#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jx9 n LEU 30 N 0.00 -6.03 -4.34 0.99 4.77 -1.26 -4.91 117.00 106.22 2jx9 n LEU 30 Ca 0.00 -0.11 -0.36 0.00 -0.03 0.00 0.00 56.01 55.51 2jx9 n LEU 30 Cb 0.00 -2.99 0.07 0.00 -2.33 0.00 0.00 43.42 38.17 2jx9 n LEU 30 CO 0.00 -1.05 -0.33 -2.65 -1.33 0.00 0.00 177.39 172.03 2jx9 n PRO 31 N -1.58 0.08 0.21 3.23 -0.02 -1.26 -4.90 135.00 130.78 2jx9 n PRO 31 Ca -0.03 0.06 0.12 0.00 -2.02 0.00 0.00 63.50 61.62 2jx9 n PRO 31 Cb 0.53 -1.57 0.16 0.00 -0.02 0.00 0.00 33.50 32.61 2jx9 n PRO 31 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2jx9 h PHE 32 N -0.68 0.00 -0.00 6.00 0.04 -1.91 -3.47 116.94 116.92 2jx9 h PHE 32 Ca -0.44 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.33 2jx9 h PHE 32 Cb 1.34 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.49 2jx9 h PHE 32 CO 0.31 0.01 -0.00 0.41 -0.60 0.00 0.00 178.31 178.45 2jx9 n GLY 33 N 1.11 0.46 2.68 -1.45 0.00 -1.26 -4.91 105.19 101.82 2jx9 n GLY 33 Ca 0.04 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 2jx9 n GLY 33 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2jx9 n LEU 34 N -0.01 -2.31 -1.46 0.99 -0.00 -1.26 -5.13 117.00 107.82 2jx9 n LEU 34 Ca -0.00 -3.64 0.00 0.00 -0.00 0.00 0.00 56.01 52.37 2jx9 n LEU 34 Cb 0.00 0.86 -0.00 0.00 -0.00 0.00 0.00 43.42 44.29 2jx9 n LEU 34 CO 0.00 2.05 -0.37 0.23 -0.00 0.00 0.00 177.39 179.30 2jx9 n MET 35 N 1.04 -3.15 -3.41 1.96 2.81 -1.26 -4.87 117.12 110.25 2jx9 n MET 35 Ca 0.09 2.45 -0.33 0.00 -1.81 0.00 0.00 57.70 58.10 2jx9 n MET 35 Cb 0.65 -3.20 -0.05 0.00 -0.71 0.00 0.00 33.22 29.91 2jx9 n MET 35 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2jx9 s ARG 36 N -5.08 3.83 -0.15 0.03 0.52 -0.19 -4.79 118.95 113.13 2jx9 s ARG 36 Ca 0.00 0.31 -0.12 0.00 -0.52 0.00 0.00 55.73 55.41 2jx9 s ARG 36 Cb 0.00 -2.70 0.04 0.00 0.52 0.00 0.00 34.95 32.81 2jx9 s ARG 36 CO 0.00 0.35 0.38 0.50 0.02 0.00 0.00 175.30 176.55 2jx9 s ARG 37 N -2.65 0.42 0.03 3.54 3.52 -1.26 -1.07 118.95 121.49 2jx9 s ARG 37 Ca 0.45 0.59 0.05 0.00 -0.13 0.00 0.00 55.73 56.69 2jx9 s ARG 37 Cb -0.12 0.14 -0.02 0.00 -1.56 0.00 0.00 34.95 33.39 2jx9 s ARG 37 CO 0.21 -0.08 -0.14 -1.21 -0.81 0.00 0.00 175.30 173.26 2jx9 s GLU 38 N 0.54 0.98 0.00 5.12 0.41 -0.63 -5.00 118.70 120.12 2jx9 s GLU 38 Ca -0.03 -0.72 0.00 0.00 -0.41 0.00 0.00 54.97 53.82 2jx9 s GLU 38 Cb -0.04 -0.98 -0.00 0.00 -1.78 0.00 0.00 34.13 31.32 2jx9 s GLU 38 CO -0.03 0.25 -0.02 -1.17 -0.49 0.00 0.00 175.26 173.80 2jx9 s LEU 39 N -0.99 2.05 -0.02 1.80 0.20 -1.26 -1.06 118.68 119.39 2jx9 s LEU 39 Ca 0.02 -0.12 -0.04 0.00 0.69 0.00 0.00 54.13 54.69 2jx9 s LEU 39 Cb -0.07 -0.05 0.01 0.00 -0.43 0.00 0.00 46.19 45.64 2jx9 s LEU 39 CO 0.01 -0.04 0.09 0.00 -0.29 0.00 0.00 176.35 176.12 2jx9 s ALA 40 N -0.30 -0.22 0.24 5.97 0.00 -0.88 -5.00 121.76 121.58 2jx9 s ALA 40 Ca -0.02 0.