#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j0s s GLN 67 N 0.00 3.27 0.30 0.54 0.74 0.18 -4.61 119.66 120.09 2j0s s GLN 67 Ca 0.00 -0.51 -0.29 0.00 0.05 0.00 0.00 55.36 54.61 2j0s s GLN 67 Cb 0.00 -2.80 -0.10 0.00 1.10 0.00 0.00 33.01 31.22 2j0s s GLN 67 CO 0.00 0.45 1.20 0.50 -0.55 0.00 0.00 175.29 176.90 2j0s s ARG 68 N -0.22 4.50 0.84 1.67 3.52 -1.26 -4.69 118.95 123.31 2j0s s ARG 68 Ca 0.04 2.00 -0.09 0.00 -0.13 0.00 0.00 55.73 57.55 2j0s s ARG 68 Cb -0.13 -3.14 0.16 0.00 -1.56 0.00 0.00 34.95 30.29 2j0s s ARG 68 CO 0.02 0.01 1.16 -1.12 -0.81 0.00 0.00 175.30 174.57 2j0s s SER 69 N -0.63 3.73 0.39 -2.12 0.01 0.15 -4.97 113.70 110.25 2j0s s SER 69 Ca 0.47 -0.02 0.08 0.00 1.31 0.00 0.00 55.95 57.78 2j0s s SER 69 Cb -0.36 -0.19 0.82 0.00 0.21 0.00 0.00 66.02 66.50 2j0s s SER 69 CO 0.46 -2.30 1.98 1.62 0.41 0.00 0.00 173.24 175.42 2j0s h VAL 70 N -1.10 1.02 0.00 3.43 3.04 -2.03 -3.06 116.25 117.55 2j0s h VAL 70 Ca -0.41 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.06 2j0s h VAL 70 Cb 1.25 0.31 0.00 0.00 -2.01 0.00 0.00 31.29 30.84 2j0s h VAL 70 CO 0.40 0.12 -0.22 -0.62 -1.01 0.00 0.00 177.57 176.23 2j0s n GLU 71 N -4.47 0.73 -3.70 4.17 1.02 -1.26 -5.12 120.64 112.01 2j0s n GLU 71 Ca 0.09 -1.64 0.00 0.00 -0.02 0.00 0.00 57.16 55.59 2j0s n GLU 71 Cb 0.22 -0.94 0.00 0.00 -0.02 0.00 0.00 31.44 30.70 2j0s n GLU 71 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2j0s n GLY 72 N -0.62 -1.04 3.26 0.62 0.00 -1.16 -4.61 105.19 101.65 2j0s n GLY 72 Ca 0.07 -1.05 -0.32 0.00 0.00 0.00 0.00 46.02 44.71 2j0s n GLY 72 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2j0s s TRP 73 N -3.00 2.66 -0.14 1.61 0.52 -0.40 0.30 118.94 120.49 2j0s s TRP 73 Ca 0.00 -0.96 -0.03 0.00 0.02 0.00 0.00 56.10 55.13 2j0s s TRP 73 Cb 0.00 -1.77 -0.03 0.00 -1.15 0.00 0.00 33.47 30.52 2j0s s TRP 73 CO 0.00 -0.38 -0.03 0.42 0.02 0.00 0.00 176.95 176.98 2j0s s ILE 74 N 0.42 3.97 -0.11 2.03 1.01 -1.26 -2.21 121.20 125.05 2j0s s ILE 74 Ca -0.15 -0.34 -0.10 0.00 0.00 0.00 0.00 60.65 60.06 2j0s s ILE 74 Cb -0.17 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.53 2j0s s ILE 74 CO 0.06 0.52 0.22 -0.76 0.00 0.00 0.00 174.94 174.98 2j0s s LEU 75 N 0.10 4.37 -0.32 2.97 1.43 0.11 -2.08 118.68 125.25 2j0s s LEU 75 Ca -0.00 0.56 -0.11 0.00 -1.03 0.00 0.00 54.13 53.54 2j0s s LEU 75 Cb -0.13 -2.23 -0.02 0.00 0.03 0.00 0.00 46.19 43.84 2j0s s LEU 75 CO 0.03 0.33 0.19 0.12 0.23 0.00 0.00 176.35 177.24 2j0s s PHE 76 N -0.69 3.20 -0.08 0.29 5.36 0.27 -1.49 117.98 124.83 2j0s s PHE 76 Ca 0.16 -0.32 0.01 0.00 -0.96 0.00 0.00 56.93 55.82 2j0s s PHE 76 Cb -0.13 -2.41 -0.03 0.00 -0.34 0.00 0.00 43.02 40.11 2j0s s PHE 76 CO 0.05 -0.37 -0.08 0.08 -1.46 0.00 0.00 175.22 173.44 2j0s s VAL 77 N 1.68 3.57 0.24 3.12 1.01 0.09 -2.19 120.40 127.91 2j0s s VAL 77 Ca 0.06 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.52 2j0s s VAL 77 Cb -0.17 -2.47 -0.05 0.00 0.00 0.00 0.00 36.38 33.70 2j0s s VAL 77 CO 0.09 