#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jqz s PRO 11 N 0.00 0.65 -0.12 1.61 0.02 -1.26 -4.92 135.00 130.97 2jqz s PRO 11 Ca 0.00 1.01 0.03 0.00 0.02 0.00 0.00 61.00 62.05 2jqz s PRO 11 Cb 0.00 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.80 2jqz s PRO 11 CO 0.00 -2.71 -0.21 0.14 -0.33 0.00 0.00 177.00 173.88 2jqz s VAL 12 N -2.74 2.24 -0.18 3.83 -7.23 0.19 -4.85 120.40 111.66 2jqz s VAL 12 Ca 0.65 -0.94 -0.25 0.00 -1.81 0.00 0.00 61.98 59.63 2jqz s VAL 12 Cb -0.21 -1.89 -0.01 0.00 0.56 0.00 0.00 36.38 34.83 2jqz s VAL 12 CO 0.59 0.55 0.83 -0.75 -0.31 0.00 0.00 175.10 176.01 2jqz s LYS 13 N 0.54 4.29 -0.10 4.82 2.20 -1.26 -0.33 119.74 129.90 2jqz s LYS 13 Ca -0.13 1.01 0.03 0.00 -0.36 0.00 0.00 55.97 56.52 2jqz s LYS 13 Cb -0.17 -3.58 -0.01 0.00 -1.51 0.00 0.00 37.83 32.57 2jqz s LYS 13 CO 0.04 -0.34 -0.21 -1.17 -0.36 0.00 0.00 175.35 173.31 2jqz s LEU 14 N 2.21 2.30 -0.42 5.43 1.98 -0.19 -2.45 118.68 127.54 2jqz s LEU 14 Ca 0.38 -0.47 -0.16 0.00 -2.89 0.00 0.00 54.13 50.98 2jqz s LEU 14 Cb -0.16 -1.47 0.03 0.00 0.66 0.00 0.00 46.19 45.24 2jqz s LEU 14 CO 0.12 0.18 0.38 -0.13 -1.89 0.00 0.00 176.35 175.01 2jqz s ARG 15 N 0.26 3.03 -0.49 1.98 0.52 -0.95 -1.91 118.95 121.39 2jqz s ARG 15 Ca -0.14 -0.92 -0.18 0.00 -0.52 0.00 0.00 55.73 53.97 2jqz s ARG 15 Cb -0.17 -3.99 0.06 0.00 0.52 0.00 0.00 34.95 31.37 2jqz s ARG 15 CO 0.07 -0.84 0.55 -1.17 0.02 0.00 0.00 175.30 173.94 2jqz s LEU 16 N 1.93 5.11 -0.45 2.53 2.96 -0.44 -2.62 118.68 127.70 2jqz s LEU 16 Ca 0.09 -0.98 -0.22 0.00 -0.22 0.00 0.00 54.13 52.79 2jqz s LEU 16 Cb -0.18 -2.38 0.03 0.00 0.50 0.00 0.00 46.19 44.15 2jqz s LEU 16 CO 0.12 -0.80 0.74 -0.89 -1.32 0.00 0.00 176.35 174.19 2jqz s THR 17 N 2.35 4.70 -0.96 3.68 2.01 -0.19 -1.64 115.64 125.59 2jqz s THR 17 Ca 0.12 0.30 -0.23 0.00 0.31 0.00 0.00 61.69 62.20 2jqz s THR 17 Cb -0.20 -4.29 0.06 0.00 0.01 0.00 0.00 72.50 68.07 2jqz s THR 17 CO 0.11 -0.70 1.38 -0.69 -0.69 0.00 0.00 174.62 174.03 2jqz s VAL 18 N 3.15 4.00 0.03 3.82 1.01 0.30 -0.63 120.40 132.08 2jqz s VAL 18 Ca 0.27 -0.69 -0.28 0.00 0.00 0.00 0.00 61.98 61.29 2jqz s VAL 18 Cb -0.13 -5.00 -0.15 0.00 0.00 0.00 0.00 36.38 31.10 2jqz s VAL 18 CO 0.21 -1.87 1.25 0.25 0.00 0.00 0.00 175.10 174.95 2jqz h LEU 19 N 12.52 -0.85 -7.85 3.92 6.46 -1.22 -2.13 115.31 126.16 2jqz h LEU 19 Ca 0.12 0.03 0.12 0.00 -0.12 0.00 0.00 57.88 58.03 2jqz h LEU 19 Cb 1.02 0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 41.12 2jqz h LEU 