#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jij s VAL 29 N 0.00 0.55 0.00 2.03 -7.23 -1.26 -4.02 120.40 110.47 2jij s VAL 29 Ca 0.00 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 2jij s VAL 29 Cb 0.00 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.59 2jij s VAL 29 CO 0.00 -0.25 0.00 0.61 -0.31 0.00 0.00 175.10 175.15 2jij n GLY 30 N -0.33 2.60 0.00 2.32 0.00 -1.26 -4.06 105.19 104.46 2jij n GLY 30 Ca -0.03 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2jij n GLY 30 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jij n PHE 31 N 13.49 0.00 -1.08 1.61 3.01 -1.26 -0.58 117.46 132.66 2jij n PHE 31 Ca 0.00 -0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.60 2jij n PHE 31 Cb 0.00 -0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.43 2jij n PHE 31 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jij n GLY 32 N -0.00 -2.05 3.68 1.37 0.00 -1.26 -4.78 105.19 102.16 2jij n GLY 32 Ca 0.00 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 2jij n GLY 32 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jij s GLU 33 N -2.35 4.21 0.28 1.61 8.01 -1.26 -5.14 118.70 124.06 2jij s GLU 33 Ca 0.00 2.26 -0.29 0.00 0.01 0.00 0.00 54.97 56.95 2jij s GLU 33 Cb 0.00 -3.65 -0.10 0.00 -4.31 0.00 0.00 34.13 26.07 2jij s GLU 33 CO 0.00 -0.73 1.28 -0.51 0.01 0.00 0.00 175.26 175.31 2jij s LEU 34 N 2.80 4.44 0.00 1.80 1.43 -1.26 -5.08 118.68 122.82 2jij s LEU 34 Ca 0.72 2.54 0.00 0.00 -1.03 0.00 0.00 54.13 56.37 2jij s LEU 34 Cb -0.38 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.21 2jij s LEU 34 CO 0.31 -0.47 0.00 1.21 0.23 0.00 0.00 176.35 177.63 2jij n GLU 37 N 1.42 0.00 -2.92 1.70 4.07 -1.26 -5.23 120.64 118.42 2jij n GLU 37 Ca 0.02 0.00 -0.40 0.00 -0.06 0.00 0.00 57.16 56.72 2jij n GLU 37 Cb 0.42 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.75 2jij n GLU 37 CO 0.00 0.00 0.00 -0.46 -0.06 0.00 0.00 177.13 176.61 2jij s TRP 38 N 0.00 3.77 -0.27 4.31 -0.00 -1.26 -4.99 118.94 120.49 2jij s TRP 38 Ca 0.00 1.56 0.22 0.00 -0.00 0.00 0.00 56.10 57.88 2jij s TRP 38 Cb 0.00 -2.87 0.50 0.00 -0.00 0.00 0.00 33.47 31.10 2jij s TRP 38 CO 0.00 0.28 1.07 0.54 -0.00 0.00 0.00 176.95 178.84 2jij n ARG 39 N 2.70 1.61 -0.24 5.86 1.74 -1.26 -5.04 116.66 122.02 2jij n ARG 39 Ca -0.02 -3.46 -0.01 0.00 -0.77 0.00 0.00 57.85 53.60 2jij n ARG 39 Cb 0.50 -1.53 0.01 0.00 -1.02 0.00 0.00 32.46 30.42 2jij n ARG 39 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jij n GLY 40 N -0.47 -0.67 3.73 -0.13 0.00 -1.26 -5.03 105.19 101.36 2jij n GLY 40 Ca 0.08 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 2jij n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jij s GLU 41 N -2.97 4.68 -0.19 1.61 2.12 -1.26 -4.94 118.70 117.74 2jij s GLU 41 Ca 0.03 1.47 -0.01 0.00 0.36 0.00 0.00 54.97 56.82 2jij s GLU 41 Cb -0.00 -3.38 0.01 0.00 0.26 0.00 0.00 34.13 31.02 2jij s GLU 41 CO 0.02 0.18 -0.13 0.08 -0.54 0.00 0.00 175.26 174.87 2jij s VAL 42 N 0.08 2.69 -0.25 3.70 1.01 -1.26 -1.37 120.40 125.00 2jij s VAL 42 Ca 0.48 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.65 2jij s VAL 42 Cb -0.24 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 2jij s VAL 42 CO 0.30 0.49 0.09 -0.69 0.00 0.00 0.00 175.10 175.29 2jij s VAL 43 N 1.30 4.48 -0.36 2.92 1.01 0.29 -4.98 120.40 125.05 2jij s VAL 43 Ca 0.04 -0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 2jij s VAL 43 Cb -0.14 -3.10 0.02 0.00 0.00 0.00 0.00 36.38 33.16 2jij s VAL 43 CO -0.07 0.33 1.07 -2.28 0.00 0.00 0.00 175.10 174.15 2jij s HIS 44 N 1.60 3.08 -0.12 5.22 5.65 -1.26 -0.54 115.29 128.92 2jij s HIS 44 Ca 0.06 1.06 0.13 0.00 0.25 0.00 0.00 55.06 56.56 2jij s HIS 44 Cb -0.15 -3.84 -0.24 0.00 -1.18 0.00 0.00 32.58 27.18 2jij s HIS 44 CO 0.05 -0.87 0.38 1.28 -0.65 0.00 0.00 174.74 174.92 2jij n LEU 45 N 7.06 0.75 -3.60 8.88 4.77 -0.26 -4.97 117.00 129.62 2jij n LEU 45 Ca 0.11 0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 56.23 2jij n LEU 45 Cb 0.48 0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.68 2jij n LEU 45 CO 0.62 0.48 0.82 -0.55 -1.33 0.00 0.00 177.39 177.43 2jij s SER 46 N -5.94 -0.34 -0.14 -1.43 0.15 -1.20 -4.98 113.70 99.82 2jij s SER 46 Ca -0.09 0.46 0.07 0.00 0.70 0.00 0.00 55.95 57.09 2jij s SER 46 Cb 0.07 0.39 -0.23 0.00 -1.71 0.00 0.00 66.02 64.54 2jij s SER 46 CO 0.81 -0.25 0.30 0.79 1.20 0.00 0.00 173.24 176.09 2jij n TRP 47 N 1.08 0.66 -3.73 3.44 7.02 -1.26 -2.33 117.44 122.32 2jij n TRP 47 Ca -0.10 0.19 -0.30 0.00 -1.02 0.00 0.00 57.50 56.28 2jij n TRP 47 Cb 0.57 -1.11 -0.15 0.00 -2.42 0.00 0.00 31.31 28.21 2jij n TRP 47 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2jij s SER 48 N -6.25 3.96 1.02 -0.99 0.15 -1.26 -2.80 113.70 107.53 2jij s SER 48 Ca -0.15 -1.58 -0.12 0.00 0.70 0.00 0.00 55.95 54.79 2jij s SER 48 Cb 0.07 -0.83 0.17 0.00 -1.71 0.00 0.00 66.02 63.72 2jij s SER 48 CO 0.78 -0.41 0.96 -0.81 1.20 0.00 0.00 173.24 174.95 2jij n PRO 49 N 4.88 -1.12 -3.05 5.44 -0.04 -1.26 -1.48 135.00 138.37 2jij n PRO 49 Ca -0.03 -1.48 -0.43 0.00 -0.04 0.00 0.00 63.50 61.52 2jij n PRO 49 Cb 0.42 -1.02 -0.06 0.00 -0.04 0.00 0.00 33.50 32.80 2jij n PRO 49 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2jij s ARG 50 N -5.10 3.27 0.00 0.54 3.52 -1.12 -4.52 118.95 115.54 2jij s ARG 50 Ca 0.55 -0.44 0.03 0.00 -0.13 0.00 0.00 55.73 55.74 2jij s ARG 50 Cb -0.02 -4.00 -0.01 0.00 -1.56 0.00 0.00 34.95 29.36 2jij s ARG 50 CO 0.39 -1.16 -0.10 0.00 -0.81 0.00 0.00 175.30 173.62 2jij s ALA 51 N 3.03 0.82 0.08 6.12 0.00 -0.99 -1.20 121.76 129.62 2jij s ALA 51 Ca 0.23 -0.50 0.08 0.00 0.00 0.00 0.00 51.96 51.77 2jij s ALA 51 Cb -0.15 -0.18 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 2jij s ALA 51 CO 0.18 0.18 -0.20 -0.06 0.00 0.00 0.00 175.76 175.86 2jij s PHE 52 N -0.40 1.75 -0.21 0.00 0.40 0.20 -1.10 117.98 118.61 2jij s PHE 52 Ca 0.02 -0.40 -0.09 0.00 -0.60 0.00 0.00 56.93 55.86 2jij s PHE 52 Cb -0.05 -0.99 -0.05 0.00 0.51 0.00 0.00 43.02 42.45 2jij s PHE 52 CO -0.00 0.16 0.12 -1.17 0.70 0.00 0.00 175.22 175.02 2jij s LEU 53 N -1.64 4.02 -0.47 -0.37 2.96 0.30 -0.96 118.68 122.52 2jij s LEU 53 Ca 0.06 0.12 -0.14 0.00 -0.22 0.00 0.00 54.13 53.96 2jij s LEU 53 Cb -0.10 -2.05 0.09 0.00 0.50 0.00 0.00 46.19 44.64 2jij s LEU 53 CO 0.03 0.13 0.38 -0.76 -1.32 0.00 0.00 176.35 174.81 2jij s LEU 54 N 0.68 5.65 0.21 -0.68 1.43 0.14 -0.55 118.68 125.56 2jij s LEU 54 Ca 0.06 -1.52 -0.31 0.00 -1.03 0.00 0.00 54.13 51.34 2jij s LEU 54 Cb -0.12 -2.13 -0.10 0.00 0.03 0.00 0.00 46.19 43.87 2jij s LEU 54 CO 0.01 -0.67 1.48 -0.54 0.23 0.00 0.00 176.35 176.86 2jij s LYS 55 N 1.56 4.25 -1.53 1.70 -0.14 -0.47 -1.52 119.74 123.58 2jij s LYS 55 Ca 