#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j0q s GLN 67 N 0.00 0.42 0.35 0.54 -0.44 -1.06 -4.29 119.66 115.18 2j0q s GLN 67 Ca 0.00 0.74 -0.29 0.00 -2.50 0.00 0.00 55.36 53.31 2j0q s GLN 67 Cb 0.00 -0.07 -0.11 0.00 -1.64 0.00 0.00 33.01 31.18 2j0q s GLN 67 CO 0.00 -0.59 1.53 0.50 0.50 0.00 0.00 175.29 177.23 2j0q s ARG 68 N 2.65 4.10 0.79 1.67 3.52 -1.26 -4.66 118.95 125.77 2j0q s ARG 68 Ca 0.13 2.59 -0.07 0.00 -0.13 0.00 0.00 55.73 58.25 2j0q s ARG 68 Cb -0.15 -2.98 0.13 0.00 -1.56 0.00 0.00 34.95 30.39 2j0q s ARG 68 CO -0.17 -0.58 1.10 -1.12 -0.81 0.00 0.00 175.30 173.72 2j0q s SER 69 N 0.07 4.10 0.53 -2.12 0.01 0.43 -4.94 113.70 111.78 2j0q s SER 69 Ca 0.56 0.08 0.29 0.00 1.31 0.00 0.00 55.95 58.19 2j0q s SER 69 Cb -0.47 -0.44 1.43 0.00 0.21 0.00 0.00 66.02 66.75 2j0q s SER 69 CO 0.59 -2.05 1.93 1.62 0.41 0.00 0.00 173.24 175.73 2j0q h VAL 70 N -0.90 0.63 -0.13 3.43 3.04 -2.03 -2.68 116.25 117.61 2j0q h VAL 70 Ca -0.41 -0.01 -0.19 0.00 -1.01 0.00 0.00 66.70 65.07 2j0q h VAL 70 Cb 1.27 0.60 -0.37 0.00 -2.01 0.00 0.00 31.29 30.78 2j0q h VAL 70 CO 0.45 0.00 -0.98 -0.62 -1.01 0.00 0.00 177.57 175.41 2j0q n GLU 71 N -4.32 0.58 -3.62 4.17 1.02 -1.26 -5.13 120.64 112.08 2j0q n GLU 71 Ca 0.15 -2.37 0.00 0.00 -0.02 0.00 0.00 57.16 54.93 2j0q n GLU 71 Cb 0.82 -0.45 0.00 0.00 -0.02 0.00 0.00 31.44 31.79 2j0q n GLU 71 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2j0q n GLY 72 N 0.05 -2.12 3.67 0.62 0.00 -1.01 -4.78 105.19 101.61 2j0q n GLY 72 Ca 0.03 -1.36 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 2j0q n GLY 72 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2j0q s TRP 73 N -2.23 3.25 -0.13 1.61 0.52 0.43 0.16 118.94 122.56 2j0q s TRP 73 Ca 0.00 0.13 -0.01 0.00 0.02 0.00 0.00 56.10 56.24 2j0q s TRP 73 Cb 0.00 -1.96 -0.02 0.00 -1.15 0.00 0.00 33.47 30.34 2j0q s TRP 73 CO 0.00 0.31 -0.09 0.42 0.02 0.00 0.00 176.95 177.61 2j0q s ILE 74 N -0.19 3.41 -0.03 2.03 1.01 -1.26 -0.42 121.20 125.74 2j0q s ILE 74 Ca 0.07 -0.54 -0.03 0.00 0.00 0.00 0.00 60.65 60.15 2j0q s ILE 74 Cb -0.12 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 2j0q s ILE 74 CO 0.02 0.53 0.14 -0.76 0.00 0.00 0.00 174.94 174.86 2j0q s LEU 75 N 0.16 4.23 -0.13 2.97 1.43 0.19 -1.33 118.68 126.20 2j0q s LEU 75 Ca -0.05 0.32 -0.05 0.00 -1.03 0.00 0.00 54.13 53.32 2j0q s LEU 75 Cb -0.14 -2.39 -0.04 0.00 0.03 0.00 0.00 46.19 43.65 2j0q s LEU 75 CO 0.04 0.30 0.04 0.12 0.23 0.00 0.00 176.35 177.08 2j0q s PHE 76 N -1.22 3.24 -0.25 0.29 5.36 0.07 -1.39 117.98 124.09 2j0q s PHE 76 Ca 0.23 0.14 -0.01 0.00 -0.96 0.00 0.00 56.93 56.34 2j0q s PHE 76 Cb -0.12 -1.93 0.07 0.00 -0.34 0.00 0.00 43.02 40.70 2j0q s PHE 76 CO 0.14 0.34 0.02 0.08 -1.46 0.00 0.00 175.22 174.34 2j0q s VAL 77 N -0.33 1.04 0.34 3.12 1.01 -0.30 -2.02 120.40 123.26 2j0q s VAL 77 Ca 0.08 -1.10 0.03 0.00 0.00 0.00 0.00 61.98 60.99 2j0q s VAL 77 Cb -0.12 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 2j0q