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.76 2jx9 s ALA 40 Cb -0.02 -0.09 -0.10 0.00 0.00 0.00 0.00 23.12 22.91 2jx9 s ALA 40 CO -0.00 -0.08 1.39 0.00 0.00 0.00 0.00 175.76 177.06 2jx9 n GLU 42 N 2.32 1.05 0.00 0.00 2.13 -0.95 -1.68 120.64 123.51 2jx9 n GLU 42 Ca 0.06 0.37 0.00 0.00 0.66 0.00 0.00 57.16 58.25 2jx9 n GLU 42 Cb 0.41 -1.83 0.00 0.00 0.27 0.00 0.00 31.44 30.29 2jx9 n GLU 42 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jx9 n GLY 43 N 1.93 2.45 3.76 8.31 0.00 -1.02 -4.93 105.19 115.68 2jx9 n GLY 43 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 2jx9 n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jx9 s TYR 44 N -2.50 3.04 0.54 1.61 1.51 -0.68 -4.84 117.35 116.03 2jx9 s TYR 44 Ca 0.00 -0.07 -0.16 0.00 -1.01 0.00 0.00 57.07 55.82 2jx9 s TYR 44 Cb 0.00 -1.44 -0.07 0.00 -0.11 0.00 0.00 41.96 40.34 2jx9 s TYR 44 CO 0.00 0.52 1.01 -1.25 -1.11 0.00 0.00 175.55 174.72 2jx9 s PRO 45 N -3.20 3.76 0.13 -1.71 0.04 -1.26 -2.03 135.00 130.73 2jx9 s PRO 45 Ca 0.30 1.03 0.09 0.00 0.04 0.00 0.00 61.00 62.47 2jx9 s PRO 45 Cb -0.09 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 2jx9 s PRO 45 CO 0.22 -0.43 -0.18 -1.50 0.04 0.00 0.00 177.00 175.15 2jx9 s ILE 46 N -2.57 2.83 -0.07 0.56 2.07 0.35 -4.85 121.20 119.53 2jx9 s ILE 46 Ca 0.60 -1.56 0.03 0.00 -1.41 0.00 0.00 60.65 58.31 2jx9 s ILE 46 Cb -0.12 -2.31 0.01 0.00 0.13 0.00 0.00 42.46 40.17 2jx9 s ILE 46 CO 0.33 0.07 -0.15 -0.70 -1.91 0.00 0.00 174.94 172.58 2jx9 s GLU 47 N -2.24 1.93 -0.05 3.50 2.12 -1.26 -2.58 118.70 120.12 2jx9 s GLU 47 Ca 0.19 -0.52 0.06 0.00 0.36 0.00 0.00 54.97 55.06 2jx9 s GLU 47 Cb -0.10 -1.57 -0.01 0.00 0.26 0.00 0.00 34.13 32.71 2jx9 s GLU 47 CO 0.10 0.09 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.18 2jx9 s LEU 48 N 0.51 2.02 -0.10 2.70 1.43 -0.74 -4.98 118.68 119.52 2jx9 s LEU 48 Ca -0.14 -0.45 -0.07 0.00 -1.03 0.00 0.00 54.13 52.45 2jx9 s LEU 48 Cb -0.15 -1.23 0.04 0.00 0.03 0.00 0.00 46.19 44.87 2jx9 s LEU 48 CO 0.04 0.23 0.24 -0.13 0.23 0.00 0.00 176.35 176.96 2jx9 s ARG 49 N -0.17 0.23 -0.01 1.70 0.52 -1.26 -1.61 118.95 118.36 2jx9 s ARG 49 Ca -0.02 0.43 -0.01 0.00 -0.52 0.00 0.00 55.73 55.62 2jx9 s ARG 49 Cb -0.12 -0.00 -0.04 0.00 0.52 0.00 0.00 34.95 35.30 2jx9 s ARG 49 CO 0.02 -0.10 0.10 0.00 0.02 0.00 0.00 175.30 175.34 2jx9 s PRO 51 N -1.77 2.77 3.53 0.00 0.04 -1.26 -4.72 135.00 133.59 2jx9 s PRO 51 Ca 0.24 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.61 2jx9 s PRO 51 Cb -0.12 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2jx9 s PRO 51 CO 0.15 -1.26 0.00 0.41 0.04 0.00 0.00 177.00 176.33 2jx9 n GLY 52 N -0.68 2.88 1.73 0.56 0.00 -1.26 -1.60 105.19 106.82 2jx9 n GLY 52 Ca 0.10 -0.08 0.01 0.00 0.00 0.00 0.00 46.02 46.05 2jx9 n GLY 52 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jx9 n SER 53 N 2.26 4.87 -4.85 1.61 3.41 -1.26 -4.98 113.62 114.67 2jx9 n SER 53 Ca 0.00 -3.12 -0.30 0.00 -0.26 0.00 0.00 58.87 55.19 2jx9 n SER 53 Cb 0.00 -0.69 0.07 0.00 -0.26 0.00 0.00 64.21 63.33 2jx9 n SER 53 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2jx9 s ASP 54 N -1.20 4.98 0.05 4.04 1.01 -0.63 -1.88 116.67 123.04 2jx9 s ASP 54 Ca 0.52 1.17 0.07 0.00 0.71 0.00 0.00 52.55 55.03 2jx9 s ASP 54 Cb 0.41 -1.92 -0.03 0.00 1.01 0.00 0.00 42.92 42.40 2jx9 s ASP 54 CO 0.13 -1.65 -0.20 0.68 0.21 0.00 0.00 175.17 174.35 2jx9 s VAL 55 N -3.29 1.58 0.24 -1.27 -7.23 0.52 -4.33 120.40 106.62 2jx9 s VAL 55 Ca 0.60 -1.21 -0.30 0.00 -1.81 0.00 0.00 61.98 59.26 2jx9 s VAL 55 Cb -0.12 -1.39 -0.09 0.00 0.56 0.00 0.00 36.38 35.33 2jx9 s VAL 55 CO 0.53 0.14 1.34 -0.63 -0.31 0.00 0.00 175.10 176.17 2jx9 s ILE 56 N -0.86 2.95 -0.33 -0.62 1.01 0.34 -1.99 121.20 121.71 2jx9 s ILE 56 Ca 0.06 0.82 -0.00 0.00 0.00 0.00 0.00 