0.04 2.31 -0.10 0.00 -1.36 0.00 0.00 55.97 56.86 2jij s LYS 55 Cb -0.25 -3.13 0.08 0.00 -1.68 0.00 0.00 37.83 32.84 2jij s LYS 55 CO 0.04 -0.49 0.75 0.09 -0.76 0.00 0.00 175.35 174.99 2jij n ASN 56 N 2.95 -2.82 -0.23 2.83 4.13 -1.24 -4.07 115.26 116.82 2jij n ASN 56 Ca 0.09 -0.91 -0.06 0.00 1.68 0.00 0.00 54.58 55.38 2jij n ASN 56 Cb 0.40 -3.35 0.04 0.00 -1.54 0.00 0.00 39.78 35.33 2jij n ASN 56 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 2jij h PHE 57 N -1.82 0.81 -2.98 3.10 3.57 -0.35 -3.43 116.94 115.84 2jij h PHE 57 Ca -0.60 0.02 -0.61 0.00 3.53 0.00 0.00 57.97 60.31 2jij h PHE 57 Cb 1.38 -0.27 -0.09 0.00 2.79 0.00 0.00 35.95 39.75 2jij h PHE 57 CO 0.56 0.51 -0.61 -0.51 -2.23 0.00 0.00 178.31 176.03 2jij s LEU 58 N -10.14 3.64 0.55 0.59 1.43 0.25 -5.05 118.68 109.95 2jij s LEU 58 Ca -0.13 -0.16 -0.16 0.00 -1.03 0.00 0.00 54.13 52.64 2jij s LEU 58 Cb 0.14 -2.30 -0.06 0.00 0.03 0.00 0.00 46.19 44.00 2jij s LEU 58 CO 0.76 0.12 1.02 -0.94 0.23 0.00 0.00 176.35 177.54 2jij s SER 59 N -2.75 6.27 0.24 2.29 1.04 -1.26 -4.50 113.70 115.03 2jij s SER 59 Ca 0.29 1.69 -0.04 0.00 0.48 0.00 0.00 55.95 58.36 2jij s SER 59 Cb -0.11 -2.52 0.44 0.00 0.10 0.00 0.00 66.02 63.93 2jij s SER 59 CO 0.21 -0.83 1.75 0.44 0.98 0.00 0.00 173.24 175.79 2jij h ASP 60 N 0.75 0.36 -0.55 7.02 3.32 -1.96 -1.47 116.42 123.89 2jij h ASP 60 Ca -0.47 0.09 0.06 0.00 0.02 0.00 0.00 57.03 56.73 2jij h ASP 60 Cb 1.20 0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.75 2jij h ASP 60 CO 0.60 0.16 0.27 -0.33 -1.72 0.00 0.00 179.24 178.22 2jij h GLU 61 N 0.51 0.49 -0.68 3.56 3.07 -1.99 -1.31 114.58 118.24 2jij h GLU 61 Ca 0.40 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 59.22 2jij h GLU 61 Cb 0.56 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 28.33 2jij h GLU 61 CO -0.36 0.32 0.37 0.93 -1.40 0.00 0.00 179.01 178.87 2jij h GLU 62 N 0.51 0.95 -0.21 2.33 5.08 -1.74 0.24 114.58 121.74 2jij h GLU 62 Ca 0.25 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 2jij h GLU 62 Cb 0.19 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2jij h GLU 62 CO -0.19 0.72 0.10 0.00 -1.00 0.00 0.00 179.01 178.64 2jij h ASP 64 N 0.21 0.38 -0.46 0.00 3.32 -1.13 -2.18 116.42 116.56 2jij h ASP 64 Ca 0.07 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.20 2jij h ASP 64 Cb 0.11 -0.08 -0.07 0.00 0.22 0.00 0.00 39.33 39.51 2jij h ASP 64 CO -0.01 0.27 0.05 0.22 -1.72 0.00 0.00 179.24 178.05 2jij h TYR 65 N 0.47 0.06 -0.19 4.55 3.20 -0.18 -0.73 116.97 124.15 2jij h TYR 65 Ca 0.15 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 2jij h TYR 65 Cb -0.01 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 2jij h TYR 65 CO -0.07 -0.05 0.08 0.82 -1.64 0.00 0.00 178.16 177.30 2jij h ILE 66 N 0.17 1.16 -0.22 1.81 2.04 -1.09 -0.51 117.51 120.85 2jij h ILE 66 Ca 0.23 -0.47 0.03 0.00 1.00 0.00 0.00 64.86 65.65 2jij h ILE 66 Cb 0.32 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.49 2jij h ILE 66 CO -0.34 0.15 0.04 0.58 0.00 0.00 0.00 178.15 178.58 2jij h VAL 67 N 0.16 0.89 -0.97 1.67 2.07 -1.02 0.26 116.25 119.31 2jij h VAL 67 Ca 0.06 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.54 2jij h VAL 67 Cb 0.17 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 2jij h VAL 67 CO -0.01 0.02 0.61 -0.33 0.02 0.00 0.00 177.57 177.89 2jij h GLU 68 N 0.13 1.31 -0.22 1.57 4.39 -0.95 0.01 114.58 120.81 2jij h GLU 68 Ca 0.10 -0.10 -0.17 0.00 0.34 0.00 0.00 59.36 59.53 2jij h GLU 68 Cb 0.10 -0.28 -0.00 0.00 -0.10 0.00 0.00 28.75 28.46 2jij h GLU 68 CO -0.14 0.89 -0.53 0.87 -1.16 0.00 0.00 179.01 178.94 2jij h LYS 69 N 1.33 0.65 -0.21 2.33 1.79 -0.82 -3.24 116.57 118.41 2jij h LYS 69 Ca 0.35 -0.40 -0.13 0.00 -2.18 0.00 0.00 60.65 58.29 2jij h LYS 69 Cb -0.10 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.58 2jij h LYS 69 CO -0.07 1.02 -0.40 0.00 -1.08 0.00 0.00 179.45 178.92 2jij h ALA 70 N 0.90 0.92 -0.22 3.86 0.00 0.13 -3.38 119.26 121.46 2jij h ALA 70 Ca 0.01 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.50 2jij h ALA 70 Cb 1.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 2jij h ALA 70 CO 0.11 0.63 0.12 -0.09 0.00 0.00 0.00 179.25 180.02 2jij h ARG 71 N 0.40 0.25 0.00 0.00 2.43 -1.03 -0.14 114.38 116.29 2jij h ARG 71 Ca 0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2jij h ARG 71 Cb 0.87 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 2jij h ARG 71 CO 0.07 0.16 0.00 -0.35 -1.51 0.00 0.00 179.97 178.35 2jij n PRO 72 N -4.98 0.09 0.00 0.20 -0.04 -1.26 -2.09 135.00 126.93 2jij n PRO 72 Ca -0.03 0.20 0.10 0.00 -0.04 0.00 0.00 63.50 63.73 2jij n PRO 72 Cb 0.05 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.03 2jij n PRO 72 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2jij n LYS 73 N -1.41 1.58 -1.91 0.54 5.02 -0.12 -5.00 118.16 116.85 2jij n LYS 73 Ca 0.05 -1.17 -0.42 0.00 -2.02 0.00 0.00 58.31 54.76 2jij n LYS 73 Cb 0.16 -1.38 -0.02 0.00 -0.02 0.00 0.00 35.03 33.77 2jij n LYS 73 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2jij s MET 74 N -2.02 4.20 -0.02 1.97 -1.94 -0.84 -4.75 119.30 115.90 2jij s MET 74 Ca 0.18 2.42 0.06 0.00 -1.71 0.00 0.00 55.69 56.64 2jij s MET 74 Cb 0.16 -3.08 -0.01 0.00 2.01 0.00 0.00 34.83 33.90 2jij s MET 74 CO 0.41 -0.53 -0.20 0.14 -0.01 0.00 0.00 175.02 174.83 2jij s VAL 75 N 0.20 1.58 -0.03 -6.03 -7.23 -1.09 -4.98 120.40 102.82 2jij s VAL 75 Ca 0.63 -0.84 -0.30 0.00 -1.81 0.00 0.00 61.98 59.65 2jij s VAL 75 Cb -0.44 -1.32 -0.05 0.00 0.56 0.00 0.00 36.38 35.13 2jij s VAL 75 CO 0.43 0.45 1.34 -0.54 -0.31 0.00 0.00 175.10 176.47 2jij s LYS 76 N -0.39 4.30 0.00 4.82 3.01 -1.26 -1.94 119.74 128.27 2jij s LYS 76 Ca 0.06 1.87 0.00 0.00 -1.01 0.00 0.00 55.97 56.89 2jij s LYS 76 Cb -0.08 -3.59 0.00 0.00 -1.01 0.00 0.00 37.83 33.14 2jij s LYS 76 CO -0.00 -0.56 0.00 -1.13 0.51 0.00 0.00 175.35 174.17 2jij n SER 77 N 5.45 2.41 -0.34 2.83 3.41 -1.26 -4.97 113.62 121.15 2jij n SER 77 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 2jij n SER 77 Cb 0.44 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2jij n SER 77 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2jij n SER 95 N -1.69 0.00 -4.48 4.04 3.41 -1.26 -5.13 113.62 108.51 2jij n SER 95 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.31 2jij n SER 95 Cb 0.27 -0.51 -0.12 0.00 -0.26 0.00 0.00 64.21 63.59 2jij n SER 95 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2jij s THR 96 N -1.23 2.89 0.25 6.66 -4.23 -0.81 -4.98 115.64 114.21 2jij s THR 96 Ca 0.00 -1.26 0.01 0.00 -1.18 0.00 0.00 61.69 59.27 2jij s THR 96 Cb 0.00 -2.26 -0.04 0.00 1.34 0.00 0.00 72.50 71.54 2jij s THR 96 CO 0.00 0.26 0.14 -0.83 -0.54 0.00 0.00 174.62 