.00 0.00 57.85 58.36 1jdz n ARG 43 Cb 0.34 -5.62 0.00 0.00 -1.02 0.00 0.00 32.46 26.17 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 -0.53 0.58 3.38 -0.13 0.00 -0.60 -4.94 105.19 102.94 1jdz n GLY 44 Ca -0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1jdz n GLY 44 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1jdz n PHE 45 N -2.44 4.55 -1.96 1.61 0.99 -0.69 -4.79 117.46 114.73 1jdz n PHE 45 Ca 0.00 -3.12 -0.42 0.00 -0.00 0.00 0.00 57.45 53.91 1jdz n PHE 45 Cb 0.06 -2.31 -0.03 0.00 -1.00 0.00 0.00 39.48 36.19 1jdz n PHE 45 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1jdz s LEU 46 N 2.16 4.37 -0.11 4.37 1.43 -1.26 -4.21 118.68 125.43 1jdz s LEU 46 Ca 0.46 2.56 -0.00 0.00 -1.03 0.00 0.00 54.13 56.12 1jdz s LEU 46 Cb 0.02 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.67 1jdz s LEU 46 CO 0.02 -0.81 -0.08 -0.69 0.23 0.00 0.00 176.35 175.02 1jdz s VAL 47 N 1.35 1.04 -0.02 -1.59 1.01 -0.59 -1.17 120.40 120.43 1jdz s VAL 47 Ca 0.70 -0.30 0.05 0.00 0.00 0.00 0.00 61.98 62.42 1jdz s VAL 47 Cb -0.42 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 1jdz s VAL 47 CO 0.31 0.37 -0.15 -0.31 0.00 0.00 0.00 175.10 175.32 1jdz s TYR 48 N 1.64 2.67 -0.03 5.22 1.51 0.45 -0.35 117.35 128.47 1jdz s TYR 48 Ca 0.04 -0.18 0.05 0.00 -1.01 0.00 0.00 57.07 55.96 1jdz s TYR 48 Cb -0.13 -1.59 -0.01 0.00 -0.11 0.00 0.00 41.96 40.13 1jdz s TYR 48 CO -0.08 0.21 -0.16 0.99 -1.11 0.00 0.00 175.55 175.40 1jdz s THR 49 N -0.79 1.32 0.00 -0.71 2.01 -0.25 -0.22 115.64 116.99 1jdz s THR 49 Ca 0.13 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.44 1jdz s THR 49 Cb -0.11 -1.12 0.00 0.00 0.01 0.00 0.00 72.50 71.28 1jdz s THR 49 CO 0.02 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 174.94 1jdz n GLY 50 N 2.94 2.29 3.57 4.40 0.00 0.34 -1.55 105.19 117.18 1jdz n GLY 50 Ca -0.16 -0.70 -0.25 0.00 0.00 0.00 0.00 46.02 44.90 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 1.01 2.05 -0.24 1.61 -0.14 -0.88 0.68 119.74 123.84 1jdz s LYS 51 Ca 0.00 -1.39 -0.08 0.00 -1.36 0.00 0.00 55.97 53.14 1jdz s LYS 51 Cb 0.00 -2.09 0.11 0.00 -1.68 0.00 0.00 37.83 34.17 1jdz s LYS 51 CO 0.00 0.40 0.50 -0.47 -0.76 0.00 0.00 175.35 175.02 1jdz s TYR 52 N -1.99 -1.01 -0.72 3.18 5.04 0.59 -0.65 117.35 121.80 1jdz s TYR 52 Ca 0.27 1.82 -0.15 0.00 -2.44 0.00 0.00 57.07 56.57 1jdz s TYR 52 Cb -0.08 0.49 0.02 0.00 0.35 0.00 0.00 41.96 42.74 1jdz s TYR 52 CO 0.16 -0.56 0.44 0.27 -1.34 0.00 0.00 175.55 174.53 1jdz n ASN 53 N 5.41 -2.95 0.00 4.32 0.23 -1.26 -1.58 115.26 119.44 1jdz n ASN 53 Ca -0.10 -0.80 0.00 0.00 -0.53 0.00 0.00 54.58 53.15 1jdz n ASN 53 Cb 0.49 -1.07 0.00 0.00 -2.08 0.00 0.00 39.78 37.12 1jdz n ASN 53 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1jdz n GLY 54 N -1.55 0.68 3.11 4.83 0.00 -1.26 -5.03 105.19 105.97 1jdz n GLY 54 Ca -0.13 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.74 1jdz n GLY 54 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jdz s GLU 55 N -0.08 0.67 0.08 1.61 2.56 -0.61 -5.13 118.70 117.79 1jdz s GLU 55 Ca 0.00 -0.87 -0.25 0.00 0.00 0.00 0.00 54.97 53.84 1jdz s GLU 55 Cb 0.00 -0.51 -0.06 0.00 2.00 0.00 0.00 34.13 35.56 1jdz s GLU 55 CO 0.00 0.10 0.78 0.99 -0.56 0.00 0.00 175.26 176.57 1jdz s THR 56 N -1.45 4.63 0.01 -1.70 2.01 -1.26 -0.30 115.64 117.58 1jdz s THR 56 Ca -0.05 1.68 -0.04 0.00 0.31 0.00 0.00 61.69 63.58 1jdz s THR 56 Cb -0.09 -4.13 -0.01 0.00 0.01 0.00 0.00 72.50 68.28 1jdz s THR 56 CO 0.01 0.40 0.07 -0.69 -0.69 0.00 0.00 174.62 173.72 1jdz s VAL 57 N -0.31 0.10 0.09 3.82 1.01 0.22 -4.58 120.40 120.74 1jdz s VAL 57 Ca 0.38 -0.79 0.09 0.00 0.00 0.00 0.00 61.98 61.66 1jdz s VAL 57 Cb -0.21 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.75 1jdz s VAL 57 CO 0.24 -0.44 -0.23 -0.44 0.00 0.00 0.00 175.10 174.24 1jdz s SER 58 N -1.44 2.79 -0.15 3.32 0.01 -0.78 -0.50 113.70 116.95 1jdz s SER 58 Ca -0.15 -0.66 0.01 0.00 1.31 0.00 0.00 55.95 56.46 1jdz s SER 58 Cb -0.08 -0.19 0.02 0.00 0.21 0.00 0.00 66.02 65.98 1jdz s SER 58 CO 0.00 0.13 -0.16 -0.63 0.41 0.00 0.00 173.24 172.99 1jdz s ILE 59 N -1.03 1.73 0.09 1.44 1.01 0.69 -0.91 121.20 124.22 1jdz s ILE 59 Ca 0.09 -0.74 0.07 0.00 0.00 0.00 0.00 60.65 60.08 1jdz s ILE 59 Cb -0.10 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 1jdz s ILE 59 CO 0.04 0.48 -0.19 0.00 0.00 0.00 0.00 174.94 175.27 1jdz s ALA 60 N 1.31 1.65 -0.10 9.38 0.00 -0.31 -0.41 121.76 133.29 1jdz s ALA 60 Ca 0.02 -1.17 -0.17 0.00 0.00 0.00 0.00 51.96 50.65 1jdz s ALA 60 Cb -0.13 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 1jdz s ALA 60 CO -0.09 0.32 0.43 0.99 0.00 0.00 0.00 175.76 177.40 1jdz s THR 61 N -1.16 5.18 -0.75 0.00 2.01 -0.32 -0.55 115.64 120.05 1jdz s THR 61 Ca 0.05 0.85 0.07 0.00 0.31 0.00 0.00 61.69 62.96 1jdz s THR 61 Cb -0.10 -3.76 0.03 0.00 0.01 0.00 0.00 72.50 68.69 1jdz s THR 61 CO 0.04 0.39 0.63 0.00 -0.69 0.00 0.00 174.62 174.99 1jdz n HIS 62 N 3.26 0.00 -4.48 4.92 1.44 0.66 -4.70 115.22 116.33 1jdz n HIS 62 Ca -0.09 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.62 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 0.51 -0.95 3.59 -1.39 0.00 -1.01 -3.32 105.19 102.62 1jdz n GLY 63 Ca 0.03 -1.15 -0.34 0.00 0.00 0.00 0.00 46.02 44.56 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 4.26 0.00 -0.61 1.01 -1.26 -4.57 121.20 120.02 1jdz s ILE 64 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.41 1jdz s ILE 64 Cb 0.00 -2.86 0.00 0.00 0.01 0.00 0.00 42.46 39.61 1jdz s ILE 64 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 174.94 176.07 1jdz n GLY 65 N 3.14 0.73 0.24 6.18 0.00 -1.26 -4.45 105.19 109.77 1jdz n GLY 65 Ca -0.17 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.25 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 0.54 1.19 -0.02 0.00 -1.91 -1.70 103.07 101.17 1jdz h GLY 66 Ca 0.00 0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.50 1jdz h GLY 66 CO 0.00 -0.22 0.50 -2.55 0.00 0.00 0.00 176.54 174.27 1jdz h PRO 67 N 0.05 0.95 0.07 4.80 0.11 -1.95 -0.63 132.00 135.39 1jdz h PRO 67 Ca 0.31 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.36 1jdz h PRO 67 Cb 0.49 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.39 