#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jqz n PRO 11 N 0.00 -1.04 -5.03 1.61 -0.04 -1.26 -4.97 135.00 124.26 2jqz n PRO 11 Ca 0.00 -0.27 -0.30 0.00 -0.04 0.00 0.00 63.50 62.89 2jqz n PRO 11 Cb 0.00 -1.87 -0.17 0.00 -0.04 0.00 0.00 33.50 31.42 2jqz n PRO 11 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2jqz s VAL 12 N -2.35 1.80 -0.27 0.52 -7.23 -0.97 -4.86 120.40 107.04 2jqz s VAL 12 Ca 0.58 -0.86 -0.25 0.00 -1.81 0.00 0.00 61.98 59.64 2jqz s VAL 12 Cb -0.18 -1.57 0.00 0.00 0.56 0.00 0.00 36.38 35.19 2jqz s VAL 12 CO 0.66 0.50 0.86 -0.75 -0.31 0.00 0.00 175.10 176.07 2jqz s LYS 13 N 0.44 4.11 -0.08 4.82 2.20 -1.26 -0.43 119.74 129.54 2jqz s LYS 13 Ca -0.17 0.89 0.02 0.00 -0.36 0.00 0.00 55.97 56.35 2jqz s LYS 13 Cb -0.17 -3.68 -0.02 0.00 -1.51 0.00 0.00 37.83 32.45 2jqz s LYS 13 CO 0.07 -0.62 -0.15 -1.17 -0.36 0.00 0.00 175.35 173.12 2jqz s LEU 14 N 3.01 2.67 -0.37 5.43 2.96 -0.19 -2.01 118.68 130.18 2jqz s LEU 14 Ca 0.36 -0.27 -0.08 0.00 -0.22 0.00 0.00 54.13 53.92 2jqz s LEU 14 Cb -0.15 -1.56 0.05 0.00 0.50 0.00 0.00 46.19 45.03 2jqz s LEU 14 CO 0.10 0.27 0.17 -0.60 -1.32 0.00 0.00 176.35 174.97 2jqz s ARG 15 N -0.28 2.66 -0.41 1.98 3.52 -0.96 -1.49 118.95 123.97 2jqz s ARG 15 Ca 0.02 -1.22 -0.18 0.00 -0.13 0.00 0.00 55.73 54.21 2jqz s ARG 15 Cb -0.13 -3.61 0.02 0.00 -1.56 0.00 0.00 34.95 29.67 2jqz s ARG 15 CO 0.03 -0.75 0.49 -1.17 -0.81 0.00 0.00 175.30 173.09 2jqz s LEU 16 N 1.45 4.67 -0.44 -0.88 0.20 -0.95 -2.60 118.68 120.13 2jqz s LEU 16 Ca 0.01 -0.47 -0.20 0.00 0.69 0.00 0.00 54.13 54.16 2jqz s LEU 16 Cb -0.20 -2.49 0.03 0.00 -0.43 0.00 0.00 46.19 43.10 2jqz s LEU 16 CO 0.04 -0.59 0.58 -0.89 -0.29 0.00 0.00 176.35 175.20 2jqz s THR 17 N 2.31 4.91 -0.98 3.68 2.01 -0.11 -2.55 115.64 124.91 2jqz s THR 17 Ca 0.15 -0.09 -0.23 0.00 0.31 0.00 0.00 61.69 61.84 2jqz s THR 17 Cb -0.16 -4.17 0.06 0.00 0.01 0.00 0.00 72.50 68.25 2jqz s THR 17 CO 0.15 -0.57 1.37 -0.69 -0.69 0.00 0.00 174.62 174.19 2jqz s VAL 18 N 2.60 4.05 -0.02 3.82 1.01 0.12 -1.11 120.40 130.86 2jqz s VAL 18 Ca 0.19 -0.81 -0.18 0.00 0.00 0.00 0.00 61.98 61.17 2jqz s VAL 18 Cb -0.15 -4.99 -0.10 0.00 0.00 0.00 0.00 36.38 31.13 2jqz s VAL 18 CO 0.17 -1.85 0.75 0.25 0.00 0.00 0.00 175.10 174.42 2jqz h LEU 19 N 12.37 -0.55 -7.91 3.92 5.85 -1.68 0.31 115.31 127.62 2jqz h LEU 19 Ca 0.15 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.98 2jqz h LEU 19 Cb 1.02 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 2jqz h LEU 19 CO 1.36 -0.14 0.33 0.00 -0.34 0.00 0.00 178.44 179.65 2jqz s ALA 21 N -3.28 1.74 0.22 0.00 0.00 -1.11 -0.44 121.76 118.88 2jqz s ALA 21 Ca 0.13 -1.42 0.09 0.00 0.00 0.00 0.00 51.96 50.76 2jqz s ALA 21 Cb -0.04 -0.11 -0.05 0.00 0.00 0.00 0.00 23.12 22.92 2jqz s ALA 21 CO 0.07 0.13 -0.17 0.15 0.00 0.00 0.00 175.76 175.94 2jqz s LYS 22 N -2.91 1.43 -0.80 0.00 -0.14 0.13 -3.48 119.74 113.97 2jqz s LYS 22 Ca 0.13 -1.61 -0.07 0.00 -1.36 0.00 0.00 55.97 53.07 2jqz s LYS 22 Cb -0.04 -1.38 0.01 0.00 -1.68 0.00 0.00 37.83 34.74 2jqz s LYS 22 CO 0.05 0.25 0.54 -1.71 -0.76 0.00 0.00 175.35 173.72 2jqz n ASN 23 N -0.30 -4.05 -4.68 2.83 4.05 -0.95 -0.48 115.26 111.68 2jqz n ASN 23 Ca -0.08 -0.93 -0.42 0.00 0.45 0.00 0.00 54.58 53.59 2jqz n ASN 23 Cb 0.59 -1.39 -0.03 0.00 1.23 0.00 0.00 39.78 40.19 2jqz n ASN 23 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2jqz s LEU 24 N -5.19 4.26 -0.27 1.20 2.01 -1.06 -2.22 118.68 117.41 2jqz s LEU 24 Ca 0.10 1.78 -0.33 0.00 0.01 0.00 0.00 54.13 55.69 2jqz s LEU 24 Cb -0.05 -3.56 -0.09 0.00 0.01 0.00 0.00 46.19 42.50 2jqz s LEU 24 CO 0.80 -0.60 2.15 0.55 1.01 0.00 0.00 176.35 180.27 2jqz n VAL 25 N 4.72 0.30 0.20 -1.59 3.14 -1.26 -4.74 118.33 119.09 2jqz n VAL 25 Ca 0.11 -0.31 0.03 0.00 -2.96 0.00 0.00 64.34 61.22 2jqz n VAL 25 Cb 0.46 -1.99 0.15 0.00 -1.06 0.00 0.00 33.84 31.40 2jqz n VAL 25 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 2jqz n LYS 26 N 8.15 0.01 0.00 1.45 2.85 -1.26 -4.58 118.16 124.77 2jqz n LYS 26 Ca 0.35 0.41 0.00 0.00 -1.05 0.00 0.00 58.31 58.02 2jqz n LYS 26 Cb 0.31 -1.53 0.00 0.00 -0.65 0.00 0.00 35.03 33.16 2jqz n LYS 26 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2jqz n LYS 27 N -1.55 0.00 -3.76 -1.58 4.76 -1.26 -4.17 118.16 110.59 2jqz n LYS 27 Ca 0.01 0.00 -0.37 