173.65 2jij s GLY 97 N -1.69 1.76 0.29 3.99 0.00 -0.82 -1.09 107.32 109.76 2jij s GLY 97 Ca 0.16 -1.79 -0.16 0.00 0.00 0.00 0.00 44.72 42.93 2jij s GLY 97 CO 0.07 -1.50 0.63 -1.08 0.00 0.00 0.00 173.10 171.23 2jij s THR 98 N -3.86 0.00 0.08 0.90 -1.32 0.07 -2.66 115.64 108.86 2jij s THR 98 Ca 0.38 -1.18 0.08 0.00 -1.21 0.00 0.00 61.69 59.76 2jij s THR 98 Cb 0.06 -2.24 -0.03 0.00 -1.51 0.00 0.00 72.50 68.78 2jij s THR 98 CO 0.15 0.00 -0.21 0.26 -2.21 0.00 0.00 174.62 172.61 2jij s TRP 99 N -3.65 1.84 -0.18 9.09 0.52 -1.26 0.06 118.94 125.35 2jij s TRP 99 Ca 0.17 -0.40 -0.03 0.00 0.02 0.00 0.00 56.10 55.86 2jij s TRP 99 Cb -0.04 -1.05 -0.02 0.00 -1.15 0.00 0.00 33.47 31.22 2jij s TRP 99 CO 0.09 0.16 -0.06 -0.06 0.02 0.00 0.00 176.95 177.11 2jij s PHE 100 N -0.99 2.95 0.28 -1.98 0.08 0.11 -4.98 117.98 113.45 2jij s PHE 100 Ca 0.07 -0.69 -0.30 0.00 0.12 0.00 0.00 56.93 56.14 2jij s PHE 100 Cb -0.09 -2.01 -0.13 0.00 -0.57 0.00 0.00 43.02 40.21 2jij s PHE 100 CO 0.03 -0.34 1.32 0.00 -0.10 0.00 0.00 175.22 176.13 2jij n ALA 101 N 4.20 1.01 -1.69 5.36 0.00 -1.26 -0.81 120.51 127.32 2jij n ALA 101 Ca -0.18 0.39 -0.56 0.00 0.00 0.00 0.00 53.44 53.09 2jij n ALA 101 Cb 0.52 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.66 2jij n ALA 101 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2jij n LYS 102 N 1.32 1.16 -1.00 0.00 4.81 -1.26 -1.05 118.16 122.14 2jij n LYS 102 Ca 0.09 0.43 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 2jij n LYS 102 Cb 0.33 -2.10 0.00 0.00 0.02 0.00 0.00 35.03 33.28 2jij n LYS 102 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jij n GLY 103 N 3.86 0.78 0.30 3.14 0.00 -1.26 -4.92 105.19 107.10 2jij n GLY 103 Ca 0.25 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.44 2jij n GLY 103 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2jij h GLU 104 N 2.14 0.00 -2.97 1.61 4.81 -1.44 -3.44 114.58 115.29 2jij h GLU 104 Ca 0.00 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.04 2jij h GLU 104 Cb 0.00 0.00 -0.30 0.00 0.63 0.00 0.00 28.75 29.08 2jij h GLU 104 CO 0.00 0.03 -0.48 0.34 -0.73 0.00 0.00 179.01 178.17 2jij s ASP 105 N -5.83 -0.18 0.15 1.04 -1.08 -1.26 -5.06 116.67 104.45 2jij s ASP 105 Ca -0.04 0.56 -0.12 0.00 -0.52 0.00 0.00 52.55 52.43 2jij s ASP 105 Cb 0.14 0.48 0.00 0.00 -1.46 0.00 0.00 42.92 42.08 2jij s ASP 105 CO 0.51 -0.18 1.56 0.77 0.52 0.00 0.00 175.17 178.35 2jij h SER 106 N 7.38 0.93 0.20 -0.34 4.64 -1.99 0.17 113.55 124.53 2jij h SER 106 Ca -0.36 -0.36 0.01 0.00 -0.47 0.00 0.00 61.79 60.61 2jij h SER 106 Cb 1.15 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 62.95 2jij h SER 106 CO 0.33 1.08 -0.40 0.58 -0.87 0.00 0.00 176.83 177.55 2jij h VAL 107 N 0.76 0.19 -0.55 0.95 2.07 -1.99 -2.73 116.25 114.95 2jij h VAL 107 Ca 0.12 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 2jij h VAL 107 Cb 0.68 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2jij h VAL 107 CO 0.05 0.00 0.31 0.40 0.02 0.00 0.00 177.57 178.35 2jij h ILE 108 N -0.68 1.17 -0.29 4.57 2.04 -1.94 -2.65 117.51 119.73 2jij h ILE 108 Ca 0.01 -0.40 0.03 0.00 1.00 0.00 0.00 64.86 65.49 2jij h ILE 108 Cb 0.68 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 2jij h ILE 108 CO -0.19 0.18 0.19 0.28 0.00 0.00 0.00 178.15 178.62 2jij h SER 109 N 0.76 0.24 -0.42 1.72 0.02 -0.42 0.27 113.55 115.73 2jij h SER 109 Ca 0.20 -0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.07 2jij h SER 109 Cb 0.01 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 2jij h SER 109 CO -0.03 0.17 -0.02 0.50 -1.14 0.00 0.00 176.83 176.31 2jij h LYS 110 N 0.28 0.75 -0.27 3.45 3.64 -1.18 0.40 116.57 123.65 2jij h LYS 110 Ca 0.12 -0.25 -0.08 0.00 -1.27 0.00 0.00 60.65 59.17 2jij h LYS 110 Cb 0.12 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2jij h LYS 110 CO -0.02 0.83 -0.17 0.82 -2.27 0.00 0.00 179.45 178.64 2jij h ILE 111 N 0.58 1.24 -0.50 2.00 2.04 -1.24 -1.47 117.51 120.17 2jij h ILE 111 Ca 0.12 -1.11 -0.05 0.00 1.00 0.00 0.00 64.86 64.81 2jij h ILE 111 Cb 0.51 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 2jij h ILE 111 CO 0.02 0.36 0.09 -0.33 0.00 0.00 0.00 178.15 178.30 2jij h GLU 112 N 0.44 0.81 -0.78 2.37 5.08 0.47 -0.13 114.58 122.85 2jij h GLU 112 Ca 0.08 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.21 2jij h GLU 112 Cb 0.56 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 2jij h GLU 112 CO 0.04 0.80 0.41 0.87 -1.00 0.00 0.00 179.01 180.13 2jij h LYS 113 N 0.69 1.09 -0.20 2.33 1.57 -0.78 -1.65 116.57 119.61 2jij h LYS 113 Ca 0.15 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2jij h LYS 113 Cb 0.37 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 2jij h LYS 113 CO 0.01 0.81 0.10 -0.09 -0.57 0.00 0.00 179.45 179.71 2jij h ARG 114 N 1.09 0.21 -0.94 3.15 2.43 -0.52 -1.89 114.38 117.91 2jij h ARG 114 Ca 0.27 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 2jij h ARG 114 Cb 0.05 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 2jij h ARG 114 CO -0.04 0.14 0.56 0.28 -1.51 0.00 0.00 179.97 179.39 2jij h VAL 115 N 0.21 1.26 -0.50 0.20 2.07 -0.66 -1.11 116.25 117.73 2jij h VAL 115 Ca 0.08 -0.58 -0.05 0.00 0.82 0.00 0.00 66.70 66.98 2jij h VAL 115 Cb 0.02 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.70 2jij h VAL 115 CO -0.06 0.28 0.12 0.00 0.02 0.00 0.00 177.57 177.93 2jij h ALA 116 N 1.31 1.28 0.20 1.67 0.00 -0.72 -1.70 119.26 121.30 2jij h ALA 116 Ca 0.34 -0.19 -0.31 0.00 0.00 0.00 0.00 54.91 54.75 2jij h ALA 116 Cb -0.04 -0.20 0.03 0.00 0.00 0.00 0.00 17.79 17.57 2jij h ALA 116 CO -0.06 0.51 -1.37 1.96 0.00 0.00 0.00 179.25 180.28 2jij h GLN 117 N 0.73 0.45 -0.23 0.00 4.20 -0.90 -1.21 115.11 118.15 2jij h GLN 117 Ca 0.16 -0.75 -0.07 0.00 0.06 0.00 0.00 58.65 58.05 2jij h GLN 117 Cb 0.27 0.28 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 2jij h GLN 117 CO -0.00 1.36 -0.14 -0.24 -0.67 0.00 0.00 178.83 179.13 2jij h VAL 118 N 0.13 1.31 0.00 -0.54 3.04 -1.06 -3.12 116.25 116.02 2jij h VAL 118 Ca -0.21 -1.24 0.00 0.00 -1.01 0.00 0.00 66.70 64.24 2jij h VAL 118 Cb 2.07 1.62 0.00 0.00 -2.01 0.00 0.00 31.29 32.98 2jij h VAL 118 CO 0.25 0.38 0.00 0.71 -1.01 0.00 0.00 177.57 177.90 2jij h THR 119 N 0.20 0.00 -3.57 3.17 1.35 -1.36 -3.47 112.91 109.23 2jij h THR 119 Ca 0.05 -0.42 -0.41 0.00 -0.55 0.00 0.00 66.41 65.08 2jij h THR 119 Cb 0.65 1.33 0.01 0.00 -1.73 0.00 0.00 68.15 68.41 2jij h THR 119 CO 0.04 0.00 -0.56 0.23 -0.25 0.00 0.00 175.52 174.98 2jij n MET 120 N -2.30 -2.89 -5.07 4.72 0.00 -0.51 -5.01 117.12 106.05 2jij n MET 120 Ca 0.04 0.97 -0.32 0.00 0.00 0.00 0.00 57.70 58.39 2jij n MET 120 Cb 0.37 -5.71 -0.17 0.00 0.00 0.00 0.00 33.22 27.71 2jij n MET 120 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 2jij s ILE 121 N -3.09 2.06 0.69 2.02 1.01 -0.91 -5.02 121.20 117.96 2jij s ILE 121 Ca 0.11 -1.01 -0.17 0.00 0.00 0.00 0.00 60.65 59.59 2jij s ILE 121 Cb -0.05 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.63 2jij s ILE 121 CO 0.14 0.56 1.08 -2.65 0.00 0.00 0.00 174.94 174.07 2jij n PRO 122 N 3.67 0.69 0.28 2.79 -0.02 -1.26 -4.61 135.00 136.53 2jij n PRO 122 Ca -0.19 0.29 0.15 0.00 -2.02 0.00 0.00 63.50 61.73 2jij n PRO 122 Cb 0.53 -2.32 0.83 0.00 -0.02 0.00 0.00 33.50 32.52 2jij n PRO 122 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2jij h LEU 123 N -0.01 0.00 -1.04 2.45 3.38 -1.12 -1.84 115.31 117.13 2jij h LEU 123 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2jij h LEU 123 Cb 1.