60.65 61.53 2jx9 s ILE 56 Cb -0.09 -3.52 0.11 0.00 0.01 0.00 0.00 42.46 38.97 2jx9 s ILE 56 CO 0.02 0.14 0.12 0.00 0.00 0.00 0.00 174.94 175.22 2jx9 s MET 57 N -0.54 0.81 0.06 2.79 0.23 -0.37 -1.13 119.30 121.14 2jx9 s MET 57 Ca 0.56 -1.25 -0.30 0.00 -1.03 0.00 0.00 55.69 53.67 2jx9 s MET 57 Cb -0.39 -2.04 -0.09 0.00 -1.53 0.00 0.00 34.83 30.79 2jx9 s MET 57 CO 0.43 -1.02 1.84 0.08 -2.03 0.00 0.00 175.02 174.32 2jx9 s VAL 58 N 1.38 2.93 -0.26 5.16 1.01 -1.26 -2.40 120.40 126.96 2jx9 s VAL 58 Ca 0.11 0.18 -0.15 0.00 0.00 0.00 0.00 61.98 62.12 2jx9 s VAL 58 Cb -0.19 -3.11 -0.11 0.00 0.00 0.00 0.00 36.38 32.97 2jx9 s VAL 58 CO -0.20 -0.01 -0.32 -0.62 0.00 0.00 0.00 175.10 173.95 2jx9 n GLU 59 N 6.61 0.58 -3.72 2.72 -0.58 -0.39 -4.95 120.64 120.91 2jx9 n GLU 59 Ca 0.18 0.27 -0.14 0.00 -0.42 0.00 0.00 57.16 57.06 2jx9 n GLU 59 Cb 0.40 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.69 2jx9 n GLU 59 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2jx9 s ASN 60 N -7.21 -0.27 -0.10 1.62 0.01 -0.89 -5.03 114.94 103.08 2jx9 s ASN 60 Ca -0.37 0.18 -0.30 0.00 -0.71 0.00 0.00 52.86 51.67 2jx9 s ASN 60 Cb 0.13 0.35 0.12 0.00 0.41 0.00 0.00 41.25 42.25 2jx9 s ASN 60 CO 0.48 -0.47 0.95 0.00 -1.51 0.00 0.00 177.10 176.55 2jx9 s ALA 61 N -1.31 -1.89 -0.05 0.60 0.00 -1.26 0.50 121.76 118.35 2jx9 s ALA 61 Ca -0.13 1.36 -0.13 0.00 0.00 0.00 0.00 51.96 53.06 2jx9 s ALA 61 Cb -0.04 -0.22 0.02 0.00 0.00 0.00 0.00 23.12 22.88 2jx9 s ALA 61 CO 0.05 -0.47 0.29 1.21 0.00 0.00 0.00 175.76 176.85 2jx9 s ASN 62 N -1.68 -0.22 -0.23 0.00 2.47 -0.53 -3.61 114.94 111.15 2jx9 s ASN 62 Ca 0.01 0.26 -0.02 0.00 0.42 0.00 0.00 52.86 53.53 2jx9 s ASN 62 Cb -0.01 0.43 0.01 0.00 -1.45 0.00 0.00 41.25 40.23 2jx9 s ASN 62 CO -0.02 -0.31 -0.07 -0.47 -3.72 0.00 0.00 177.10 172.50 2jx9 s TYR 63 N -0.77 2.97 0.00 0.43 5.04 -1.25 -1.92 117.35 121.85 2jx9 s TYR 63 Ca -0.09 -1.29 0.00 0.00 -2.44 0.00 0.00 57.07 53.25 2jx9 s TYR 63 Cb -0.04 -2.06 0.00 0.00 0.35 0.00 0.00 41.96 40.21 2jx9 s TYR 63 CO 0.03 -0.66 0.00 0.41 -1.34 0.00 0.00 175.55 173.98 2jx9 n GLY 64 N 4.72 -0.56 3.22 8.97 0.00 0.14 -3.23 105.19 118.45 2jx9 n GLY 64 Ca -0.18 -0.35 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 2jx9 n GLY 64 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jx9 s ARG 65 N -1.64 0.30 0.00 1.61 3.52 -0.82 0.57 118.95 122.48 2jx9 s ARG 65 Ca 0.00 0.98 0.00 0.00 -0.13 0.00 0.00 55.73 56.58 2jx9 s ARG 65 Cb 0.00 0.26 0.00 0.00 -1.56 0.00 0.00 34.95 33.65 2jx9 s ARG 65 CO 0.00 -0.27 0.57 0.25 -0.81 0.00 0.00 175.30 175.04 2jx9 n THR 66 N 5.38 0.31 -3.83 4.11 -2.24 -1.26 -0.39 114.28 116.37 2jx9 n THR 66 Ca -0.08 -0.49 -0.11 0.00 -2.27 0.00 0.00 64.05 61.10 2jx9 n THR 66 Cb 0.49 1.02 -0.09 0.00 -2.10 0.00 0.00 70.33 69.66 2jx9 n THR 66 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2jx9 s ASP 67 N -0.31 -0.01 0.00 3.42 -1.08 -1.26 -4.79 116.67 112.64 2jx9 s ASP 67 Ca 0.00 -0.26 0.11 0.00 -0.52 0.00 0.00 52.55 51.88 2jx9 s ASP 67 Cb 0.00 0.28 0.20 0.00 -1.46 0.00 0.00 42.92 41.94 2jx9 s ASP 67 CO 0.00 -0.51 1.06 -0.90 0.52 0.00 0.00 175.17 175.34 2jx9 n ASP 68 N 0.89 2.46 -0.91 -0.34 5.75 -1.26 -4.43 116.55 118.71 2jx9 n ASP 68 Ca -0.20 -1.74 0.10 0.00 -0.01 0.00 0.00 54.79 52.94 2jx9 n ASP 68 Cb 0.58 -0.12 0.16 0.00 -1.03 0.00 0.00 41.12 