s VAL 77 CO 0.02 -0.32 0.51 0.42 0.00 0.00 0.00 175.10 175.73 2j0q s THR 78 N 1.59 4.62 -0.17 3.92 -4.23 -1.06 -1.50 115.64 118.81 2j0q s THR 78 Ca 0.01 -0.75 -0.01 0.00 -1.18 0.00 0.00 61.69 59.76 2j0q s THR 78 Cb -0.18 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 70.01 2j0q s THR 78 CO -0.12 -0.34 0.14 0.61 -0.54 0.00 0.00 174.62 174.37 2j0q n GLY 79 N -1.72 0.58 3.88 3.99 0.00 -1.10 -0.95 105.19 109.87 2j0q n GLY 79 Ca -0.03 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.17 2j0q n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j0q s VAL 80 N -3.04 5.08 0.02 1.61 1.01 -1.17 -4.19 120.40 119.71 2j0q s VAL 80 Ca 0.04 0.27 -0.29 0.00 0.00 0.00 0.00 61.98 62.01 2j0q s VAL 80 Cb -0.02 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2j0q s VAL 80 CO 0.10 0.07 0.92 -2.28 0.00 0.00 0.00 175.10 173.90 2j0q s HIS 81 N -1.64 3.69 0.55 5.22 2.46 -1.26 -4.64 115.29 119.67 2j0q s HIS 81 Ca 0.41 1.64 0.32 0.00 0.47 0.00 0.00 55.06 57.89 2j0q s HIS 81 Cb -0.12 -3.04 1.47 0.00 -0.13 0.00 0.00 32.58 30.76 2j0q s HIS 81 CO 0.22 0.07 1.85 1.05 -2.47 0.00 0.00 174.74 175.47 2j0q h GLU 82 N 6.44 0.00 -3.57 2.88 9.09 -1.97 -3.22 114.58 124.23 2j0q h GLU 82 Ca -0.42 0.00 -0.58 0.00 0.05 0.00 0.00 59.36 58.41 2j0q h GLU 82 Cb 1.21 0.00 -0.40 0.00 -1.65 0.00 0.00 28.75 27.91 2j0q h GLU 82 CO 0.74 0.00 -0.76 -1.83 0.05 0.00 0.00 179.01 177.21 2j0q s GLU 83 N -4.86 0.72 0.00 1.06 1.03 -1.26 -1.89 118.70 113.50 2j0q s GLU 83 Ca -0.05 -1.06 0.00 0.00 0.03 0.00 0.00 54.97 53.89 2j0q s GLU 83 Cb 0.20 -2.00 0.00 0.00 -0.80 0.00 0.00 34.13 31.53 2j0q s GLU 83 CO 0.71 -0.98 0.00 0.00 -1.33 0.00 0.00 175.26 173.66 2j0q n ALA 84 N 4.85 0.00 -2.25 -0.84 0.00 -1.22 -5.06 120.51 115.99 2j0q n ALA 84 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.19 2j0q n ALA 84 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2j0q n ALA 84 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2j0q s THR 85 N 0.00 2.14 0.00 0.00 -4.23 -1.26 -4.81 115.64 107.48 2j0q s THR 85 Ca 0.00 -1.32 0.00 0.00 -1.18 0.00 0.00 61.69 59.19 2j0q s THR 85 Cb 0.00 -2.46 0.00 0.00 1.34 0.00 0.00 72.50 71.38 2j0q s THR 85 CO 0.00 0.00 0.00 -1.84 -0.54 0.00 0.00 174.62 172.24 2j0q n GLU 86 N -1.80 0.00 -0.12 3.99 0.00 -1.26 -0.00 120.64 121.45 2j0q n GLU 86 Ca 0.04 0.00 0.16 0.00 0.00 0.00 0.00 57.16 57.36 2j0q n GLU 86 Cb 0.63 0.00 0.54 0.00 0.00 0.00 0.00 31.44 32.61 2j0q n GLU 86 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 2j0q h GLU 87 N 0.00 0.32 -0.28 3.44 -0.00 -1.98 1.05 114.58 117.14 2j0q h GLU 87 Ca 0.00 -0.02 -0.05 0.00 -0.00 0.00 0.00 59.36 59.29 2j0q h GLU 87 Cb 0.00 -0.07 -0.01 0.00 -0.00 0.00 0.00 28.75 28.67 2j0q h GLU 87 CO 0.00 0.21 -0.04 -0.44 -0.00 0.00 0.00 179.01 178.75 2j0q h ASP 88 N 0.33 0.51 0.08 3.06 5.19 -0.76 -2.09 116.42 122.75 2j0q h ASP 88 Ca 0.33 -0.34 -0.20 0.00 -0.62 0.00 0.00 57.03 56.20 2j0q h ASP 88 Cb 0.84 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.21 