0.58 0.10 0.42 0.00 0.00 0.00 175.10 176.28 2j0s s THR 78 N -0.56 0.43 -0.44 3.92 -4.23 -0.60 -0.57 115.64 113.59 2j0s s THR 78 Ca 0.08 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 2j0s s THR 78 Cb -0.12 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.16 2j0s s THR 78 CO 0.02 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 2j0s n GLY 79 N -0.40 0.40 3.69 3.99 0.00 -0.80 -1.49 105.19 110.58 2j0s n GLY 79 Ca -0.00 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 2j0s n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j0s s VAL 80 N -2.21 4.87 0.43 1.61 1.01 -0.70 -4.46 120.40 120.95 2j0s s VAL 80 Ca 0.00 1.80 -0.26 0.00 0.00 0.00 0.00 61.98 63.52 2j0s s VAL 80 Cb 0.00 -4.21 -0.09 0.00 0.00 0.00 0.00 36.38 32.08 2j0s s VAL 80 CO 0.00 0.07 1.36 1.57 0.00 0.00 0.00 175.10 178.11 2j0s n HIS 81 N 4.75 2.47 0.34 5.22 -0.00 -1.26 -4.35 115.22 122.39 2j0s n HIS 81 Ca 0.05 0.47 0.15 0.00 -0.00 0.00 0.00 57.72 58.38 2j0s n HIS 81 Cb 0.49 -2.43 0.60 0.00 -0.00 0.00 0.00 29.99 28.66 2j0s n HIS 81 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.34 177.39 2j0s h GLU 82 N 2.24 0.00 -0.31 1.57 4.11 -1.95 -2.27 114.58 117.97 2j0s h GLU 82 Ca -0.49 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.91 2j0s h GLU 82 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2j0s h GLU 82 CO 0.61 0.00 0.01 0.39 0.07 0.00 0.00 179.01 180.08 2j0s n GLU 83 N -2.62 3.03 -3.07 1.06 1.02 -1.26 -1.82 120.64 116.98 2j0s n GLU 83 Ca 0.01 -2.91 -0.33 0.00 -0.02 0.00 0.00 57.16 53.92 2j0s n GLU 83 Cb 0.25 -1.89 -0.06 0.00 -0.02 0.00 0.00 31.44 29.71 2j0s n GLU 83 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2j0s s ALA 84 N -2.87 3.26 0.38 0.62 0.00 -0.86 -5.08 121.76 117.21 2j0s s ALA 84 Ca 0.44 0.12 0.08 0.00 0.00 0.00 0.00 51.96 52.60 2j0s s ALA 84 Cb 0.36 -2.85 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 2j0s s ALA 84 CO 0.09 0.29 0.23 0.95 0.00 0.00 0.00 175.76 177.32 2j0s s THR 85 N -2.03 2.78 0.45 0.00 -4.23 -1.26 -4.91 115.64 106.44 2j0s s THR 85 Ca 0.56 -1.56 0.10 0.00 -1.18 0.00 0.00 61.69 59.61 2j0s s THR 85 Cb -0.10 -3.01 0.27 0.00 1.34 0.00 0.00 72.50 71.00 2j0s s THR 85 CO 0.16 -0.08 2.09 -0.08 -0.54 0.00 0.00 174.62 176.17 2j0s h GLU 86 N 1.34 0.35 -0.78 3.99 4.81 -1.98 -1.79 114.58 120.52 2j0s h GLU 86 Ca -0.43 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2j0s h GLU 86 Cb 1.26 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 30.52 2j0s h GLU 86 CO 0.63 0.23 0.43 0.93 -0.73 0.00 0.00 179.01 180.50 2j0s h GLU 87 N 0.36 1.08 -0.29 1.92 5.08 -1.98 -0.63 114.58 120.11 2j0s h GLU 87 Ca 0.10 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2j0s h GLU 87 Cb -0.03 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 2j0s h GLU 87 CO -0.02 0.80 0.07 -0.44 -1.00 0.00 0.00 179.01 178.42 2j0s h ASP 88 N 1.08 0.45 -0.27 1.42 3.32 -1.73 -0.97 116.42 119.71 2j0s h ASP 88 Ca 0.27 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 2j0s