40.71 2jx9 n ASP 68 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2jx9 n LYS 69 N 0.61 2.12 -4.54 0.11 5.02 -1.26 -4.88 118.16 115.34 2jx9 n LYS 69 Ca 0.09 -1.97 -0.34 0.00 -2.02 0.00 0.00 58.31 54.07 2jx9 n LYS 69 Cb 0.36 -1.41 -0.12 0.00 -0.02 0.00 0.00 35.03 33.84 2jx9 n LYS 69 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2jx9 s ILE 70 N -1.36 3.71 -0.75 -0.18 -1.09 -1.26 -4.70 121.20 115.58 2jx9 s ILE 70 Ca 0.30 -0.44 -0.00 0.00 -2.23 0.00 0.00 60.65 58.27 2jx9 s ILE 70 Cb 0.18 -2.58 0.00 0.00 -1.58 0.00 0.00 42.46 38.48 2jx9 s ILE 70 CO 0.25 0.54 0.68 0.00 -1.23 0.00 0.00 174.94 175.19 2jx9 n ASP 72 N -1.88 3.28 -0.19 0.00 -0.08 -1.26 -4.93 116.55 111.48 2jx9 n ASP 72 Ca -0.05 0.99 0.00 0.00 -1.51 0.00 0.00 54.79 54.23 2jx9 n ASP 72 Cb 0.53 -1.34 0.00 0.00 2.34 0.00 0.00 41.12 42.65 2jx9 n ASP 72 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jx9 n ALA 73 N 6.35 0.00 -1.79 -1.67 0.00 -1.26 -5.12 120.51 117.03 2jx9 n ALA 73 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.26 2jx9 n ALA 73 Cb 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.71 2jx9 n ALA 73 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2jx9 s ASP 74 N 0.62 6.45 0.37 0.00 -4.77 -1.26 -4.85 116.67 113.24 2jx9 s ASP 74 Ca 0.00 2.91 0.09 0.00 -3.30 0.00 0.00 52.55 52.25 2jx9 s ASP 74 Cb 0.00 -2.65 0.84 0.00 -1.09 0.00 0.00 42.92 40.03 2jx9 s ASP 74 CO 0.00 -0.83 1.91 1.55 0.70 0.00 0.00 175.17 178.50 2jx9 h PRO 75 N 4.12 0.63 -0.29 2.11 0.13 -1.99 -1.00 132.00 135.71 2jx9 h PRO 75 Ca -0.48 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 64.58 2jx9 h PRO 75 Cb 1.23 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 2jx9 h PRO 75 CO 0.73 0.42 0.05 0.74 -0.23 0.00 0.00 178.00 179.71 2jx9 h PHE 76 N 0.65 0.42 0.00 1.56 -1.00 -1.96 0.12 116.94 116.74 2jx9 h PHE 76 Ca 0.38 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.14 2jx9 h PHE 76 Cb 0.58 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 40.01 2jx9 h PHE 76 CO -0.00 0.39 -0.48 1.96 -1.61 0.00 0.00 178.31 178.57 2jx9 h GLN 77 N 0.41 0.00 -0.03 1.51 4.20 -1.43 -3.28 115.11 116.50 2jx9 h GLN 77 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 2jx9 h GLN 77 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 2jx9 h GLN 77 CO -0.00 0.00 -0.04 -1.33 -0.67 0.00 0.00 178.83 176.79 2jx9 n MET 78 N -2.73 2.10 -0.08 1.46 2.81 -0.46 -1.21 117.12 119.01 2jx9 n MET 78 Ca 0.02 -1.66 -0.11 0.00 -1.81 0.00 0.00 57.70 54.15 2jx9 n MET 78 Cb 0.52 -1.47 -0.04 0.00 -0.71 0.00 0.00 33.22 31.52 2jx9 n MET 78 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 2jx9 h GLU 79 N 4.04 0.38 -6.50 0.03 5.08 -0.88 -3.42 114.58 113.33 2jx9 h GLU 79 Ca 0.00 -0.09 -0.57 0.00 -1.00 0.00 0.00 59.36 57.70 2jx9 h GLU 79 Cb 0.88 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 30.02 2jx9 h GLU 79 CO 0.00 0.50 0.93 1.21 -1.00 0.00 0.00 179.01 180.65 2jx9 s ASN 80 N -5.78 6.69 -0.39 1.42 2.47 -1.26 -4.88 114.94 113.22 2jx9 s ASN 80 Ca -0.14 0.84 0.06 0.00 0.42 0.00 0.00 52.86 54.04 2jx9 s ASN 80 Cb 0.08 -2.54 0.59 0.00 -1.45 0.00 0.00 41.25 37.92 2jx9 s ASN 80 CO 0.73 -1.13 1.71 1.33 -3.72 0.00 0.00 177.10 176.02 2jx9 n VAL 81 N 6.45 2.92 -3.37 -5.21 0.24 -1.26 -4.72 118.33 113.38 2jx9 n VAL 81 Ca 0.13 -2.38 -0.25 0.00 -2.04 0.00 0.00 64.34 59.80 2jx9 n VAL 