#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 0.14 -4.54 0.99 0.00 -1.26 -5.13 117.00 107.19 2jx9 n LEU 30 Ca 0.00 -4.58 -0.35 0.00 0.00 0.00 0.00 56.01 51.08 2jx9 n LEU 30 Cb 0.00 0.46 0.10 0.00 0.00 0.00 0.00 43.42 43.97 2jx9 n LEU 30 CO 0.00 1.94 0.29 -2.65 0.00 0.00 0.00 177.39 176.98 2jx9 n PRO 31 N 2.17 0.21 0.00 1.96 -0.02 -1.26 -4.88 135.00 133.18 2jx9 n PRO 31 Ca 0.26 0.13 0.15 0.00 -2.02 0.00 0.00 63.50 62.02 2jx9 n PRO 31 Cb 0.49 -2.05 0.91 0.00 -0.02 0.00 0.00 33.50 32.83 2jx9 n PRO 31 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2jx9 n PHE 32 N -2.83 0.00 0.00 6.00 3.72 -1.26 -4.88 117.46 118.20 2jx9 n PHE 32 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2jx9 n PHE 32 Cb 0.51 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.03 2jx9 n PHE 32 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jx9 n GLY 33 N 0.96 -0.25 2.69 1.37 0.00 -1.26 -0.87 105.19 107.83 2jx9 n GLY 33 Ca 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.19 2jx9 n GLY 33 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2jx9 n LEU 34 N 0.00 -1.52 -1.47 0.99 -0.00 -1.26 -5.14 117.00 108.60 2jx9 n LEU 34 Ca 0.00 -3.42 0.18 0.00 -0.00 0.00 0.00 56.01 52.76 2jx9 n LEU 34 Cb 0.00 0.07 -0.10 0.00 -0.00 0.00 0.00 43.42 43.39 2jx9 n LEU 34 CO 0.00 1.82 -0.65 0.23 -0.00 0.00 0.00 177.39 178.79 2jx9 n MET 35 N -0.75 -3.39 -3.53 1.47 2.81 -0.05 -4.85 117.12 108.83 2jx9 n MET 35 Ca -0.05 2.77 -0.33 0.00 -1.81 0.00 0.00 57.70 58.28 2jx9 n MET 35 Cb 0.85 -3.97 -0.05 0.00 -0.71 0.00 0.00 33.22 29.34 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 -4.35 3.77 -0.19 0.03 0.52 -0.21 -4.96 118.95 113.57 2jx9 s ARG 36 Ca 0.00 0.19 -0.14 0.00 -0.52 0.00 0.00 55.73 55.26 2jx9 s ARG 36 Cb 0.00 -2.87 0.06 0.00 0.52 0.00 0.00 34.95 32.65 2jx9 s ARG 36 CO 0.00 0.47 0.48 0.50 0.02 0.00 0.00 175.30 176.77 2jx9 s ARG 37 N -2.29 0.52 0.09 3.54 3.52 -1.26 -0.59 118.95 122.48 2jx9 s ARG 37 Ca 0.39 0.79 0.09 0.00 -0.13 0.00 0.00 55.73 56.86 2jx9 s ARG 37 Cb -0.13 0.14 -0.03 0.00 -1.56 0.00 0.00 34.95 33.37 2jx9 s ARG 37 CO 0.20 -0.11 -0.23 -1.21 -0.81 0.00 0.00 175.30 173.14 2jx9 s GLU 38 N 0.87 1.29 0.00 5.12 0.41 -0.71 -5.00 118.70 120.68 2jx9 s GLU 38 Ca -0.05 -1.16 0.00 0.00 -0.41 0.00 0.00 54.97 53.35 2jx9 s GLU 38 Cb -0.06 -1.57 -0.00 0.00 -1.78 0.00 0.00 34.13 30.72 2jx9 s GLU 38 CO -0.07 0.38 -0.00 -1.17 -0.49 0.00 0.00 175.26 173.90 2jx9 s LEU 39 N -1.75 2.02 -0.01 1.80 0.20 -1.26 -1.63 118.68 118.04 2jx9 s LEU 39 Ca 0.09 -0.05 -0.02 0.00 0.69 0.00 0.00 54.13 54.84 2jx9 s LEU 39 Cb -0.10 0.00 0.00 0.00 -0.43 0.00 0.00 46.19 45.66 2jx9 s LEU 39 CO 0.04 -0.03 0.05 0.00 -0.29 0.00 0.00 176.35 176.12 2jx9 s ALA 40 N -0.14 -0.11 0.27 5.97 0.00 -0.84 -5.00 121.76 121.91 2jx9 s ALA 40 Ca -0.01 0.