19 CO 1.37 -0.54 0.42 0.00 -0.62 0.00 0.00 178.44 179.07 2jqz s ALA 21 N -3.04 1.44 0.27 0.00 0.00 -0.59 -0.09 121.76 119.75 2jqz s ALA 21 Ca 0.14 -0.91 0.11 0.00 0.00 0.00 0.00 51.96 51.30 2jqz s ALA 21 Cb -0.03 -0.27 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 2jqz s ALA 21 CO 0.05 0.31 -0.09 0.15 0.00 0.00 0.00 175.76 176.18 2jqz s LYS 22 N -1.08 2.01 -0.84 0.00 -0.14 -0.08 -3.00 119.74 116.61 2jqz s LYS 22 Ca 0.05 -1.57 -0.02 0.00 -1.36 0.00 0.00 55.97 53.06 2jqz s LYS 22 Cb -0.08 -1.99 0.00 0.00 -1.68 0.00 0.00 37.83 34.08 2jqz s LYS 22 CO 0.01 0.35 0.63 -1.71 -0.76 0.00 0.00 175.35 173.87 2jqz n ASN 23 N -0.75 -5.36 -4.62 2.83 4.05 -1.19 -0.59 115.26 109.63 2jqz n ASN 23 Ca -0.06 -0.82 -0.43 0.00 0.45 0.00 0.00 54.58 53.72 2jqz n ASN 23 Cb 0.59 -2.37 -0.02 0.00 1.23 0.00 0.00 39.78 39.22 2jqz n ASN 23 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 2jqz s LEU 24 N -4.94 3.78 -0.23 1.20 1.98 -0.30 -2.45 118.68 117.72 2jqz s LEU 24 Ca 0.03 1.02 -0.32 0.00 -2.89 0.00 0.00 54.13 51.97 2jqz s LEU 24 Cb -0.02 -3.54 -0.09 0.00 0.66 0.00 0.00 46.19 43.20 2jqz s LEU 24 CO 0.87 -1.18 2.13 0.55 -1.89 0.00 0.00 176.35 176.83 2jqz n VAL 25 N 6.49 0.35 0.08 1.68 3.14 -1.26 -4.73 118.33 124.08 2jqz n VAL 25 Ca 0.15 -0.30 0.01 0.00 -2.96 0.00 0.00 64.34 61.24 2jqz n VAL 25 Cb 0.47 -2.05 0.05 0.00 -1.06 0.00 0.00 33.84 31.25 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 8.03 0.02 0.00 1.45 2.85 -1.26 -4.61 118.16 124.63 2jqz n LYS 26 Ca 0.32 0.36 0.00 0.00 -1.05 0.00 0.00 58.31 57.94 2jqz n LYS 26 Cb 0.33 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.21 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 -1.38 0.00 -3.33 -1.58 4.76 -1.26 -4.25 118.16 111.12 2jqz n LYS 27 Ca 0.01 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.07 2jqz n LYS 27 Cb 0.02 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.15 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 -4.00 6.63 0.63 4.39 1.11 -1.26 -5.05 116.67 119.12 2jqz s ASP 28 Ca 0.00 0.75 -0.18 0.00 0.18 0.00 0.00 52.55 53.30 2jqz s ASP 28 Cb 0.00 -2.27 -0.03 0.00 1.07 0.00 0.00 42.92 41.68 2jqz s ASP 28 CO 0.00 -0.02 1.03 2.22 1.18 0.00 0.00 175.17 179.58 2jqz n PHE 29 N 3.87 1.03 -0.24 4.23 1.16 -1.26 -1.00 117.46 125.24 2jqz n PHE 29 Ca -0.07 0.43 0.00 0.00 -1.87 0.00 0.00 57.45 55.93 2jqz n PHE 29 Cb 0.51 -2.16 0.00 0.00 -1.61 0.00 0.00 39.48 36.23 2jqz n PHE 29 CO 0.00 0.00 0.00 1.19 -1.87 0.00 0.00 176.76 176.08 2jqz n PHE 