2j0q h ASP 88 CO -0.09 0.73 -0.73 0.40 -3.12 0.00 0.00 179.24 176.43 2j0q h ILE 89 N 0.28 1.33 -0.65 0.35 5.03 -0.85 -2.59 117.51 120.41 2j0q h ILE 89 Ca 0.07 -2.05 -0.01 0.00 -0.12 0.00 0.00 64.86 62.76 2j0q h ILE 89 Cb 0.49 2.03 -0.03 0.00 -3.03 0.00 0.00 36.82 36.29 2j0q h ILE 89 CO 0.02 0.63 0.38 -0.74 -0.68 0.00 0.00 178.15 177.76 2j0q h HIS 90 N 0.39 0.88 -0.17 1.37 2.76 0.95 -2.98 115.15 118.35 2j0q h HIS 90 Ca -0.04 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.01 2j0q h HIS 90 Cb 1.33 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 30.00 2j0q h HIS 90 CO 0.06 0.61 -0.34 -0.44 -1.30 0.00 0.00 177.93 176.52 2j0q h ASP 91 N 0.89 0.59 -0.08 3.26 3.32 -1.25 0.54 116.42 123.70 2j0q h ASP 91 Ca 0.23 -0.55 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 2j0q h ASP 91 Cb 0.00 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 2j0q h ASP 91 CO -0.04 1.04 0.05 0.11 -1.72 0.00 0.00 179.24 178.67 2j0q h LYS 92 N 0.17 0.11 0.00 3.56 1.79 -1.55 -3.04 116.57 117.62 2j0q h LYS 92 Ca 0.01 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2j0q h LYS 92 Cb 0.94 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 2j0q h LYS 92 CO 0.08 0.13 -0.07 0.74 -1.08 0.00 0.00 179.45 179.25 2j0q h PHE 93 N 0.06 0.00 -0.63 -1.35 0.04 -1.55 -3.36 116.94 110.15 2j0q h PHE 93 Ca 0.03 0.00 0.13 0.00 2.80 0.00 0.00 57.97 60.92 2j0q h PHE 93 Cb 0.05 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 38.08 2j0q h PHE 93 CO -0.05 0.00 -0.16 0.00 -0.60 0.00 0.00 178.31 177.49 2j0q h ALA 94 N 2.41 0.41 0.00 2.45 0.00 0.23 -2.91 119.26 121.85 2j0q h ALA 94 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2j0q h ALA 94 Cb 0.80 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2j0q h ALA 94 CO 0.00 -0.43 0.00 0.39 0.00 0.00 0.00 179.25 179.21 2j0q n GLU 95 N -5.43 0.61 -0.06 0.00 1.02 -1.26 -1.55 120.64 113.97 2j0q n GLU 95 Ca 0.08 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.26 2j0q n GLU 95 Cb 0.33 -1.29 0.07 0.00 -0.02 0.00 0.00 31.44 30.53 2j0q n GLU 95 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2j0q n TYR 96 N -0.79 0.15 0.00 -0.32 4.02 -1.10 -5.09 117.16 114.03 2j0q n TYR 96 Ca 0.09 -0.22 0.00 0.00 -0.01 0.00 0.00 57.90 57.76 2j0q n TYR 96 Cb 0.04 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.35 2j0q n TYR 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2j0q n GLY 97 N 0.39 1.64 3.64 2.72 0.00 -0.60 -4.60 105.19 108.38 2j0q n GLY 97 Ca 0.07 -1.40 -0.43 0.00 0.00 0.00 0.00 46.02 44.26 2j0q n GLY 97 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j0q s GLU 98 N -1.89 3.97 -0.10 1.61 2.56 -1.26 -4.67 118.70 118.92 2j0q s GLU 98 Ca 0.00 1.46 -0.30 0.00 0.00 0.00 0.00 54.97 56.13 2j0q s GLU 98 Cb 0.00 -3.89 -0.02 0.00 2.00 0.00 0.00 34.13 32.22 2j0q s GLU 98 CO 0.00 -1.05 1.09 0.42 -0.56 0.00 0.00 175.26 175.16 2j0q s ILE 99 N 4.33 4.57 0.12 -3.70 1.01 -1.26 -4.44 121.20 121.82 2j0q s ILE 99 Ca 0.60 