1jdz h PRO 67 CO -0.59 0.63 -0.03 1.03 -0.21 0.00 0.00 178.00 178.83 1jdz h SER 68 N 0.97 -0.08 0.27 -2.05 0.87 -1.55 -2.95 113.55 109.04 1jdz h SER 68 Ca 0.29 -0.43 -0.05 0.00 -1.23 0.00 0.00 61.79 60.37 1jdz h SER 68 Cb -0.03 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 1jdz h SER 68 CO -0.08 0.41 -0.24 -0.29 -0.53 0.00 0.00 176.83 176.11 1jdz h ILE 69 N -0.59 1.11 -0.14 2.23 2.10 -1.28 -2.34 117.51 118.61 1jdz h ILE 69 Ca -0.01 -0.83 -0.00 0.00 1.08 0.00 0.00 64.86 65.10 1jdz h ILE 69 Cb 0.50 1.45 -0.01 0.00 -1.09 0.00 0.00 36.82 37.68 1jdz h ILE 69 CO 0.01 0.23 0.08 0.00 -1.08 0.00 0.00 178.15 177.40 1jdz h ALA 70 N 1.76 0.18 0.02 0.18 0.00 -1.10 0.78 119.26 121.08 1jdz h ALA 70 Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1jdz h ALA 70 Cb 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1jdz h ALA 70 CO 0.03 -0.29 -0.01 0.82 0.00 0.00 0.00 179.25 179.80 1jdz h ILE 71 N 0.14 1.02 -0.29 0.00 2.04 -1.31 -1.11 117.51 117.99 1jdz h ILE 71 Ca 0.05 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.80 1jdz h ILE 71 Cb 0.06 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1jdz h ILE 71 CO -0.01 0.03 0.16 0.58 0.00 0.00 0.00 178.15 178.91 1jdz h VAL 72 N -0.09 1.01 -0.41 1.67 2.07 -1.31 -1.92 116.25 117.27 1jdz h VAL 72 Ca -0.00 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.41 1jdz h VAL 72 Cb 0.08 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1jdz h VAL 72 CO 0.01 0.06 0.26 -0.07 0.02 0.00 0.00 177.57 177.85 1jdz h LEU 73 N 0.33 0.44 -0.27 2.57 3.38 -0.74 -1.13 115.31 119.89 1jdz h LEU 73 Ca 0.12 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.12 1jdz h LEU 73 Cb 0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1jdz h LEU 73 CO -0.07 0.31 0.04 -0.33 0.09 0.00 0.00 178.44 178.49 1jdz h GLU 74 N 0.53 0.13 -0.33 1.13 4.39 -0.94 -2.06 114.58 117.43 1jdz h GLU 74 Ca 0.16 -0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.72 1jdz h GLU 74 Cb -0.03 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1jdz h GLU 74 CO -0.05 0.08 -0.31 0.93 -1.16 0.00 0.00 179.01 178.50 1jdz h GLU 75 N 0.13 0.70 -0.67 2.33 5.08 -1.14 -1.71 114.58 119.30 1jdz h GLU 75 Ca 0.13 -0.32 -0.06 0.00 -1.00 0.00 0.00 59.36 58.10 1jdz h GLU 75 Cb 0.14 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1jdz h GLU 75 CO -0.18 0.92 0.17 -0.07 -1.00 0.00 0.00 179.01 178.85 1jdz h LEU 76 N 0.60 0.99 -0.50 1.33 3.38 -1.07 -1.70 115.31 118.33 1jdz h LEU 76 Ca 0.07 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1jdz h LEU 76 Cb 0.82 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1jdz h LEU 76 CO 0.07 0.95 0.24 0.00 0.09 0.00 0.00 178.44 179.79 1jdz h ALA 77 N 1.18 0.65 0.00 1.53 0.00 -1.16 -0.45 119.26 121.00 1jdz h ALA 77 Ca 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1jdz h ALA 77 Cb 0.34 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1jdz h ALA 77 CO -0.00 0.22 0.00 0.52 0.00 0.00 0.00 179.25 179.99 1jdz h MET 78 N 0.67 0.00 -0.42 0.00 2.86 -0.81 -0.05 114.93 117.17 1jdz h MET 78 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1jdz h MET 78 Cb 0.12 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1jdz h MET 78 CO -0.02 0.00 0.00 1.28 1.06 0.00 0.00 176.91 179.23 1jdz n LEU 79 N -2.88 3.33 0.00 1.22 4.77 -0.29 -4.95 117.00 118.20 1jdz n LEU 79 Ca -0.02 -1.48 0.00 0.00 -0.03 0.00 0.00 56.01 54.49 1jdz n LEU 79 Cb 0.13 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1jdz n LEU 79 CO 0.20 0.74 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 1jdz n GLY 80 N 1.49 0.94 3.78 -0.72 0.00 -0.03 -4.16 105.19 106.49 1jdz n GLY 80 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.53 -4.25 121.76 122.87 1jdz s ALA 81 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.42 1jdz s ALA 81 Cb 0.00 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 20.01 1jdz s ALA 81 CO 0.00 0.21 0.00 0.27 0.00 0.00 0.00 175.76 176.24 1jdz n ASN 82 N 0.73 0.00 -3.85 0.00 0.23 -0.71 -4.10 115.26 107.55 1jdz n ASN 82 Ca 0.00 -0.99 -0.28 0.00 -0.53 0.00 0.00 54.58 52.79 1jdz n ASN 82 Cb 0.50 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 38.04 1jdz n ASN 82 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1jdz s VAL 83 N 0.00 0.99 -0.11 3.53 1.01 -0.58 -1.34 120.40 123.90 1jdz s VAL 83 Ca 0.00 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.33 1jdz s VAL 83 Cb 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 36.38 35.10 1jdz s VAL 83 CO 0.00 -0.01 -0.23 -0.36 0.00 0.00 0.00 175.10 174.50 1jdz s PHE 84 N 1.67 2.59 -0.22 5.22 0.40 0.26 -0.62 117.98 127.27 1jdz s PHE 84 Ca -0.01 -1.09 0.01 0.00 -0.60 0.00 0.00 56.93 55.23 1jdz s PHE 84 Cb -0.16 -1.73 0.05 0.00 0.51 0.00 0.00 43.02 41.69 1jdz s PHE 84 CO -0.07 -0.45 -0.06 0.42 0.70 0.00 0.00 175.22 175.75 1jdz s ILE 85 N 0.43 1.50 0.15 0.64 1.01 -0.51 -1.33 121.20 123.08 1jdz s ILE 85 Ca -0.17 -1.10 -0.27 0.00 0.00 0.00 0.00 60.65 59.11 1jdz s ILE 85 Cb -0.18 -1.71 -0.07 0.00 0.01 0.00 0.00 42.46 40.51 1jdz s ILE 85 CO 0.07 -0.01 0.85 -0.60 0.00 0.00 0.00 174.94 175.25 1jdz s ARG 86 N 1.43 4.65 -0.17 2.79 3.52 -0.27 -1.73 118.95 129.18 1jdz s ARG 86 Ca -0.04 1.28 -0.01 0.00 -0.13 0.00 0.00 55.73 56.83 1jdz s ARG 86 Cb -0.18 -3.31 0.04 0.00 -1.56 0.00 0.00 34.95 29.95 1jdz s ARG 86 CO -0.07 0.44 -0.04 -0.47 -0.81 0.00 0.00 175.30 174.34 1jdz s TYR 87 N -0.74 1.64 0.00 5.12 5.04 -0.30 -1.97 117.35 126.15 1jdz s TYR 87 Ca 0.40 -1.06 0.00 0.00 -2.44 0.00 0.00 57.07 53.97 1jdz s TYR 87 Cb -0.23 -1.29 0.00 0.00 0.35 0.00 0.00 41.96 40.79 1jdz s TYR 87 CO 0.28 -0.61 0.00 0.41 -1.34 0.00 0.00 175.55 174.29 1jdz n GLY 88 N 4.89 3.76 3.84 8.97 0.00 -1.15 -4.41 105.19 121.09 1jdz n GLY 88 Ca -0.12 -1.29 -0.23 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.10 4.57 0.18 2.61 -4.23 -1.26 0.09 115.64 115.50 1jdz s THR 89 Ca 0.00 -1.25 -0.15 0.00 -1.18 0.00 0.00 61.69 59.12 1jdz s THR 89 Cb 0.00 -3.43 0.02 0.00 1.34 0.00 0.00 72.50 70.43 1jdz s THR 89 CO 0.00 -0.27 0.44 0.28 -0.54 0.00 0.00 174.62 174.53 1jdz s THR 90 N -2.00 0.04 -0.24 3.99 -1.32 -0.15 -4.78 115.64 111.19 1jdz s THR 90 Ca 0.32 -0.94 -0.04 0.00 -1.21 0.00 0.00 61.69 