0.00 -2.87 0.00 0.00 58.31 55.09 2jqz n LYS 27 Cb 0.07 0.00 -0.12 0.00 -1.84 0.00 0.00 35.03 33.14 2jqz n LYS 27 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2jqz s ASP 28 N -2.42 5.46 0.59 4.39 1.11 -1.26 -5.07 116.67 119.46 2jqz s ASP 28 Ca 0.00 -0.10 -0.18 0.00 0.18 0.00 0.00 52.55 52.45 2jqz s ASP 28 Cb 0.00 -1.98 -0.07 0.00 1.07 0.00 0.00 42.92 41.93 2jqz s ASP 28 CO 0.00 -0.00 0.65 0.49 1.18 0.00 0.00 175.17 177.49 2jqz n PHE 29 N 4.70 -0.27 0.00 4.23 3.72 -1.26 -0.39 117.46 128.19 2jqz n PHE 29 Ca -0.16 0.44 0.00 0.00 -0.05 0.00 0.00 57.45 57.68 2jqz n PHE 29 Cb 0.52 -2.00 0.00 0.00 -0.94 0.00 0.00 39.48 37.05 2jqz n PHE 29 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2jqz n PHE 30 N -1.74 0.00 -2.96 1.38 7.35 -1.26 -4.90 117.46 115.33 2jqz n PHE 30 Ca 0.12 0.00 -0.21 0.00 -0.76 0.00 0.00 57.45 56.61 2jqz n PHE 30 Cb 0.48 -0.04 0.02 0.00 0.35 0.00 0.00 39.48 40.28 2jqz n PHE 30 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2jqz s ARG 31 N 0.00 2.86 0.06 -4.13 0.52 0.48 -5.13 118.95 113.60 2jqz s ARG 31 Ca 0.00 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.44 2jqz s ARG 31 Cb 0.00 -2.61 -0.03 0.00 0.52 0.00 0.00 34.95 32.83 2jqz s ARG 31 CO 0.00 -0.36 -0.07 -0.51 0.02 0.00 0.00 175.30 174.37 2jqz s LEU 32 N -4.53 2.32 0.24 2.53 2.01 -1.26 -4.60 118.68 115.39 2jqz s LEU 32 Ca 0.52 -0.67 -0.04 0.00 0.01 0.00 0.00 54.13 53.95 2jqz s LEU 32 Cb -0.10 -0.12 -0.05 0.00 0.01 0.00 0.00 46.19 45.92 2jqz s LEU 32 CO 0.36 -0.28 0.48 -2.16 1.01 0.00 0.00 176.35 175.76 2jqz s PRO 33 N -2.19 3.61 -0.86 1.29 0.04 -1.26 -4.70 135.00 130.93 2jqz s PRO 33 Ca -0.04 -0.08 -0.00 0.00 0.04 0.00 0.00 61.00 60.91 2jqz s PRO 33 Cb -0.06 -2.73 0.22 0.00 0.04 0.00 0.00 34.50 31.97 2jqz s PRO 33 CO -0.01 0.31 0.77 -0.25 0.04 0.00 0.00 177.00 177.86 2jqz n ASP 34 N -0.65 4.10 -4.77 6.66 9.92 -1.26 -1.66 116.55 128.91 2jqz n ASP 34 Ca -0.02 -3.18 -0.40 0.00 -0.53 0.00 0.00 54.79 50.66 2jqz n ASP 34 Cb 0.53 -0.99 0.01 0.00 -0.64 0.00 0.00 41.12 40.03 2jqz n ASP 34 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2jqz s PRO 35 N -1.54 3.82 0.26 -0.24 0.04 -1.16 -1.74 135.00 134.44 2jqz s PRO 35 Ca 0.28 2.30 -0.11 0.00 0.04 0.00 0.00 61.00 63.51 2jqz s PRO 35 Cb -0.05 -2.70 -0.00 0.00 0.04 0.00 0.00 34.50 31.79 2jqz s PRO 35 CO -0.12 -0.67 0.48 -0.59 0.04 0.00 0.00 177.00 176.14 2jqz s PHE 36 N -1.23 0.47 0.18 0.56 -0.71 -0.72 0.26 117.98 116.78 2jqz s PHE 36 Ca 0.59 -0.83 0.09 0.00 -1.04 0.00 0.00 56.93 55.75 2jqz s PHE 36 Cb -0.41 0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 41.51 2jqz s PHE 36 CO 0.53 -1.02 -0.19 0.00 -1.34 0.00 0.00 175.22 173.19 2jqz s ALA 37 N -3.84 2.15 -0.18 1.99 0.00 -1.11 -1.52 121.76 119.25 2jqz s ALA 37 Ca 0.24 -1.54 -0.03 0.00 0.00 0.00 0.00 51.96 50.62 2jqz s ALA 37 Cb -0.00 -0.22 0.06 0.00 0.00 0.00 0.00 23.12 22.96 2jqz s ALA 37 CO 0.11 0.28 0.05 0.15 0.00 0.00 0.00 175.76 176.34 2jqz s LYS 38 N -2.81 0.47 0.01 0.00 1.02 0.30 -0.05 119.74 118.67 2jqz s LYS 38 Ca 0.18 -0.29 -0.20 0.00 0.02 0.00 0.00 55.97 55.68 2jqz s LYS 38 Cb -0.06 -1.96 -0.06 0.00 -0.52 0.00 0.00 37.83 35.23 2jqz s LYS 38 CO 0.08 -0.63 0.57 0.08 -0.92 0.00 0.00 175.35 174.53 2jqz s VAL 39 N 1.95 4.89 -0.01 3.17 1.01 0.10 -1.05 120.40 130.46 2jqz s VAL 39 Ca 0.00 1.20 0.06 0.00 0.00 0.00 0.00 61.98 63.25 2jqz s VAL 39 Cb -0.16 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 2jqz s VAL 39 CO -0.08 0.45 -0.20 -0.69 0.00 0.00 0.00 175.10 174.58 2jqz s VAL 40 N -0.38 1.60 -0.62 2.92 1.01 -0.82 -1.02 120.40 123.09 2jqz s VAL 40 Ca 0.30 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 61.29 2jqz s VAL 40 Cb -0.18 -1.33 0.16 0.00 0.00 0.00 0.00 36.38 35.03 2jqz s VAL 40 CO 0.17 0.45 0.54 -0.69 0.00 0.00 0.00 175.10 175.56 2jqz s VAL 41 N -0.48 4.94 -0.26 2.92 1.01 -1.15 -2.54 120.40 124.84 2jqz s VAL 41 Ca 0.08 -2.00 -0.04 0.00 0.00 0.00 0.00 61.98 60.02 2jqz s VAL 41 Cb -0.08 -4.15 -0.08 0.00 0.00 0.00 0.00 36.38 32.07 2jqz s VAL 41 CO -0.01 -0.89 0.60 -0.67 0.00 0.00 0.00 175.10 174.13 2jqz n ASP 42 N 4.62 -0.29 0.00 3.32 2.03 -1.20 -2.15 116.55 122.88 2jqz n ASP 42 Ca -0.02 -0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.19 2jqz n ASP 42 Cb 0.42 -0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.66 2jqz