h ASP 88 Cb 0.02 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2j0s h ASP 88 CO -0.05 0.56 0.05 0.40 -1.72 0.00 0.00 179.24 178.48 2j0s h ILE 89 N 0.31 1.22 -0.72 0.35 5.03 -1.41 -2.73 117.51 119.56 2j0s h ILE 89 Ca 0.09 -0.76 0.03 0.00 -0.12 0.00 0.00 64.86 64.10 2j0s h ILE 89 Cb 0.28 1.20 -0.04 0.00 -3.03 0.00 0.00 36.82 35.23 2j0s h ILE 89 CO 0.00 0.25 0.45 -0.74 -0.68 0.00 0.00 178.15 177.43 2j0s h HIS 90 N 0.27 0.85 -0.63 1.37 2.76 -1.00 -0.69 115.15 118.08 2j0s h HIS 90 Ca 0.08 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.27 2j0s h HIS 90 Cb 0.32 -0.28 -0.03 0.00 1.55 0.00 0.00 27.41 28.97 2j0s h HIS 90 CO 0.02 0.49 0.35 -0.44 -1.30 0.00 0.00 177.93 177.04 2j0s h ASP 91 N 0.89 0.78 -0.34 3.26 3.32 -1.10 0.25 116.42 123.48 2j0s h ASP 91 Ca 0.29 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 2j0s h ASP 91 Cb 0.01 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 2j0s h ASP 91 CO -0.11 0.65 0.15 0.11 -1.72 0.00 0.00 179.24 178.33 2j0s h LYS 92 N 0.86 0.50 0.00 3.56 1.79 -1.16 -3.33 116.57 118.79 2j0s h LYS 92 Ca 0.22 -0.08 -0.15 0.00 -2.18 0.00 0.00 60.65 58.47 2j0s h LYS 92 Cb 0.04 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.58 2j0s h LYS 92 CO -0.04 0.47 -0.95 0.74 -1.08 0.00 0.00 179.45 178.59 2j0s h PHE 93 N 0.41 0.00 0.00 -1.35 0.04 -0.74 -3.34 116.94 111.97 2j0s h PHE 93 Ca 0.12 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.86 2j0s h PHE 93 Cb 0.14 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.29 2j0s h PHE 93 CO -0.01 0.59 -0.11 0.00 -0.60 0.00 0.00 178.31 178.18 2j0s h ALA 94 N 1.41 1.20 0.00 2.45 0.00 -0.61 -2.20 119.26 121.50 2j0s h ALA 94 Ca -0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2j0s h ALA 94 Cb 1.52 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 2j0s h ALA 94 CO 0.06 0.13 -0.04 1.05 0.00 0.00 0.00 179.25 180.45 2j0s h GLU 95 N 0.00 0.00 0.00 0.00 4.11 -1.73 -2.98 114.58 113.98 2j0s h GLU 95 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2j0s h GLU 95 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2j0s h GLU 95 CO 0.01 0.04 -0.79 0.66 0.07 0.00 0.00 179.01 179.01 2j0s n TYR 96 N -4.00 0.19 0.00 2.06 4.02 -0.83 -5.03 117.16 113.57 2j0s n TYR 96 Ca -0.03 0.06 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 2j0s n TYR 96 Cb 0.13 -0.36 0.00 0.00 -0.02 0.00 0.00 39.34 39.09 2j0s n TYR 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2j0s n GLY 97 N 1.42 0.88 3.66 2.72 0.00 -1.13 -4.64 105.19 108.10 2j0s n GLY 97 Ca 0.04 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.50 2j0s n GLY 97 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j0s s GLU 98 N -2.00 4.16 -0.10 1.61 2.56 -1.26 -4.45 118.70 119.22 2j0s s GLU 98 Ca 0.00 1.91 -0.27 0.00 0.00 0.00 0.00 54.97 56.61 2j0s s GLU 98 Cb 0.00 -3.90 -0.02 0.00 2.00 0.00 0.00 34.13 32.21 2j0s s GLU 98 CO 0.00 -0.83 0.86 0.42 -0.56 0.00 0.00 175.26 175.15 2j0s s ILE 99 N 3.93 4.90 -0.10 -3.70 1.01 -1.26 -4.40 121.20 121.57 