59.82 1jdz s THR 90 Cb -0.09 -1.62 -0.00 0.00 -1.51 0.00 0.00 72.50 69.29 1jdz s THR 90 CO 0.25 -0.19 -0.02 -0.83 -2.21 0.00 0.00 174.62 171.61 1jdz s GLY 91 N -2.89 1.64 0.45 6.08 0.00 -0.99 -1.63 107.32 109.98 1jdz s GLY 91 Ca 0.11 -1.26 -0.25 0.00 0.00 0.00 0.00 44.72 43.32 1jdz s GLY 91 CO -0.03 0.48 1.30 0.00 0.00 0.00 0.00 173.10 174.85 1jdz s ALA 92 N 1.46 3.12 -0.90 3.20 0.00 -0.12 -0.92 121.76 127.59 1jdz s ALA 92 Ca 0.04 1.22 0.09 0.00 0.00 0.00 0.00 51.96 53.32 1jdz s ALA 92 Cb -0.15 -3.49 0.01 0.00 0.00 0.00 0.00 23.12 19.49 1jdz s ALA 92 CO -0.02 -0.93 0.64 1.28 0.00 0.00 0.00 175.76 176.72 1jdz n LEU 93 N -0.24 1.26 -4.27 0.00 4.77 -0.32 -1.39 117.00 116.82 1jdz n LEU 93 Ca 0.06 -0.80 -0.30 0.00 -0.03 0.00 0.00 56.01 54.94 1jdz n LEU 93 Cb 0.44 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.38 1jdz n LEU 93 CO 0.54 0.25 -0.55 0.68 -1.33 0.00 0.00 177.39 176.98 1jdz s VAL 94 N -1.22 1.88 0.48 4.08 -7.23 -1.25 -4.61 120.40 112.53 1jdz s VAL 94 Ca 0.08 -1.01 0.18 0.00 -1.81 0.00 0.00 61.98 59.42 1jdz s VAL 94 Cb 0.08 -1.57 0.34 0.00 0.56 0.00 0.00 36.38 35.78 1jdz s VAL 94 CO 0.22 0.53 2.02 1.55 -0.31 0.00 0.00 175.10 179.11 1jdz h PRO 95 N 5.67 0.20 0.00 4.82 0.13 -1.93 -3.22 132.00 137.66 1jdz h PRO 95 Ca -0.39 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1jdz h PRO 95 Cb 1.14 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1jdz h PRO 95 CO 0.47 0.13 0.00 2.48 -0.23 0.00 0.00 178.00 180.85 1jdz n TYR 96 N -4.45 0.00 -3.19 1.56 0.18 -1.26 -4.78 117.16 105.22 1jdz n TYR 96 Ca 0.07 0.00 -0.39 0.00 1.88 0.00 0.00 57.90 59.46 1jdz n TYR 96 Cb 0.38 -0.50 -0.05 0.00 -0.38 0.00 0.00 39.34 38.79 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 -3.00 5.12 0.23 -3.48 1.01 -1.22 -5.06 121.20 114.80 1jdz s ILE 97 Ca 0.11 1.18 0.01 0.00 0.00 0.00 0.00 60.65 61.96 1jdz s ILE 97 Cb 0.15 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1jdz s ILE 97 CO 0.42 0.29 0.40 0.20 0.00 0.00 0.00 174.94 176.24 1jdz s ASN 98 N 0.71 6.35 0.44 3.58 0.01 -1.26 -4.93 114.94 119.83 1jdz s ASN 98 Ca 0.31 0.30 -0.25 0.00 -0.71 0.00 0.00 52.86 52.51 1jdz s ASN 98 Cb -0.16 -1.96 -0.08 0.00 0.41 0.00 0.00 41.25 39.45 1jdz s ASN 98 CO 0.14 -0.08 1.36 -0.76 -1.51 0.00 0.00 177.10 176.24 1jdz s LEU 99 N -3.66 4.13 0.00 0.60 1.43 -1.26 -2.47 118.68 117.46 1jdz s LEU 99 Ca 0.37 2.77 0.00 0.00 -1.03 0.00 0.00 54.13 56.24 1jdz s LEU 99 Cb -0.10 -3.96 0.00 0.00 0.03 0.00 0.00 46.19 42.16 1jdz s LEU 99 CO 0.30 -1.06 0.00 0.61 0.23 0.00 0.00 176.35 176.44 1jdz n GLY 100 N 0.62 3.30 3.89 -3.19 0.00 -0.71 -5.01 105.19 104.10 1jdz n GLY 100 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.71 1.69 0.20 1.61 2.02 -1.03 -4.77 118.70 117.71 1jdz s GLU 101 Ca 0.00 0.06 0.10 0.00 0.02 0.00 0.00 54.97 55.15 1jdz s GLU 101 Cb 0.00 -1.92 -0.04 0.00 0.10 0.00 0.00 34.13 32.26 1jdz s GLU 101 CO 0.00 -1.78 -0.14 0.71 0.02 0.00 0.00 175.26 174.07 1jdz s TYR 102 N -3.59 2.51 -0.15 1.61 1.51 -0.75 -1.86 117.35 116.63 1jdz s TYR 102 Ca 0.64 -0.27 -0.00 0.00 -1.01 0.00 0.00 57.07 56.43 1jdz s TYR 102 Cb -0.10 -1.21 0.03 0.00 -0.11 0.00 0.00 41.96 40.56 1jdz s TYR 102 CO 0.50 0.53 -0.10 0.42 -1.11 0.00 0.00 175.55 175.80 1jdz s ILE 103 N -1.80 1.30 -0.36 2.71 1.01 -0.42 -0.95 121.20 122.69 1jdz s ILE 103 Ca 0.24 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 60.16 1jdz s ILE 103 Cb -0.08 -1.33 -0.00 0.00 0.01 0.00 0.00 42.46 41.06 1jdz s ILE 103 CO 0.14 0.32 0.41 -0.63 0.00 0.00 0.00 174.94 175.18 1jdz s ILE 104 N 1.58 5.12 0.05 2.92 1.01 0.28 -0.53 121.20 131.63 1jdz s ILE 104 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 60.65 60.38 1jdz s ILE 104 Cb -0.14 -3.91 -0.06 0.00 0.01 0.00 0.00 42.46 38.37 1jdz s ILE 104 CO -0.09 -0.20 1.26 -0.69 0.00 0.00 0.00 174.94 175.22 1jdz s VAL 105 N 2.13 3.87 -1.11 2.92 1.01 -0.80 -2.20 120.40 126.21 1jdz s VAL 105 Ca 0.13 1.32 0.14 0.00 0.00 0.00 0.00 61.98 63.57 1jdz s VAL 105 Cb -0.16 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1jdz s VAL 105 CO 0.12 0.08 0.72 0.35 0.00 0.00 0.00 175.10 176.37 1jdz n THR 106 N 4.12 0.00 0.00 3.92 -2.24 -0.23 -4.64 114.28 115.21 1jdz n THR 106 Ca 0.10 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1jdz n THR 106 Cb 0.45 1.13 0.00 0.00 -2.10 0.00 0.00 70.33 69.81 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 1.10 0.94 2.92 3.38 0.00 -1.26 -4.46 105.19 107.82 1jdz n GLY 107 Ca 0.05 -0.79 -0.20 0.00 0.00 0.00 0.00 46.02 45.08 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 0.73 0.16 4.61 0.00 -0.61 -1.46 121.76 123.18 1jdz s ALA 108 Ca 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 51.96 51.80 1jdz s ALA 108 Cb 0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.67 1jdz s ALA 108 CO 0.00 0.03 0.39 -1.12 0.00 0.00 0.00 175.76 175.06 1jdz s SER 109 N 0.72 6.47 0.12 0.00 0.01 0.09 -4.60 113.70 116.51 1jdz s SER 109 Ca -0.10 0.56 -0.21 0.00 1.31 0.00 0.00 55.95 57.51 1jdz s SER 109 Cb -0.13 -2.08 0.06 0.00 0.21 0.00 0.00 66.02 64.08 1jdz s SER 109 CO 0.01 0.03 0.53 -0.72 0.41 0.00 0.00 173.24 173.49 1jdz s TYR 110 N -1.71 -0.42 0.03 2.43 1.13 -1.26 -0.95 117.35 116.60 1jdz s TYR 110 Ca 0.41 0.26 -0.21 0.00 -1.41 0.00 0.00 57.07 56.13 1jdz s TYR 110 Cb -0.12 0.42 -0.06 0.00 -1.10 0.00 0.00 41.96 41.10 1jdz s TYR 110 CO 0.26 -0.75 0.60 -0.80 -2.51 0.00 0.00 175.55 172.35 1jdz s ASN 111 N -2.53 7.03 0.82 -0.18 0.01 -1.26 -5.05 114.94 113.78 1jdz s ASN 111 Ca -0.00 1.23 -0.12 0.00 -0.71 0.00 0.00 52.86 53.25 1jdz s ASN 111 Cb -0.00 -2.37 0.09 0.00 0.41 0.00 0.00 41.25 39.38 1jdz s ASN 111 CO -0.09 0.16 1.19 0.00 -1.51 0.00 0.00 177.10 176.85 1jdz s GLN 112 N -0.54 1.80 0.00 -0.60 -2.07 -1.26 -4.98 119.66 112.02 1jdz s GLN 112 Ca 0.31 0.03 0.00 0.00 -1.82 0.00 0.00 55.36 53.88 1jdz s GLN 112 Cb -0.19 -1.95 0.00 0.00 -1.09 0.00 0.00 33.01 29.78 1jdz s GLN 112 CO 0.18 -1.69 0.00 0.41 -1.32 0.00 0.00 175.29 172.88 1jdz n GLY 113 N -3.36 0.59 1.75 2.60 0.00 -1.26 -5.04 105.19 100.48 1jdz n GLY 113 Ca 0.09 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.87 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 0.40 0.24 -0.02 0.00 -1.26 -1.03 105.19 103.51 