1.86 0.07 0.00 0.00 0.00 0.00 60.65 63.18 2j0q s ILE 99 Cb -0.20 -4.20 -0.20 0.00 0.01 0.00 0.00 42.46 37.88 2j0q s ILE 99 CO 0.23 -0.02 1.29 0.11 0.00 0.00 0.00 174.94 176.55 2j0q h LYS 100 N 7.30 0.00 -1.87 2.79 1.79 -1.44 -3.48 116.57 121.67 2j0q h LYS 100 Ca -0.31 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.15 2j0q h LYS 100 Cb 1.14 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 31.59 2j0q h LYS 100 CO 0.88 0.98 0.29 1.21 -1.08 0.00 0.00 179.45 181.73 2j0q s ASN 101 N -6.71 -0.58 -0.01 0.86 3.84 -1.15 -4.99 114.94 106.21 2j0q s ASN 101 Ca 0.01 0.66 0.01 0.00 0.21 0.00 0.00 52.86 53.75 2j0q s ASN 101 Cb 0.10 0.51 0.01 0.00 -0.55 0.00 0.00 41.25 41.32 2j0q s ASN 101 CO 0.82 -0.52 -0.02 -0.63 -2.79 0.00 0.00 177.10 173.96 2j0q s ILE 102 N -1.09 0.24 -0.12 -5.21 1.01 -1.26 -1.20 121.20 113.56 2j0q s ILE 102 Ca -0.08 -0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.53 2j0q s ILE 102 Cb -0.00 -0.25 0.00 0.00 0.01 0.00 0.00 42.46 42.22 2j0q s ILE 102 CO 0.07 0.10 -0.22 -1.00 0.00 0.00 0.00 174.94 173.89 2j0q s HIS 103 N 0.29 2.63 -0.45 3.97 3.76 -0.93 -4.99 115.29 119.56 2j0q s HIS 103 Ca -0.03 -1.08 0.03 0.00 -0.15 0.00 0.00 55.06 53.83 2j0q s HIS 103 Cb -0.06 -1.76 0.15 0.00 1.11 0.00 0.00 32.58 32.02 2j0q s HIS 103 CO -0.01 -0.45 0.30 -1.17 -0.85 0.00 0.00 174.74 172.56 2j0q s LEU 104 N 0.50 2.34 0.49 0.89 2.96 -1.26 -1.44 118.68 123.16 2j0q s LEU 104 Ca -0.14 -2.83 -0.18 0.00 -0.22 0.00 0.00 54.13 50.76 2j0q s LEU 104 Cb -0.17 -0.85 -0.08 0.00 0.50 0.00 0.00 46.19 45.59 2j0q s LEU 104 CO 0.05 -0.22 0.99 0.20 -1.32 0.00 0.00 176.35 176.04 2j0q s ASN 105 N 0.15 6.61 0.20 3.68 0.01 -1.26 -4.97 114.94 119.37 2j0q s ASN 105 Ca 0.23 1.67 0.08 0.00 -0.71 0.00 0.00 52.86 54.13 2j0q s ASN 105 Cb -0.14 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 38.95 2j0q s ASN 105 CO -0.07 -0.59 -0.03 -0.76 -1.51 0.00 0.00 177.10 174.14 2j0q s LEU 106 N -3.78 3.18 0.25 0.60 1.02 -1.26 -1.71 118.68 116.99 2j0q s LEU 106 Ca 0.61 -0.51 -0.30 0.00 0.02 0.00 0.00 54.13 53.95 2j0q s LEU 106 Cb -0.11 -1.81 -0.09 0.00 0.02 0.00 0.00 46.19 44.20 2j0q s LEU 106 CO 0.25 0.07 1.25 -0.62 0.02 0.00 0.00 176.35 177.32 2j0q s ASP 107 N -3.09 6.96 0.00 2.29 -1.08 0.16 -4.64 116.67 117.27 2j0q s ASP 107 Ca 0.28 2.44 0.21 0.00 -0.52 0.00 0.00 52.55 54.95 2j0q s ASP 107 Cb -0.08 -2.62 0.62 0.00 -1.46 0.00 0.00 42.92 39.38 2j0q s ASP 107 CO 0.18 -0.43 1.48 0.54 0.52 0.00 0.00 175.17 177.46 2j0q n ARG 108 N 1.77 1.95 -0.03 4.34 5.12 -1.26 -2.06 116.66 126.49 2j0q n ARG 108 Ca 0.03 -1.44 -0.06 0.00 -1.93 0.00 0.00 57.85 54.45 2j0q n ARG 108 Cb 0.43 -1.42 -0.02 0.00 -1.16 0.00 0.00 32.46 30.29 2j0q n ARG 108 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2j0q n ARG 109 N 0.66 0.13 -0.05 5.56 0.63 -1.26 -4.85 116.66 117.47 2j0q n ARG 109 Ca 0.17 0.05 -0.11 0.00 -0.92 0.00 0.00 57.85 57.04 2j0q n ARG 109 Cb 0.40 -0.71 -0.10 0.00 0.45 0.00 0.00 32.46 32.50 2j0q n ARG 