2j0s s ILE 99 Ca 0.65 1.75 0.20 0.00 0.00 0.00 0.00 60.65 63.26 2j0s s ILE 99 Cb -0.27 -4.18 -0.28 0.00 0.01 0.00 0.00 42.46 37.73 2j0s s ILE 99 CO 0.23 0.10 0.42 0.29 0.00 0.00 0.00 174.94 175.98 2j0s n LYS 100 N 4.61 0.66 -3.49 2.79 4.76 0.42 -4.97 118.16 122.94 2j0s n LYS 100 Ca 0.04 -0.09 -0.16 0.00 -2.87 0.00 0.00 58.31 55.24 2j0s n LYS 100 Cb 0.50 -1.56 -0.05 0.00 -1.84 0.00 0.00 35.03 32.08 2j0s n LYS 100 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 2j0s s ASN 101 N -4.96 -0.62 -0.05 4.39 3.84 -1.22 -5.00 114.94 111.32 2j0s s ASN 101 Ca -0.08 0.47 -0.02 0.00 0.21 0.00 0.00 52.86 53.44 2j0s s ASN 101 Cb 0.11 0.56 0.04 0.00 -0.55 0.00 0.00 41.25 41.40 2j0s s ASN 101 CO 0.87 -0.73 0.10 -0.63 -2.79 0.00 0.00 177.10 173.92 2j0s s ILE 102 N -2.07 -0.10 -0.21 -5.21 1.01 -1.26 -1.24 121.20 112.11 2j0s s ILE 102 Ca -0.07 0.26 -0.06 0.00 0.00 0.00 0.00 60.65 60.79 2j0s s ILE 102 Cb -0.00 -0.19 -0.03 0.00 0.01 0.00 0.00 42.46 42.25 2j0s s ILE 102 CO 0.02 0.11 0.03 -1.00 0.00 0.00 0.00 174.94 174.10 2j0s s HIS 103 N 1.51 3.09 -0.54 3.97 3.76 -0.49 -4.97 115.29 121.63 2j0s s HIS 103 Ca -0.05 -0.34 0.04 0.00 -0.15 0.00 0.00 55.06 54.56 2j0s s HIS 103 Cb -0.12 -2.12 0.14 0.00 1.11 0.00 0.00 32.58 31.59 2j0s s HIS 103 CO -0.05 -0.19 0.31 -1.17 -0.85 0.00 0.00 174.74 172.79 2j0s s LEU 104 N 1.04 3.93 0.22 0.89 2.96 -1.26 -1.23 118.68 125.24 2j0s s LEU 104 Ca 0.03 -3.11 -0.29 0.00 -0.22 0.00 0.00 54.13 50.54 2j0s s LEU 104 Cb -0.14 -1.45 -0.09 0.00 0.50 0.00 0.00 46.19 45.01 2j0s s LEU 104 CO 0.02 -0.20 0.92 0.20 -1.32 0.00 0.00 176.35 175.96 2j0s s ASN 105 N -0.38 7.61 0.07 3.68 0.01 -1.25 -4.96 114.94 119.71 2j0s s ASN 105 Ca 0.19 1.90 -0.20 0.00 -0.71 0.00 0.00 52.86 54.04 2j0s s ASN 105 Cb -0.20 -2.59 -0.07 0.00 0.41 0.00 0.00 41.25 38.80 2j0s s ASN 105 CO -0.04 0.16 0.59 -0.76 -1.51 0.00 0.00 177.10 175.54 2j0s s LEU 106 N -1.13 4.51 0.15 0.60 1.02 -1.26 -0.84 118.68 121.73 2j0s s LEU 106 Ca 0.40 1.28 -0.31 0.00 0.02 0.00 0.00 54.13 55.52 2j0s s LEU 106 Cb -0.25 -2.94 -0.10 0.00 0.02 0.00 0.00 46.19 42.92 2j0s s LEU 106 CO 0.31 0.24 1.63 -0.62 0.02 0.00 0.00 176.35 177.92 2j0s s ASP 107 N -0.93 6.55 0.33 2.29 -1.08 0.24 -4.60 116.67 119.46 2j0s s ASP 107 Ca 0.30 2.63 0.18 0.00 -0.52 0.00 0.00 52.55 55.14 2j0s s ASP 107 Cb -0.20 -2.59 0.31 0.00 -1.46 0.00 0.00 42.92 38.99 2j0s s ASP 107 CO 0.19 -0.87 1.56 0.03 0.52 0.00 0.00 175.17 176.60 2j0s h ARG 108 N 7.27 0.00 0.00 4.34 2.47 -1.96 0.15 114.38 126.65 2j0s h ARG 108 Ca -0.43 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.26 2j0s h ARG 108 Cb 1.20 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.52 2j0s h ARG 108 CO 0.93 0.41 -0.19 -0.09 0.56 0.00 0.00 179.97 181.58 2j0s h ARG 109 N 0.00 0.00 0.00 0.04 2.43 -1.96 -3.43 114.38 111.46 2j0s h ARG 109 Ca -0.00 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 58.87 2j0s h ARG 109 Cb 1.19 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.68 2j0s h ARG 