81 Cb 0.48 -0.44 -0.10 0.00 -1.47 0.00 0.00 33.84 32.31 2jx9 n VAL 81 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2jx9 s GLN 82 N -3.31 0.77 -0.11 7.34 -1.52 -0.85 -4.06 119.66 117.92 2jx9 s GLN 82 Ca 0.52 -1.66 -0.04 0.00 -1.95 0.00 0.00 55.36 52.23 2jx9 s GLN 82 Cb 0.45 -1.22 0.06 0.00 -0.22 0.00 0.00 33.01 32.08 2jx9 s GLN 82 CO 0.05 -1.31 0.21 0.00 -0.25 0.00 0.00 175.29 174.00 2jx9 s TYR 84 N 2.36 1.62 -0.37 0.00 2.02 -1.26 -1.95 117.35 119.76 2jx9 s TYR 84 Ca 0.02 -0.52 0.03 0.00 -0.37 0.00 0.00 57.07 56.23 2jx9 s TYR 84 Cb -0.12 -0.82 0.15 0.00 -0.40 0.00 0.00 41.96 40.77 2jx9 s TYR 84 CO -0.07 0.24 0.34 -1.17 -1.57 0.00 0.00 175.55 173.32 2jx9 s LEU 85 N -2.59 0.17 0.22 -1.29 2.96 -1.20 -4.90 118.68 112.05 2jx9 s LEU 85 Ca 0.13 -1.74 -0.10 0.00 -0.22 0.00 0.00 54.13 52.20 2jx9 s LEU 85 Cb -0.05 0.35 0.32 0.00 0.50 0.00 0.00 46.19 47.31 2jx9 s LEU 85 CO 0.05 -0.27 1.68 -0.65 -1.32 0.00 0.00 176.35 175.84 2jx9 h PRO 86 N 7.01 0.18 -0.12 0.98 0.11 -1.91 -0.64 132.00 137.61 2jx9 h PRO 86 Ca 0.06 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.19 2jx9 h PRO 86 Cb 1.04 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 2jx9 h PRO 86 CO 0.21 0.12 0.28 -0.44 -0.21 0.00 0.00 178.00 177.95 2jx9 h ASP 87 N 0.18 0.00 -0.85 -2.05 3.32 -1.96 -0.23 116.42 114.84 2jx9 h ASP 87 Ca 0.33 0.00 0.19 0.00 0.02 0.00 0.00 57.03 57.58 2jx9 h ASP 87 Cb 0.54 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.03 2jx9 h ASP 87 CO -0.49 0.00 0.57 0.00 -1.72 0.00 0.00 179.24 177.60 2jx9 h ALA 88 N 1.56 2.27 -0.32 3.45 0.00 -1.40 -0.80 119.26 124.03 2jx9 h ALA 88 Ca 0.06 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2jx9 h ALA 88 Cb 0.61 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2jx9 h ALA 88 CO -0.00 -0.53 0.06 0.35 0.00 0.00 0.00 179.25 179.13 2jx9 h PHE 89 N 0.34 0.55 -0.64 0.00 3.57 -1.09 -2.75 116.94 116.92 2jx9 h PHE 89 Ca 0.43 -0.07 -0.06 0.00 3.53 0.00 0.00 57.97 61.79 2jx9 h PHE 89 Cb 1.15 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.71 2jx9 h PHE 89 CO -0.00 0.59 0.14 1.57 -2.23 0.00 0.00 178.31 178.38 2jx9 h LYS 90 N 0.35 1.01 -0.11 1.11 2.10 -1.31 -0.71 116.57 119.02 2jx9 h LYS 90 Ca 0.10 -0.24 0.00 0.00 -2.00 0.00 0.00 60.65 58.51 2jx9 h LYS 90 Cb 0.33 -0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 31.51 2jx9 h LYS 90 CO 0.00 0.91 0.07 0.82 -2.00 0.00 0.00 179.45 179.25 2jx9 h ILE 91 N 0.96 1.04 -0.27 0.07 2.04 -1.36 -1.50 117.51 118.49 2jx9 h ILE 91 Ca 0.20 -0.09 -0.16 0.00 1.00 0.00 0.00 64.86 65.81 2jx9 h ILE 91 Cb 0.36 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 2jx9 h ILE 91 CO 0.00 0.04 -0.47 0.24 0.00 0.00 0.00 178.15 177.96 2jx9 h MET 92 N 0.13 0.72 -0.30 2.37 2.86 -1.37 -2.45 114.93 116.89 2jx9 h MET 92 Ca 0.04 -0.41 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 2jx9 h MET 92 Cb 0.00 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 2jx9 h MET 92 CO -0.01 1.03 0.19 0.77 1.06 0.00 0.00 176.91 179.95 2jx9 h SER 93 N 0.57 0.35 -0.36 1.22 0.02 -0.98 0.40 113.55 114.76 2jx9 h SER 93 Ca 0.03 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 60.89 2jx9 h SER 93 Cb 1.03 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.46 2jx9 h SER 93 CO 0.10 0.27 0.01 1.56 -1.14 0.00 0.00 176.83 177.63 2jx9 h GLN 94 N 0.39 0.73 0.04 3.45 4.20 -1.26 0.48 115.11 123.14 2jx9 h GLN 94 Ca 0.11 -0.18 -0.23 0.00 0.06 0.00 0.00 58.65 58.41 2jx9 h GLN 94 Cb -0.02 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 2jx9 h GLN 94 CO -0.02 0.74 -1.03 0.00 -0.67 0.00 0.00 178.83 177.84 2jx9 h ARG 95 N 0.69 0.16 0.00 1.46 3.08 -0.94 -3.38 114.38 115.45 2jx9 h ARG 95 Ca 0.14 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2jx9 h ARG 95 Cb 0.41 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2jx9 h ARG 95 CO 0.02 1.05 -0.89 0.00 -1.07 0.00 0.00 179.97 179.08 2jx9 n ASN 97 N -1.50 3.94 -0.42 0.00 4.13 0.17 -1.84 115.26 119.74 2jx9 n ASN 97 Ca -0.00 1.11 -0.06 0.00 1.68 0.00 0.00 54.58 57.32 2jx9 n ASN 97 Cb 0.18 -1.59 -0.02 0.00 -1.54 0.00 0.00 39.78 36.80 2jx9 n ASN 97 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2jx9 n ASN 98 N 2.90 -4.72 -4.48 6.41 4.13 -0.29 -4.95 115.26 114.26 2jx9 n ASN 98 Ca 0.11 0.14 -0.30 0.00 1.68 0.00 0.00 54.58 56.21 2jx9 n ASN 98 Cb 0.36 -2.71 -0.12 0.00 -1.54 0.00 0.00 39.78 35.77 2jx9 n ASN 98 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2jx9 s ARG 99 N -2.03 1.97 0.22 3.52 0.52 -0.77 -4.80 118.95 117.58 2jx9 s ARG 99 Ca 0.00 -1.05 0.03 0.00 -0.52 0.00 0.00 55.73 54.18 2jx9 s ARG 99 Cb 0.00 -2.17 0.19 0.00 0.52 0.00 0.00 34.95 33.49 2jx9 s ARG 99 CO 0.00 0.52 1.53 1.15 0.02 0.00 0.00 175.30 178.51 2jx9 h THR 100 N 3.76 1.38 -3.12 0.02 2.02 -1.86 0.98 112.91 116.10 2jx9 h THR 100 Ca -0.49 -2.01 -0.11 0.00 0.77 0.00 0.00 66.41 64.57 2jx9 h THR 100 Cb 1.16 2.01 -0.19 0.00 -1.74 0.00 0.00 68.15 69.39 2jx9 h THR 100 CO 0.47 0.60 -0.27 0.00 0.37 0.00 0.00 175.52 176.69 2jx9 s GLN 101 N -3.74 0.71 -0.06 6.66 1.03 -1.26 0.12 119.66 123.12 2jx9 s GLN 101 Ca -0.05 -0.29 -0.19 0.00 0.04 0.00 0.00 55.36 54.88 2jx9 s GLN 101 Cb 0.12 0.31 0.04 0.00 0.03 0.00 0.00 33.01 33.51 2jx9 s GLN 101 CO 0.81 -0.21 0.43 0.00 -2.54 0.00 0.00 175.29 173.79 2jx9 s VAL 103 N -0.87 1.16 0.04 0.00 1.01 -1.26 -1.80 120.40 118.68 2jx9 s VAL 103 Ca -0.09 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.42 2jx9 s VAL 103 Cb -0.04 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 2jx9 s VAL 103 CO 0.05 0.36 -0.08 -0.69 0.00 0.00 0.00 175.10 174.74 2jx9 s VAL 104 N 0.67 0.56 -0.35 2.92 1.01 -1.06 -4.96 120.40 119.18 2jx9 s VAL 104 Ca -0.14 -0.99 -0.27 0.00 0.00 0.00 0.00 61.98 60.58 2jx9 s VAL 104 Cb -0.16 -0.61 0.01 0.00 0.00 0.00 0.00 36.38 35.63 2jx9 s VAL 104 CO 0.04 -0.31 0.98 -0.69 0.00 0.00 0.00 175.10 175.12 2jx9 s VAL 105 N -1.22 4.56 0.00 2.92 1.01 -1.26 -0.49 120.40 125.92 2jx9 s VAL 105 Ca -0.08 1.41 0.00 0.00 0.00 0.00 0.00 61.98 63.31 2jx9 s VAL 105 Cb -0.09 -4.36 0.00 0.00 0.00 0.00 0.00 36.38 31.93 2jx9 s VAL 105 CO 0.00 -0.50 1.18 0.00 0.00 0.00 0.00 175.10 175.78 2jx9 n ALA 106 N 6.79 2.97 -2.00 5.51 0.00 -0.86 -4.58 120.51 128.34 2jx9 n ALA 106 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2jx9 n ALA 106 Cb 0.48 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2jx9 n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jx9 n GLY 107 N 1.68 0.31 3.14 0.00 0.00 -1.26 -2.43 105.19 106.63 2jx9 n GLY 107 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2jx9 n GLY 107 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jx9 n SER 108 N 0.00 0.00 0.00 1.61 2.88 -1.26 -1.37 113.62 115.48 2jx9 n SER 