1jdz n GLY 114 Ca 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 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 0.49 -0.86 0.99 6.46 -1.98 -1.52 115.31 118.88 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 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 1jdz h LEU 115 CO 0.00 0.32 0.01 -0.26 -0.62 0.00 0.00 178.44 177.90 1jdz h PHE 116 N 0.63 0.91 -0.39 1.25 -1.00 -1.48 -2.02 116.94 114.83 1jdz h PHE 116 Ca 0.27 -0.13 -0.07 0.00 2.81 0.00 0.00 57.97 60.85 1jdz h PHE 116 Cb 0.16 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.46 1jdz h PHE 116 CO -0.09 0.83 -0.02 -0.92 -1.61 0.00 0.00 178.31 176.50 1jdz h TYR 117 N 0.80 0.78 -0.62 -0.55 3.20 -0.86 0.17 116.97 119.90 1jdz h TYR 117 Ca 0.15 -0.14 -0.06 0.00 3.14 0.00 0.00 58.73 61.82 1jdz h TYR 117 Cb 0.46 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 1jdz h TYR 117 CO 0.03 0.81 0.14 1.96 -1.64 0.00 0.00 178.16 179.45 1jdz h GLN 118 N 0.53 0.99 -0.02 1.82 4.20 -1.14 0.38 115.11 121.88 1jdz h GLN 118 Ca 0.11 -0.24 -0.16 0.00 0.06 0.00 0.00 58.65 58.42 1jdz h GLN 118 Cb 0.51 -0.13 0.01 0.00 0.30 0.00 0.00 27.48 28.18 1jdz h GLN 118 CO 0.03 0.91 -0.60 1.88 -0.67 0.00 0.00 178.83 180.38 1jdz h TYR 119 N 0.91 0.64 0.00 2.96 0.05 -1.29 -3.35 116.97 116.89 1jdz h TYR 119 Ca 0.19 -0.33 -0.02 0.00 0.05 0.00 0.00 58.73 58.62 1jdz h TYR 119 Cb 0.37 -0.08 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 1jdz h TYR 119 CO 0.03 1.14 -0.73 -0.07 -1.05 0.00 0.00 178.16 177.48 1jdz h LEU 120 N -0.05 0.00 0.00 3.88 3.38 -0.68 -3.48 115.31 118.36 1jdz h LEU 120 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1jdz h LEU 120 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1jdz h LEU 120 CO 0.12 0.08 0.00 0.54 0.09 0.00 0.00 178.44 179.27 1jdz n ARG 121 N -2.85 0.00 -3.11 1.13 1.74 0.13 -4.94 116.66 108.76 1jdz n ARG 121 Ca 0.00 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.03 1jdz n ARG 121 Cb 0.58 -2.82 0.02 0.00 -1.02 0.00 0.00 32.46 29.22 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 -1.65 -1.63 0.55 3.85 -1.25 -5.02 116.55 111.40 1jdz n ASP 122 Ca 0.00 -2.10 0.03 0.00 -0.71 0.00 0.00 54.79 52.02 1jdz n ASP 122 Cb 0.00 2.73 0.30 0.00 -1.35 0.00 0.00 41.12 42.80 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 -1.35 4.61 -4.76 -1.12 3.02 -1.26 -4.56 115.26 109.84 1jdz n ASN 123 Ca -0.06 -2.78 -0.40 0.00 -0.03 0.00 0.00 54.58 51.32 1jdz n ASN 123 Cb 0.44 -0.66 0.02 0.00 -0.61 0.00 0.00 39.78 38.97 1jdz n ASN 123 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jdz n ALA 124 N 0.37 2.06 -2.81 5.41 0.00 -1.26 -4.89 120.51 119.40 1jdz n ALA 124 Ca 0.24 0.25 -0.43 0.00 0.00 0.00 0.00 53.44 53.49 1jdz n ALA 124 Cb 1.03 -2.40 -0.01 0.00 0.00 0.00 0.00 19.45 18.08 1jdz n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jdz s VAL 126 N 2.77 3.52 -0.24 0.00 1.01 -1.26 -4.90 120.40 121.29 1jdz s VAL 126 Ca 0.45 1.06 -0.36 0.00 0.00 0.00 0.00 61.98 63.12 1jdz s VAL 126 Cb -0.01 -3.68 -0.13 0.00 0.00 0.00 0.00 36.38 32.57 1jdz s VAL 126 CO 0.00 0.06 1.95 0.00 0.00 0.00 0.00 175.10 177.11 1jdz n ALA 127 N 4.27 0.62 -3.34 5.51 0.00 -1.26 -4.89 120.51 121.43 1jdz n ALA 127 Ca 0.11 0.19 -0.46 0.00 0.00 0.00 0.00 53.44 53.29 1jdz n ALA 127 Cb 0.43 -2.44 -0.01 0.00 0.00 0.00 0.00 19.45 17.43 1jdz n ALA 127 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1jdz s SER 128 N 5.07 6.94 0.22 0.00 0.15 -1.26 -4.80 113.70 120.02 1jdz s SER 128 Ca 1.00 -2.99 0.07 0.00 0.70 0.00 0.00 55.95 54.73 1jdz s SER 128 Cb -0.86 -2.21 -0.05 0.00 -1.71 0.00 0.00 66.02 61.19 1jdz s SER 128 CO 0.55 -0.48 -0.12 0.42 1.20 0.00 0.00 173.24 174.82 1jdz s THR 129 N -0.31 1.64 0.76 6.45 -4.23 -1.26 -1.57 115.64 117.11 1jdz s THR 129 Ca 0.22 -2.17 -0.06 0.00 -1.18 0.00 0.00 61.69 58.49 1jdz s THR 129 Cb -0.10 -2.13 0.12 0.00 1.34 0.00 0.00 72.50 71.73 1jdz s THR 129 CO -0.09 -0.53 1.07 -2.16 -0.54 0.00 0.00 174.62 172.37 1jdz s PRO 130 N -3.68 1.65 0.03 3.99 0.04 -1.26 -4.71 135.00 131.05 1jdz s PRO 130 Ca 0.24 -0.63 -0.30 0.00 0.04 0.00 0.00 61.00 60.34 1jdz s PRO 130 Cb 0.01 -2.17 -0.06 0.00 0.04 0.00 0.00 34.50 32.32 1jdz s PRO 130 CO 0.07 -1.57 1.38 0.34 0.04 0.00 0.00 177.00 177.27 1jdz s ASP 131 N -4.68 6.86 0.13 6.66 2.15 0.28 -4.92 116.67 123.14 1jdz s ASP 131 Ca 0.66 2.16 -0.19 0.00 0.43 0.00 0.00 52.55 55.60 1jdz s ASP 131 Cb -0.07 -2.57 -0.01 0.00 -0.30 0.00 0.00 42.92 39.97 1jdz s ASP 131 CO 0.46 -0.69 1.72 0.15 -0.17 0.00 0.00 175.17 176.65 1jdz h PHE 132 N 7.53 -0.00 0.86 -5.34 3.57 -1.95 -1.66 116.94 119.95 1jdz h PHE 132 Ca -0.39 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.08 1jdz h PHE 132 Cb 1.19 0.04 0.01 0.00 2.79 0.00 0.00 35.95 39.97 1jdz h PHE 132 CO 0.72 -0.03 -0.41 0.93 -2.23 0.00 0.00 178.31 177.29 1jdz h GLU 133 N 0.08 -1.12 -1.00 1.11 5.08 -1.98 -2.41 114.58 114.34 1jdz h GLU 133 Ca 0.11 0.08 0.19 0.00 -1.00 0.00 0.00 59.36 58.73 1jdz h GLU 133 Cb 0.13 0.25 -0.10 0.00 0.50 0.00 0.00 28.75 29.53 1jdz h GLU 133 CO -0.17 -0.74 0.61 1.25 -1.00 0.00 0.00 179.01 178.96 1jdz h LEU 134 N -1.22 0.74 -0.85 1.33 5.85 -1.92 -0.55 115.31 118.69 1jdz h LEU 134 Ca -0.12 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 1jdz h LEU 134 Cb 0.89 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 1jdz h LEU 134 CO 0.19 0.26 0.14 0.74 -0.34 0.00 0.00 178.44 179.44 1jdz h THR 135 N 0.72 1.25 -0.23 1.05 2.02 -1.12 -2.27 112.91 114.33 1jdz h THR 135 Ca 0.57 -0.92 -0.11 0.00 0.77 0.00 0.00 66.41 66.71 1jdz h THR 135 Cb 0.94 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 1jdz h THR 135 CO -0.36 0.35 -0.33 0.78 0.37 0.00 0.00 175.52 176.34 1jdz h ASN 136 N 0.94 0.49 -0.42 4.18 2.35 -0.61 -2.38 115.58 120.14 1jdz h ASN 136 Ca 0.20 -0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1jdz h ASN 136 Cb 0.35 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1jdz h ASN 136 CO 0.00 0.79 0.20 0.11 -1.65 0.00 0.00 177.43 176.88 1jdz h LYS 137 N 0.41 0.65 -0.24 0.81 1.57 -0.97 -0.74 116.57 118.07 1jdz h LYS 137 Ca 0.05 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1jdz h LYS 137 Cb 0.77 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 1jdz h LYS 137 