109 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 2j0q h THR 110 N -0.21 1.37 0.00 5.15 1.35 -1.99 -3.48 112.91 115.09 2j0q h THR 110 Ca -0.15 -1.94 0.00 0.00 -0.55 0.00 0.00 66.41 63.77 2j0q h THR 110 Cb 1.10 2.54 0.00 0.00 -1.73 0.00 0.00 68.15 70.06 2j0q h THR 110 CO -0.09 0.45 0.00 0.61 -0.25 0.00 0.00 175.52 176.24 2j0q n GLY 111 N 1.50 1.95 3.78 5.82 0.00 -0.87 -5.04 105.19 112.32 2j0q n GLY 111 Ca -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 2j0q n GLY 111 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j0q s TYR 112 N -2.21 1.58 0.44 1.61 1.51 -1.26 -4.54 117.35 114.47 2j0q s TYR 112 Ca 0.00 0.56 -0.24 0.00 -1.01 0.00 0.00 57.07 56.38 2j0q s TYR 112 Cb 0.00 -3.66 -0.08 0.00 -0.11 0.00 0.00 41.96 38.11 2j0q s TYR 112 CO 0.00 -2.93 1.16 -0.51 -1.11 0.00 0.00 175.55 172.16 2j0q s LEU 113 N -6.26 4.07 0.31 -1.29 1.43 -0.79 0.39 118.68 116.54 2j0q s LEU 113 Ca 0.69 2.30 0.26 0.00 -1.03 0.00 0.00 54.13 56.35 2j0q s LEU 113 Cb -0.09 -4.18 0.82 0.00 0.03 0.00 0.00 46.19 42.76 2j0q s LEU 113 CO 0.54 -0.82 1.75 0.50 0.23 0.00 0.00 176.35 178.55 2j0q h LYS 114 N 2.23 0.00 0.00 1.70 1.63 -1.59 -3.42 116.57 117.12 2j0q h LYS 114 Ca -0.49 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.31 2j0q h LYS 114 Cb 1.24 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 2j0q h LYS 114 CO 0.61 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 177.02 2j0q n GLY 115 N 0.82 0.95 3.23 5.01 0.00 -1.26 -4.98 105.19 108.95 2j0q n GLY 115 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 2j0q n GLY 115 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2j0q s TYR 116 N -2.00 1.20 -0.03 1.61 -0.85 -1.26 -2.71 117.35 113.30 2j0q s TYR 116 Ca 0.00 -1.18 -0.27 0.00 -0.52 0.00 0.00 57.07 55.10 2j0q s TYR 116 Cb 0.00 -0.67 0.06 0.00 0.38 0.00 0.00 41.96 41.73 2j0q s TYR 116 CO 0.00 -0.40 0.59 -0.08 -1.52 0.00 0.00 175.55 174.15 2j0q s THR 117 N -3.87 0.01 0.10 -3.49 -1.32 -0.56 -4.23 115.64 102.28 2j0q s THR 117 Ca 0.30 -0.11 0.05 0.00 -1.21 0.00 0.00 61.69 60.72 2j0q s THR 117 Cb 0.07 -0.92 -0.04 0.00 -1.51 0.00 0.00 72.50 70.10 2j0q s THR 117 CO 0.07 -0.06 0.02 -0.76 -2.21 0.00 0.00 174.62 171.68 2j0q s LEU 118 N -1.29 3.52 -0.04 9.08 1.02 -0.52 -1.15 118.68 129.30 2j0q s LEU 118 Ca -0.11 -0.17 -0.02 0.00 0.02 0.00 0.00 54.13 53.85 2j0q s LEU 118 Cb -0.01 -2.23 0.03 0.00 0.02 0.00 0.00 46.19 44.00 2j0q s LEU 118 CO 0.08 0.16 0.06 -0.69 0.02 0.00 0.00 176.35 175.98 2j0q s VAL 119 N -1.38 -0.09 -0.21 -1.59 1.01 -0.48 -2.20 120.40 115.46 2j0q s VAL 119 Ca 0.27 0.42 -0.06 0.00 0.00 0.00 0.00 61.98 62.60 2j0q s VAL 119 Cb -0.11 -0.16 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 2j0q s VAL 119 CO 0.19 0.18 0.04 -0.70 0.00 0.00 0.00 175.10 174.81 2j0q s GLU 120 N 2.16 3.74 0.40 2.72 2.12 -0.34 0.57 118.70 130.06 2j0q s GLU 120 Ca 0.05 -0.46 0.08 0.00 0.36 0.00 0.00 54.97 55.00 2j0q s GLU 120 Cb -0.12 -3.17 -0.03 0.00 0.26 0.00 0.00 34.13 