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.66 2jx9 s ALA 40 Cb -0.01 -0.03 -0.10 0.00 0.00 0.00 0.00 23.12 22.98 2jx9 s ALA 40 CO -0.00 -0.06 1.31 0.00 0.00 0.00 0.00 175.76 177.00 2jx9 n GLU 42 N 1.72 1.22 0.00 0.00 2.13 -0.98 -1.49 120.64 123.23 2jx9 n GLU 42 Ca 0.03 0.43 0.00 0.00 0.66 0.00 0.00 57.16 58.28 2jx9 n GLU 42 Cb 0.42 -1.88 0.00 0.00 0.27 0.00 0.00 31.44 30.25 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 1.80 3.28 3.71 8.31 0.00 -0.89 -4.93 105.19 116.48 2jx9 n GLY 43 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.67 3.02 0.67 1.61 2.02 -0.56 -4.79 117.35 116.65 2jx9 s TYR 44 Ca 0.00 -0.03 -0.15 0.00 -0.37 0.00 0.00 57.07 56.52 2jx9 s TYR 44 Cb 0.00 -1.52 0.01 0.00 -0.40 0.00 0.00 41.96 40.05 2jx9 s TYR 44 CO 0.00 0.50 1.13 -1.25 -1.57 0.00 0.00 175.55 174.35 2jx9 s PRO 45 N -2.55 2.66 0.07 -1.71 0.04 -1.26 -2.16 135.00 130.10 2jx9 s PRO 45 Ca 0.27 1.45 0.09 0.00 0.04 0.00 0.00 61.00 62.85 2jx9 s PRO 45 Cb -0.11 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 2jx9 s PRO 45 CO 0.20 -1.37 -0.23 -1.50 0.04 0.00 0.00 177.00 174.14 2jx9 s ILE 46 N -2.29 2.43 -0.09 0.56 2.07 0.00 -4.82 121.20 119.06 2jx9 s ILE 46 Ca 0.68 -1.42 0.04 0.00 -1.41 0.00 0.00 60.65 58.54 2jx9 s ILE 46 Cb -0.22 -2.02 0.00 0.00 0.13 0.00 0.00 42.46 40.36 2jx9 s ILE 46 CO 0.42 0.27 -0.21 -0.70 -1.91 0.00 0.00 174.94 172.81 2jx9 s GLU 47 N -1.56 2.67 -0.09 3.50 2.12 -1.26 -2.41 118.70 121.66 2jx9 s GLU 47 Ca 0.14 -0.77 0.04 0.00 0.36 0.00 0.00 54.97 54.73 2jx9 s GLU 47 Cb -0.10 -2.07 0.00 0.00 0.26 0.00 0.00 34.13 32.22 2jx9 s GLU 47 CO 0.05 0.17 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.21 2jx9 s LEU 48 N 0.35 1.99 -0.11 2.70 1.43 -0.82 -4.98 118.68 119.25 2jx9 s LEU 48 Ca -0.16 -0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 52.39 2jx9 s LEU 48 Cb -0.17 -1.27 0.05 0.00 0.03 0.00 0.00 46.19 44.83 2jx9 s LEU 48 CO 0.07 0.14 0.27 -0.13 0.23 0.00 0.00 176.35 176.93 2jx9 s ARG 49 N 0.33 0.24 -0.01 1.70 0.52 -1.26 -1.42 118.95 119.05 2jx9 s ARG 49 Ca -0.16 0.56 -0.07 0.00 -0.52 0.00 0.00 55.73 55.54 2jx9 s ARG 49 Cb -0.17 -0.10 -0.05 0.00 0.52 0.00 0.00 34.95 35.16 2jx9 s ARG 49 CO 0.07 -0.16 0.26 0.00 0.02 0.00 0.00 175.30 175.49 2jx9 s PRO 51 N -1.60 1.66 3.85 0.00 0.04 -1.26 -4.68 135.00 133.01 2jx9 s PRO 51 Ca 0.25 0.89 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2jx9 s PRO 51 Cb -0.13 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.56 2jx9 s PRO 51 CO 0.14 -1.98 0.00 0.41 0.04 0.00 0.00 177.00 175.61 2jx9 n GLY 52 N -1.30 3.12 0.69 0.56 0.00 -1.26 -1.58 105.19 105.42 2jx9 n GLY 52 Ca 0.08 0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.20 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 3.75 2.64 -4.85 1.61 3.41 -1.26 -5.04 113.62 113.87 2jx9 n SER 53 Ca 0.00 -3.43 -0.29 0.00 -0.26 0.00 0.00 58.87 54.89 2jx9 n SER 53 Cb 0.00 -0.54 0.10 0.00 -0.26 0.00 0.00 64.21 63.51 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 -2.62 4.25 0.05 4.04 1.01 -0.61 -4.23 116.67 118.56 2jx9 s ASP 54 Ca 0.39 0.91 0.06 0.00 0.71 0.00 0.00 52.55 54.63 2jx9 s ASP 54 Cb 0.35 -1.47 -0.02 0.00 1.01 0.00 0.00 42.92 42.78 2jx9 s ASP 54 CO 0.02 -2.08 -0.18 0.68 0.21 0.00 0.00 175.17 173.81 2jx9 s VAL 55 N -3.43 1.45 0.28 -1.27 -7.23 -0.62 -4.33 120.40 105.24 2jx9 s VAL 55 Ca 0.62 -1.16 -0.29 0.00 -1.81 0.00 0.00 61.98 59.33 2jx9 s VAL 55 Cb -0.13 -1.28 -0.10 0.00 0.56 0.00 0.00 36.38 35.43 2jx9 s VAL 55 CO 0.51 0.09 1.28 -0.63 -0.31 0.00 0.00 175.10 176.04 2jx9 s ILE 56 N -0.87 2.99 -0.31 -0.62 1.01 0.23 -2.28 121.20 121.35 2jx9 s ILE 56 Ca 0.05 0.93 -0.00 0.00 0.00 0.00 0.00 60.65 