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.09 2jij h LEU 123 CO 0.49 0.07 0.00 -1.84 0.09 0.00 0.00 178.44 177.25 2jij n GLU 124 N -3.59 0.17 0.00 1.13 0.00 -1.26 -1.34 120.64 115.75 2jij n GLU 124 Ca -0.02 0.53 0.12 0.00 0.00 0.00 0.00 57.16 57.79 2jij n GLU 124 Cb 0.18 -1.91 0.27 0.00 0.00 0.00 0.00 31.44 29.98 2jij n GLU 124 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2jij n ASN 125 N -2.24 1.27 -4.88 -1.84 4.13 -0.69 -1.07 115.26 109.94 2jij n ASN 125 Ca 0.00 -1.04 -0.34 0.00 1.68 0.00 0.00 54.58 54.88 2jij n ASN 125 Cb 0.13 0.24 -0.05 0.00 -1.54 0.00 0.00 39.78 38.56 2jij n ASN 125 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 2jij s HIS 126 N -2.52 3.57 0.82 3.10 3.76 -0.45 -0.25 115.29 123.33 2jij s HIS 126 Ca 0.22 0.62 -0.09 0.00 -0.15 0.00 0.00 55.06 55.66 2jij s HIS 126 Cb 0.19 -2.03 0.14 0.00 1.11 0.00 0.00 32.58 31.99 2jij s HIS 126 CO 0.54 0.58 1.14 -1.21 -0.85 0.00 0.00 174.74 174.94 2jij s GLU 127 N -1.87 1.37 0.00 1.40 2.02 -0.74 -4.94 118.70 115.94 2jij s GLU 127 Ca 0.30 -0.59 0.00 0.00 0.02 0.00 0.00 54.97 54.69 2jij s GLU 127 Cb -0.13 -2.08 0.00 0.00 0.10 0.00 0.00 34.13 32.02 2jij s GLU 127 CO 0.17 -1.81 0.00 0.41 0.02 0.00 0.00 175.26 174.05 2jij n GLY 128 N -3.26 -2.61 3.35 -1.39 0.00 -1.26 -4.70 105.19 95.32 2jij n GLY 128 Ca 0.13 -1.32 -0.34 0.00 0.00 0.00 0.00 46.02 44.50 2jij n GLY 128 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jij s LEU 129 N 0.00 2.83 -0.17 0.99 2.96 0.01 -4.55 118.68 120.75 2jij s LEU 129 Ca 0.00 -0.34 -0.10 0.00 -0.22 0.00 0.00 54.13 53.46 2jij s LEU 129 Cb 0.00 -1.68 -0.05 0.00 0.50 0.00 0.00 46.19 44.96 2jij s LEU 129 CO 0.00 0.08 0.18 -1.58 -1.32 0.00 0.00 176.35 173.71 2jij s GLN 130 N 0.88 4.06 -0.14 1.98 0.74 -0.83 0.07 119.66 126.42 2jij s GLN 130 Ca -0.02 -0.11 0.01 0.00 0.05 0.00 0.00 55.36 55.28 2jij s GLN 130 Cb -0.15 -3.37 -0.00 0.00 1.10 0.00 0.00 33.01 30.59 2jij s GLN 130 CO 0.01 0.39 -0.16 0.08 -0.55 0.00 0.00 175.29 175.05 2jij s VAL 131 N 0.08 2.65 0.07 1.34 1.01 0.11 -0.33 120.40 125.34 2jij s VAL 131 Ca 0.12 -0.78 0.09 0.00 0.00 0.00 0.00 61.98 61.40 2jij s VAL 131 Cb -0.12 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 2jij s VAL 131 CO 0.01 0.52 -0.22 -0.76 0.00 0.00 0.00 175.10 174.66 2jij s LEU 132 N 0.67 2.48 -0.07 3.92 1.43 0.30 -0.75 118.68 126.65 2jij s LEU 132 Ca -0.08 -0.55 0.02 0.00 -1.03 0.00 0.00 54.13 52.49 2jij s LEU 132 Cb -0.16 -1.42 0.01 0.00 0.03 0.00 0.00 46.19 44.66 2jij s LEU 132 CO 0.02 0.23 -0.13 -2.28 0.23 0.00 0.00 176.35 174.41 2jij s HIS 133 N -0.97 1.62 0.00 0.29 5.65 -0.25 -0.91 115.29 120.72 2jij s HIS 133 Ca 0.15 -0.63 0.00 0.00 0.25 0.00 0.00 55.06 54.82 2jij s HIS 133 Cb -0.10 -1.18 0.00 0.00 -1.18 0.00 0.00 32.58 30.12 2jij s HIS 133 CO 0.06 -0.32 0.00 0.66 -0.65 0.00 0.00 174.74 174.49 2jij n TYR 134 N 3.87 -0.57 0.00 3.88 4.01 0.10 -1.92 117.16 126.53 2jij n TYR 134 Ca -0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.52 2jij n TYR 134 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 2jij n TYR 134 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 2jij n TYR 140 N -0.19 0.00 -1.66 -0.72 9.36 -1.01 -2.62 117.16 120.32 2jij n TYR 140 Ca 0.00 0.00 -0.37 0.00 3.32 0.00 0.00 57.90 60.85 2jij n TYR 140 Cb 0.00 0.00 0.08 0.00 -0.63 0.00 0.00 39.34 38.79 2jij n TYR 140 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 2jij n GLU 141 N 0.00 1.01 -1.67 2.98 1.02 -1.26 -0.41 120.64 122.30 2jij n GLU 141 Ca 0.00 0.40 -0.57 0.00 -0.02 0.00 0.00 57.16 56.98 2jij n GLU 141 Cb 0.00 -2.52 -0.07 0.00 -0.02 0.00 0.00 31.44 28.83 2jij n GLU 141 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2jij n PRO 142 N -2.06 1.04 -3.89 3.49 -0.02 -1.26 -4.57 135.00 127.73 2jij n PRO 142 Ca 0.16 0.38 -0.09 0.00 -2.02 0.00 0.00 63.50 61.92 2jij n PRO 142 Cb 0.48 -2.03 -0.06 0.00 -0.02 0.00 0.00 33.50 31.87 2jij n PRO 142 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2jij s HIS 143 N 2.56 0.23 0.39 6.00 -3.43 -0.10 -4.87 115.29 116.07 2jij s HIS 143 Ca 0.95 -0.58 0.00 0.00 -0.80 0.00 0.00 55.06 54.63 2jij s HIS 143 Cb -1.07 0.11 -0.02 0.00 -1.43 0.00 0.00 32.58 30.17 2jij s HIS 143 CO 0.61 -0.81 0.61 0.71 -2.00 0.00 0.00 174.74 173.86 2jij s TYR 144 N -3.94 3.39 -0.12 0.38 1.51 -1.26 0.24 117.35 117.55 2jij s TYR 144 Ca 0.15 0.32 0.20 0.00 -1.01 0.00 0.00 57.07 56.73 2jij s TYR 144 Cb 0.02 -2.08 -0.25 0.00 -0.11 0.00 0.00 41.96 39.54 2jij s TYR 144 CO -0.00 -0.09 0.44 -0.25 -1.11 0.00 0.00 175.55 174.55 2jij n ASP 145 N -1.92 0.22 -4.84 2.29 9.92 -1.26 -4.94 116.55 116.01 2jij n ASP 145 Ca -0.02 0.09 -0.33 0.00 -0.53 0.00 0.00 54.79 54.01 2jij n ASP 145 Cb 0.57 1.22 -0.06 0.00 -0.64 0.00 0.00 41.12 42.20 2jij n ASP 145 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 2jij s TYR 146 N -3.05 3.37 -0.19 1.24 1.13 -1.26 -4.82 117.35 113.77 2jij s TYR 146 Ca -0.07 1.29 -0.29 0.00 -1.41 0.00 0.00 57.07 56.59 2jij s TYR 146 Cb 0.10 -2.59 -0.06 0.00 -1.10 0.00 0.00 41.96 38.31 2jij s TYR 146 CO 0.86 0.07 2.18 1.19 -2.51 0.00 0.00 175.55 177.34 2jij n PHE 147 N -0.37 2.03 -0.24 -3.49 3.72 -1.26 -4.82 117.46 113.02 2jij n PHE 147 Ca 0.04 -0.14 0.22 0.00 -0.05 0.00 0.00 57.45 57.52 2jij n PHE 147 Cb 0.53 -2.73 0.38 0.00 -0.94 0.00 0.00 39.48 36.72 2jij n PHE 147 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 2jij n HIS 148 N 10.95 0.53 -3.87 1.38 -0.00 -1.26 -3.16 115.22 119.79 2jij n HIS 148 Ca 0.29 0.53 -0.36 0.00 -0.00 0.00 0.00 57.72 58.18 2jij n HIS 148 Cb 0.43 -0.94 -0.13 0.00 -0.00 0.00 0.00 29.99 29.34 2jij n HIS 148 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2jij s ASP 149 N -4.53 4.69 0.37 0.26 -1.08 -1.26 -5.03 116.67 110.08 2jij s ASP 149 Ca -0.05 -0.77 0.27 0.00 -0.52 0.00 0.00 52.55 51.48 2jij s ASP 149 Cb 0.19 -1.77 1.16 0.00 -1.46 0.00 0.00 42.92 41.04 2jij s ASP 149 CO 0.47 -0.15 1.82 1.55 0.52 0.00 0.00 175.17 179.38 