31.06 2j0q s GLU 120 CO -0.03 0.05 0.29 0.71 -0.54 0.00 0.00 175.26 175.74 2j0q s TYR 121 N 0.94 2.69 -0.09 5.30 2.02 0.44 -1.08 117.35 127.57 2j0q s TYR 121 Ca 0.03 -0.50 -0.22 0.00 -0.37 0.00 0.00 57.07 56.01 2j0q s TYR 121 Cb -0.14 -2.04 -0.28 0.00 -0.40 0.00 0.00 41.96 39.10 2j0q s TYR 121 CO 0.02 0.03 0.73 1.49 -1.57 0.00 0.00 175.55 176.25 2j0q h GLU 122 N 1.20 0.21 -6.67 -0.62 4.57 -1.85 0.12 114.58 111.55 2j0q h GLU 122 Ca -0.42 -0.36 -0.67 0.00 -1.18 0.00 0.00 59.36 56.74 2j0q h GLU 122 Cb 1.26 0.13 -0.18 0.00 -0.16 0.00 0.00 28.75 29.80 2j0q h GLU 122 CO 0.62 1.17 -0.80 0.95 -1.18 0.00 0.00 179.01 179.77 2j0q s THR 123 N -2.40 2.76 0.22 0.32 -4.23 -1.26 -4.33 115.64 106.73 2j0q s THR 123 Ca -0.17 -1.65 -0.11 0.00 -1.18 0.00 0.00 61.69 58.58 2j0q s THR 123 Cb 0.01 -2.29 0.26 0.00 1.34 0.00 0.00 72.50 71.83 2j0q s THR 123 CO 0.77 0.02 1.62 0.22 -0.54 0.00 0.00 174.62 176.72 2j0q h TYR 124 N 3.51 -0.28 -0.04 3.99 3.20 -1.97 -2.33 116.97 123.05 2j0q h TYR 124 Ca -0.49 0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.47 2j0q h TYR 124 Cb 1.18 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 39.64 2j0q h TYR 124 CO 0.62 -0.28 -0.17 -0.22 -1.64 0.00 0.00 178.16 176.48 2j0q h LYS 125 N 0.03 -0.25 0.00 1.82 3.64 -1.99 0.12 116.57 119.94 2j0q h LYS 125 Ca 0.34 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.71 2j0q h LYS 125 Cb 0.55 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2j0q h LYS 125 CO -0.68 -0.17 -0.14 1.05 -2.27 0.00 0.00 179.45 177.24 2j0q h GLU 126 N -0.26 0.00 0.00 1.90 4.11 -1.75 -1.86 114.58 116.73 2j0q h GLU 126 Ca 0.07 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.50 2j0q h GLU 126 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2j0q h GLU 126 CO -0.19 0.14 -0.00 0.00 0.07 0.00 0.00 179.01 179.03 2j0q h ALA 127 N 1.86 -0.00 -0.74 1.06 0.00 -0.83 -2.95 119.26 117.65 2j0q h ALA 127 Ca -0.00 -0.40 0.10 0.00 0.00 0.00 0.00 54.91 54.61 2j0q h ALA 127 Cb 0.67 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 2j0q h ALA 127 CO 0.02 -0.01 0.49 0.37 0.00 0.00 0.00 179.25 180.11 2j0q h GLN 128 N -0.98 0.60 -0.31 0.00 4.15 -0.79 -0.90 115.11 116.87 2j0q h GLN 128 Ca -0.00 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.39 2j0q h GLN 128 Cb 0.81 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.35 2j0q h GLN 128 CO 0.00 0.40 0.20 0.00 -1.93 0.00 0.00 178.83 177.50 2j0q h ALA 129 N 1.63 0.39 0.00 3.38 0.00 -1.42 -1.90 119.26 121.34 2j0q h ALA 129 Ca 0.34 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 2j0q h ALA 129 Cb 0.51 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2j0q h ALA 129 CO -0.12 -0.15 -0.33 0.00 0.00 0.00 0.00 179.25 178.65 2j0q h ALA 130 N 1.11 0.94 0.19 0.00 0.00 -1.12 0.27 119.26 120.66 2j0q h ALA 130 Ca 0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2j0q h ALA 130 Cb -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2j0q h ALA 130 CO -0.03 0.41 -0.09 1.98 0.00 