n ASP 42 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jqz n GLY 43 N 1.51 0.73 0.00 0.27 0.00 -1.26 -4.78 105.19 101.66 2jqz n GLY 43 Ca 0.18 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2jqz n GLY 43 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jqz n SER 44 N 0.00 0.00 0.00 1.61 7.64 -0.91 -5.03 113.62 116.93 2jqz n SER 44 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2jqz n SER 44 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2jqz n SER 44 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jqz n GLY 45 N 0.00 1.04 3.12 0.23 0.00 -1.26 -4.87 105.19 103.45 2jqz n GLY 45 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2jqz n GLY 45 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jqz s GLN 46 N 0.00 2.47 0.13 1.61 -0.21 -1.26 -5.10 119.66 117.29 2jqz s GLN 46 Ca 0.00 -1.21 0.08 0.00 0.02 0.00 0.00 55.36 54.25 2jqz s GLN 46 Cb 0.00 -2.94 -0.04 0.00 1.00 0.00 0.00 33.01 31.03 2jqz s GLN 46 CO 0.00 -0.51 -0.18 0.00 -2.12 0.00 0.00 175.29 172.47 2jqz s HIS 48 N -1.65 0.81 -0.21 0.00 3.76 -0.19 -4.97 115.29 112.83 2jqz s HIS 48 Ca 0.10 -1.11 -0.22 0.00 -0.15 0.00 0.00 55.06 53.67 2jqz s HIS 48 Cb -0.08 -0.32 0.06 0.00 1.11 0.00 0.00 32.58 33.36 2jqz s HIS 48 CO 0.05 -0.69 0.61 -1.54 -0.85 0.00 0.00 174.74 172.32 2jqz s SER 49 N -3.07 -0.62 0.10 1.40 1.04 -1.26 0.01 113.70 111.30 2jqz s SER 49 Ca 0.28 1.15 0.03 0.00 0.48 0.00 0.00 55.95 57.90 2jqz s SER 49 Cb 0.05 1.16 -0.04 0.00 0.10 0.00 0.00 66.02 67.29 2jqz s SER 49 CO 0.07 -0.25 0.14 0.42 0.98 0.00 0.00 173.24 174.59 2jqz s THR 50 N 0.15 4.77 0.99 2.02 -4.23 0.93 -4.94 115.64 115.35 2jqz s THR 50 Ca -0.01 -0.74 -0.15 0.00 -1.18 0.00 0.00 61.69 59.60 2jqz s THR 50 Cb -0.04 -3.35 0.01 0.00 1.34 0.00 0.00 72.50 70.46 2jqz s THR 50 CO 0.02 0.06 0.06 -0.90 -0.54 0.00 0.00 174.62 173.32 2jqz n ASP 51 N 0.17 -2.77 -4.89 3.99 5.75 -1.26 -2.75 116.55 114.78 2jqz n ASP 51 Ca -0.08 0.20 -0.32 0.00 -0.01 0.00 0.00 54.79 54.59 2jqz n ASP 51 Cb 0.52 -1.06 -0.05 0.00 -1.03 0.00 0.00 41.12 39.50 2jqz n ASP 51 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2jqz s THR 52 N -2.29 5.13 -0.31 2.12 2.01 -1.26 -4.21 115.64 116.84 2jqz s THR 52 Ca 0.53 0.13 -0.01 0.00 0.31 0.00 0.00 61.69 62.65 2jqz s THR 52 Cb -0.17 -3.62 0.06 0.00 0.01 0.00 0.00 72.50 68.77 2jqz s THR 52 CO 0.69 0.05 0.01 -0.69 -0.69 0.00 0.00 174.62 173.99 2jqz s VAL 53 N -1.65 2.92 0.22 3.82 1.01 0.14 -4.97 120.40 121.89 2jqz s VAL 53 Ca 0.41 -1.48 -0.32 0.00 0.00 0.00 0.00 61.98 60.59 2jqz s VAL 53 Cb -0.12 -2.72 -0.13 0.00 0.00 0.00 0.00 36.38 33.41 2jqz s VAL 53 CO 0.23 -0.16 1.56 0.29 0.00 0.00 0.00 175.10 177.02 2jqz n LYS 54 N 4.59 2.35 -0.15 2.72 4.01 -1.26 -3.00 118.16 127.42 2jqz n LYS 54 Ca -0.12 0.84 0.00 0.00 -0.51 0.00 0.00 58.31 58.52 2jqz n LYS 54 Cb 0.43 -2.59 0.00 0.00 -0.51 0.00 0.00 35.03 32.36 2jqz n LYS 54 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 2jqz n ASN 55 N 2.88 0.00 -3.76 4.39 6.94 -1.16 -4.91 115.26 119.64 2jqz n ASN 55 Ca 0.13 0.00 -0.10 0.00 -0.02 0.00 0.00 54.58 54.60 2jqz n ASN 55 Cb 0.32 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.70 2jqz n ASN 55 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2jqz s THR 56 N 0.00 0.03 0.00 5.53 -1.32 -0.66 -4.92 115.64 114.30 2jqz s THR 56 Ca 0.00 -0.84 0.00 0.00 -1.21 0.00 0.00 61.69 59.64 2jqz s THR 56 Cb 0.00 -1.59 0.00 0.00 -1.51 0.00 0.00 72.50 69.40 2jqz s THR 56 CO 0.00 -0.15 0.76 0.18 -2.21 0.00 0.00 174.62 173.20 2jqz n LEU 57 N -0.32 1.46 -2.76 9.08 4.77 -1.26 -4.35 117.00 123.62 2jqz n LEU 57 Ca -0.10 -1.46 -0.05 0.00 -0.03 0.00 0.00 56.01 54.37 2jqz n LEU 57 Cb 0.63 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.74 2jqz n LEU 57 CO 0.18 0.37 0.15 -0.67 -1.33 0.00 0.00 177.39 176.08 2jqz n ASP 58 N -0.28 -3.28 -2.85 -1.43 -0.08 -1.26 -2.24 116.55 105.13 2jqz n ASP 58 Ca 0.00 -3.01 -0.12 0.00 -1.51 0.00 0.00 54.79 50.15 2jqz n ASP 58 Cb 0.18 1.77 0.08 0.00 2.34 0.00 0.00 41.12 45.49 2jqz n ASP 58 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2jqz n PRO 59 N 2.56 -0.42 -3.57 -0.67 -0.04 -1.23 -4.89 135.00 126.74 2jqz n PRO 59 Ca 0.15 -0.91 -0.15 0.00 -0.04 0.00 0.00 63.50 62.55 2jqz n PRO 59 Cb 0.58 -0.54 -0.06 0.00 -0.04 0.00 0.00 33.50 33.44 2jqz n PRO 59 