109 CO 0.05 0.88 -2.07 0.25 -1.51 0.00 0.00 179.97 177.57 2j0s n THR 110 N -4.60 1.29 -0.58 0.20 -2.24 -1.17 -4.99 114.28 102.18 2j0s n THR 110 Ca -0.12 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 60.87 2j0s n THR 110 Cb 0.46 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 2j0s n THR 110 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j0s n GLY 111 N 1.61 0.77 3.99 3.38 0.00 0.50 -5.02 105.19 110.43 2j0s n GLY 111 Ca -0.24 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 2j0s n GLY 111 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j0s s TYR 112 N -2.84 2.58 0.47 1.61 1.51 -1.26 -4.77 117.35 114.66 2j0s s TYR 112 Ca 0.00 -0.25 -0.24 0.00 -1.01 0.00 0.00 57.07 55.58 2j0s s TYR 112 Cb 0.00 -2.59 -0.07 0.00 -0.11 0.00 0.00 41.96 39.19 2j0s s TYR 112 CO 0.00 -0.82 1.29 -0.51 -1.11 0.00 0.00 175.55 174.41 2j0s s LEU 113 N -4.64 4.03 0.30 -1.29 1.43 -0.76 0.79 118.68 118.53 2j0s s LEU 113 Ca 0.58 2.62 0.15 0.00 -1.03 0.00 0.00 54.13 56.45 2j0s s LEU 113 Cb -0.09 -4.13 0.27 0.00 0.03 0.00 0.00 46.19 42.27 2j0s s LEU 113 CO 0.37 -1.14 1.54 0.50 0.23 0.00 0.00 176.35 177.85 2j0s h LYS 114 N 2.06 0.00 0.00 1.70 1.63 -1.24 -3.39 116.57 117.32 2j0s h LYS 114 Ca -0.50 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 2j0s h LYS 114 Cb 1.27 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 2j0s h LYS 114 CO 0.60 0.51 0.00 0.41 -3.45 0.00 0.00 179.45 177.52 2j0s n GLY 115 N 0.85 0.55 3.26 5.01 0.00 -1.26 -4.94 105.19 108.65 2j0s n GLY 115 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 2j0s n GLY 115 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2j0s s TYR 116 N -1.53 1.36 0.05 1.61 -0.85 -1.26 -1.72 117.35 115.02 2j0s s TYR 116 Ca 0.00 -0.65 -0.04 0.00 -0.52 0.00 0.00 57.07 55.86 2j0s s TYR 116 Cb 0.00 -0.69 -0.02 0.00 0.38 0.00 0.00 41.96 41.63 2j0s s TYR 116 CO 0.00 0.14 0.07 -0.08 -1.52 0.00 0.00 175.55 174.16 2j0s s THR 117 N -2.78 0.16 -0.05 -3.49 -1.32 0.26 -3.97 115.64 104.45 2j0s s THR 117 Ca 0.14 -1.33 0.06 0.00 -1.21 0.00 0.00 61.69 59.35 2j0s s THR 117 Cb -0.01 -1.15 -0.02 0.00 -1.51 0.00 0.00 72.50 69.82 2j0s s THR 117 CO 0.02 -0.73 -0.23 -0.76 -2.21 0.00 0.00 174.62 170.71 2j0s s LEU 118 N -2.49 2.20 -0.07 9.08 1.02 -0.37 -0.74 118.68 127.32 2j0s s LEU 118 Ca 0.00 -0.44 0.00 0.00 0.02 0.00 0.00 54.13 53.71 2j0s s LEU 118 Cb 0.02 -1.40 0.02 0.00 0.02 0.00 0.00 46.19 44.85 2j0s s LEU 118 CO -0.07 0.28 -0.05 -0.69 0.02 0.00 0.00 176.35 175.84 2j0s s VAL 119 N -0.35 0.67 -0.07 -1.59 1.01 -0.56 -1.39 120.40 118.13 2j0s s VAL 119 Ca 0.02 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.89 2j0s s VAL 119 Cb -0.12 -0.72 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2j0s s VAL 119 CO 0.02 0.28 -0.11 -0.70 0.00 0.00 0.00 175.10 174.59 2j0s s GLU 120 N 1.33 2.70 0.18 2.72 2.12 -0.37 0.04 118.70 127.42 2j0s s GLU 120 Ca -0.04 -0.63 0.07 0.00 0.36 0.00 0.00 54.97 54.74 2j0s s GLU 120 Cb -0.14 -2.50 -0.04 0.00 0.26 0.00 0.00 