2jij h PRO 150 N 8.12 0.00 0.00 4.34 0.13 -1.97 -2.55 132.00 140.07 2jij h PRO 150 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2jij h PRO 150 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2jij h PRO 150 CO 0.59 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.69 2jij n VAL 151 N -2.53 0.00 0.86 1.56 0.24 -1.26 -3.01 118.33 114.19 2jij n VAL 151 Ca 0.01 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.43 2jij n VAL 151 Cb 0.24 -0.58 0.10 0.00 -1.47 0.00 0.00 33.84 32.12 2jij n VAL 151 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2jij n ASN 152 N -0.94 0.65 -4.52 -1.34 3.02 -0.96 -4.72 115.26 106.45 2jij n ASN 152 Ca 0.15 -0.39 -0.41 0.00 -0.03 0.00 0.00 54.58 53.90 2jij n ASN 152 Cb 0.07 0.57 -0.10 0.00 -0.61 0.00 0.00 39.78 39.71 2jij n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jij s ALA 153 N -3.06 3.49 0.55 5.41 0.00 -1.16 -5.08 121.76 121.91 2jij s ALA 153 Ca 0.08 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.72 2jij s ALA 153 Cb 0.16 -2.83 0.09 0.00 0.00 0.00 0.00 23.12 20.54 2jij s ALA 153 CO 0.77 -1.16 0.62 0.41 0.00 0.00 0.00 175.76 176.40 2jij n GLY 154 N 5.03 1.01 0.36 0.00 0.00 -1.26 -4.58 105.19 105.75 2jij n GLY 154 Ca -0.10 -2.05 -0.02 0.00 0.00 0.00 0.00 46.02 43.85 2jij n GLY 154 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2jij h PRO 155 N 0.00 1.17 0.00 1.61 0.11 -1.95 -0.62 132.00 132.32 2jij h PRO 155 Ca -0.21 -0.11 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 2jij h PRO 155 Cb 0.80 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 2jij h PRO 155 CO 0.24 0.82 -0.29 0.93 -0.21 0.00 0.00 178.00 179.49 2jij h GLU 156 N 1.19 0.00 -0.00 1.05 3.07 -1.88 -0.07 114.58 117.93 2jij h GLU 156 Ca 0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 2jij h GLU 156 Cb -0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.87 2jij h GLU 156 CO -0.06 0.29 -0.14 0.72 -1.40 0.00 0.00 179.01 178.42 2jij n HIS 157 N -3.52 0.00 -1.35 4.33 8.25 -1.08 0.52 115.22 122.36 2jij n HIS 157 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2jij n HIS 157 Cb 0.44 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.33 2jij n HIS 157 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jij n GLY 158 N 1.32 0.72 7.00 -1.41 0.00 -0.04 -4.59 105.19 108.20 2jij n GLY 158 Ca 0.13 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2jij n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jij n GLY 159 N -1.36 0.39 3.68 -0.02 0.00 -0.26 -1.47 105.19 106.15 2jij n GLY 159 Ca 0.00 -0.91 -0.37 0.00 0.00 0.00 0.00 46.02 44.75 2jij n GLY 159 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jij n GLN 160 N -0.33 0.92 -2.22 1.61 1.13 -1.26 -4.61 117.38 112.62 2jij n GLN 160 Ca 0.00 0.37 -0.41 0.00 -1.94 0.00 0.00 57.00 55.01 2jij n GLN 160 Cb 0.00 -2.38 -0.03 0.00 0.11 0.00 0.00 30.24 27.94 2jij n GLN 160 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2jij s ARG 161 N -3.22 4.38 -0.09 -1.09 0.52 -1.26 -1.73 118.95 116.45 2jij s ARG 161 Ca 0.79 2.05 -0.01 0.00 -0.52 0.00 0.00 55.73 58.04 2jij s ARG 161 Cb -0.38 -3.21 -0.05 0.00 0.52 0.00 0.00 34.95 31.83 2jij s ARG 161 CO 0.44 -0.28 -0.10 1.55 0.02 0.00 0.00 175.30 176.93 2jij n VAL 162 N 2.89 0.53 -5.24 3.52 3.14 0.75 -4.36 118.33 119.56 2jij n VAL 162 Ca 0.07 -0.18 -0.30 0.00 -2.96 0.00 0.00 64.34 60.97 2jij n VAL 162 Cb 0.43 -1.12 -0.16 0.00 -1.06 0.00 0.00 33.84 31.92 2jij n VAL 162 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2jij s VAL 163 N -2.18 1.97 -0.14 1.55 1.01 -0.93 -0.63 120.40 121.05 2jij s VAL 163 Ca -0.13 -1.05 -0.00 0.00 0.00 0.00 0.00 61.98 60.80 2jij s VAL 163 Cb 0.04 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.76 2jij s VAL 163 CO 0.20 0.56 -0.13 -0.89 0.00 0.00 0.00 175.10 174.83 2jij s THR 164 N -0.44 3.02 -0.27 3.92 2.01 -0.25 -1.21 115.64 122.41 2jij s THR 164 Ca 0.05 -0.67 -0.03 0.00 0.31 0.00 0.00 61.69 61.35 2jij s THR 164 Cb -0.11 -2.28 0.02 0.00 0.01 0.00 0.00 72.50 70.15 2jij s THR 164 CO 0.00 0.52 -0.00 -0.32 -0.69 0.00 0.00 174.62 174.13 2jij s MET 165 N 0.47 2.84 -0.30 4.92 -2.45 0.41 -1.20 119.30 124.00 2jij s MET 165 Ca -0.09 -0.99 -0.10 0.00 -1.25 0.00 0.00 55.69 53.25 2jij s MET 165 Cb -0.16 -3.16 -0.02 0.00 1.25 0.00 0.00 34.83 32.74 2jij s MET 165 CO 0.04 -0.46 0.17 -0.51 1.05 0.00 0.00 175.02 175.32 2jij s LEU 166 N 1.37 4.10 -0.33 4.11 1.43 0.38 -0.57 118.68 129.17 2jij s LEU 166 Ca -0.00 -0.32 -0.10 0.00 -1.03 0.00 0.00 54.13 52.67 2jij s LEU 166 Cb -0.17 -2.05 0.00 0.00 0.03 0.00 0.00 46.19 43.99 2jij s LEU 166 CO -0.01 -0.15 0.18 -0.04 0.23 0.00 0.00 176.35 176.56 2jij s MET 167 N 1.68 3.22 -0.27 1.70 -1.94 0.14 0.82 119.30 124.65 2jij s MET 167 Ca 0.06 -0.81 -0.28 0.00 -1.71 0.00 0.00 55.69 52.95 2jij s MET 167 Cb -0.17 -3.64 0.01 0.00 2.01 0.00 0.00 34.83 33.05 2jij s MET 167 CO 0.08 -0.49 1.00 0.71 -0.01 0.00 0.00 175.02 176.31 2jij s TYR 168 N 1.61 3.26 -0.57 -0.03 2.02 -0.76 -0.73 117.35 122.15 2jij s TYR 168 Ca 0.04 1.26 0.23 0.00 -0.37 0.00 0.00 57.07 58.24 2jij s TYR 168 Cb -0.18 -3.38 0.10 0.00 -0.40 0.00 0.00 41.96 38.10 2jij s TYR 168 CO 0.07 -0.58 1.08 1.28 -1.57 0.00 0.00 175.55 175.83 2jij n LEU 169 N 6.46 0.63 -4.13 -1.29 4.77 0.43 -1.22 117.00 122.64 2jij n LEU 169 Ca 0.10 0.07 -0.10 0.00 -0.03 0.00 0.00 56.01 56.05 2jij n LEU 169 Cb 0.47 -0.11 -0.10 0.00 -2.33 0.00 0.00 43.42 41.34 2jij n LEU 169 CO 0.54 -0.00 -0.38 0.42 -1.33 0.00 0.00 177.39 176.63 2jij s THR 170 N -3.22 0.59 0.04 -5.08 -4.23 -1.21 -4.63 115.64 97.90 2jij s THR 170 Ca 0.03 -1.73 -0.22 0.00 -1.18 0.00 0.00 61.69 58.59 2jij s THR 170 Cb 0.14 -1.43 -0.06 0.00 1.34 0.00 0.00 72.50 72.49 2jij s THR 170 CO 0.78 -0.79 0.67 -0.89 -0.54 0.00 0.00 174.62 173.86 2jij s THR 171 N -3.19 4.76 -0.19 3.99 2.01 -1.26 -3.56 115.64 118.19 2jij s THR 171 Ca 0.06 1.43 -0.01 0.00 0.31 0.00 0.00 61.69 63.48 2jij s THR 171 Cb 0.02 -4.02 0.00 0.00 0.01 0.00 0.00 72.50 68.52 2jij s THR 171 CO -0.04 0.43 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.50 2jij s VAL 172 N -0.35 2.80 0.03 3.82 1.01 -0.33 -4.69 120.40 122.68 2jij s VAL 172 Ca 0.34 -0.70 -0.28 0.00 0.00 0.00 0.00 61.98 61.34 2jij s VAL 172 Cb -0.20 -2.23 -0.17 0.00 0.00 0.00 0.00 36.38 33.79 2jij s VAL 172 CO 0.20 0.48 1.34 -0.33 0.00 0.00 0.00 175.10 176.79 2jij h GLU 173 N 7.88 -0.71 -3.74 2.72 3.07 -1.89 -3.44 114.58 118.47 2jij h GLU 173 Ca -0.41 0.05 -0.29 0.00 -0.50 0.00 0.00 59.36 58.20 2jij h GLU 173 Cb 1.16 0.16 -0.31 0.00 -0.84 0.00 0.00 28.75 28.92 2jij h GLU 173 CO 0.61 -0.40 -0.74 -1.83 -1.40 0.00 0.00 179.01 175.25 2jij s GLU 174 N -5.16 0.13 0.70 2.33 -1.05 -1.23 -5.06 118.70 109.37 2jij s GLU 174 Ca -0.15 0.05 0.00 0.00 -0.15 0.00 0.00 54.97 54.72 2jij s GLU 174 Cb 0.02 -0.26 0.00 0.00 -0.44 0.00 0.00 34.13 33.45 2jij s GLU 174 CO 0.54 -0.07 0.00 0.41 0.95 0.00 0.00 175.26 177.08 2jij n GLY 175 N 3.68 -1.85 2.77 -3.83 0.00 -1.26 -2.13 105.19 102.57 2jij n GLY 175 Ca -0.21 -1.69 -0.05 0.00 0.00 0.00 0.00 46.02 44.07 2jij n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jij n GLY 176 N 0.00 0.45 3.76 -0.02 0.00 0.01 -4.77 105.19 104.61 2jij n GLY 176 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2jij n GLY 176 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jij s GLU 177 N -2.23 3.72 0.04 1.61 8.01 -1.26 -4.45 118.70 124.15 2jij s GLU 177 Ca 0.00 2.28 -0.30 0.00 0.01 0.00 0.00 54.97 56.96 2jij s GLU 177 Cb 0.00 -2.63 -0.05 0.00 -4.31 0.00 0.00 34.13 27.13 2jij s GLU 177 CO 0.00 -0.74 1.24 0.99 0.01 0.00 0.00 175.26 176.76 2jij s THR 178 N -1.25 3.96 -0.03 3.63 2.01 -0.88 -0.40 115.64 122.68 2jij s THR 178 Ca 0.61 1.38 0.05 0.00 0.31 0.00 0.00 61.69 64.04 2jij s THR 178 Cb -0.41 -3.89 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 2jij s THR 178 CO 0.52 0.08 -0.17 0.54 -0.69 0.00 0.00 174.62 174.89 2jij s VAL 179 N 1.39 2.81 -0.53 3.82 0.11 0.95 -1.81 120.40 127.13 2jij s VAL 179 Ca 0.59 -0.88 0.04 0.00 -2.93 0.00 0.00 61.98 58.80 2jij s VAL 179 Cb -0.30 -2.09 0.15 0.00 -1.53 0.00 0.00 36.38 32.61 2jij s VAL 179 CO 0.28 0.55 0.34 -0.76 -3.33 0.00 0.00 175.10 172.17 2jij s LEU 180 N -0.82 3.32 0.29 2.54 1.02 0.41 -0.79 118.68 124.65 2jij s LEU 180 Ca 0.12 -3.13 0.03 0.00 0.02 0.00 0.00 54.13 51.17 2jij s LEU 180 Cb -0.10 -1.19 0.65 0.00 0.02 0.00 0.00 46.19 45.57 2jij s LEU 180 CO 0.01 -0.19 1.78 -0.65 0.02 0.00 0.00 176.35 177.32 2jij h PRO 181 N 6.10 0.74 0.00 1.29 0.11 -1.78 -1.45 132.00 137.02 2jij h PRO 181 Ca 0.08 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2jij h PRO 181 Cb 0.87 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.81 2jij h PRO 181 CO 0.56 0.49 0.00 0.09 -0.21 0.00 0.00 178.00 178.93 2jij n ASN 182 N -4.77 0.00 -4.53 -2.05 3.02 -1.26 -4.51 115.26 101.17 2jij n ASN 182 Ca 0.21 0.14 -0.37 0.00 -0.03 0.00 0.00 54.58 54.53 2jij n ASN 182 Cb 0.50 -0.38 0.06 0.00 -0.61 0.00 0.00 39.78 39.36 2jij n ASN 182 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jij n ALA 183 N -1.38 -0.82 -0.03 5.41 0.00 -0.57 -4.80 120.51 118.32 2jij n ALA 183 Ca 0.11 -0.13 -0.08 0.00 0.00 0.00 0.00 53.44 53.34 2jij n ALA 183 Cb 0.27 -1.95 -0.02 0.00 0.00 0.00 0.00 19.45 17.75 2jij n ALA 183 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2jij h GLU 184 N -0.03 -0.16 -6.19 0.00 5.08 -1.60 -3.43 114.58 108.25 2jij h GLU 184 Ca -0.47 0.01 -0.69 0.00 -1.00 0.00 0.00 59.36 57.22 2jij h GLU 184 Cb 1.36 0.04 -0.26 0.00 0.50 0.00 0.00 28.75 30.39 2jij h GLU 184 CO 0.46 -0.11 -0.81 -0.65 -1.00 0.00 0.00 179.01 176.91 2jij s GLN 185 N -6.14 2.57 0.10 2.33 -0.21 -1.26 -5.06 119.66 111.98 2jij s GLN 185 Ca -0.14 -0.77 0.04 0.00 0.02 0.00 0.00 55.36 54.51 2jij s GLN 185 Cb 0.11 -2.32 -0.04 0.00 1.00 0.00 0.00 33.01 31.76 2jij s GLN 185 CO 0.68 0.52 0.10 0.15 -2.12 0.00 0.00 175.29 174.62 2jij s LYS 186 N -0.47 2.91 0.89 2.91 1.02 -1.26 -3.22 119.74 122.52 2jij s LYS 186 Ca 0.06 -0.73 -0.12 0.00 0.02 0.00 0.00 55.97 55.20 2jij s LYS 186 Cb -0.12 -2.72 0.12 0.00 -0.52 0.00 0.00 37.83 34.60 2jij s LYS 186 CO 0.01 0.54 1.10 0.14 -0.92 0.00 0.00 175.35 176.23 2jij s VAL 187 N -1.50 2.55 -0.48 3.17 -7.23 -0.66 -4.89 120.40 111.36 2jij s VAL 187 Ca 0.30 0.18 0.06 0.00 -1.81 0.00 0.00 61.98 60.71 2jij s VAL 187 Cb -0.12 -2.79 0.18 0.00 0.56 0.00 0.00 36.38 34.22 2jij s VAL 187 CO 0.23 -0.23 0.64 0.28 -0.31 0.00 0.00 175.10 175.70 2jij s THR 188 N -3.06 -0.77 1.30 5.32 -1.32 -1.26 -4.66 115.64 111.19 2jij s THR 188 Ca 0.63 -1.11 -0.17 0.00 -1.21 0.00 0.00 61.69 59.83 2jij s THR 188 Cb -0.16 -0.22 0.33 0.00 -1.51 0.00 0.00 72.50 70.94 2jij s THR 188 CO 0.56 -0.22 0.97 -0.83 -2.21 0.00 0.00 174.62 172.89 2jij s GLY 189 N 0.91 1.47 1.14 6.08 0.00 -1.26 -5.03 107.32 110.64 2jij s GLY 189 Ca 0.28 -0.45 -0.19 0.00 0.00 0.00 0.00 44.72 44.36 2jij s GLY 189 CO -0.07 0.42 1.20 0.99 0.00 0.00 0.00 173.10 175.64 2jij s ASP 190 N -2.75 1.47 -0.54 1.64 1.01 -1.26 -4.96 116.67 111.28 2jij s ASP 190 Ca 0.69 0.39 0.00 0.00 0.71 0.00 0.00 52.55 54.33 2jij s ASP 190 Cb -0.20 -0.47 0.00 0.00 1.01 0.00 0.00 42.92 43.26 2jij s ASP 190 CO 0.62 -3.76 0.00 0.61 0.21 0.00 0.00 175.17 172.85 2jij n GLY 191 N -2.06 0.65 3.18 0.21 0.00 -1.26 -5.01 105.19 100.90 2jij n GLY 191 Ca 0.15 -0.14 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 2jij n GLY 191 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jij s TRP 192 N -1.78 1.45 0.57 1.61 0.52 -1.26 -5.01 118.94 115.04 2jij s TRP 192 Ca 0.00 -0.35 -0.14 0.00 0.02 0.00 0.00 56.10 55.63 2jij s TRP 192 Cb 0.00 -0.87 -0.06 0.00 -1.15 0.00 0.00 33.47 31.40 2jij s TRP 192 CO 0.00 0.05 1.01 -1.54 0.02 0.00 0.00 176.95 176.49 2jij s SER 193 N -1.09 6.39 0.21 2.95 1.04 -1.26 -4.85 113.70 117.09 2jij s SER 193 Ca 0.04 1.50 -0.12 0.00 0.48 0.00 0.00 55.95 57.85 2jij s SER 193 Cb -0.08 -2.49 0.26 0.00 0.10 0.00 0.00 66.02 63.82 2jij s SER 193 CO 0.01 -0.75 1.65 -0.33 0.98 0.00 0.00 173.24 174.80 2jij h GLU 194 N 0.27 0.06 -0.59 4.02 4.39 -2.01 0.81 114.58 121.52 2jij h GLU 194 Ca -0.45 -0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.35 2jij h GLU 194 Cb 1.19 -0.01 -0.11 0.00 -0.10 0.00 0.00 28.75 29.71 2jij h GLU 194 CO 0.62 0.04 -0.33 0.00 -1.16 0.00 0.00 179.01 178.17 2jij h ALA 196 N 1.01 1.55 0.00 0.00 0.00 -1.25 -2.51 119.26 118.06 2jij h ALA 196 Ca 0.23 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2jij h ALA 196 Cb 0.55 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2jij h ALA 196 CO -0.68 0.39 0.00 1.63 0.00 0.00 0.00 179.25 180.59 2jij n LYS 197 N -4.45 0.28 0.10 0.00 5.02 -0.48 -2.47 118.16 116.16 2jij n LYS 197 Ca 0.09 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.50 2jij n LYS 197 Cb 0.10 -1.46 0.23 0.00 -0.02 0.00 0.00 35.03 33.88 2jij n LYS 197 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jij h ARG 198 N 0.00 0.00 0.00 1.97 3.08 -1.49 -3.43 114.38 114.51 2jij h ARG 198 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2jij h ARG 198 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2jij h ARG 198 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 2jij n GLY 199 N 1.29 3.61 3.78 0.04 0.00 -1.03 -4.46 105.19 108.40 2jij n GLY 199 Ca 0.04 -0.80 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 2jij n GLY 199 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jij s LEU 200 N 0.00 4.26 0.08 0.99 2.96 -1.05 -1.65 118.68 124.28 2jij s LEU 200 Ca 0.00 2.05 0.02 0.00 -0.22 0.00 0.00 54.13 55.98 2jij s LEU 200 Cb 0.00 -4.04 -0.04 0.00 0.50 0.00 0.00 46.19 42.62 2jij s LEU 200 CO 0.00 -0.34 -0.07 0.00 -1.32 0.00 0.00 176.35 174.62 2jij s ALA 201 N -1.54 0.83 -0.05 5.97 0.00 -1.26 -0.45 121.76 125.26 2jij s ALA 201 Ca 0.54 -1.16 0.05 0.00 0.00 0.00 0.00 51.96 51.38 2jij s ALA 201 Cb -0.24 0.13 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 2jij s ALA 201 CO 0.30 -0.18 -0.21 0.08 0.00 0.00 0.00 175.76 175.76 2jij s VAL 202 N -2.95 1.71 0.12 0.00 1.01 -0.75 -4.98 120.40 114.55 2jij s VAL 202 Ca 0.05 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 2jij s VAL 202 Cb 0.01 -1.45 -0.06 0.00 0.00 0.00 0.00 36.38 34.87 2jij s VAL 202 CO -0.03 0.48 1.07 -0.54 0.00 0.00 0.00 175.10 176.07 2jij s LYS 203 N -0.04 4.59 -0.68 2.72 1.02 -1.26 -2.07 119.74 124.03 2jij s LYS 203 Ca -0.04 1.62 -0.26 0.00 0.02 0.00 0.00 55.97 57.30 2jij s LYS 203 Cb -0.13 -3.34 -0.01 0.00 -0.52 0.00 0.00 37.83 33.84 2jij s LYS 203 CO 0.03 0.04 1.71 -2.14 -0.92 0.00 0.00 175.35 174.07 2jij s PRO 204 N 0.16 2.78 -0.18 -1.68 0.02 -1.26 -4.95 135.00 129.89 2jij s PRO 204 Ca 0.51 0.29 -0.06 0.00 0.02 0.00 0.00 61.00 61.75 2jij s PRO 204 Cb -0.27 -4.41 -0.04 0.00 0.02 0.00 0.00 34.50 29.80 2jij s PRO 204 CO 0.32 -2.63 0.03 0.42 -0.33 0.00 0.00 177.00 174.81 2jij s ILE 205 N 8.23 4.47 -0.43 2.83 1.01 -1.26 -1.19 121.20 134.86 2jij s ILE 205 Ca 0.59 -0.14 -0.45 0.00 0.00 0.00 0.00 60.65 60.65 2jij s ILE 205 Cb -0.11 -3.01 -0.18 0.00 0.01 0.00 0.00 42.46 39.17 2jij s ILE 205 CO 0.17 0.45 1.69 1.17 0.00 0.00 0.00 174.94 178.43 2jij n LYS 206 N 3.71 0.36 0.00 2.79 4.81 -1.23 -2.00 118.16 126.60 2jij n LYS 206 Ca -0.17 0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 2jij n LYS 206 Cb 0.52 -1.70 0.00 0.00 0.02 0.00 0.00 35.03 33.87 2jij n LYS 206 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jij n GLY 207 N 4.35 2.07 3.80 3.14 0.00 -0.36 -4.86 105.19 113.32 2jij n GLY 207 Ca 0.31 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.00 2jij n GLY 207 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jij s ASP 208 N -1.56 5.94 -0.04 1.61 1.01 -0.85 0.03 116.67 122.82 2jij s ASP 208 Ca 0.00 1.91 0.03 0.00 0.71 0.00 0.00 52.55 55.21 2jij s ASP 208 Cb 0.00 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.38 2jij s ASP 208 CO 0.00 -1.06 -0.13 0.00 0.21 0.00 0.00 175.17 174.20 2jij s ALA 209 N -2.19 1.16 -0.09 5.23 0.00 -0.58 -1.83 121.76 123.47 2jij s ALA 209 Ca 0.66 -0.48 -0.20 0.00 0.00 0.00 0.00 51.96 51.94 2jij s ALA 209 Cb -0.17 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 2jij s ALA 209 CO 0.30 0.19 0.56 -1.17 0.00 0.00 0.00 175.76 175.64 2jij s LEU 210 N 0.17 4.30 -0.11 0.00 2.96 0.24 0.26 118.68 126.50 2jij s LEU 210 Ca -0.04 0.97 0.02 0.00 -0.22 0.00 0.00 54.13 54.85 2jij s LEU 210 Cb -0.10 -2.84 0.01 0.00 0.50 0.00 0.00 46.19 43.76 2jij s LEU 210 CO 0.01 -0.04 -0.16 -0.32 -1.32 0.00 0.00 176.35 174.53 2jij s MET 211 N 0.64 2.31 0.04 1.98 -2.45 -0.13 0.15 119.30 121.84 2jij s MET 211 Ca 0.30 -0.60 -0.03 0.00 -1.25 0.00 0.00 55.69 54.12 2jij s MET 211 Cb -0.16 -1.94 -0.02 0.00 1.25 0.00 0.00 34.83 33.95 2jij s MET 211 CO 0.13 -0.05 0.03 -0.59 1.05 0.00 0.00 175.02 175.59 2jij s PHE 212 N 0.93 0.34 -0.08 4.11 -0.71 -0.34 0.59 117.98 122.82 2jij s PHE 212 Ca -0.07 -0.75 -0.19 0.00 -1.04 0.00 0.00 56.93 54.88 2jij s PHE 212 Cb -0.15 -0.25 -0.04 0.00 -1.21 0.00 0.00 43.02 41.37 2jij s PHE 212 CO -0.01 -0.35 0.52 0.71 -1.34 0.00 0.00 175.22 174.75 2jij s TYR 213 N -3.01 3.57 -0.92 3.49 2.02 -0.34 -1.10 117.35 121.05 2jij s TYR 213 Ca -0.01 1.00 0.17 0.00 -0.37 0.00 0.00 57.07 57.85 2jij s TYR 213 Cb 0.01 -2.57 -0.15 0.00 -0.40 0.00 0.00 41.96 38.85 2jij s TYR 213 CO -0.07 0.22 0.74 -1.13 -1.57 0.00 0.00 175.55 173.75 2jij n SER 214 N 3.39 0.94 -4.72 2.29 3.41 0.19 -4.42 113.62 114.70 2jij n SER 214 Ca -0.07 -0.97 -0.31 0.00 -0.26 0.00 0.00 58.87 57.26 2jij n SER 214 Cb 0.52 0.91 -0.08 0.00 -0.26 0.00 0.00 64.21 65.30 2jij n SER 214 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2jij s LEU 215 N -2.68 3.61 0.83 1.04 1.43 -1.25 -0.89 118.68 120.78 2jij s LEU 215 Ca 0.08 -0.08 -0.12 0.00 -1.03 0.00 0.00 54.13 52.98 2jij s LEU 215 Cb 0.13 -2.28 0.09 0.00 0.03 0.00 0.00 46.19 44.16 2jij s LEU 215 CO 0.64 0.19 1.10 -0.54 0.23 0.00 0.00 176.35 177.98 2jij s LYS 216 N -2.21 1.78 0.36 1.70 1.02 0.98 -4.77 119.74 118.59 2jij s LYS 216 Ca 0.26 0.60 0.09 0.00 0.02 0.00 0.00 55.97 56.94 2jij s LYS 216 Cb -0.12 -1.89 0.82 0.00 -0.52 0.00 0.00 37.83 36.13 2jij s LYS 216 CO 0.18 -1.83 1.88 -1.35 -0.92 0.00 0.00 175.35 173.32 2jij h PRO 217 N -1.24 0.66 0.00 -1.68 0.11 -2.01 0.14 132.00 127.99 2jij h PRO 217 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2jij h PRO 217 Cb 1.28 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2jij h PRO 217 CO 0.59 0.44 0.00 -0.40 -0.21 0.00 0.00 178.00 178.42 2jij n ASP 218 N -4.55 0.00 0.00 -2.05 5.68 -1.26 -4.88 116.55 109.49 2jij n ASP 218 Ca 0.17 0.04 0.00 0.00 -0.50 0.00 0.00 54.79 54.50 2jij n ASP 218 Cb 0.45 -0.28 0.00 0.00 -1.14 0.00 0.00 41.12 40.15 2jij n ASP 218 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jij n GLY 219 N 0.15 0.90 3.76 6.12 0.00 0.48 -5.08 105.19 111.52 2jij n GLY 219 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 2jij n GLY 219 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jij s SER 220 N -2.09 4.55 0.28 1.61 1.04 -1.26 -4.66 113.70 113.17 2jij s SER 220 Ca 0.00 1.97 -0.30 0.00 0.48 0.00 0.00 55.95 58.10 2jij s SER 220 Cb 0.00 -2.54 -0.11 0.00 0.10 0.00 0.00 66.02 63.47 2jij s SER 220 CO 0.00 -2.01 1.58 0.20 0.98 0.00 0.00 173.24 173.99 2jij s ASN 221 N -2.91 6.41 -0.49 7.02 0.01 -1.26 -0.01 114.94 123.70 2jij s ASN 221 Ca 0.65 2.91 -0.13 0.00 -0.71 0.00 0.00 52.86 55.58 2jij s ASN 221 Cb -0.20 -2.63 0.10 0.00 0.41 0.00 0.00 41.25 38.93 2jij s ASN 221 CO 0.50 -0.89 0.40 -0.62 -1.51 0.00 0.00 177.10 174.98 2jij s ASP 222 N 0.50 5.98 0.00 -1.22 2.15 -0.07 -4.64 116.67 119.38 2jij s ASP 222 Ca 0.63 -1.65 0.09 0.00 0.43 0.00 0.00 52.55 52.05 2jij s ASP 222 Cb -0.47 -2.12 0.45 0.00 -0.30 0.00 0.00 42.92 40.47 2jij s ASP 222 CO 0.47 -0.71 1.14 -0.81 -0.17 0.00 0.00 175.17 175.08 2jij n PRO 223 N 5.11 0.14 0.01 4.34 -0.04 -1.26 -1.19 135.00 142.10 2jij n PRO 223 Ca -0.12 0.19 0.12 0.00 -0.04 0.00 0.00 63.50 63.65 2jij n PRO 223 Cb 0.42 -1.50 0.53 0.00 -0.04 0.00 0.00 33.50 32.91 2jij n PRO 223 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jij n ALA 224 N -1.26 2.16 1.43 0.55 0.00 -1.26 -3.31 120.51 118.81 2jij n ALA 224 Ca 0.04 -0.08 0.14 0.00 0.00 0.00 0.00 53.44 53.54 2jij n ALA 224 Cb 0.07 -1.41 0.47 0.00 0.00 0.00 0.00 19.45 