CO 0.06 0.53 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.37 1jdz h LEU 138 N 0.65 0.44 -0.64 2.94 3.38 -1.02 -0.93 115.31 120.14 1jdz h LEU 138 Ca 0.16 -0.35 0.07 0.00 0.09 0.00 0.00 57.88 57.86 1jdz h LEU 138 Cb 0.11 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 1jdz h LEU 138 CO -0.02 0.68 0.31 0.58 0.09 0.00 0.00 178.44 180.09 1jdz h VAL 139 N 0.19 0.89 -0.24 1.22 2.07 -0.93 -0.24 116.25 119.21 1jdz h VAL 139 Ca 0.06 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1jdz h VAL 139 Cb 0.48 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1jdz h VAL 139 CO 0.02 0.10 0.12 0.74 0.02 0.00 0.00 177.57 178.58 1jdz h THR 140 N 0.57 1.13 0.05 2.57 2.02 -0.92 -1.22 112.91 117.10 1jdz h THR 140 Ca 0.30 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 1jdz h THR 140 Cb 0.27 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1jdz h THR 140 CO -0.23 0.13 -0.03 0.28 0.37 0.00 0.00 175.52 176.04 1jdz h SER 141 N 0.27 -0.06 -0.30 4.18 0.02 -0.56 0.10 113.55 117.21 1jdz h SER 141 Ca 0.08 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1jdz h SER 141 Cb 0.09 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 1jdz h SER 141 CO -0.01 -0.04 0.17 -0.26 -1.14 0.00 0.00 176.83 175.54 1jdz h PHE 142 N -0.07 0.43 -0.20 3.45 -1.00 -1.01 -1.86 116.94 116.68 1jdz h PHE 142 Ca -0.01 -0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.73 1jdz h PHE 142 Cb 0.06 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.47 1jdz h PHE 142 CO -0.07 0.32 -0.05 0.77 -1.61 0.00 0.00 178.31 177.66 1jdz h SER 143 N 0.45 0.39 -0.64 2.17 0.02 -0.74 -1.06 113.55 114.14 1jdz h SER 143 Ca 0.12 -0.37 0.06 0.00 -0.84 0.00 0.00 61.79 60.75 1jdz h SER 143 Cb 0.04 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 1jdz h SER 143 CO -0.02 0.67 0.43 0.11 -1.14 0.00 0.00 176.83 176.88 1jdz h LYS 144 N 0.11 0.64 -0.40 3.45 1.57 -0.04 -0.43 116.57 121.47 1jdz h LYS 144 Ca 0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1jdz h LYS 144 Cb 0.50 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1jdz h LYS 144 CO 0.02 0.42 0.00 0.54 -0.57 0.00 0.00 179.45 179.86 1jdz n ARG 145 N -4.47 1.87 -2.81 3.15 1.74 -0.80 -4.92 116.66 110.42 1jdz n ARG 145 Ca 0.09 -1.14 -0.22 0.00 -0.77 0.00 0.00 57.85 55.81 1jdz n ARG 145 Cb 0.22 -1.34 0.02 0.00 -1.02 0.00 0.00 32.46 30.34 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 0.38 -5.84 -4.83 0.55 3.02 -0.17 -4.98 115.26 103.38 1jdz n ASN 146 Ca 0.10 -0.18 -0.37 0.00 -0.03 0.00 0.00 54.58 54.10 1jdz n ASN 146 Cb 0.33 -4.78 -0.06 0.00 -0.61 0.00 0.00 39.78 34.66 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 -6.42 4.44 -0.14 3.41 1.43 -0.42 -5.04 118.68 115.95 1jdz s LEU 147 Ca 0.20 1.09 -0.27 0.00 -1.03 0.00 0.00 54.13 54.11 1jdz s LEU 147 Cb -0.09 -2.93 -0.01 0.00 0.03 0.00 0.00 46.19 43.19 1jdz s LEU 147 CO 0.24 0.23 0.90 -0.75 0.23 0.00 0.00 176.35 177.21 1jdz s LYS 148 N -1.42 4.36 0.21 1.70 2.47 -1.26 -4.65 119.74 121.15 1jdz s LYS 148 Ca 0.30 1.18 -0.09 0.00 -1.56 0.00 0.00 55.97 55.80 1jdz s LYS 148 Cb -0.17 -3.55 -0.01 0.00 -1.46 0.00 0.00 37.83 32.63 1jdz s LYS 148 CO 0.17 -0.31 0.33 1.52 0.16 0.00 0.00 175.35 177.22 1jdz s TYR 149 N 2.03 0.57 0.08 4.03 -0.85 -1.26 -1.81 117.35 120.14 1jdz s TYR 149 Ca 0.43 -0.90 0.03 0.00 -0.52 0.00 0.00 57.07 56.11 1jdz s TYR 149 Cb -0.17 -0.08 -0.03 0.00 0.38 0.00 0.00 41.96 42.06 1jdz s TYR 149 CO 0.15 -0.81 -0.10 0.71 -1.52 0.00 0.00 175.55 173.98 1jdz s TYR 150 N -4.04 0.98 -0.13 -3.49 1.51 -0.13 -4.95 117.35 107.11 1jdz s TYR 150 Ca 0.25 -0.60 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 1jdz s TYR 150 Cb 0.03 -0.55 -0.01 0.00 -0.11 0.00 0.00 41.96 41.32 1jdz s TYR 150 CO 0.07 -0.02 -0.16 0.08 -1.11 0.00 0.00 175.55 174.40 1jdz s VAL 151 N -2.08 2.73 -0.08 0.71 1.01 -1.26 -0.56 120.40 120.88 1jdz s VAL 151 Ca 0.01 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 60.92 1jdz s VAL 151 Cb -0.05 -2.13 0.10 0.00 0.00 0.00 0.00 36.38 34.30 1jdz s VAL 151 CO 0.00 0.53 1.33 0.61 0.00 0.00 0.00 175.10 177.57 1jdz n GLY 152 N 3.64 0.12 3.86 4.51 0.00 -0.94 -4.97 105.19 111.42 1jdz n GLY 152 Ca -0.19 -1.02 -0.31 0.00 0.00 0.00 0.00 46.02 44.51 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 -3.91 6.53 0.12 1.61 0.02 -1.26 -1.07 114.94 116.98 1jdz s ASN 153 Ca 0.32 1.29 0.04 0.00 -1.02 0.00 0.00 52.86 53.48 1jdz s ASN 153 Cb -0.00 -2.39 -0.04 0.00 0.02 0.00 0.00 41.25 38.84 1jdz s ASN 153 CO -0.02 -0.50 -0.09 0.68 0.02 0.00 0.00 177.10 177.18 1jdz s VAL 154 N -2.52 0.99 -0.23 1.60 -7.23 -0.54 -1.00 120.40 111.47 1jdz s VAL 154 Ca 0.54 -1.87 -0.09 0.00 -1.81 0.00 0.00 61.98 58.75 1jdz s VAL 154 Cb -0.10 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 1jdz s VAL 154 CO 0.33 -0.70 0.11 0.12 -0.31 0.00 0.00 175.10 174.66 1jdz s PHE 155 N -3.04 3.23 -0.71 2.82 5.36 -0.32 -0.73 117.98 124.59 1jdz s PHE 155 Ca 0.11 0.02 -0.18 0.00 -0.96 0.00 0.00 56.93 55.93 1jdz s PHE 155 Cb 0.01 -2.22 0.13 0.00 -0.34 0.00 0.00 43.02 40.61 1jdz s PHE 155 CO -0.01 -0.03 0.81 -1.12 -1.46 0.00 0.00 175.22 173.41 1jdz s SER 156 N 1.05 6.40 0.51 6.13 0.01 -0.12 -0.99 113.70 126.69 1jdz s SER 156 Ca 0.06 -1.82 -0.17 0.00 1.31 0.00 0.00 55.95 55.33 1jdz s SER 156 Cb -0.14 -2.30 -0.08 0.00 0.21 0.00 0.00 66.02 63.71 1jdz s SER 156 CO 0.04 -1.00 0.99 -0.55 0.41 0.00 0.00 173.24 173.13 1jdz s SER 157 N 3.33 6.55 -0.01 2.44 0.15 0.52 -4.61 113.70 122.06 1jdz s SER 157 Ca 0.17 1.62 0.10 0.00 0.70 0.00 0.00 55.95 58.55 1jdz s SER 157 Cb -0.17 -2.52 -0.14 0.00 -1.71 0.00 0.00 66.02 61.48 1jdz s SER 157 CO -0.00 -0.64 0.32 0.47 1.20 0.00 0.00 173.24 174.59 1jdz n ASP 158 N -1.52 1.70 -3.85 5.45 8.00 -1.26 -4.37 116.55 120.70 1jdz n ASP 158 Ca 0.07 -0.31 -0.30 0.00 0.71 0.00 0.00 54.79 54.96 1jdz n ASP 158 Cb 0.54 1.28 -0.14 0.00 -0.02 0.00 0.00 41.12 42.78 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 -2.42 2.50 0.31 2.24 0.00 -1.26 -4.98 121.76 118.16 1jdz s ALA 159 Ca -0.01 -2.58 0.02 0.00 0.00 0.00 0.00 51.96 49.39 1jdz s ALA 159 Cb 0.07 -1.93 0.57 0.00 0.00 0.00 0.00 23.12 21.83 1jdz s ALA 159 CO 0.43 -1.89 1.91 0.35 0.00 0.00 0.00 175.76 176.56 1jdz h PHE 160 N 7.13 1.02 -0.24 0.00 3.57 -2.00 -2.96 116.94 123.46 1jdz h PHE 160 Ca -0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1jdz h PHE 160 Cb 0.96 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.36 1jdz h PHE 160 CO 0.46 0.51 0.00 0.66 -2.23 0.00 0.00 178.31 177.71 1jdz n TYR 161 N -4.50 0.30 -2.02 0.41 4.02 -1.26 -4.98 117.16 109.12 1jdz n TYR 161 Ca 0.14 -0.15 -0.41 0.00 -0.01 0.00 0.00 57.90 57.47 1jdz n TYR 161 Cb 0.23 -0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.54 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 -1.65 3.53 -0.02 -0.72 0.00 -1.12 -4.97 121.76 116.81 1jdz s ALA 162 Ca 0.34 1.35 -0.24 0.00 0.00 0.00 0.00 51.96 53.40 1jdz s ALA 162 Cb 0.21 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1jdz s ALA 162 CO 0.30 -0.76 0.73 -1.21 0.00 0.00 0.00 175.76 174.82 1jdz s GLU 163 N -1.67 4.45 -0.29 0.00 2.02 -1.26 -5.02 118.70 116.93 1jdz s GLU 163 Ca 0.51 0.96 0.01 0.00 0.02 0.00 0.00 54.97 56.47 1jdz s GLU 163 Cb -0.42 -3.41 0.15 0.00 0.10 0.00 0.00 34.13 30.55 1jdz s GLU 163 CO 0.54 0.15 0.35 0.34 0.02 0.00 0.00 175.26 176.67 1jdz s ASP 164 N 0.46 1.01 0.67 -0.19 -1.08 -1.26 -5.03 116.67 111.25 1jdz s ASP 164 Ca 0.38 -0.55 0.37 0.00 -0.52 0.00 0.00 52.55 52.23 1jdz s ASP 164 Cb -0.19 0.81 2.01 0.00 -1.46 0.00 0.00 42.92 44.10 1jdz s ASP 164 CO 0.20 -0.37 2.13 1.05 0.52 0.00 0.00 175.17 178.71 1jdz h GLU 165 N 8.21 0.00 -0.02 4.34 4.11 -2.05 -2.04 114.58 127.13 1jdz h GLU 165 Ca -0.11 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.31 1jdz h GLU 165 Cb 1.10 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 1jdz h GLU 165 CO 0.30 0.00 -0.27 0.39 0.07 0.00 0.00 179.01 179.50 1jdz n GLU 166 N -2.98 1.50 -0.06 1.06 1.02 -1.26 -4.89 120.64 115.03 1jdz n GLU 166 Ca -0.02 -3.00 -0.08 0.00 -0.02 0.00 0.00 57.16 54.04 1jdz n GLU 166 Cb 0.23 -1.58 -0.05 0.00 -0.02 0.00 0.00 31.44 30.02 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 0.60 -0.93 -0.15 -0.32 3.57 -1.79 -0.97 116.94 116.95 1jdz h PHE 167 Ca 0.01 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.59 1jdz h PHE 167 Cb 1.03 0.43 -0.04 0.00 2.79 0.00 0.00 35.95 40.16 1jdz h PHE 167 CO 0.45 -0.27 -0.12 0.28 -2.23 0.00 0.00 178.31 176.42 1jdz h VAL 168 N -0.24 0.66 -0.45 1.41 2.07 -1.90 -2.42 116.25 115.39 1jdz h VAL 168 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 1jdz h VAL 168 Cb 0.33 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1jdz h VAL 168 CO -0.31 0.00 0.29 0.50 0.02 0.00 0.00 177.57 178.06 1jdz h LYS 169 N -0.13 0.60 0.31 1.57 3.64 -1.90 -1.37 116.57 119.29 1jdz h LYS 169 Ca 0.09 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1jdz h LYS 169 Cb 0.27 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1jdz h LYS 169 CO -0.23 0.42 -0.26 -0.22 -2.27 0.00 0.00 179.45 176.89 1jdz h LYS 170 N 0.60 -0.56 -0.03 1.90 3.64 -0.97 -0.84 116.57 120.31 1jdz h LYS 170 Ca 0.16 0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.42 1jdz h LYS 170 Cb -0.04 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1jdz h LYS 170 CO -0.03 -0.38 -0.70 -1.49 -2.27 0.00 0.00 179.45 174.58 1jdz h TRP 171 N -0.58 0.21 -0.09 1.91 4.06 -1.46 -3.04 115.95 116.96 1jdz h TRP 171 Ca -0.02 -0.10 -0.15 0.00 2.06 0.00 0.00 58.89 60.68 1jdz h TRP 171 Cb 0.52 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.64 1jdz h TRP 171 CO -0.15 0.80 -0.61 0.66 -3.56 0.00 0.00 178.44 175.59 1jdz h SER 172 N 0.11 0.38 0.62 -3.49 4.64 -1.22 -2.35 113.55 112.24 1jdz h SER 172 Ca -0.02 -0.22 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1jdz h SER 172 Cb 1.24 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1jdz h SER 172 CO 0.10 0.90 0.00 -1.54 -0.87 0.00 0.00 176.83 175.42 1jdz n SER 173 N -3.89 0.00 -1.84 4.97 3.41 -0.33 -2.76 113.62 113.19 1jdz n SER 173 Ca -0.03 0.28 -0.02 0.00 -0.26 0.00 0.00 58.87 58.85 1jdz n SER 173 Cb 0.63 -0.41 0.32 0.00 -0.26 0.00 0.00 64.21 64.48 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 -1.41 3.79 -0.99 4.33 1.74 -0.92 -4.93 116.66 118.27 1jdz n ARG 174 Ca 0.07 -3.09 0.00 0.00 -0.77 0.00 0.00 57.85 54.06 1jdz n ARG 174 Cb 0.23 -2.18 0.00 0.00 -1.02 0.00 0.00 32.46 29.49 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 -0.10 0.61 3.86 -0.13 0.00 -1.11 -5.04 105.19 103.28 1jdz n GLY 175 Ca 0.36 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.21 6.59 0.00 1.61 0.01 -1.00 -4.08 114.94 115.87 1jdz s ASN 176 Ca 0.00 0.71 0.09 0.00 -0.71 0.00 0.00 52.86 52.95 1jdz s ASN 176 Cb 0.00 -2.16 0.08 0.00 0.41 0.00 0.00 41.25 39.59 1jdz s ASN 176 CO 0.00 0.35 0.81 2.30 -1.51 0.00 0.00 177.10 179.06 1jdz n ILE 177 N 1.80 0.04 -3.55 0.60 -5.35 -0.17 -4.12 119.36 108.61 1jdz n ILE 177 Ca -0.16 -0.52 -0.08 0.00 -0.27 0.00 0.00 62.75 61.72 1jdz n ILE 177 Cb 0.54 1.17 -0.02 0.00 -1.74 0.00 0.00 39.64 39.58 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 -0.79 -1.73 -0.03 -1.28 0.00 -1.25 -1.17 121.76 115.50 1jdz s ALA 178 Ca 0.11 0.71 0.06 0.00 0.00 0.00 0.00 51.96 52.84 1jdz s ALA 178 Cb 0.08 0.56 -0.01 0.00 0.00 0.00 0.00 23.12 23.74 1jdz s ALA 178 CO 0.12 -0.78 -0.21 0.54 0.00 0.00 0.00 175.76 175.43 1jdz s VAL 179 N -3.29 1.69 0.00 0.00 0.11 -0.10 -1.17 120.40 117.64 1jdz s VAL 179 Ca 0.06 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.22 1jdz s VAL 179 Cb -0.01 -1.42 0.00 0.00 -1.53 0.00 0.00 36.38 33.42 1jdz s VAL 179 CO -0.07 0.48 0.00 1.21 -3.33 0.00 0.00 175.10 173.39 1jdz n GLU 180 N 2.77 0.00 0.00 1.54 0.00 -0.16 -2.35 120.64 122.44 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 2.26 0.00 5.31 2.81 -1.26 -0.36 117.12 125.88 1jdz n MET 181 Ca 0.00 -0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.84 1jdz n MET 181 Cb 0.00 -0.32 0.00 0.00 -0.71 0.00 0.00 33.22 32.19 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 0.31 -0.03 0.03 0.00 -1.26 -3.79 120.64 115.57 1jdz n GLU 182 Ca 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 57.16 56.54 1jdz n GLU 182 Cb 0.03 -0.57 0.04 0.00 0.00 0.00 0.00 31.44 30.94 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 0.94 0.92 -0.31 0.00 0.00 -1.89 0.51 119.26 119.43 1jdz h ALA 184 Ca 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1jdz h ALA 184 Cb 1.