34.13 31.71 2j0s s GLU 120 CO -0.03 0.60 -0.15 0.71 -0.54 0.00 0.00 175.26 175.86 2j0s s TYR 121 N -0.65 1.66 0.10 5.30 2.02 -0.94 -0.43 117.35 124.41 2j0s s TYR 121 Ca 0.10 -0.57 -0.11 0.00 -0.37 0.00 0.00 57.07 56.12 2j0s s TYR 121 Cb -0.11 -0.79 -0.16 0.00 -0.40 0.00 0.00 41.96 40.49 2j0s s TYR 121 CO 0.01 0.31 1.26 1.49 -1.57 0.00 0.00 175.55 177.06 2j0s h GLU 122 N 2.79 0.67 -6.20 -0.62 4.81 -1.81 -1.05 114.58 113.18 2j0s h GLU 122 Ca -0.39 -0.65 -0.52 0.00 -0.13 0.00 0.00 59.36 57.68 2j0s h GLU 122 Cb 1.21 0.17 -0.06 0.00 0.63 0.00 0.00 28.75 30.70 2j0s h GLU 122 CO 0.59 1.25 -0.55 0.95 -0.73 0.00 0.00 179.01 180.51 2j0s s THR 123 N -3.48 4.22 0.10 0.32 -4.23 -1.26 -4.50 115.64 106.81 2j0s s THR 123 Ca -0.09 -1.51 -0.17 0.00 -1.18 0.00 0.00 61.69 58.73 2j0s s THR 123 Cb 0.08 -3.27 -0.05 0.00 1.34 0.00 0.00 72.50 70.59 2j0s s THR 123 CO 0.90 -0.35 1.58 0.22 -0.54 0.00 0.00 174.62 176.43 2j0s h TYR 124 N 1.60 0.54 -0.51 3.99 3.20 -1.97 -2.77 116.97 121.05 2j0s h TYR 124 Ca -0.48 -0.08 0.10 0.00 3.14 0.00 0.00 58.73 61.42 2j0s h TYR 124 Cb 1.24 -0.15 -0.08 0.00 1.54 0.00 0.00 36.73 39.28 2j0s h TYR 124 CO 0.58 0.59 0.01 -0.22 -1.64 0.00 0.00 178.16 177.49 2j0s h LYS 125 N 0.34 0.12 0.01 1.82 3.64 -1.99 -0.59 116.57 119.92 2j0s h LYS 125 Ca 0.09 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2j0s h LYS 125 Cb 0.34 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2j0s h LYS 125 CO 0.01 0.08 -0.00 0.93 -2.27 0.00 0.00 179.45 178.19 2j0s h GLU 126 N 0.13 -0.01 -0.32 1.90 5.08 -1.81 -1.19 114.58 118.36 2j0s h GLU 126 Ca 0.26 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.65 2j0s h GLU 126 Cb 0.39 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 2j0s h GLU 126 CO -0.42 0.04 0.14 0.00 -1.00 0.00 0.00 179.01 177.78 2j0s h ALA 127 N 0.93 0.38 -0.50 3.43 0.00 -1.17 -1.79 119.26 120.54 2j0s h ALA 127 Ca -0.00 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 2j0s h ALA 127 Cb 0.06 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2j0s h ALA 127 CO 0.00 -0.25 -0.05 0.37 0.00 0.00 0.00 179.25 179.33 2j0s h GLN 128 N 0.30 0.92 -0.88 0.00 4.15 -1.05 -1.35 115.11 117.20 2j0s h GLN 128 Ca 0.14 -0.32 0.05 0.00 0.77 0.00 0.00 58.65 59.29 2j0s h GLN 128 Cb 0.08 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 27.64 2j0s h GLN 128 CO -0.11 0.97 0.58 0.00 -1.93 0.00 0.00 178.83 178.33 2j0s h ALA 129 N 0.92 1.48 -0.07 3.38 0.00 -1.07 0.21 119.26 124.11 2j0s h ALA 129 Ca 0.14 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.82 2j0s h ALA 129 Cb 0.59 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2j0s h ALA 129 CO 0.04 0.42 -0.76 0.00 0.00 0.00 0.00 179.25 178.94 2j0s h ALA 130 N 1.50 0.55 -0.12 0.00 0.00 -0.98 -0.71 119.26 119.50 2j0s h ALA 130 Ca 0.36 -0.62 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2j0s h ALA 130 Cb 0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2j0s h ALA 130 CO -0.12 0.77 -0.10 1.98 0.00 0.00 0.00 179.25 181.78 