18.57 2jij n ALA 224 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2jij n SER 225 N -1.58 1.69 -4.62 0.00 3.41 -0.33 -4.04 113.62 108.15 2jij n SER 225 Ca 0.06 -1.56 -0.55 0.00 -0.26 0.00 0.00 58.87 56.55 2jij n SER 225 Cb 0.30 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.19 2jij n SER 225 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2jij n LEU 226 N 0.32 1.60 -3.80 1.04 7.94 -1.21 -4.76 117.00 118.14 2jij n LEU 226 Ca 0.18 1.12 -0.12 0.00 -1.11 0.00 0.00 56.01 56.08 2jij n LEU 226 Cb 0.39 -1.12 -0.09 0.00 0.53 0.00 0.00 43.42 43.13 2jij n LEU 226 CO 0.16 -0.98 -0.04 -1.38 -1.11 0.00 0.00 177.39 174.05 2jij s HIS 227 N 1.43 -0.09 0.32 1.96 -3.43 0.14 -3.92 115.29 111.69 2jij s HIS 227 Ca 0.90 0.08 0.07 0.00 -0.80 0.00 0.00 55.06 55.32 2jij s HIS 227 Cb -1.06 0.04 -0.03 0.00 -1.43 0.00 0.00 32.58 30.10 2jij s HIS 227 CO 0.56 -0.38 0.27 0.41 -2.00 0.00 0.00 174.74 173.60 2jij n GLY 228 N 1.21 2.96 3.22 -1.38 0.00 0.03 -0.92 105.19 110.31 2jij n GLY 228 Ca -0.21 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 43.57 2jij n GLY 228 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jij s SER 229 N -3.24 4.32 0.57 1.61 0.15 0.45 -0.04 113.70 117.53 2jij s SER 229 Ca 0.38 -0.79 -0.21 0.00 0.70 0.00 0.00 55.95 56.04 2jij s SER 229 Cb 0.02 -1.68 -0.04 0.00 -1.71 0.00 0.00 66.02 62.61 2jij s SER 229 CO 0.27 -0.11 1.31 0.00 1.20 0.00 0.00 173.24 175.91 2jij n PRO 231 N -1.27 1.69 -2.91 0.00 -0.02 -1.26 -2.93 135.00 128.30 2jij n PRO 231 Ca 0.12 0.60 -0.43 0.00 -2.02 0.00 0.00 63.50 61.77 2jij n PRO 231 Cb 0.46 -2.14 -0.04 0.00 -0.02 0.00 0.00 33.50 31.76 2jij n PRO 231 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2jij s THR 232 N -0.52 4.47 0.11 3.45 2.01 -1.26 -0.81 115.64 123.09 2jij s THR 232 Ca 0.65 -0.05 -0.03 0.00 0.31 0.00 0.00 61.69 62.56 2jij s THR 232 Cb -0.69 -4.53 -0.23 0.00 0.01 0.00 0.00 72.50 67.06 2jij s THR 232 CO 0.55 -1.14 1.23 -0.07 -0.69 0.00 0.00 174.62 174.50 2jij h LEU 233 N 10.81 0.41 -7.03 4.42 3.38 -1.75 -3.46 115.31 122.09 2jij h LEU 233 Ca -0.27 -0.39 -0.05 0.00 0.09 0.00 0.00 57.88 57.26 2jij h LEU 233 Cb 1.08 -0.13 -0.21 0.00 0.09 0.00 0.00 40.66 41.49 2jij h LEU 233 CO 1.09 1.25 0.11 -0.75 0.09 0.00 0.00 178.44 180.22 2jij s LYS 234 N -2.92 0.85 0.00 1.13 2.20 -0.91 -5.01 119.74 115.09 2jij s LYS 234 Ca -0.04 0.80 0.00 0.00 -0.36 0.00 0.00 55.97 56.37 2jij s LYS 234 Cb 0.08 0.41 0.00 0.00 -1.51 0.00 0.00 37.83 36.81 2jij s LYS 234 CO 0.87 -0.14 0.00 0.41 -0.36 0.00 0.00 175.35 176.12 2jij n GLY 235 N 2.32 -1.09 2.66 5.54 0.00 -1.26 -3.41 105.19 109.94 2jij n GLY 235 Ca -0.15 -2.15 -0.23 0.00 0.00 0.00 0.00 46.02 43.49 2jij n GLY 235 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jij s ASP 236 N -3.76 2.03 -0.22 1.61 2.15 -1.26 -5.02 116.67 112.20 2jij s ASP 236 Ca 0.00 -0.50 -0.18 0.00 0.43 0.00 0.00 52.55 52.30 2jij s ASP 236 Cb 0.00 -0.01 -0.03 0.00 -0.30 0.00 0.00 42.92 42.58 2jij s ASP 236 CO 0.00 -0.35 0.51 -0.75 -0.17 0.00 0.00 175.17 174.41 2jij s LYS 237 N 2.21 4.15 -0.12 4.34 2.20 -1.08 -4.79 119.74 126.65 2jij s LYS 237 Ca 0.04 0.37 0.03 0.00 -0.36 0.00 0.00 55.97 56.05 2jij s LYS 237 Cb -0.16 -3.59 0.00 0.00 -1.51 0.00 0.00 37.83 32.58 2jij s LYS 237 CO -0.12 -0.20 -0.23 -1.58 -0.36 0.00 0.00 175.35 172.87 2jij s TRP 238 N 1.81 2.56 0.09 4.03 0.52 -1.26 0.01 118.94 126.70 2jij s TRP 238 Ca 0.23 -1.16 0.04 0.00 0.02 0.00 0.00 56.10 55.23 2jij s TRP 238 Cb -0.15 -1.73 -0.03 0.00 -1.15 0.00 0.00 33.47 30.40 2jij s TRP 238 CO 0.09 -0.50 -0.10 -1.54 0.02 0.00 0.00 176.95 174.92 2jij s SER 239 N 0.56 1.42 -0.09 2.95 1.04 -0.08 -0.43 113.70 119.06 2jij s SER 239 Ca -0.14 -0.76 0.03 0.00 0.48 0.00 0.00 55.95 55.57 2jij s SER 239 Cb -0.17 0.00 0.00 0.00 0.10 0.00 0.00 66.02 65.96 2jij s SER 239 CO 0.04 -0.23 -0.21 0.00 0.98 0.00 0.00 173.24 173.82 2jij s ALA 240 N -2.18 1.91 -0.13 5.32 0.00 0.09 -0.54 121.76 126.23 2jij s ALA 240 Ca 0.03 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.16 2jij s ALA 240 Cb -0.05 -0.75 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 2jij s ALA 240 CO 0.00 0.23 -0.07 0.99 0.00 0.00 0.00 175.76 176.91 2jij s THR 241 N 0.45 3.61 -0.27 0.00 2.01 0.55 0.23 115.64 122.22 2jij s THR 241 Ca -0.17 -0.47 -0.02 0.00 0.31 0.00 0.00 61.69 61.33 2jij s THR 241 Cb -0.17 -2.54 0.03 0.00 0.01 0.00 0.00 72.50 69.83 2jij s THR 241 CO 0.07 0.53 -0.03 -0.75 -0.69 0.00 0.00 174.62 173.75 2jij s LYS 242 N 0.06 2.74 -0.15 4.92 2.47 0.26 -1.96 119.74 128.08 2jij s LYS 242 Ca -0.02 -1.05 -0.10 0.00 -1.56 0.00 0.00 55.97 53.24 2jij s LYS 242 Cb -0.14 -3.08 -0.05 0.00 -1.46 0.00 0.00 37.83 33.10 2jij s LYS 242 CO 0.03 -0.47 0.19 -1.58 0.16 0.00 0.00 175.35 173.68 2jij s TRP 243 N 1.32 3.50 -0.01 4.03 0.51 -1.26 -0.44 118.94 126.58 2jij s TRP 243 Ca -0.01 0.49 0.07 0.00 -2.12 0.00 0.00 56.10 54.53 2jij s TRP 243 Cb -0.18 -2.15 -0.02 0.00 -0.81 0.00 0.00 33.47 30.32 2jij s TRP 243 CO -0.03 0.43 -0.21 0.42 -0.51 0.00 0.00 176.95 177.05 2jij s ILE 244 N -0.10 1.66 0.35 2.03 1.01 -0.35 -1.78 121.20 124.02 2jij s ILE 244 Ca 0.13 -0.92 0.07 0.00 0.00 0.00 0.00 60.65 59.93 2jij s ILE 244 Cb -0.12 -1.38 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 2jij s ILE 244 CO 0.02 0.45 0.31 -1.00 0.00 0.00 0.00 174.94 174.72 2jij s HIS 245 N -0.52 2.86 0.13 3.97 3.76 0.65 -0.18 115.29 125.97 2jij s HIS 245 Ca 0.08 -0.34 0.24 0.00 -0.15 0.00 0.00 55.06 54.89 2jij s HIS 245 Cb -0.08 -1.88 0.89 0.00 1.11 0.00 0.00 32.58 32.62 2jij s HIS 245 CO -0.01 0.12 1.81 -0.39 -0.85 0.00 0.00 174.74 175.42 2jij h VAL 246 N 1.20 0.57 -4.12 -0.90 -1.51 -1.09 -3.44 116.25 106.96 2jij h VAL 246 Ca -0.44 -1.16 -0.29 0.00 -1.23 0.00 0.00 66.70 63.58 2jij h VAL 246 Cb 1.26 1.79 -0.15 0.00 -2.13 0.00 0.00 31.29 32.06 2jij h VAL 246 CO 0.58 0.23 -0.62 0.00 -1.23 0.00 0.00 177.57 176.53 2jij s ALA 247 N -3.63 1.43 0.67 5.19 0.00 -0.54 -5.03 121.76 119.84 2jij s ALA 247 Ca 0.01 -1.76 -0.17 0.00 0.00 0.00 0.00 51.96 50.04 2jij s ALA 247 Cb 0.10 1.12 0.00 0.00 0.00 0.00 0.00 23.12 24.34 2jij s ALA 247 CO 0.64 -0.50 1.27 -2.14 0.00 0.00 0.00 175.76 175.04 2jij s PRO 248 N -4.07 2.43 0.23 0.00 0.02 -1.26 -4.49 135.00 127.86 2jij s PRO 248 Ca 0.36 1.99 -0.15 0.00 0.02 0.00 0.00 61.00 63.22 2jij s PRO 248 Cb 0.07 -1.84 -0.08 0.00 0.02 0.00 0.00 34.50 32.67 2jij s PRO 248 CO 0.11 -1.67 0.65 0.42 -0.33 0.00 0.00 177.00 176.18 2jij s ILE 249 N -1.54 4.74 0.00 2.83 1.01 -0.23 -3.14 121.20 124.87 2jij s ILE 249 Ca 0.81 0.92 0.00 0.00 0.00 0.00 0.00 60.65 62.38 2jij s ILE 249 Cb -0.35 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.40 2jij s ILE 249 CO 0.41 0.05 0.00 0.61 0.00 0.00 0.00 174.94 176.01