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2jqz s LYS 60 N -4.13 0.86 0.00 0.54 0.00 -1.26 -2.75 119.74 113.00 2jqz s LYS 60 Ca 0.31 0.45 0.00 0.00 0.00 0.00 0.00 55.97 56.73 2jqz s LYS 60 Cb -0.01 0.41 0.00 0.00 0.00 0.00 0.00 37.83 38.23 2jqz s LYS 60 CO 0.22 -0.22 0.00 0.91 0.00 0.00 0.00 175.35 176.26 2jqz n TRP 61 N 1.44 0.00 -2.84 1.78 8.01 -0.83 -4.98 117.44 120.01 2jqz n TRP 61 Ca -0.15 0.00 -0.17 0.00 -1.31 0.00 0.00 57.50 55.87 2jqz n TRP 61 Cb 0.57 0.00 -0.00 0.00 -2.01 0.00 0.00 31.31 29.86 2jqz n TRP 61 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.69 174.97 2jqz n ASN 62 N -1.56 -3.83 -4.61 -0.99 2.85 0.08 -4.94 115.26 102.26 2jqz n ASN 62 Ca 0.00 -0.05 -0.32 0.00 -0.11 0.00 0.00 54.58 54.10 2jqz n ASN 62 Cb 0.20 -3.22 -0.10 0.00 1.24 0.00 0.00 39.78 37.90 2jqz n ASN 62 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2jqz s GLN 63 N -5.46 2.55 0.04 1.20 -0.21 -1.10 -4.91 119.66 111.77 2jqz s GLN 63 Ca 0.18 -0.74 0.03 0.00 0.02 0.00 0.00 55.36 54.85 2jqz s GLN 63 Cb -0.09 -2.51 -0.02 0.00 1.00 0.00 0.00 33.01 31.39 2jqz s GLN 63 CO 0.22 0.59 -0.09 -3.38 -2.12 0.00 0.00 175.29 170.51 2jqz s HIS 64 N -1.04 0.78 -0.02 0.91 -3.43 -1.26 0.10 115.29 111.33 2jqz s HIS 64 Ca 0.18 -0.40 0.06 0.00 -0.80 0.00 0.00 55.06 54.11 2jqz s HIS 64 Cb -0.11 -0.46 -0.01 0.00 -1.43 0.00 0.00 32.58 30.56 2jqz s HIS 64 CO 0.09 -0.04 -0.22 0.71 -2.00 0.00 0.00 174.74 173.29 2jqz s TYR 65 N -1.06 1.98 -0.81 0.38 2.02 -1.06 -4.93 117.35 113.88 2jqz s TYR 65 Ca -0.05 -0.42 -0.14 0.00 -0.37 0.00 0.00 57.07 56.09 2jqz s TYR 65 Cb -0.08 -1.28 0.21 0.00 -0.40 0.00 0.00 41.96 40.41 2jqz s TYR 65 CO 0.01 -0.07 0.74 -0.51 -1.57 0.00 0.00 175.55 174.15 2jqz s ASP 66 N -0.40 6.68 0.01 2.29 1.11 -1.26 -2.24 116.67 122.86 2jqz s ASP 66 Ca 0.05 -2.67 -0.05 0.00 0.18 0.00 0.00 52.55 50.07 2jqz s ASP 66 Cb -0.09 -2.19 -0.04 0.00 1.07 0.00 0.00 42.92 41.66 2jqz s ASP 66 CO 0.00 -0.57 0.23 -0.76 1.18 0.00 0.00 175.17 175.25 2jqz s LEU 67 N 0.21 4.36 0.36 1.23 2.01 -0.56 -4.77 118.68 121.53 2jqz s LEU 67 Ca 0.17 0.46 -0.18 0.00 0.01 0.00 0.00 54.13 54.59 2jqz s LEU 67 Cb -0.11 -2.68 -0.10 0.00 0.01 0.00 0.00 46.19 43.31 2jqz s LEU 67 CO -0.08 0.25 0.83 -0.31 1.01 0.00 0.00 176.35 178.05 2jqz s TYR 68 N -1.33 3.38 -0.24 0.29 2.02 -1.26 -1.02 117.35 119.19 2jqz s TYR 68 Ca 0.28 1.41 0.02 0.00 -0.37 0.00 0.00 57.07 58.42 2jqz s TYR 68 Cb -0.13 -2.69 0.05 0.00 -0.40 0.00 0.00 41.96 38.80 2jqz s TYR 68 CO 0.18 0.03 -0.12 0.42 -1.57 0.00 0.00 175.55 174.49 2jqz s ILE 69 N -2.02 2.08 0.00 2.71 -1.09 0.42 -4.88 121.20 118.42 2jqz s ILE 69 Ca 0.57 -1.46 0.00 0.00 -2.23 0.00 0.00 60.65 57.52 2jqz s ILE 69 Cb -0.10 -2.15 0.00 0.00 -1.58 0.00 0.00 42.46 38.63 2jqz s ILE 69 CO 0.16 0.07 0.00 0.61 -1.23 0.00 0.00 174.94 174.55 2jqz n GLY 70 N 4.49 -2.29 0.21 6.18 0.00 -1.26 -2.29 105.19 110.22 2jqz n GLY 70 Ca -0.15 -1.42 -0.05 0.00 0.00 0.00 0.00 46.02 44.40 2jqz n GLY 70 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2jqz h LYS 71 N 0.00 -0.05 -2.08 1.61 1.63 -2.00 -3.23 116.57 112.45 2jqz h LYS 71 Ca 0.00 0.00 -0.53 0.00 -0.85 0.00 0.00 60.65 59.27 2jqz h LYS 71 Cb 0.00 0.01 -0.40 0.00 -0.60 0.00 0.00 32.23 31.24 2jqz h LYS 71 CO 0.00 -0.03 -1.00 0.45 -3.45 0.00 0.00 179.45 175.42 2jqz n SER 72 N -5.35 1.82 -4.73 4.20 2.88 -1.26 -5.10 113.62 106.09 2jqz n SER 72 Ca 0.03 -3.15 -0.23 0.00 -1.33 0.00 0.00 58.87 54.19 2jqz n SER 72 Cb 0.26 -0.61 -0.06 0.00 -0.75 0.00 0.00 64.21 63.04 2jqz n SER 72 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jqz s ASP 73 N -2.45 4.93 0.28 -3.46 2.15 -1.22 -4.97 116.67 111.92 2jqz s ASP 73 Ca 0.41 -0.53 0.02 0.00 0.43 0.00 0.00 52.55 52.89 2jqz s ASP 73 Cb 0.28 -1.02 -0.04 0.00 -0.30 0.00 0.00 42.92 41.85 2jqz s ASP 73 CO -0.09 -0.08 0.15 -0.44 -0.17 0.00 0.00 175.17 174.54 2jqz s SER 74 N -3.78 1.22 -0.01 -0.34 0.01 -1.26 -3.29 113.70 106.25 2jqz s SER 74 Ca 0.33 -1.51 0.00 0.00 1.31 0.00 0.00 55.95 56.09 2jqz s SER 74 Cb -0.06 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.54 2jqz s SER 74 CO 0.22 -0.87 -0.01 -0.69 0.41 0.00 0.00 173.24 172.30 2jqz s VAL 75 N -3.73 0.12 -0.25 3.43 1.01 -0.73 -3.26 120.40 117.00 2jqz s VAL 75 Ca 0.37 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.31 2jqz s VAL 75 Cb 0.06 -0.13 0.07 