61.62 2jx9 s ILE 56 Cb -0.09 -3.59 0.10 0.00 0.01 0.00 0.00 42.46 38.89 2jx9 s ILE 56 CO 0.02 0.19 0.09 0.00 0.00 0.00 0.00 174.94 175.25 2jx9 s MET 57 N -1.16 0.76 0.02 2.79 0.23 0.20 -1.26 119.30 120.88 2jx9 s MET 57 Ca 0.51 -1.12 -0.30 0.00 -1.03 0.00 0.00 55.69 53.74 2jx9 s MET 57 Cb -0.38 -2.07 -0.07 0.00 -1.53 0.00 0.00 34.83 30.78 2jx9 s MET 57 CO 0.46 -0.98 1.69 0.08 -2.03 0.00 0.00 175.02 174.24 2jx9 s VAL 58 N 1.57 3.26 -0.27 5.16 1.01 -1.26 -2.34 120.40 127.52 2jx9 s VAL 58 Ca 0.10 0.52 -0.09 0.00 0.00 0.00 0.00 61.98 62.50 2jx9 s VAL 58 Cb -0.17 -3.33 -0.13 0.00 0.00 0.00 0.00 36.38 32.74 2jx9 s VAL 58 CO -0.24 -0.03 -0.32 -0.62 0.00 0.00 0.00 175.10 173.89 2jx9 n GLU 59 N 6.46 0.61 -3.72 2.72 1.02 -0.48 -4.98 120.64 122.26 2jx9 n GLU 59 Ca 0.17 0.23 -0.14 0.00 -0.02 0.00 0.00 57.16 57.40 2jx9 n GLU 59 Cb 0.42 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.26 2jx9 n GLU 59 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2jx9 s ASN 60 N -7.21 -0.25 -0.04 1.62 0.01 -1.03 -5.03 114.94 103.01 2jx9 s ASN 60 Ca -0.38 0.14 -0.29 0.00 -0.71 0.00 0.00 52.86 51.62 2jx9 s ASN 60 Cb 0.13 0.35 0.10 0.00 0.41 0.00 0.00 41.25 42.24 2jx9 s ASN 60 CO 0.52 -0.50 0.83 0.00 -1.51 0.00 0.00 177.10 176.44 2jx9 s ALA 61 N -1.51 -1.81 -0.02 0.60 0.00 -1.26 0.22 121.76 117.97 2jx9 s ALA 61 Ca -0.12 1.18 -0.19 0.00 0.00 0.00 0.00 51.96 52.84 2jx9 s ALA 61 Cb -0.04 0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.16 2jx9 s ALA 61 CO 0.04 -0.51 0.40 1.21 0.00 0.00 0.00 175.76 176.90 2jx9 s ASN 62 N -1.79 -0.31 -0.17 0.00 2.47 0.16 -3.76 114.94 111.53 2jx9 s ASN 62 Ca -0.02 0.25 0.01 0.00 0.42 0.00 0.00 52.86 53.52 2jx9 s ASN 62 Cb -0.01 0.37 0.02 0.00 -1.45 0.00 0.00 41.25 40.19 2jx9 s ASN 62 CO -0.02 -0.49 -0.17 -0.47 -3.72 0.00 0.00 177.10 172.24 2jx9 s TYR 63 N -1.28 2.56 0.00 0.43 5.04 -1.26 -1.39 117.35 121.45 2jx9 s TYR 63 Ca -0.13 -1.53 0.00 0.00 -2.44 0.00 0.00 57.07 52.97 2jx9 s TYR 63 Cb -0.04 -1.78 0.00 0.00 0.35 0.00 0.00 41.96 40.49 2jx9 s TYR 63 CO 0.06 -0.76 0.00 0.41 -1.34 0.00 0.00 175.55 173.92 2jx9 n GLY 64 N 4.67 -0.54 3.32 8.97 0.00 -0.26 -3.33 105.19 118.02 2jx9 n GLY 64 Ca -0.19 -0.30 -0.05 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.25 0.43 -0.01 1.61 3.52 -0.94 0.44 118.95 122.76 2jx9 s ARG 65 Ca 0.00 1.09 0.01 0.00 -0.13 0.00 0.00 55.73 56.70 2jx9 s ARG 65 Cb 0.00 0.42 0.02 0.00 -1.56 0.00 0.00 34.95 33.82 2jx9 s ARG 65 CO 0.00 -0.33 0.92 0.25 -0.81 0.00 0.00 175.30 175.33 2jx9 n THR 66 N 5.41 0.87 -3.57 4.11 -2.24 -1.26 0.19 114.28 117.79 2jx9 n THR 66 Ca -0.08 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 60.81 2jx9 n THR 66 Cb 0.50 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 2jx9 n THR 66 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2jx9 n ASP 67 N -0.46 0.00 0.00 3.42 2.03 -1.26 -4.75 116.55 115.53 2jx9 n ASP 67 Ca 0.01 -0.90 0.00 0.00 0.52 0.00 0.00 54.79 54.42 2jx9 n ASP 67 Cb 0.32 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.72 2jx9 n ASP 67 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2jx9 n ASP 68 N -2.10 0.00 -1.06 1.67 5.68 -1.26 -4.50 116.55 114.98 2jx9 n ASP 68 Ca 0.00 -0.98 0.10 0.00 -0.50 0.00 0.00 54.79 