108 Ca 0.00 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.59 2jx9 n SER 108 Cb 0.00 0.00 0.28 0.00 -0.75 0.00 0.00 64.21 63.74 2jx9 n SER 108 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2jx9 n ASP 109 N -1.80 0.00 0.03 -3.46 8.00 -1.26 -2.15 116.55 115.92 2jx9 n ASP 109 Ca 0.00 -0.36 0.13 0.00 0.71 0.00 0.00 54.79 55.27 2jx9 n ASP 109 Cb 0.00 0.00 0.40 0.00 -0.02 0.00 0.00 41.12 41.50 2jx9 n ASP 109 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jx9 n ALA 110 N -0.95 2.78 -3.73 2.24 0.00 -0.47 -4.77 120.51 115.61 2jx9 n ALA 110 Ca 0.07 -0.19 -0.14 0.00 0.00 0.00 0.00 53.44 53.19 2jx9 n ALA 110 Cb 0.03 -1.32 -0.14 0.00 0.00 0.00 0.00 19.45 18.02 2jx9 n ALA 110 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2jx9 s PHE 111 N -3.05 -0.18 0.00 0.00 0.08 -0.50 -4.90 117.98 109.43 2jx9 s PHE 111 Ca 0.11 0.53 0.00 0.00 0.12 0.00 0.00 56.93 57.69 2jx9 s PHE 111 Cb 0.16 -0.10 0.00 0.00 -0.57 0.00 0.00 43.02 42.51 2jx9 s PHE 111 CO 0.62 -0.19 0.00 -2.30 -0.10 0.00 0.00 175.22 173.25 2jx9 n PRO 112 N 4.40 2.96 -3.44 0.24 -0.02 -1.26 -4.70 135.00 133.19 2jx9 n PRO 112 Ca -0.23 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.03 2jx9 n PRO 112 Cb 0.51 0.00 -0.11 0.00 -0.02 0.00 0.00 33.50 33.88 2jx9 n PRO 112 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2jx9 s ASP 113 N -2.47 2.28 0.01 2.55 -1.08 -1.26 -4.98 116.67 111.72 2jx9 s ASP 113 Ca 0.00 -1.23 0.26 0.00 -0.52 0.00 0.00 52.55 51.06 2jx9 s ASP 113 Cb 0.00 0.16 0.60 0.00 -1.46 0.00 0.00 42.92 42.22 2jx9 s ASP 113 CO 0.00 -0.37 1.48 -0.81 0.52 0.00 0.00 175.17 175.99 2jx9 n PRO 114 N 4.95 0.03 -3.03 4.34 -0.04 -1.26 -4.71 135.00 135.28 2jx9 n PRO 114 Ca 0.01 0.01 0.01 0.00 -0.04 0.00 0.00 63.50 63.49 2jx9 n PRO 114 Cb 0.44 -1.52 -0.00 0.00 -0.04 0.00 0.00 33.50 32.37 2jx9 n PRO 114 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jx9 s PRO 116 N 1.93 3.49 0.00 0.00 0.04 -1.26 -3.64 135.00 135.56 2jx9 s PRO 116 Ca 0.15 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.26 2jx9 s PRO 116 Cb -0.01 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2jx9 s PRO 116 CO -0.11 -0.66 0.00 0.41 0.04 0.00 0.00 177.00 176.69 2jx9 n GLY 117 N -1.41 0.74 3.24 0.56 0.00 -1.26 -5.02 105.19 102.03 2jx9 n GLY 117 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 2jx9 n GLY 117 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jx9 s THR 118 N -2.95 1.52 -0.50 2.61 2.01 -1.24 -4.41 115.64 112.67 2jx9 s THR 118 Ca 0.00 -1.31 -0.29 0.00 0.31 0.00 0.00 61.69 60.40 2jx9 s THR 118 Cb 0.00 -1.37 0.03 0.00 0.01 0.00 0.00 72.50 71.17 2jx9 s THR 118 CO 0.00 0.01 1.20 -0.47 -0.69 0.00 0.00 174.62 174.67 2jx9 s TYR 119 N -1.01 2.68 0.00 4.92 6.14 -0.35 -5.00 117.35 124.74 2jx9 s TYR 119 Ca 0.05 0.62 0.00 0.00 0.64 0.00 0.00 57.07 58.37 2jx9 s TYR 119 Cb -0.09 -4.45 0.00 0.00 0.42 0.00 0.00 41.96 37.84 2jx9 s TYR 119 CO 0.03 -1.47 0.00 1.63 0.64 0.00 0.00 175.55 176.37 2jx9 n LYS 120 N 8.08 0.79 -3.80 4.97 5.02 -1.26 -4.77 118.16 127.19 2jx9 n LYS 120 Ca 0.12 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.40 2jx9 n LYS 120 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.50 2jx9 n LYS 120 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2jx9 s TYR 121 N 0.06 -0.01 -0.07 2.13 -0.85 0.19 -2.24 117.35 116.56 2jx9 s TYR 121 Ca 