0.00 0.00 0.00 0.00 36.38 36.38 2jqz s VAL 75 CO 0.17 0.05 0.02 -0.89 0.00 0.00 0.00 175.10 174.45 2jqz s THR 76 N 0.16 1.10 -0.18 3.92 2.01 -1.05 -1.56 115.64 120.03 2jqz s THR 76 Ca -0.01 -1.14 -0.20 0.00 0.31 0.00 0.00 61.69 60.65 2jqz s THR 76 Cb -0.03 -1.59 -0.03 0.00 0.01 0.00 0.00 72.50 70.86 2jqz s THR 76 CO -0.00 -0.32 0.57 -0.63 -0.69 0.00 0.00 174.62 173.54 2jqz s ILE 77 N 1.56 5.08 0.30 1.82 1.01 0.05 -1.94 121.20 129.09 2jqz s ILE 77 Ca 0.01 1.07 0.09 0.00 0.00 0.00 0.00 60.65 61.81 2jqz s ILE 77 Cb -0.18 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 2jqz s ILE 77 CO -0.12 0.17 0.08 -0.94 0.00 0.00 0.00 174.94 174.13 2jqz s SER 78 N 1.10 4.66 -0.06 3.58 1.04 -0.22 0.21 113.70 124.00 2jqz s SER 78 Ca 0.27 -0.69 0.01 0.00 0.48 0.00 0.00 55.95 56.01 2jqz s SER 78 Cb -0.16 -0.82 0.02 0.00 0.10 0.00 0.00 66.02 65.17 2jqz s SER 78 CO 0.10 -0.15 -0.06 -0.69 0.98 0.00 0.00 173.24 173.42 2jqz s VAL 79 N -2.37 0.74 0.11 5.02 1.01 0.44 -0.54 120.40 124.82 2jqz s VAL 79 Ca 0.34 -0.21 0.10 0.00 0.00 0.00 0.00 61.98 62.21 2jqz s VAL 79 Cb -0.04 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 2jqz s VAL 79 CO 0.21 0.28 -0.25 0.26 0.00 0.00 0.00 175.10 175.61 2jqz s TRP 80 N 1.09 2.13 -0.62 5.22 0.52 -0.58 -1.79 118.94 124.91 2jqz s TRP 80 Ca -0.08 -0.39 -0.21 0.00 0.02 0.00 0.00 56.10 55.44 2jqz s TRP 80 Cb -0.14 -1.17 0.08 0.00 -1.15 0.00 0.00 33.47 31.09 2jqz s TRP 80 CO -0.01 0.28 0.84 1.21 0.02 0.00 0.00 176.95 179.29 2jqz s ASN 81 N -1.94 6.19 0.27 2.95 3.04 0.73 -1.76 114.94 124.41 2jqz s ASN 81 Ca 0.11 -1.14 -0.09 0.00 0.04 0.00 0.00 52.86 51.78 2jqz s ASN 81 Cb -0.10 -2.36 0.41 0.00 -1.54 0.00 0.00 41.25 37.66 2jqz s ASN 81 CO 0.05 -1.27 1.57 -0.74 -3.04 0.00 0.00 177.10 173.67 2jqz h HIS 82 N 9.37 -0.52 -0.34 0.43 -0.00 -1.61 0.26 115.15 122.75 2jqz h HIS 82 Ca -0.29 0.08 0.07 0.00 -0.00 0.00 0.00 60.37 60.24 2jqz h HIS 82 Cb 1.08 0.37 -0.08 0.00 -0.00 0.00 0.00 27.41 28.78 2jqz h HIS 82 CO 0.90 -0.40 -0.29 0.87 -0.00 0.00 0.00 177.93 179.00 2jqz h LYS 83 N -0.00 -0.24 0.00 5.26 1.79 -1.92 -1.98 116.57 119.47 2jqz h LYS 83 Ca 0.44 0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.88 2jqz h LYS 83 Cb 0.68 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.38 2jqz h LYS 83 CO -0.96 -0.16 -0.25 -0.22 -1.08 0.00 0.00 179.45 176.78 2jqz h LYS 84 N -0.25 0.00 -0.22 3.15 1.63 -1.20 -2.19 116.57 117.49 2jqz h LYS 84 Ca 0.16 0.00 0.05 0.00 -0.85 0.00 0.00 60.65 60.01 2jqz h LYS 84 Cb 0.51 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 2jqz h LYS 84 CO -0.49 0.25 0.15 -0.84 -3.45 0.00 0.00 179.45 175.07 2jqz h ILE 85 N 0.00 0.93 0.00 2.00 3.07 0.17 0.32 117.51 124.00 2jqz h ILE 85 Ca -0.00 -0.02 0.00 0.00 1.55 0.00 0.00 64.86 66.38 2jqz h ILE 85 Cb 1.17 0.85 0.00 0.00 -0.27 0.00 0.00 36.82 38.58 2jqz h ILE 85 CO 0.03 0.01 -1.30 0.00 -1.05 0.00 0.00 178.15 175.85 2jqz n HIS 86 N -4.49 0.44 -0.09 0.16 1.44 -1.09 -4.41 115.22 107.19 2jqz n HIS 86 Ca 0.02 0.13 -0.12 0.00 -2.01 0.00 0.00 57.72 55.74 2jqz n HIS 86 Cb 0.25 -0.64 -0.09 0.00 0.12 0.00 0.00 29.99 29.63 2jqz n HIS 86 CO 0.00 0.00 0.00 -0.22 -2.81 0.00 0.00 176.34 173.31 2jqz h LYS 87 N 0.00 -0.37 0.00 -1.40 1.63 0.30 -3.47 116.57 113.26 2jqz h LYS 87 Ca 0.00 0.03 0.24 0.00 -0.85 0.00 0.00 60.65 60.06 2jqz h LYS 87 Cb 0.90 0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 32.57 2jqz h LYS 87 CO 0.00 -0.25 0.67 1.63 -3.45 0.00 0.00 179.45 178.05 2jqz n LYS 88 N -4.99 0.27 -1.75 1.90 4.76 -1.15 -5.06 118.16 112.13 2jqz n LYS 88 Ca -0.04 -0.82 -0.42 0.00 -2.87 0.00 0.00 58.31 54.17 2jqz n LYS 88 Cb 0.30 1.24 -0.01 0.00 -1.84 0.00 0.00 35.03 34.72 2jqz n LYS 88 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 2jqz n GLN 89 N -0.71 2.65 0.00 1.97 -0.06 -1.26 -1.90 117.38 118.06 2jqz n GLN 89 Ca 0.02 0.94 0.00 0.00 -2.00 0.00 0.00 57.00 55.96 2jqz n GLN 89 Cb 0.48 -2.69 0.00 0.00 -4.06 0.00 0.00 30.24 23.97 2jqz n GLN 89 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2jqz n GLY 90 N 1.50 1.18 3.72 1.69 0.00 -1.26 -4.94 105.19 107.08 2jqz n GLY 90 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2jqz n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jqz s ALA 91 N 0.00 3.60 0.00 4.61 0.00 -0.80 -4.18 121.76 124.99 2jqz s ALA 91 