53.41 2jx9 n ASP 68 Cb 0.00 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.19 2jx9 n ASP 68 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2jx9 n LYS 69 N 0.00 2.43 -4.57 0.11 5.02 -1.26 -4.82 118.16 115.07 2jx9 n LYS 69 Ca 0.00 -2.23 -0.34 0.00 -2.02 0.00 0.00 58.31 53.72 2jx9 n LYS 69 Cb 0.25 -1.46 -0.12 0.00 -0.02 0.00 0.00 35.03 33.67 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 -1.28 3.67 -1.05 -0.18 -1.09 -1.26 -4.58 121.20 115.43 2jx9 s ILE 70 Ca 0.36 -0.47 -0.01 0.00 -2.23 0.00 0.00 60.65 58.31 2jx9 s ILE 70 Cb 0.21 -2.54 -0.01 0.00 -1.58 0.00 0.00 42.46 38.53 2jx9 s ILE 70 CO 0.28 0.55 0.88 0.00 -1.23 0.00 0.00 174.94 175.42 2jx9 n ASP 72 N -2.93 -0.38 -0.49 0.00 -0.08 -1.26 -4.83 116.55 106.57 2jx9 n ASP 72 Ca -0.23 -0.15 0.00 0.00 -1.51 0.00 0.00 54.79 52.90 2jx9 n ASP 72 Cb 0.64 -0.78 0.00 0.00 2.34 0.00 0.00 41.12 43.32 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 8.65 0.00 -1.74 -1.67 0.00 -1.26 -5.07 120.51 119.42 2jx9 n ALA 73 Ca 0.66 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.68 2jx9 n ALA 73 Cb 0.09 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.52 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 0.26 6.36 0.41 0.00 -4.77 -1.26 -4.87 116.67 112.80 2jx9 s ASP 74 Ca 0.00 2.92 0.14 0.00 -3.30 0.00 0.00 52.55 52.31 2jx9 s ASP 74 Cb 0.00 -2.62 0.99 0.00 -1.09 0.00 0.00 42.92 40.21 2jx9 s ASP 74 CO 0.00 -0.96 1.92 1.55 0.70 0.00 0.00 175.17 178.38 2jx9 h PRO 75 N 5.84 0.46 -0.30 2.11 0.13 -1.97 -0.51 132.00 137.76 2jx9 h PRO 75 Ca -0.45 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 2jx9 h PRO 75 Cb 1.21 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 2jx9 h PRO 75 CO 0.88 0.31 0.07 0.74 -0.23 0.00 0.00 178.00 179.76 2jx9 h PHE 76 N 0.48 0.43 -0.01 1.56 0.04 -1.96 0.27 116.94 117.74 2jx9 h PHE 76 Ca 0.37 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.12 2jx9 h PHE 76 Cb 0.77 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.79 2jx9 h PHE 76 CO -0.00 0.38 -0.00 1.04 -0.60 0.00 0.00 178.31 179.13 2jx9 n GLN 77 N -4.37 1.49 -0.00 1.51 6.02 -0.23 -3.47 117.38 118.32 2jx9 n GLN 77 Ca 0.01 -0.71 0.00 0.00 -0.01 0.00 0.00 57.00 56.29 2jx9 n GLN 77 Cb 0.17 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.95 2jx9 n GLN 77 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 2jx9 n MET 78 N -0.14 -0.85 0.03 -1.09 2.81 0.19 0.48 117.12 118.55 2jx9 n MET 78 Ca 0.20 -0.54 -0.12 0.00 -1.81 0.00 0.00 57.70 55.42 2jx9 n MET 78 Cb 0.29 -1.00 -0.08 0.00 -0.71 0.00 0.00 33.22 31.72 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 0.05 -0.01 -6.61 0.03 5.08 -0.63 -3.41 114.58 109.09 2jx9 h GLU 79 Ca 0.00 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 2jx9 h GLU 79 Cb 0.03 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.21 2jx9 h GLU 79 CO 0.00 0.13 0.90 1.21 -1.00 0.00 0.00 179.01 180.25 2jx9 s ASN 80 N -5.32 6.70 -0.53 1.42 2.47 -1.26 -4.88 114.94 113.53 2jx9 s ASN 80 Ca -0.14 0.59 0.02 0.00 0.42 0.00 0.00 52.86 53.75 2jx9 s ASN 80 Cb 0.05 -2.55 0.54 0.00 -1.45 0.00 0.00 41.25 37.84 2jx9 s ASN 80 CO 0.66 -1.16 1.88 1.33 -3.72 0.00 0.00 177.10 176.09 2jx9 n VAL 81 N 6.62 3.31 -3.42 -5.21 0.24 -1.26 -4.74 118.33 