0.00 -0.23 0.00 0.00 -0.52 0.00 0.00 57.07 56.32 2jx9 s TYR 121 Cb 0.00 0.62 0.02 0.00 0.38 0.00 0.00 41.96 42.98 2jx9 s TYR 121 CO 0.00 -0.60 -0.05 -1.17 -1.52 0.00 0.00 175.55 172.22 2jx9 s LEU 122 N -3.27 1.14 -0.14 -3.49 2.96 -0.95 -0.69 118.68 114.25 2jx9 s LEU 122 Ca 0.19 -0.17 0.02 0.00 -0.22 0.00 0.00 54.13 53.95 2jx9 s LEU 122 Cb 0.00 -0.57 0.01 0.00 0.50 0.00 0.00 46.19 46.13 2jx9 s LEU 122 CO 0.01 -0.09 -0.21 -0.70 -1.32 0.00 0.00 176.35 174.04 2jx9 s GLU 123 N 1.32 3.06 -0.09 1.98 2.12 -0.81 -2.06 118.70 124.22 2jx9 s GLU 123 Ca -0.04 -0.84 0.00 0.00 0.36 0.00 0.00 54.97 54.45 2jx9 s GLU 123 Cb -0.14 -2.46 0.02 0.00 0.26 0.00 0.00 34.13 31.82 2jx9 s GLU 123 CO -0.02 0.01 -0.07 0.08 -0.54 0.00 0.00 175.26 174.71 2jx9 s VAL 124 N 0.76 0.91 -0.16 3.70 1.01 -0.22 -1.45 120.40 124.95 2jx9 s VAL 124 Ca -0.08 -0.26 -0.05 0.00 0.00 0.00 0.00 61.98 61.59 2jx9 s VAL 124 Cb -0.16 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 2jx9 s VAL 124 CO -0.01 0.33 -0.01 -1.10 0.00 0.00 0.00 175.10 174.32 2jx9 s GLN 125 N 1.36 3.74 0.19 2.72 -0.21 0.18 -1.61 119.66 126.03 2jx9 s GLN 125 Ca -0.02 -0.47 -0.18 0.00 0.02 0.00 0.00 55.36 54.71 2jx9 s GLN 125 Cb -0.14 -2.99 0.03 0.00 1.00 0.00 0.00 33.01 30.91 2jx9 s GLN 125 CO -0.04 0.26 0.53 1.52 -2.12 0.00 0.00 175.29 175.45 2jx9 s TYR 126 N 0.32 -0.14 0.22 0.91 1.13 -0.23 -1.26 117.35 118.31 2jx9 s TYR 126 Ca -0.02 -0.20 0.11 0.00 -1.41 0.00 0.00 57.07 55.56 2jx9 s TYR 126 Cb -0.14 0.40 -0.05 0.00 -1.10 0.00 0.00 41.96 41.08 2jx9 s TYR 126 CO 0.02 -0.91 -0.20 -0.51 -2.51 0.00 0.00 175.55 171.43 2jx9 s ASP 127 N -2.87 3.61 -0.23 -0.18 1.01 -1.01 -1.02 116.67 115.98 2jx9 s ASP 127 Ca 0.09 -0.88 -0.06 0.00 0.71 0.00 0.00 52.55 52.40 2jx9 s ASP 127 Cb -0.01 -0.34 -0.02 0.00 1.01 0.00 0.00 42.92 43.56 2jx9 s ASP 127 CO -0.03 0.09 0.03 0.00 0.21 0.00 0.00 175.17 175.47 2jx9 s VAL 129 N 1.46 2.15 0.48 0.00 -7.23 -0.84 -4.80 120.40 111.61 2jx9 s VAL 129 Ca 0.05 -1.88 -0.23 0.00 -1.81 0.00 0.00 61.98 58.11 2jx9 s VAL 129 Cb -0.15 -1.97 -0.08 0.00 0.56 0.00 0.00 36.38 34.75 2jx9 s VAL 129 CO 0.02 -0.10 1.13 -2.65 -0.31 0.00 0.00 175.10 173.19 2jx9 n PRO 130 N 0.53 1.47 0.00 4.82 -0.02 -1.26 0.20 135.00 140.73 2jx9 n PRO 130 Ca -0.15 0.53 0.10 0.00 -2.02 0.00 0.00 63.50 61.96 2jx9 n PRO 130 Cb 0.55 -2.26 0.53 0.00 -0.02 0.00 0.00 33.50 32.31 2jx9 n PRO 130 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 2jx9 n TYR 131 N -0.79 0.00 0.00 6.00 9.36 -0.79 -4.64 117.16 126.30 2jx9 n TYR 131 Ca 0.10 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.32 2jx9 n TYR 131 Cb 0.42 -0.23 0.00 0.00 -0.63 0.00 0.00 39.34 38.90 2jx9 n TYR 131 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 2jx9 n LYS 132 N -1.23 0.00 -3.67 2.98 5.02 -1.26 -5.08 118.16 114.92 2jx9 n LYS 132 Ca 0.11 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.31 2jx9 n LYS 132 Cb 0.14 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 35.06 2jx9 n LYS 132 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2jx9 s VAL 133 N 0.25 -0.37 0.00 -0.18 0.11 -1.26 -5.22 120.40 113.72 2jx9 s VAL 133 Ca 0.00 0.11 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 2jx9 s VAL 133 Cb 0.00 -0.71 0.00 0.00 -1.53 0.00 0.00 36.38 34.14 2jx9 s VAL 133 CO 0.00 0.04 0.00 -0.62 -3.33 0.00 0.00 175.10 171.19