2j0s h MET 131 N 0.28 0.27 -0.08 0.00 -1.53 -0.82 -0.50 114.93 112.55 2j0s h MET 131 Ca -0.04 -0.14 -0.12 0.00 -3.44 0.00 0.00 59.70 55.97 2j0s h MET 131 Cb 1.35 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 32.39 2j0s h MET 131 CO 0.13 0.66 -0.48 0.93 0.14 0.00 0.00 176.91 178.29 2j0s h GLU 132 N -0.12 0.20 0.13 0.39 5.08 -0.99 -2.17 114.58 117.11 2j0s h GLU 132 Ca 0.02 -0.11 -0.28 0.00 -1.00 0.00 0.00 59.36 57.99 2j0s h GLU 132 Cb 0.60 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.87 2j0s h GLU 132 CO 0.03 0.64 -1.25 0.78 -1.00 0.00 0.00 179.01 178.21 2j0s h GLY 133 N 1.34 0.44 0.00 -3.84 0.00 -1.09 -3.38 103.07 96.55 2j0s h GLY 133 Ca 0.01 -1.04 0.00 0.00 0.00 0.00 0.00 47.33 46.30 2j0s h GLY 133 CO 0.07 0.91 -1.33 1.04 0.00 0.00 0.00 176.54 177.24 2j0s n LEU 134 N -3.64 0.38 -4.67 3.11 4.77 -0.20 -4.84 117.00 111.92 2j0s n LEU 134 Ca -0.11 -0.24 -0.42 0.00 -0.03 0.00 0.00 56.01 55.22 2j0s n LEU 134 Cb 1.01 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.07 2j0s n LEU 134 CO 0.55 0.09 1.42 0.21 -1.33 0.00 0.00 177.39 178.34 2j0s s ASN 135 N -3.34 6.57 0.00 -1.43 2.47 -0.82 -1.67 114.94 116.72 2j0s s ASN 135 Ca -0.00 2.47 0.00 0.00 0.42 0.00 0.00 52.86 55.74 2j0s s ASN 135 Cb 0.12 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 2j0s s ASN 135 CO 0.71 -0.95 0.00 0.61 -3.72 0.00 0.00 177.10 173.75 2j0s n GLY 136 N 4.20 1.07 3.94 1.21 0.00 0.12 -4.94 105.19 110.78 2j0s n GLY 136 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 2j0s n GLY 136 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j0s s GLN 137 N -0.52 2.61 0.37 1.61 -1.52 -0.67 -4.61 119.66 116.93 2j0s s GLN 137 Ca 0.00 -0.31 -0.05 0.00 -1.95 0.00 0.00 55.36 53.06 2j0s s GLN 137 Cb 0.00 -2.31 -0.04 0.00 -0.22 0.00 0.00 33.01 30.43 2j0s s GLN 137 CO 0.00 -0.84 0.65 -0.51 -0.25 0.00 0.00 175.29 174.34 2j0s s ASP 138 N -4.39 6.37 0.00 5.90 -0.00 -1.26 -1.28 116.67 122.00 2j0s s ASP 138 Ca 0.56 0.77 0.00 0.00 -0.00 0.00 0.00 52.55 53.89 2j0s s ASP 138 Cb -0.10 -2.17 0.00 0.00 -0.00 0.00 0.00 42.92 40.64 2j0s s ASP 138 CO 0.43 -0.36 0.00 -0.11 -0.00 0.00 0.00 175.17 175.13 2j0s n LEU 139 N -1.56 0.00 -2.91 1.23 0.00 -0.32 -4.82 117.00 108.61 2j0s n LEU 139 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 56.01 55.68 2j0s n LEU 139 Cb 0.55 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 43.97 2j0s n LEU 139 CO 0.50 0.00 0.63 0.23 0.00 0.00 0.00 177.39 178.75 2j0s n MET 140 N 0.00 3.61 0.00 1.96 0.00 -1.26 -3.90 117.12 117.52 2j0s n MET 140 Ca 0.00 -4.48 0.00 0.00 0.00 0.00 0.00 57.70 53.22 2j0s n MET 140 Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 33.22 30.93 2j0s n MET 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2j0s n GLY 141 N -0.34 0.61 3.17 3.03 0.00 -1.26 -5.12 105.19 105.28 2j0s n GLY 141 Ca 0.40 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.25 2j0s n GLY 141 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2j0s s GLN 142 N 0.00 0.83 