113.86 2jx9 n VAL 81 Ca 0.12 -2.64 -0.26 0.00 -2.04 0.00 0.00 64.34 59.51 2jx9 n VAL 81 Cb 0.49 -0.83 -0.11 0.00 -1.47 0.00 0.00 33.84 31.91 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 -3.57 0.64 -0.10 7.34 -1.52 -0.94 -4.09 119.66 117.41 2jx9 s GLN 82 Ca 0.59 -1.41 -0.04 0.00 -1.95 0.00 0.00 55.36 52.55 2jx9 s GLN 82 Cb 0.48 -1.21 0.05 0.00 -0.22 0.00 0.00 33.01 32.11 2jx9 s GLN 82 CO 0.04 -1.25 0.21 0.00 -0.25 0.00 0.00 175.29 174.04 2jx9 s TYR 84 N 2.10 1.08 -0.39 0.00 1.51 -1.26 -2.21 117.35 118.18 2jx9 s TYR 84 Ca -0.00 -0.60 0.04 0.00 -1.01 0.00 0.00 57.07 55.49 2jx9 s TYR 84 Cb -0.12 -0.59 0.16 0.00 -0.11 0.00 0.00 41.96 41.30 2jx9 s TYR 84 CO -0.07 0.01 0.41 -1.17 -1.11 0.00 0.00 175.55 173.62 2jx9 s LEU 85 N -2.25 -0.07 0.22 -1.29 2.96 -1.21 -4.85 118.68 112.20 2jx9 s LEU 85 Ca 0.03 -1.73 -0.10 0.00 -0.22 0.00 0.00 54.13 52.11 2jx9 s LEU 85 Cb -0.05 0.61 0.31 0.00 0.50 0.00 0.00 46.19 47.57 2jx9 s LEU 85 CO 0.01 -0.23 1.67 -0.65 -1.32 0.00 0.00 176.35 175.83 2jx9 h PRO 86 N 6.74 0.14 -0.27 0.98 0.11 -1.91 -1.31 132.00 136.49 2jx9 h PRO 86 Ca 0.08 -0.01 0.08 0.00 0.11 0.00 0.00 66.00 66.26 2jx9 h PRO 86 Cb 1.05 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 2jx9 h PRO 86 CO 0.20 0.10 0.33 -0.44 -0.21 0.00 0.00 178.00 177.97 2jx9 h ASP 87 N 0.15 0.00 -0.71 -2.05 3.32 -1.96 -0.81 116.42 114.35 2jx9 h ASP 87 Ca 0.33 0.00 0.19 0.00 0.02 0.00 0.00 57.03 57.57 2jx9 h ASP 87 Cb 0.53 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 2jx9 h ASP 87 CO -0.51 0.00 0.50 0.00 -1.72 0.00 0.00 179.24 177.51 2jx9 h ALA 88 N 1.60 2.54 -0.29 3.45 0.00 -1.55 -1.33 119.26 123.68 2jx9 h ALA 88 Ca 0.13 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2jx9 h ALA 88 Cb 0.78 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2jx9 h ALA 88 CO -0.00 -0.75 0.02 0.35 0.00 0.00 0.00 179.25 178.87 2jx9 h PHE 89 N 0.09 0.54 -0.47 0.00 3.57 -1.23 -2.68 116.94 116.75 2jx9 h PHE 89 Ca 0.34 -0.08 -0.06 0.00 3.53 0.00 0.00 57.97 61.70 2jx9 h PHE 89 Cb 1.23 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.81 2jx9 h PHE 89 CO -0.00 0.62 0.08 1.57 -2.23 0.00 0.00 178.31 178.34 2jx9 h LYS 90 N 0.30 0.79 -0.47 1.11 2.10 -1.41 -0.07 116.57 118.91 2jx9 h LYS 90 Ca 0.08 -0.21 0.02 0.00 -2.00 0.00 0.00 60.65 58.54 2jx9 h LYS 90 Cb 0.39 -0.09 -0.03 0.00 -0.90 0.00 0.00 32.23 31.60 2jx9 h LYS 90 CO 0.01 0.80 0.28 0.82 -2.00 0.00 0.00 179.45 179.35 2jx9 h ILE 91 N 0.66 1.05 -0.22 0.07 2.04 -1.47 0.95 117.51 120.58 2jx9 h ILE 91 Ca 0.14 -0.19 -0.14 0.00 1.00 0.00 0.00 64.86 65.68 2jx9 h ILE 91 Cb 0.39 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2jx9 h ILE 91 CO 0.01 0.10 -0.43 0.24 0.00 0.00 0.00 178.15 178.07 2jx9 h MET 92 N 0.56 0.53 -0.25 2.37 2.86 -1.35 -1.79 114.93 117.85 2jx9 h MET 92 Ca 0.19 -0.28 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2jx9 h MET 92 Cb 0.02 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 2jx9 h MET 92 CO -0.09 0.87 0.15 0.77 1.06 0.00 0.00 176.91 179.67 2jx9 h SER 93 N 0.44 0.31 -0.53 1.22 0.02 -0.35 0.49 113.55 115.14 2jx9 h SER 93 Ca 0.03 -0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 60.87 2jx9 h SER 93 Cb 0.93 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 