0.00 0.00 179.25 181.52 2j0q h MET 131 N 0.00 -0.25 -0.56 0.00 -1.53 -1.00 -1.26 114.93 110.32 2j0q h MET 131 Ca -0.00 0.02 -0.03 0.00 -3.44 0.00 0.00 59.70 56.24 2j0q h MET 131 Cb 0.93 0.06 -0.03 0.00 -0.55 0.00 0.00 31.60 32.01 2j0q h MET 131 CO 0.04 0.15 0.21 0.93 0.14 0.00 0.00 176.91 178.38 2j0q h GLU 132 N -0.78 0.81 -0.41 0.39 3.07 -1.36 -1.94 114.58 114.36 2j0q h GLU 132 Ca -0.03 -0.13 -0.11 0.00 -0.50 0.00 0.00 59.36 58.60 2j0q h GLU 132 Cb 0.51 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.27 2j0q h GLU 132 CO 0.04 0.67 -0.16 0.78 -1.40 0.00 0.00 179.01 178.95 2j0q h GLY 133 N 0.93 0.90 0.00 -3.84 0.00 -0.39 -3.37 103.07 97.30 2j0q h GLY 133 Ca 0.19 -0.78 0.00 0.00 0.00 0.00 0.00 47.33 46.74 2j0q h GLY 133 CO -0.02 0.71 -0.25 1.04 0.00 0.00 0.00 176.54 178.03 2j0q n LEU 134 N -4.26 0.16 -4.55 3.11 4.77 -0.48 -4.91 117.00 110.83 2j0q n LEU 134 Ca -0.01 -0.46 -0.18 0.00 -0.03 0.00 0.00 56.01 55.32 2j0q n LEU 134 Cb 0.41 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.43 2j0q n LEU 134 CO 0.44 0.04 1.42 -3.20 -1.33 0.00 0.00 177.39 174.77 2j0q n ASN 135 N -1.13 1.76 0.00 -1.43 5.15 -0.73 -1.79 115.26 117.09 2j0q n ASN 135 Ca 0.01 -1.24 0.00 0.00 -0.60 0.00 0.00 54.58 52.74 2j0q n ASN 135 Cb 0.06 -1.60 0.00 0.00 -0.53 0.00 0.00 39.78 37.71 2j0q n ASN 135 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2j0q n GLY 136 N 6.60 1.02 3.90 8.20 0.00 0.34 -4.92 105.19 120.32 2j0q n GLY 136 Ca 0.46 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.20 2j0q n GLY 136 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j0q s GLN 137 N 0.00 3.42 1.02 1.61 -1.52 -0.74 -4.57 119.66 118.87 2j0q s GLN 137 Ca 0.00 0.33 -0.17 0.00 -1.95 0.00 0.00 55.36 53.56 2j0q s GLN 137 Cb 0.00 -2.26 0.25 0.00 -0.22 0.00 0.00 33.01 30.78 2j0q s GLN 137 CO 0.00 -0.43 1.10 -0.25 -0.25 0.00 0.00 175.29 175.46 2j0q n ASP 138 N -2.49 -1.04 0.00 5.90 10.43 -1.26 -0.53 116.55 127.57 2j0q n ASP 138 Ca 0.03 -1.26 0.00 0.00 2.57 0.00 0.00 54.79 56.13 2j0q n ASP 138 Cb 0.55 -0.93 0.00 0.00 1.84 0.00 0.00 41.12 42.59 2j0q n ASP 138 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2j0q n LEU 139 N 0.00 0.00 -2.15 0.64 4.32 -1.23 -4.74 117.00 113.85 2j0q n LEU 139 Ca 0.15 0.00 -0.22 0.00 -0.02 0.00 0.00 56.01 55.92 2j0q n LEU 139 Cb 0.53 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 42.36 2j0q n LEU 139 CO 0.38 -0.28 0.16 0.23 -1.22 0.00 0.00 177.39 176.66 2j0q n MET 140 N -1.84 3.39 0.00 3.23 2.81 -1.26 -5.00 117.12 118.45 2j0q n MET 140 Ca 0.00 -4.13 0.00 0.00 -1.81 0.00 0.00 57.70 51.76 2j0q n MET 140 Cb 0.00 -2.20 0.00 0.00 -0.71 0.00 0.00 33.22 30.31 2j0q n MET 140 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2j0q n GLY 141 N -0.67 0.78 3.52 3.03 0.00 -1.26 -4.98 105.19 105.61 2j0q n GLY 141 Ca 0.40 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 2j0q n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j0q n GLN 142 N 0.00 0.22 -2.70 1.61 