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.12 2jqz s ALA 91 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2jqz s ALA 91 CO 0.00 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.55 2jqz n GLY 92 N 3.11 0.20 3.75 0.00 0.00 -1.17 -3.21 105.19 107.87 2jqz n GLY 92 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 2jqz n GLY 92 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jqz s PHE 93 N -0.87 3.20 0.05 1.61 5.36 -1.26 -0.19 117.98 125.87 2jqz s PHE 93 Ca 0.00 0.14 0.00 0.00 -0.96 0.00 0.00 56.93 56.11 2jqz s PHE 93 Cb 0.00 -1.69 0.00 0.00 -0.34 0.00 0.00 43.02 40.99 2jqz s PHE 93 CO 0.00 0.52 0.00 1.28 -1.46 0.00 0.00 175.22 175.56 2jqz n LEU 94 N 1.07 0.24 -3.65 6.12 4.77 -0.74 -4.51 117.00 120.30 2jqz n LEU 94 Ca -0.12 0.08 -0.03 0.00 -0.03 0.00 0.00 56.01 55.91 2jqz n LEU 94 Cb 0.52 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.52 2jqz n LEU 94 CO 0.38 -0.59 0.21 -0.83 -1.33 0.00 0.00 177.39 175.23 2jqz s GLY 95 N -3.61 -0.64 -0.24 -0.72 0.00 -0.91 -4.49 107.32 96.71 2jqz s GLY 95 Ca 0.00 2.15 -0.09 0.00 0.00 0.00 0.00 44.72 46.78 2jqz s GLY 95 CO 0.00 2.89 0.12 0.00 0.00 0.00 0.00 173.10 176.11 2jqz s VAL 97 N 1.28 4.67 -0.10 0.00 0.11 0.13 -4.57 120.40 121.93 2jqz s VAL 97 Ca 0.06 -0.07 0.02 0.00 -2.93 0.00 0.00 61.98 59.07 2jqz s VAL 97 Cb -0.14 -3.13 0.01 0.00 -1.53 0.00 0.00 36.38 31.58 2jqz s VAL 97 CO 0.05 0.41 -0.17 -0.60 -3.33 0.00 0.00 175.10 171.46 2jqz s ARG 98 N 0.82 2.33 -0.04 1.54 3.52 -1.26 -0.77 118.95 125.09 2jqz s ARG 98 Ca 0.04 -0.62 0.06 0.00 -0.13 0.00 0.00 55.73 55.08 2jqz s ARG 98 Cb -0.14 -1.89 -0.01 0.00 -1.56 0.00 0.00 34.95 31.36 2jqz s ARG 98 CO 0.02 0.03 -0.22 -0.51 -0.81 0.00 0.00 175.30 173.81 2jqz s LEU 99 N 0.72 2.02 0.00 -0.88 2.01 -0.60 -5.02 118.68 116.92 2jqz s LEU 99 Ca -0.12 -0.44 -0.00 0.00 0.01 0.00 0.00 54.13 53.58 2jqz s LEU 99 Cb -0.16 -1.20 0.10 0.00 0.01 0.00 0.00 46.19 44.94 2jqz s LEU 99 CO 0.03 0.23 0.66 0.18 1.01 0.00 0.00 176.35 178.46 2jqz n LEU 100 N 2.87 0.00 -0.09 1.79 4.77 -1.26 -1.76 117.00 123.31 2jqz n LEU 100 Ca -0.17 -1.39 -0.09 0.00 -0.03 0.00 0.00 56.01 54.32 2jqz n LEU 100 Cb 0.52 -0.43 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2jqz n LEU 100 CO 0.25 -0.82 0.97 0.77 -1.33 0.00 0.00 177.39 177.22 2jqz h SER 101 N -0.40 0.38 -0.56 -1.43 4.64 -1.93 0.36 113.55 114.61 2jqz h SER 101 Ca -0.22 -0.06 -0.07 0.00 -0.47 0.00 0.00 61.79 60.97 2jqz h SER 101 Cb 0.81 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.78 2jqz h SER 101 CO 0.23 0.33 0.08 -0.55 -0.87 0.00 0.00 176.83 176.06 2jqz h ASN 102 N 0.40 0.91 -0.46 4.97 -1.07 -1.95 -2.48 115.58 115.90 2jqz h ASN 102 Ca 0.11 -0.27 -0.10 0.00 0.07 0.00 0.00 56.30 56.12 2jqz h ASN 102 Cb 0.03 -0.24 -0.02 0.00 -2.07 0.00 0.00 38.32 36.02 2jqz h ASN 102 CO -0.02 0.94 -0.06 0.00 0.07 0.00 0.00 177.43 178.36 2jqz h ALA 103 N 1.00 0.93 -0.75 4.14 0.00 -1.87 -2.80 119.26 119.90 2jqz h ALA 103 Ca 0.17 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2jqz h ALA 103 Cb 0.43 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2jqz h ALA 103 CO 0.01 0.63 0.48 0.82 0.00 0.00 0.00 179.25 181.19 2jqz h ILE 104 N 0.82 1.20 0.31 0.00 5.03 0.03 0.19 117.51 125.08 2jqz h ILE 104 Ca 0.14 -0.39 -0.02 0.00 -0.12 0.00 0.00 64.86 64.48 2jqz h ILE 104 Cb 0.58 0.11 0.00 0.00 -3.03 0.00 0.00 36.82 34.48 2jqz h ILE 104 CO 0.04 0.20 -0.15 0.78 -0.68 0.00 0.00 178.15 178.33 2jqz h ASN 105 N 1.02 -0.35 -0.49 1.72 2.35 -1.22 0.27 115.58 118.88 2jqz h ASN 105 Ca 0.27 -0.19 0.01 0.00 -0.55 0.00 0.00 56.30 55.84 2jqz h ASN 105 Cb -0.09 0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 2jqz h ASN 105 CO -0.06 0.09 0.31 0.03 -1.65 0.00 0.00 177.43 176.16 2jqz h ARG 106 N -0.89 0.62 -0.35 0.81 3.08 -1.39 -2.71 114.38 113.56 2jqz h ARG 106 Ca -0.04 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 2jqz h ARG 106 Cb 0.52 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 2jqz h ARG 106 CO 0.07 0.41 -0.14 -0.07 -1.07 0.00 0.00 179.97 179.17 2jqz h LEU 107 N 0.64 0.72 -1.99 3.04 3.38 -0.69 -2.48 115.31 117.93 2jqz h LEU 107 Ca 0.18 -0.39 0.24 0.00 0.09 0.00 0.00 57.88 58.00 2jqz h LEU 107 Cb -0.05 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 2jqz h LEU 107 CO -0.05 0.95 0.60 0.07 0.09 0.00 0.00 178.44 180.10 2jqz