2jx9 h SER 93 CO 0.08 0.27 0.12 1.56 -1.14 0.00 0.00 176.83 177.72 2jx9 h GLN 94 N 0.31 0.91 0.04 3.45 4.20 -0.74 0.29 115.11 123.57 2jx9 h GLN 94 Ca 0.09 -0.21 -0.23 0.00 0.06 0.00 0.00 58.65 58.37 2jx9 h GLN 94 Cb 0.03 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.67 2jx9 h GLN 94 CO -0.02 0.83 -1.01 0.00 -0.67 0.00 0.00 178.83 177.96 2jx9 h ARG 95 N 0.87 0.25 0.00 1.46 3.08 -0.90 -3.39 114.38 115.75 2jx9 h ARG 95 Ca 0.18 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.91 2jx9 h ARG 95 Cb 0.35 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2jx9 h ARG 95 CO 0.00 1.07 -1.35 0.00 -1.07 0.00 0.00 179.97 178.63 2jx9 s ASN 97 N -2.91 6.40 -0.52 0.00 0.01 1.00 -1.72 114.94 117.20 2jx9 s ASN 97 Ca -0.03 2.92 0.00 0.00 -0.71 0.00 0.00 52.86 55.05 2jx9 s ASN 97 Cb 0.05 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 39.08 2jx9 s ASN 97 CO 0.34 -0.88 0.00 0.59 -1.51 0.00 0.00 177.10 175.64 2jx9 n ASN 98 N 2.03 -4.79 -4.54 -1.22 3.02 -0.39 -4.96 115.26 104.40 2jx9 n ASN 98 Ca 0.07 0.12 -0.31 0.00 -0.03 0.00 0.00 54.58 54.43 2jx9 n ASN 98 Cb 0.38 -2.72 -0.11 0.00 -0.61 0.00 0.00 39.78 36.72 2jx9 n ASN 98 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2jx9 s ARG 99 N -1.95 2.33 0.27 3.52 0.52 -0.70 -4.82 118.95 118.12 2jx9 s ARG 99 Ca 0.00 -0.86 0.07 0.00 -0.52 0.00 0.00 55.73 54.43 2jx9 s ARG 99 Cb 0.00 -2.36 0.37 0.00 0.52 0.00 0.00 34.95 33.47 2jx9 s ARG 99 CO 0.00 0.57 1.63 1.15 0.02 0.00 0.00 175.30 178.67 2jx9 h THR 100 N 3.75 1.37 -3.24 0.02 2.02 -1.85 0.65 112.91 115.63 2jx9 h THR 100 Ca -0.48 -1.85 -0.09 0.00 0.77 0.00 0.00 66.41 64.76 2jx9 h THR 100 Cb 1.16 1.94 -0.17 0.00 -1.74 0.00 0.00 68.15 69.35 2jx9 h THR 100 CO 0.51 0.54 -0.21 0.00 0.37 0.00 0.00 175.52 176.73 2jx9 s GLN 101 N -3.84 0.84 -0.23 6.66 -2.07 -1.26 0.84 119.66 120.60 2jx9 s GLN 101 Ca -0.03 -0.48 -0.15 0.00 -1.82 0.00 0.00 55.36 52.88 2jx9 s GLN 101 Cb 0.13 0.37 0.07 0.00 -1.09 0.00 0.00 33.01 32.48 2jx9 s GLN 101 CO 0.78 -0.28 0.58 0.00 -1.32 0.00 0.00 175.29 175.05 2jx9 s VAL 103 N 1.19 2.85 -0.01 0.00 1.01 -1.26 -1.94 120.40 122.24 2jx9 s VAL 103 Ca -0.07 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.19 2jx9 s VAL 103 Cb -0.06 -2.19 -0.00 0.00 0.00 0.00 0.00 36.38 34.14 2jx9 s VAL 103 CO -0.12 0.53 -0.04 -0.69 0.00 0.00 0.00 175.10 174.78 2jx9 s VAL 104 N 0.42 0.33 -0.23 2.92 1.01 -1.01 -4.96 120.40 118.88 2jx9 s VAL 104 Ca -0.11 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.41 2jx9 s VAL 104 Cb -0.16 -0.29 -0.01 0.00 0.00 0.00 0.00 36.38 35.91 2jx9 s VAL 104 CO 0.05 0.10 1.43 -0.69 0.00 0.00 0.00 175.10 176.00 2jx9 s VAL 105 N 0.00 3.97 0.00 2.92 1.01 -1.26 -0.82 120.40 126.22 2jx9 s VAL 105 Ca 0.00 1.11 -0.00 0.00 0.00 0.00 0.00 61.98 63.09 2jx9 s VAL 105 Cb -0.03 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 2jx9 s VAL 105 CO -0.00 -0.32 1.29 0.00 0.00 0.00 0.00 175.10 176.06 2jx9 n ALA 106 N 7.71 3.09 0.00 5.51 0.00 -0.92 -4.57 120.51 131.32 2jx9 n ALA 106 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2jx9 n ALA 106 Cb 0.46 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 1.80 -0.23 3.35 0.00 0.00 -1.26 -2.09 105.19 106.76 2jx9 n GLY 107 Ca 0.02 