0.13 1.61 -2.07 -1.25 -5.09 119.66 113.80 2j0s s GLN 142 Ca 0.00 -0.99 -0.30 0.00 -1.82 0.00 0.00 55.36 52.25 2j0s s GLN 142 Cb 0.00 -0.78 -0.06 0.00 -1.09 0.00 0.00 33.01 31.08 2j0s s GLN 142 CO 0.00 0.17 1.02 -1.25 -1.32 0.00 0.00 175.29 173.91 2j0s s PRO 143 N -1.91 4.64 0.21 9.60 0.04 -1.26 -1.17 135.00 145.14 2j0s s PRO 143 Ca -0.01 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 62.49 2j0s s PRO 143 Cb -0.09 -3.34 -0.07 0.00 0.04 0.00 0.00 34.50 31.04 2j0s s PRO 143 CO 0.02 0.13 0.54 0.96 0.04 0.00 0.00 177.00 178.69 2j0s s ILE 144 N 0.02 4.92 -0.08 0.56 -4.36 -0.41 -4.65 121.20 117.20 2j0s s ILE 144 Ca 0.49 0.55 -0.03 0.00 -0.26 0.00 0.00 60.65 61.39 2j0s s ILE 144 Cb -0.26 -3.64 -0.04 0.00 1.25 0.00 0.00 42.46 39.77 2j0s s ILE 144 CO 0.31 0.01 0.06 -0.44 0.24 0.00 0.00 174.94 175.12 2j0s s SER 145 N -2.20 5.68 -0.06 4.36 0.01 -0.55 0.11 113.70 121.04 2j0s s SER 145 Ca 0.45 0.25 0.01 0.00 1.31 0.00 0.00 55.95 57.96 2j0s s SER 145 Cb -0.12 -1.69 0.02 0.00 0.21 0.00 0.00 66.02 64.44 2j0s s SER 145 CO 0.21 0.37 -0.06 -0.69 0.41 0.00 0.00 173.24 173.48 2j0s s VAL 146 N -0.99 0.70 0.22 3.43 1.01 -1.26 -1.56 120.40 121.94 2j0s s VAL 146 Ca 0.16 -0.17 -0.08 0.00 0.00 0.00 0.00 61.98 61.88 2j0s s VAL 146 Cb -0.12 -0.73 -0.02 0.00 0.00 0.00 0.00 36.38 35.52 2j0s s VAL 146 CO 0.05 0.28 0.33 -1.81 0.00 0.00 0.00 175.10 173.95 2j0s s ASP 147 N 1.20 0.01 0.57 3.32 1.01 -0.93 -4.77 116.67 117.08 2j0s s ASP 147 Ca -0.06 -1.07 -0.19 0.00 0.71 0.00 0.00 52.55 51.94 2j0s s ASP 147 Cb -0.14 0.49 -0.05 0.00 1.01 0.00 0.00 42.92 44.23 2j0s s ASP 147 CO -0.02 -0.99 1.15 0.26 0.21 0.00 0.00 175.17 175.78 2j0s s TRP 148 N -4.05 2.56 -0.21 4.23 0.52 -1.26 -0.57 118.94 120.16 2j0s s TRP 148 Ca 0.27 1.54 -0.13 0.00 0.02 0.00 0.00 56.10 57.79 2j0s s TRP 148 Cb 0.03 -3.35 -0.19 0.00 -1.15 0.00 0.00 33.47 28.81 2j0s s TRP 148 CO 0.08 -1.81 0.06 0.00 0.02 0.00 0.00 176.95 175.31 2j0s s PHE 150 N -2.47 2.27 0.24 0.00 0.08 -1.26 -4.98 117.98 111.85 2j0s s PHE 150 Ca -0.30 -0.41 0.03 0.00 0.12 0.00 0.00 56.93 56.37 2j0s s PHE 150 Cb 0.09 -1.35 -0.05 0.00 -0.57 0.00 0.00 43.02 41.13 2j0s s PHE 150 CO 0.61 0.13 0.03 0.14 -0.10 0.00 0.00 175.22 176.03 2j0s s VAL 151 N -0.81 0.89 0.69 -0.44 -7.23 -1.26 -0.65 120.40 111.60 2j0s s VAL 151 Ca 0.11 -2.01 -0.14 0.00 -1.81 0.00 0.00 61.98 58.13 2j0s s VAL 151 Cb -0.10 -2.42 0.02 0.00 0.56 0.00 0.00 36.38 34.44 2j0s s VAL 151 CO 0.02 -0.24 1.11 0.00 -0.31 0.00 0.00 175.10 175.68 2j0s s ARG 152 N -3.91 2.61 0.29 4.82 3.03 -1.26 -4.57 118.95 119.96 2j0s s ARG 152 Ca 0.31 1.36 -0.05 0.00 2.03 0.00 0.00 55.73 59.37 2j0s s ARG 152 Cb 0.06 -1.93 0.07 0.00 -1.03 0.00 0.00 34.95 32.13 2j0s s ARG 152 CO 0.10 -1.39 0.29 0.41 -1.13 0.00 0.00 175.30 173.58 2j0s n GLY 153 N -0.63 -2.14 0.00 3.88 0.00 -1.26 -5.05 105.19 99.98 2j0s n GLY 153 Ca 0.10 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2j0s n GLY 153 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77