h LYS 108 N 0.49 0.00 0.00 1.13 2.10 -0.13 0.28 116.57 120.44 2jqz h LYS 108 Ca 0.08 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.54 2jqz h LYS 108 Cb 0.66 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.96 2jqz h LYS 108 CO 0.04 0.00 -1.57 -0.25 -2.00 0.00 0.00 179.45 175.68 2jqz n ASP 109 N -4.24 0.74 0.19 7.07 9.92 -1.13 -2.89 116.55 126.21 2jqz n ASP 109 Ca 0.17 0.33 -0.11 0.00 -0.53 0.00 0.00 54.79 54.64 2jqz n ASP 109 Cb 0.90 0.30 -0.06 0.00 -0.64 0.00 0.00 41.12 41.63 2jqz n ASP 109 CO 0.00 0.00 0.00 0.71 0.13 0.00 0.00 177.20 178.04 2jqz h THR 110 N 0.00 0.00 0.00 -3.53 1.35 0.03 -3.48 112.91 107.29 2jqz h THR 110 Ca -0.21 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 2jqz h THR 110 Cb 1.67 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.09 2jqz h THR 110 CO 0.05 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 2jqz n GLY 111 N -1.35 0.91 3.15 5.82 0.00 -0.71 -4.95 105.19 108.06 2jqz n GLY 111 Ca -0.07 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.00 2jqz n GLY 111 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jqz s TYR 112 N -2.00 -0.21 -0.09 1.61 2.02 -1.26 -4.16 117.35 113.26 2jqz s TYR 112 Ca 0.00 0.16 0.01 0.00 -0.37 0.00 0.00 57.07 56.87 2jqz s TYR 112 Cb 0.00 0.05 0.02 0.00 -0.40 0.00 0.00 41.96 41.63 2jqz s TYR 112 CO 0.00 -0.12 -0.11 -0.65 -1.57 0.00 0.00 175.55 173.10 2jqz s GLN 113 N 2.98 1.74 -0.52 -0.62 -1.52 0.41 -4.92 119.66 117.22 2jqz s GLN 113 Ca 0.13 -0.38 -0.12 0.00 -1.95 0.00 0.00 55.36 53.03 2jqz s GLN 113 Cb -0.04 -1.58 0.13 0.00 -0.22 0.00 0.00 33.01 31.30 2jqz s GLN 113 CO -0.15 -0.11 0.43 -0.98 -0.25 0.00 0.00 175.29 174.23 2jqz s ARG 114 N 1.14 2.74 -0.13 2.91 1.70 -1.26 -1.21 118.95 124.84 2jqz s ARG 114 Ca -0.05 -1.79 -0.09 0.00 -0.47 0.00 0.00 55.73 53.33 2jqz s ARG 114 Cb -0.14 -4.10 -0.04 0.00 -0.57 0.00 0.00 34.95 30.09 2jqz s ARG 114 CO -0.02 -1.26 0.17 -0.51 -1.08 0.00 0.00 175.30 172.60 2jqz s LEU 115 N 1.38 4.35 0.17 -1.89 1.02 -0.20 -4.86 118.68 118.64 2jqz s LEU 115 Ca 0.05 0.46 -0.30 0.00 0.02 0.00 0.00 54.13 54.36 2jqz s LEU 115 Cb -0.27 -2.14 -0.08 0.00 0.02 0.00 0.00 46.19 43.72 2jqz s LEU 115 CO 0.00 0.33 1.26 -0.62 0.02 0.00 0.00 176.35 177.35 2jqz s ASP 116 N -0.64 6.99 -0.72 2.29 -1.08 -1.26 -0.39 116.67 121.85 2jqz s ASP 116 Ca 0.14 2.28 -0.27 0.00 -0.52 0.00 0.00 52.55 54.19 2jqz s ASP 116 Cb -0.12 -2.60 0.03 0.00 -1.46 0.00 0.00 42.92 38.76 2jqz s ASP 116 CO 0.03 -0.47 1.29 -0.76 0.52 0.00 0.00 175.17 175.78 2jqz s LEU 117 N 0.07 3.19 0.39 -1.34 1.43 0.17 -4.84 118.68 117.75 2jqz s LEU 117 Ca 0.56 -0.38 0.04 0.00 -1.03 0.00 0.00 54.13 53.31 2jqz s LEU 117 Cb -0.34 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 2jqz s LEU 117 CO 0.36 -1.82 0.08 0.00 0.23 0.00 0.00 176.35 175.20 2jqz n LYS 119 N -0.87 0.31 0.12 0.00 -0.00 -1.26 -3.66 118.16 112.79 2jqz n LYS 119 Ca -0.06 0.15 0.17 0.00 -0.00 0.00 0.00 58.31 58.57 2jqz n LYS 119 Cb 0.66 -1.97 0.73 0.00 -0.00 0.00 0.00 35.03 34.45 2jqz n LYS 119 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2jqz h LEU 120 N -0.45 0.00 0.00 -5.58 -0.00 -1.97 -3.47 115.31 103.84 2jqz h LEU 120 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.42 2jqz h LEU 120 Cb 1.34 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.00 2jqz h LEU 120 CO 0.43 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.48 2jqz n GLY 121 N -1.54 -1.23 0.07 0.83 0.00 -1.26 -4.97 105.19 97.10 2jqz n GLY 121 Ca 0.05 -0.99 0.09 0.00 0.00 0.00 0.00 46.02 45.17 2jqz n GLY 121 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jqz n PRO 122 N 0.00 0.10 -1.21 1.61 -0.04 -1.26 -2.68 135.00 131.53 2jqz n PRO 122 Ca 0.00 0.36 -0.26 0.00 -0.04 0.00 0.00 63.50 63.56 2jqz n PRO 122 Cb 0.00 -1.71 0.14 0.00 -0.04 0.00 0.00 33.50 31.89 2jqz n PRO 122 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2jqz n ASN 123 N -1.90 4.98 -4.43 3.54 5.03 -1.26 -4.94 115.26 116.28 2jqz n ASN 123 Ca 0.02 -3.60 -0.22 0.00 0.87 0.00 0.00 54.58 51.66 2jqz n ASN 123 Cb 0.19 -0.88 -0.10 0.00 -1.02 0.00 0.00 39.78 37.97 2jqz n ASN 123 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2jqz s ASP 124 N -1.34 2.98 0.00 6.41 2.15 -1.09 -5.02 116.67 120.75 2jqz s ASP 124 Ca 0.57 -1.12 0.15 0.00 0.43 0.00 0.00 52.55 52.57 2jqz s ASP 124 Cb 