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.23 113.62 116.62 2jx9 n SER 108 Ca 0.00 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.60 2jx9 n SER 108 Cb 0.00 0.00 0.34 0.00 -0.75 0.00 0.00 64.21 63.80 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 -1.92 0.00 0.06 -3.46 8.00 -1.26 -1.97 116.55 116.00 2jx9 n ASP 109 Ca 0.00 -0.38 0.13 0.00 0.71 0.00 0.00 54.79 55.24 2jx9 n ASP 109 Cb 0.00 0.00 0.31 0.00 -0.02 0.00 0.00 41.12 41.41 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 -0.98 2.72 -3.72 2.24 0.00 -0.12 -4.79 120.51 115.86 2jx9 n ALA 110 Ca 0.09 -0.17 -0.14 0.00 0.00 0.00 0.00 53.44 53.22 2jx9 n ALA 110 Cb 0.04 -1.30 -0.14 0.00 0.00 0.00 0.00 19.45 18.05 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 -3.11 -0.23 0.00 0.00 0.08 0.68 -4.87 117.98 110.55 2jx9 s PHE 111 Ca 0.09 0.62 0.00 0.00 0.12 0.00 0.00 56.93 57.76 2jx9 s PHE 111 Cb 0.14 -0.09 0.00 0.00 -0.57 0.00 0.00 43.02 42.50 2jx9 s PHE 111 CO 0.65 -0.22 0.00 -2.30 -0.10 0.00 0.00 175.22 173.25 2jx9 n PRO 112 N 4.59 3.12 -3.23 0.24 -0.02 -1.26 -4.60 135.00 133.84 2jx9 n PRO 112 Ca -0.19 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.08 2jx9 n PRO 112 Cb 0.51 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.92 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 -2.56 0.67 0.00 2.55 -1.08 -1.26 -4.95 116.67 110.04 2jx9 s ASP 113 Ca 0.00 -2.72 0.24 0.00 -0.52 0.00 0.00 52.55 49.55 2jx9 s ASP 113 Cb 0.00 0.17 1.28 0.00 -1.46 0.00 0.00 42.92 42.92 2jx9 s ASP 113 CO 0.00 -0.14 1.79 -0.81 0.52 0.00 0.00 175.17 176.53 2jx9 n PRO 114 N 2.88 0.49 -2.72 4.34 -0.04 -1.26 -4.15 135.00 134.54 2jx9 n PRO 114 Ca 0.27 0.04 -0.07 0.00 -0.04 0.00 0.00 63.50 63.69 2jx9 n PRO 114 Cb 0.50 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.54 2jx9 n PRO 114 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jx9 n PRO 116 N 0.81 1.45 -0.26 0.00 -0.04 -1.26 -2.12 135.00 133.58 2jx9 n PRO 116 Ca 0.05 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 64.03 2jx9 n PRO 116 Cb 0.69 -2.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 2jx9 n PRO 116 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jx9 n GLY 117 N 1.10 1.02 3.25 0.55 0.00 -1.26 -5.04 105.19 104.81 2jx9 n GLY 117 Ca 0.09 0.00 -0.24 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 -2.73 1.61 -0.39 2.61 2.01 -0.90 -4.42 115.64 113.43 2jx9 s THR 118 Ca 0.00 -1.36 -0.29 0.00 0.31 0.00 0.00 61.69 60.35 2jx9 s THR 118 Cb 0.00 -1.44 0.02 0.00 0.01 0.00 0.00 72.50 71.09 2jx9 s THR 118 CO 0.00 0.03 1.08 -0.47 -0.69 0.00 0.00 174.62 174.57 2jx9 s TYR 119 N -1.02 3.01 0.00 4.92 6.14 0.18 -4.97 117.35 125.61 2jx9 s TYR 119 Ca 0.06 0.96 0.00 0.00 0.64 0.00 0.00 57.07 58.72 2jx9 s TYR 119 Cb -0.09 -3.97 0.00 0.00 0.42 0.00 0.00 41.96 38.31 2jx9 s TYR 119 CO 0.03 -0.97 0.00 1.63 0.64 0.00 0.00 175.55 176.88 2jx9 n LYS 120 N 7.23 2.14 -3.89 4.97 5.02 -1.26 -4.76 118.16 127.61 2jx9 n LYS 120 Ca 0.11 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.42 2jx9 n LYS 120 Cb 0.48 0.00 0.01 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 1.16 0.01 -0.10 2.13 -0.85 0.17 -2.32 117.35 117.55 2jx9 s TYR 121 Ca 0.00 -0.16 -0.00 0.00 -0.52 0.00 0.00 57.07 