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1jdz h ALA 184 CO 0.10 0.09 0.09 1.15 0.00 0.00 0.00 179.25 180.68 1jdz h THR 185 N 0.73 1.21 0.24 0.00 2.02 -1.88 -1.81 112.91 113.42 1jdz h THR 185 Ca 0.30 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1jdz h THR 185 Cb 0.16 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1jdz h THR 185 CO -0.17 0.23 -0.21 0.25 0.37 0.00 0.00 175.52 175.98 1jdz h LEU 186 N 0.35 -0.57 -0.01 2.58 5.85 -0.39 -1.92 115.31 121.20 1jdz h LEU 186 Ca 0.10 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 1jdz h LEU 186 Cb 0.26 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 1jdz h LEU 186 CO -0.00 -0.32 0.01 -0.26 -0.34 0.00 0.00 178.44 177.52 1jdz h PHE 187 N -0.48 0.02 0.02 1.25 0.05 -0.00 -1.87 116.94 115.92 1jdz h PHE 187 Ca -0.01 -0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.78 1jdz h PHE 187 Cb 0.44 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 38.38 1jdz h PHE 187 CO -0.14 0.05 -0.01 1.15 -0.18 0.00 0.00 178.31 179.18 1jdz h THR 188 N -0.02 1.08 -0.53 -1.55 2.02 -1.33 -1.31 112.91 111.26 1jdz h THR 188 Ca 0.00 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 1jdz h THR 188 Cb 0.04 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 1jdz h THR 188 CO -0.00 0.08 0.19 0.25 0.37 0.00 0.00 175.52 176.41 1jdz h LEU 189 N -0.16 0.70 -0.82 2.58 5.85 -1.39 -1.56 115.31 120.50 1jdz h LEU 189 Ca -0.00 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.56 1jdz h LEU 189 Cb 0.15 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 1jdz h LEU 189 CO 0.00 0.65 0.13 0.28 -0.34 0.00 0.00 178.44 179.16 1jdz h SER 190 N 0.76 0.96 -0.66 1.25 0.02 -1.09 0.77 113.55 115.54 1jdz h SER 190 Ca 0.18 -0.20 -0.08 0.00 -0.84 0.00 0.00 61.79 60.85 1jdz h SER 190 Cb 0.18 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1jdz h SER 190 CO -0.01 0.94 0.10 0.11 -1.14 0.00 0.00 176.83 176.83 1jdz h LYS 191 N 0.96 1.10 -0.08 3.45 6.56 -0.52 0.15 116.57 128.19 1jdz h LYS 191 Ca 0.20 -0.30 -0.19 0.00 -1.06 0.00 0.00 60.65 59.30 1jdz h LYS 191 Cb 0.37 -0.13 -0.00 0.00 -0.57 0.00 0.00 32.23 31.91 1jdz h LYS 191 CO 0.01 1.01 -0.75 0.28 -2.06 0.00 0.00 179.45 177.93 1jdz h VAL 192 N 1.02 1.36 0.00 0.50 2.07 -1.04 -3.29 116.25 116.88 1jdz h VAL 192 Ca 0.20 -2.14 0.00 0.00 0.82 0.00 0.00 66.70 65.59 1jdz h VAL 192 Cb 0.45 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1jdz h VAL 192 CO 0.01 0.65 -0.62 0.29 0.02 0.00 0.00 177.57 177.92 1jdz n LYS 193 N -3.85 0.13 -0.74 1.57 4.76 0.24 -4.97 118.16 115.30 1jdz n LYS 193 Ca -0.05 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 1jdz n LYS 193 Cb 0.72 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 32.35 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 1.43 0.55 3.89 0.72 0.00 0.34 -5.05 105.19 107.07 1jdz n GLY 194 Ca 0.04 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.00 3.50 -0.34 1.61 0.51 -0.20 -5.02 118.94 117.00 1jdz s TRP 195 Ca 0.00 0.85 -0.11 0.00 -2.12 0.00 0.00 56.10 54.73 1jdz s TRP 195 Cb 0.00 -2.30 0.00 0.00 -0.81 0.00 0.00 33.47 30.36 1jdz s TRP 195 CO 0.00 -0.08 0.19 0.15 -0.51 0.00 0.00 176.95 176.70 1jdz s LYS 196 N -4.06 3.16 0.14 4.98 1.02 -0.45 -4.54 119.74 119.99 1jdz s LYS 196 Ca 0.48 -0.85 0.04 0.00 0.02 0.00 0.00 55.97 55.66 1jdz s LYS 196 Cb -0.10 -3.68 -0.04 0.00 -0.52 0.00 0.00 37.83 33.49 1jdz s LYS 196 CO 0.35 -0.54 -0.10 -1.12 -0.92 0.00 0.00 175.35 173.03 1jdz s SER 197 N 1.61 1.71 0.29 2.83 0.01 -1.26 -0.57 113.70 118.31 1jdz s SER 197 Ca 0.04 -0.98 -0.17 0.00 1.31 0.00 0.00 55.95 56.14 1jdz s SER 197 Cb -0.18 -0.00 0.02 0.00 0.21 0.00 0.00 66.02 66.07 1jdz s SER 197 CO 0.07 -0.33 0.65 0.00 0.41 0.00 0.00 173.24 174.05 1jdz s ALA 198 N -3.21 -0.81 -0.14 1.44 0.00 -0.45 -0.56 121.76 118.03 1jdz s ALA 198 Ca 0.15 -0.57 -0.14 0.00 0.00 0.00 0.00 51.96 51.40 1jdz s ALA 198 Cb 0.02 0.90 0.04 0.00 0.00 0.00 0.00 23.12 24.08 1jdz s ALA 198 CO 0.00 -0.97 0.40 0.99 0.00 0.00 0.00 175.76 176.17 1jdz s THR 199 N -3.71 0.00 -0.02 0.00 2.01 -1.26 -1.11 115.64 111.55 1jdz s THR 199 Ca 0.15 -0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.16 1jdz s THR 199 Cb -0.04 -0.56 -0.00 0.00 0.01 0.00 0.00 72.50 71.90 1jdz s THR 199 CO 0.09 -0.01 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.21 1jdz s VAL 200 N 0.12 0.86 0.12 3.82 1.01 -0.83 -1.90 120.40 123.60 1jdz s VAL 200 Ca -0.01 -0.42 0.09 0.00 0.00 0.00 0.00 61.98 61.64 1jdz s VAL 200 Cb -0.03 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 1jdz s VAL 200 CO 0.01 0.26 -0.23 -0.76 0.00 0.00 0.00 175.10 174.38 1jdz s LEU 201 N 0.08 2.32 -0.23 3.92 1.43 0.32 -2.93 118.68 123.59 1jdz s LEU 201 Ca -0.01 -0.73 -0.09 0.00 -1.03 0.00 0.00 54.13 52.27 1jdz s LEU 201 Cb -0.08 -0.99 -0.04 0.00 0.03 0.00 0.00 46.19 45.10 1jdz s LEU 201 CO 0.00 0.09 0.12 -0.69 0.23 0.00 0.00 176.35 176.11 1jdz s VAL 202 N -1.22 5.02 -0.34 -1.59 1.01 0.11 -1.30 120.40 122.10 1jdz s VAL 202 Ca 0.10 0.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.85 1jdz s VAL 202 Cb -0.10 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 32.95 1jdz s VAL 202 CO 0.05 0.36 1.42 -0.69 0.00 0.00 0.00 175.10 176.24 1jdz s VAL 203 N 1.08 3.94 -0.53 2.92 1.01 -0.78 -0.98 120.40 127.06 1jdz s VAL 203 Ca 0.06 1.02 0.22 0.00 0.00 0.00 0.00 61.98 63.28 1jdz s VAL 203 Cb -0.14 -4.09 -0.25 0.00 0.00 0.00 0.00 36.38 31.90 1jdz s VAL 203 CO 0.04 -0.57 0.76 -1.54 0.00 0.00 0.00 175.10 173.79 1jdz n SER 204 N 8.39 0.52 -3.47 3.32 3.41 -0.65 -1.73 113.62 123.42 1jdz n SER 204 Ca 0.16 -0.44 -0.11 0.00 -0.26 0.00 0.00 58.87 58.23 1jdz n SER 204 Cb 0.47 1.36 -0.02 0.00 -0.26 0.00 0.00 64.21 65.76 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 -3.81 -0.50 -0.24 4.04 -4.77 -1.23 -4.95 116.67 105.21 1jdz s ASP 205 Ca 0.01 -0.04 0.02 0.00 -3.30 0.00 0.00 52.55 49.24 1jdz s ASP 205 Cb 0.15 0.56 0.05 0.00 -1.09 0.00 0.00 42.92 42.59 1jdz s ASP 205 CO 0.87 -0.91 -0.11 0.21 0.70 0.00 0.00 175.17 175.94 1jdz s ASN 206 N -2.70 4.08 0.43 2.11 3.84 -1.26 -0.94 114.94 120.50 1jdz s ASN 206 Ca 0.03 -1.22 0.24 0.00 0.21 0.00 0.00 52.86 52.12 1jdz s ASN 206 Cb -0.01 -1.44 0.67 0.00 -0.55 0.00 0.00 