0.00 -1.26 -4.60 117.38 110.65 2j0q n GLN 142 Ca 0.00 0.13 -0.36 0.00 0.00 0.00 0.00 57.00 56.76 2j0q n GLN 142 Cb 0.00 -2.00 -0.06 0.00 0.00 0.00 0.00 30.24 28.19 2j0q n GLN 142 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2j0q s PRO 143 N -3.22 4.39 0.16 2.61 0.04 -1.26 -3.48 135.00 134.24 2j0q s PRO 143 Ca 0.67 1.36 -0.07 0.00 0.04 0.00 0.00 61.00 63.00 2j0q s PRO 143 Cb -0.32 -2.63 -0.06 0.00 0.04 0.00 0.00 34.50 31.54 2j0q s PRO 143 CO 0.57 0.09 0.44 0.96 0.04 0.00 0.00 177.00 179.10 2j0q s ILE 144 N -1.71 5.08 -0.05 0.56 -4.36 0.31 -4.67 121.20 116.36 2j0q s ILE 144 Ca 0.54 0.24 -0.03 0.00 -0.26 0.00 0.00 60.65 61.14 2j0q s ILE 144 Cb -0.18 -3.63 -0.04 0.00 1.25 0.00 0.00 42.46 39.86 2j0q s ILE 144 CO 0.24 0.04 0.11 -0.44 0.24 0.00 0.00 174.94 175.12 2j0q s SER 145 N -2.31 5.95 -0.19 4.36 0.01 -0.13 -0.51 113.70 120.89 2j0q s SER 145 Ca 0.42 0.27 -0.03 0.00 1.31 0.00 0.00 55.95 57.92 2j0q s SER 145 Cb -0.12 -1.80 0.06 0.00 0.21 0.00 0.00 66.02 64.37 2j0q s SER 145 CO 0.23 0.32 0.05 -0.69 0.41 0.00 0.00 173.24 173.56 2j0q s VAL 146 N -1.14 0.34 0.40 3.43 1.01 -1.26 -2.56 120.40 120.62 2j0q s VAL 146 Ca 0.21 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.79 2j0q s VAL 146 Cb -0.12 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2j0q s VAL 146 CO 0.11 -0.23 0.08 -1.81 0.00 0.00 0.00 175.10 173.25 2j0q s ASP 147 N 1.94 2.91 0.52 3.32 1.01 -0.86 -4.81 116.67 120.70 2j0q s ASP 147 Ca -0.00 -1.57 -0.22 0.00 0.71 0.00 0.00 52.55 51.48 2j0q s ASP 147 Cb -0.17 0.29 -0.06 0.00 1.01 0.00 0.00 42.92 43.99 2j0q s ASP 147 CO -0.08 -0.80 1.23 0.26 0.21 0.00 0.00 175.17 175.99 2j0q s TRP 148 N -3.16 2.58 -0.17 4.23 0.23 -1.26 -0.75 118.94 120.63 2j0q s TRP 148 Ca 0.25 1.48 -0.21 0.00 -2.03 0.00 0.00 56.10 55.60 2j0q s TRP 148 Cb 0.05 -3.53 -0.18 0.00 0.03 0.00 0.00 33.47 29.84 2j0q s TRP 148 CO 0.13 -2.09 0.33 0.00 0.96 0.00 0.00 176.95 176.28 2j0q s PHE 150 N -2.25 2.78 0.12 0.00 0.08 -1.26 -4.98 117.98 112.47 2j0q s PHE 150 Ca -0.22 -0.26 -0.14 0.00 0.12 0.00 0.00 56.93 56.42 2j0q s PHE 150 Cb 0.02 -1.42 0.03 0.00 -0.57 0.00 0.00 43.02 41.08 2j0q s PHE 150 CO 0.54 0.48 0.36 0.14 -0.10 0.00 0.00 175.22 176.64 2j0q s VAL 151 N -2.33 0.08 1.13 -0.44 -7.23 -1.26 -2.58 120.40 107.78 2j0q s VAL 151 Ca 0.34 -0.71 -0.17 0.00 -1.81 0.00 0.00 61.98 59.64 2j0q s VAL 151 Cb -0.05 -1.21 0.25 0.00 0.56 0.00 0.00 36.38 35.94 2j0q s VAL 151 CO 0.22 -0.39 1.12 0.00 -0.31 0.00 0.00 175.10 175.74 2j0q s ARG 152 N -3.82 -0.66 0.00 4.82 3.03 -1.26 -4.82 118.95 116.24 2j0q s ARG 152 Ca 0.03 0.06 0.00 0.00 2.03 0.00 0.00 55.73 57.85 2j0q s ARG 152 Cb 0.02 -1.65 0.00 0.00 -1.03 0.00 0.00 34.95 32.29 2j0q s ARG 152 CO -0.12 -3.37 0.00 0.41 -1.13 0.00 0.00 175.30 171.10 2j0q n GLY 153 N -1.18 -3.21 0.51 3.88 0.00 -1.26 -5.11 105.19 98.83 2j0q n GLY 153 Ca 0.11 -1.26 0.14 0.00 0.00 0.00 0.00 46.02 45.00 2j0q n GLY 153 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77