56.39 2jx9 s TYR 121 Cb 0.00 0.57 0.02 0.00 0.38 0.00 0.00 41.96 42.94 2jx9 s TYR 121 CO 0.00 -0.35 -0.07 -1.17 -1.52 0.00 0.00 175.55 172.44 2jx9 s LEU 122 N -3.56 1.16 -0.12 -3.49 2.96 -0.72 -1.11 118.68 113.82 2jx9 s LEU 122 Ca 0.25 -0.27 0.03 0.00 -0.22 0.00 0.00 54.13 53.92 2jx9 s LEU 122 Cb 0.01 -0.77 0.01 0.00 0.50 0.00 0.00 46.19 45.93 2jx9 s LEU 122 CO -0.01 -0.11 -0.22 -0.70 -1.32 0.00 0.00 176.35 173.99 2jx9 s GLU 123 N 1.60 2.90 -0.04 1.98 2.12 -0.48 -1.98 118.70 124.79 2jx9 s GLU 123 Ca 0.02 -0.82 0.01 0.00 0.36 0.00 0.00 54.97 54.54 2jx9 s GLU 123 Cb -0.13 -2.28 0.02 0.00 0.26 0.00 0.00 34.13 32.01 2jx9 s GLU 123 CO -0.06 0.07 -0.03 0.08 -0.54 0.00 0.00 175.26 174.78 2jx9 s VAL 124 N 0.62 0.43 -0.16 3.70 1.01 -0.65 -0.67 120.40 124.68 2jx9 s VAL 124 Ca -0.13 -0.05 -0.04 0.00 0.00 0.00 0.00 61.98 61.76 2jx9 s VAL 124 Cb -0.17 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 2jx9 s VAL 124 CO 0.03 0.20 -0.02 -1.10 0.00 0.00 0.00 175.10 174.22 2jx9 s GLN 125 N 1.01 3.71 0.30 2.72 1.11 0.13 -1.74 119.66 126.91 2jx9 s GLN 125 Ca -0.10 -0.48 -0.13 0.00 0.01 0.00 0.00 55.36 54.66 2jx9 s GLN 125 Cb -0.14 -2.97 0.01 0.00 -1.01 0.00 0.00 33.01 28.91 2jx9 s GLN 125 CO -0.01 0.26 0.59 1.52 0.01 0.00 0.00 175.29 177.66 2jx9 s TYR 126 N 0.32 0.36 0.14 0.91 1.13 0.24 -1.38 117.35 119.08 2jx9 s TYR 126 Ca -0.02 -0.78 0.03 0.00 -1.41 0.00 0.00 57.07 54.89 2jx9 s TYR 126 Cb -0.14 0.36 -0.04 0.00 -1.10 0.00 0.00 41.96 41.04 2jx9 s TYR 126 CO 0.02 -1.19 -0.07 -0.51 -2.51 0.00 0.00 175.55 171.29 2jx9 s ASP 127 N -3.06 1.53 -0.31 -0.18 1.01 -0.99 -1.05 116.67 113.62 2jx9 s ASP 127 Ca 0.21 -1.05 -0.04 0.00 0.71 0.00 0.00 52.55 52.37 2jx9 s ASP 127 Cb -0.03 0.04 0.04 0.00 1.01 0.00 0.00 42.92 43.98 2jx9 s ASP 127 CO 0.12 -0.42 0.05 0.00 0.21 0.00 0.00 175.17 175.13 2jx9 s VAL 129 N 1.36 3.44 0.42 0.00 -7.23 -0.97 -4.81 120.40 112.61 2jx9 s VAL 129 Ca -0.02 -1.82 -0.26 0.00 -1.81 0.00 0.00 61.98 58.07 2jx9 s VAL 129 Cb -0.19 -2.81 -0.10 0.00 0.56 0.00 0.00 36.38 33.84 2jx9 s VAL 129 CO 0.01 -0.30 1.35 -2.65 -0.31 0.00 0.00 175.10 173.20 2jx9 n PRO 130 N -0.66 2.15 -2.53 4.82 -0.02 -1.26 -1.59 135.00 135.90 2jx9 n PRO 130 Ca -0.07 0.76 -0.41 0.00 -2.02 0.00 0.00 63.50 61.76 2jx9 n PRO 130 Cb 0.58 -2.49 -0.04 0.00 -0.02 0.00 0.00 33.50 31.52 2jx9 n PRO 130 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2jx9 s TYR 131 N -1.18 3.63 -0.03 6.00 5.04 -1.26 -4.82 117.35 124.73 2jx9 s TYR 131 Ca 0.59 1.65 0.02 0.00 -2.44 0.00 0.00 57.07 56.89 2jx9 s TYR 131 Cb -0.49 -3.25 0.01 0.00 0.35 0.00 0.00 41.96 38.58 2jx9 s TYR 131 CO 0.59 -0.49 -0.05 0.21 -1.34 0.00 0.00 175.55 174.47 2jx9 s LYS 132 N -0.68 0.69 -0.13 4.97 2.20 -1.26 -5.11 119.74 120.42 2jx9 s LYS 132 Ca 0.47 -0.16 -0.18 0.00 -0.36 0.00 0.00 55.97 55.75 2jx9 s LYS 132 Cb -0.30 -0.69 -0.04 0.00 -1.51 0.00 0.00 37.83 35.29 2jx9 s LYS 132 CO 0.36 0.02 0.46 0.54 -0.36 0.00 0.00 175.35 176.37 2jx9 s VAL 133 N 0.44 5.20 0.00 4.02 0.11 -1.26 -5.25 120.40 123.66 2jx9 s VAL 133 Ca -0.06 0.91 0.00 0.00 -2.93 0.00 0.00 61.98 59.91 2jx9 s VAL 133 Cb -0.09 -3.80 0.00 0.00 -1.53 0.00 0.00 36.38 30.96 2jx9 s VAL 133 CO 0.00 0.32 0.00 -0.62 -3.33 0.00 0.00 175.10 171.47