0.47 -0.21 0.63 0.00 -0.30 0.00 0.00 42.92 43.52 2jqz s ASP 124 CO 0.07 -0.22 1.47 -0.46 -0.17 0.00 0.00 175.17 175.86 2jqz n ASN 125 N -0.57 0.00 -2.97 -0.34 2.04 -1.26 -4.94 115.26 107.23 2jqz n ASN 125 Ca -0.06 0.50 -0.12 0.00 -0.44 0.00 0.00 54.58 54.46 2jqz n ASN 125 Cb 0.62 -0.50 0.01 0.00 -2.53 0.00 0.00 39.78 37.39 2jqz n ASN 125 CO 0.00 0.00 0.00 -0.67 -0.44 0.00 0.00 177.26 176.15 2jqz n ASP 126 N -1.50 -7.45 -2.71 0.53 2.03 -1.26 -4.98 116.55 101.21 2jqz n ASP 126 Ca 0.04 0.57 -0.16 0.00 0.52 0.00 0.00 54.79 55.75 2jqz n ASP 126 Cb 0.17 -4.49 0.01 0.00 -0.72 0.00 0.00 41.12 36.09 2jqz n ASP 126 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2jqz n THR 127 N -0.01 1.32 -4.50 5.18 -2.24 -1.26 -5.07 114.28 107.70 2jqz n THR 127 Ca 0.05 -3.94 -0.26 0.00 -2.27 0.00 0.00 64.05 57.63 2jqz n THR 127 Cb 0.42 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.50 2jqz n THR 127 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2jqz n VAL 128 N -0.13 0.00 0.00 2.28 0.24 -1.26 -4.89 118.33 114.57 2jqz n VAL 128 Ca 0.21 -1.94 0.00 0.00 -2.04 0.00 0.00 64.34 60.57 2jqz n VAL 128 Cb 0.72 0.32 0.00 0.00 -1.47 0.00 0.00 33.84 33.41 2jqz n VAL 128 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2jqz n ARG 129 N -1.11 0.00 -1.94 7.34 0.63 -1.22 -4.95 116.66 115.41 2jqz n ARG 129 Ca -0.15 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.69 2jqz n ARG 129 Cb 0.52 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.46 2jqz n ARG 129 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jqz n GLY 130 N 0.00 2.08 3.39 5.14 0.00 -0.94 -4.78 105.19 110.08 2jqz n GLY 130 Ca 0.00 -2.18 -0.15 0.00 0.00 0.00 0.00 46.02 43.69 2jqz n GLY 130 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jqz s GLN 131 N -3.10 1.72 -0.28 1.61 1.11 0.37 0.44 119.66 121.53 2jqz s GLN 131 Ca 0.24 -1.78 -0.17 0.00 0.01 0.00 0.00 55.36 53.66 2jqz s GLN 131 Cb -0.02 0.38 0.08 0.00 -1.01 0.00 0.00 33.01 32.44 2jqz s GLN 131 CO 0.15 -0.67 0.70 -1.50 0.01 0.00 0.00 175.29 173.98 2jqz s ILE 132 N -3.43 0.00 -0.26 1.08 2.07 0.48 -0.69 121.20 120.45 2jqz s ILE 132 Ca 0.35 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.49 2jqz s ILE 132 Cb 0.02 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.57 2jqz s ILE 132 CO 0.21 0.00 0.14 -0.69 -1.91 0.00 0.00 174.94 172.68 2jqz s VAL 133 N 1.56 4.90 0.37 4.00 1.01 0.41 -1.03 120.40 131.61 2jqz s VAL 133 Ca -0.09 0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2jqz s VAL 133 Cb -0.05 -3.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 2jqz s VAL 133 CO -0.19 0.29 0.08 1.33 0.00 0.00 0.00 175.10 176.62 2jqz n VAL 134 N 4.94 0.00 -3.72 2.92 0.24 -0.35 -2.11 118.33 120.25 2jqz n VAL 134 Ca -0.15 -1.98 -0.15 0.00 -2.04 0.00 0.00 64.34 60.02 2jqz n VAL 134 Cb 0.52 0.61 -0.15 0.00 -1.47 0.00 0.00 33.84 33.34 2jqz n VAL 134 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2jqz s SER 135 N -3.16 0.20 -0.34 -1.34 1.04 -0.27 -0.44 113.70 109.38 2jqz s SER 135 Ca 0.11 0.27 -0.09 0.00 0.48 0.00 0.00 55.95 56.72 2jqz s SER 135 Cb 0.01 0.16 0.02 0.00 0.10 0.00 0.00 66.02 66.31 2jqz s SER 135 CO 0.08 -0.18 0.15 -0.76 0.98 0.00 0.00 173.24 173.52 2jqz s LEU 136 N 1.51 4.37 -0.08 2.42 2.01 -1.26 -0.94 118.68 126.72 2jqz s LEU 136 Ca -0.05 -0.89 -0.03 0.00 0.01 0.00 0.00 54.13 53.16 2jqz s LEU 136 Cb -0.12 -1.96 0.04 0.00 0.01 0.00 0.00 46.19 44.16 2jqz s LEU 136 CO -0.05 -0.30 0.17 -1.58 1.01 0.00 0.00 176.35 175.60 2jqz s GLN 137 N 1.52 0.12 0.68 1.70 0.74 -1.07 -1.74 119.66 121.60 2jqz s GLN 137 Ca 0.02 0.44 -0.16 0.00 0.05 0.00 0.00 55.36 55.70 2jqz s GLN 137 Cb -0.18 -0.17 0.01 0.00 1.10 0.00 0.00 33.01 33.76 2jqz s GLN 137 CO 0.05 -0.18 1.19 -1.54 -0.55 0.00 0.00 175.29 174.25 2jqz s SER 138 N 1.33 4.67 0.06 6.67 1.04 -1.19 -2.28 113.70 124.00 2jqz s SER 138 Ca -0.08 2.29 0.07 0.00 0.48 0.00 0.00 55.95 58.70 2jqz s SER 138 Cb -0.11 -2.58 -0.03 0.00 0.10 0.00 0.00 66.02 63.39 2jqz s SER 138 CO -0.07 -1.94 -0.15 -0.13 0.98 0.00 0.00 173.24 171.94 2jqz s ARG 139 N -3.79 2.11 0.00 4.02 1.81 -0.85 -4.82 118.95 117.42 2jqz s ARG 139 Ca 0.74 -0.98 0.25 0.00 -1.72 0.00 0.00 55.73 54.01 2jqz s ARG 139 Cb -0.28 -2.25 0.34 0.00 -0.45 0.00 0.00 34.95 32.32 2jqz s ARG 139 CO 0.41 0.53 1.35 -3.47 -0.68 0.00 0.00 175.30 173.44