41.25 39.92 1jdz s ASN 206 CO -0.11 -0.17 1.72 -0.07 -2.79 0.00 0.00 177.10 175.68 1jdz h LEU 207 N 7.84 0.00 0.00 3.21 3.38 -1.54 -3.47 115.31 124.73 1jdz h LEU 207 Ca -0.23 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.61 1jdz h LEU 207 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1jdz h LEU 207 CO 0.47 0.16 -0.70 0.00 0.09 0.00 0.00 178.44 178.46 1jdz h ALA 208 N 1.84 0.63 0.00 1.53 0.00 -1.81 -3.49 119.26 117.95 1jdz h ALA 208 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1jdz h ALA 208 Cb 0.90 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1jdz h ALA 208 CO 0.02 0.76 0.00 0.39 0.00 0.00 0.00 179.25 180.42 1jdz n GLU 217 N -3.19 0.00 -0.10 0.00 1.02 -1.26 -4.83 120.64 112.27 1jdz n GLU 217 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 1jdz n GLU 217 Cb 0.78 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 32.17 1jdz n GLU 217 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1jdz h GLU 218 N 0.00 0.80 0.16 3.49 4.81 -2.03 -2.80 114.58 119.01 1jdz h GLU 218 Ca 0.00 -0.42 -0.01 0.00 -0.13 0.00 0.00 59.36 58.80 1jdz h GLU 218 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1jdz h GLU 218 CO 0.00 1.05 -0.08 1.25 -0.73 0.00 0.00 179.01 180.50 1jdz h LEU 219 N 0.58 -0.19 -0.46 1.64 5.85 -1.98 -1.64 115.31 119.11 1jdz h LEU 219 Ca 0.05 -0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.62 1jdz h LEU 219 Cb 0.90 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.91 1jdz h LEU 219 CO 0.08 0.11 -0.45 -0.33 -0.34 0.00 0.00 178.44 177.50 1jdz h GLU 220 N -0.49 -0.22 -0.77 1.25 5.08 -1.99 0.45 114.58 117.89 1jdz h GLU 220 Ca -0.02 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.46 1jdz h GLU 220 Cb 0.38 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.62 1jdz h GLU 220 CO 0.04 -0.15 0.51 -0.22 -1.00 0.00 0.00 179.01 178.19 1jdz h LYS 221 N -0.23 0.62 0.29 2.33 3.64 -1.51 0.52 116.57 122.24 1jdz h LYS 221 Ca 0.08 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1jdz h LYS 221 Cb 0.43 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1jdz h LYS 221 CO -0.55 0.41 -0.14 1.03 -2.27 0.00 0.00 179.45 177.93 1jdz h SER 222 N 0.64 -0.33 -0.61 4.20 0.87 0.27 -0.07 113.55 118.52 1jdz h SER 222 Ca 0.36 -0.11 0.09 0.00 -1.23 0.00 0.00 61.79 60.91 1jdz h SER 222 Cb 0.54 0.09 -0.07 0.00 -0.44 0.00 0.00 62.40 62.51 1jdz h SER 222 CO -0.14 -0.09 0.23 0.58 -0.53 0.00 0.00 176.83 176.88 1jdz h VAL 223 N -0.57 0.77 -0.06 2.23 2.07 0.64 -1.53 116.25 119.80 1jdz h VAL 223 Ca -0.04 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 1jdz h VAL 223 Cb 0.42 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1jdz h VAL 223 CO 0.07 0.07 0.02 0.24 0.02 0.00 0.00 177.57 177.99 1jdz h MET 224 N 0.41 0.09 -0.39 1.57 2.07 -0.76 -2.08 114.93 115.83 1jdz h MET 224 Ca 0.31 -0.02 0.01 0.00 -2.07 0.00 0.00 59.70 57.93 1jdz h MET 224 Cb 0.38 -0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 30.08 1jdz h MET 224 CO -0.31 0.25 0.24 -0.44 1.07 0.00 0.00 176.91 177.72 1jdz h ASP 225 N -0.09 0.41 -0.79 1.22 3.32 -0.75 -2.30 116.42 117.43 1jdz h ASP 225 Ca 0.02 -0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.13 1jdz h ASP 225 Cb 0.20 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.60 1jdz h ASP 225 CO -0.00 0.30 0.47 1.23 -1.72 0.00 0.00 179.24 179.52 1jdz h GLY 226 N 0.50 1.18 0.92 2.75 0.00 -1.26 -1.93 103.07 105.23 1jdz h GLY 226 Ca 0.15 -0.34 0.02 0.00 0.00 0.00 0.00 47.33 47.16 1jdz h GLY 226 CO -0.05 0.22 0.55 0.00 0.00 0.00 0.00 176.54 177.26 1jdz h ALA 227 N 1.39 1.09 -0.82 3.60 0.00 -0.90 -0.25 119.26 123.37 1jdz h ALA 227 Ca 0.35 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1jdz h ALA 227 Cb 0.18 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1jdz h ALA 227 CO -0.18 0.41 0.38 0.87 0.00 0.00 0.00 179.25 180.73 1jdz h LYS 228 N 1.08 1.19 -0.70 0.00 1.57 -0.86 -0.93 116.57 117.92 1jdz h LYS 228 Ca 0.33 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 1jdz h LYS 228 Cb -0.04 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.03 1jdz h LYS 228 CO -0.10 0.93 0.31 0.00 -0.57 0.00 0.00 179.45 180.02 1jdz h ALA 229 N 1.20 0.91 -0.46 3.86 0.00 -0.54 -1.63 119.26 122.60 1jdz h ALA 229 Ca 0.28 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1jdz h ALA 229 Cb 0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1jdz h ALA 229 CO -0.03 0.51 0.08 0.28 0.00 0.00 0.00 179.25 180.08 1jdz h VAL 230 N 0.99 1.25 -0.77 0.00 2.07 -0.56 -2.43 116.25 116.80 1jdz h VAL 230 Ca 0.24 -0.90 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 1jdz h VAL 230 Cb 0.17 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1jdz h VAL 230 CO -0.02 0.32 0.35 -0.07 0.02 0.00 0.00 177.57 178.16 1jdz h LEU 231 N 0.63 1.02 0.07 2.57 3.38 -0.95 -0.64 115.31 121.39 1jdz h LEU 231 Ca 0.14 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1jdz h LEU 231 Cb 0.38 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1jdz h LEU 231 CO 0.01 0.88 -0.05 0.44 0.09 0.00 0.00 178.44 179.81 1jdz h ASP 232 N 1.11 -0.13 -0.29 -0.43 3.32 -1.18 -2.17 116.42 116.64 1jdz h ASP 232 Ca 0.26 0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.38 1jdz h ASP 232 Cb 0.14 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.68 1jdz h ASP 232 CO -0.03 -0.08 -0.04 0.74 -1.72 0.00 0.00 179.24 178.11 1jdz h THR 233 N -0.12 0.74 0.00 0.35 2.02 -1.03 -1.37 112.91 113.49 1jdz h THR 233 Ca -0.00 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1jdz h THR 233 Cb 0.11 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 67.22 1jdz h THR 233 CO -0.00 0.01 -0.02 -0.07 0.37 0.00 0.00 175.52 175.80 1jdz h LEU 234 N 0.03 0.00 -3.10 2.58 3.38 -0.94 -2.93 115.31 114.34 1jdz h LEU 234 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1jdz h LEU 234 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1jdz h LEU 234 CO -0.28 0.02 0.00 0.35 0.09 0.00 0.00 178.44 178.63 1jdz n THR 235 N -3.56 1.73 0.50 0.22 -2.24 -0.59 -4.99 114.28 105.35 1jdz n THR 235 Ca -0.03 -1.54 0.06 0.00 -2.27 0.00 0.00 64.05 60.27 1jdz n THR 235 Cb 0.12 0.06 0.05 0.00 -2.10 0.00 0.00 70.33 68.45 1jdz n THR 235 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96