30 N -1.87 0.00 -3.93 2.97 3.72 -1.26 -4.90 117.46 112.19 2jqz n PHE 30 Ca 0.14 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.31 2jqz n PHE 30 Cb 0.48 -0.97 -0.05 0.00 -0.94 0.00 0.00 39.48 37.99 2jqz n PHE 30 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2jqz s ARG 31 N -0.33 2.33 0.02 -1.08 0.52 -0.17 -5.15 118.95 115.08 2jqz s ARG 31 Ca 0.00 -1.78 0.01 0.00 -0.52 0.00 0.00 55.73 53.44 2jqz s ARG 31 Cb 0.00 -2.11 -0.01 0.00 0.52 0.00 0.00 34.95 33.34 2jqz s ARG 31 CO 0.00 -0.21 -0.05 -0.51 0.02 0.00 0.00 175.30 174.55 2jqz s LEU 32 N -4.03 2.15 0.42 2.53 2.01 -1.26 -4.70 118.68 115.80 2jqz s LEU 32 Ca 0.42 -0.34 -0.02 0.00 0.01 0.00 0.00 54.13 54.20 2jqz s LEU 32 Cb 0.01 -0.12 -0.03 0.00 0.01 0.00 0.00 46.19 46.07 2jqz s LEU 32 CO 0.24 -0.12 0.66 -2.16 1.01 0.00 0.00 176.35 175.98 2jqz s PRO 33 N -0.93 3.40 -0.69 1.29 0.05 -1.26 -4.70 135.00 132.15 2jqz s PRO 33 Ca -0.07 -0.18 0.05 0.00 0.05 0.00 0.00 61.00 60.85 2jqz s PRO 33 Cb -0.06 -2.54 0.17 0.00 0.05 0.00 0.00 34.50 32.12 2jqz s PRO 33 CO -0.00 -0.08 0.50 -0.25 0.05 0.00 0.00 177.00 177.22 2jqz n ASP 34 N -2.02 2.86 -4.77 6.66 9.92 -1.26 -1.97 116.55 125.96 2jqz n ASP 34 Ca -0.02 -3.18 -0.40 0.00 -0.53 0.00 0.00 54.79 50.67 2jqz n ASP 34 Cb 0.56 -0.74 0.00 0.00 -0.64 0.00 0.00 41.12 40.30 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 -1.43 3.98 0.09 -0.24 0.04 -1.19 -0.74 135.00 135.50 2jqz s PRO 35 Ca 0.26 2.38 -0.15 0.00 0.04 0.00 0.00 61.00 63.53 2jqz s PRO 35 Cb -0.03 -2.84 0.03 0.00 0.04 0.00 0.00 34.50 31.70 2jqz s PRO 35 CO -0.17 -0.57 0.35 -0.59 0.04 0.00 0.00 177.00 176.07 2jqz s PHE 36 N -1.18 -0.14 0.10 0.56 -0.12 -0.77 -0.22 117.98 116.20 2jqz s PHE 36 Ca 0.56 -0.11 0.07 0.00 -0.05 0.00 0.00 56.93 57.39 2jqz s PHE 36 Cb -0.43 0.18 -0.04 0.00 -0.63 0.00 0.00 43.02 42.10 2jqz s PHE 36 CO 0.56 -0.62 -0.08 0.00 -0.05 0.00 0.00 175.22 175.03 2jqz s ALA 37 N -3.37 3.00 -0.18 1.99 0.00 -1.13 -1.26 121.76 120.82 2jqz s ALA 37 Ca 0.01 -1.21 -0.04 0.00 0.00 0.00 0.00 51.96 50.71 2jqz s ALA 37 Cb 0.01 -0.95 0.09 0.00 0.00 0.00 0.00 23.12 22.27 2jqz s ALA 37 CO -0.09 0.65 0.24 0.21 0.00 0.00 0.00 175.76 176.77 2jqz s LYS 38 N -2.17 0.18 0.12 0.00 2.20 0.69 -0.62 119.74 120.15 2jqz s LYS 38 Ca 0.22 0.41 -0.02 0.00 -0.36 0.00 0.00 55.97 56.22 2jqz s LYS 38 Cb -0.11 -0.75 -0.05 0.00 -1.51 0.00 0.00 37.83 35.41 2jqz s LYS 38 CO 0.14 -0.53 0.32 0.54 -0.36 0.00 0.00 175.35 175.46 2jqz s VAL 39 N 2.37 5.25 0.01 4.02 0.11 0.23 -1.14 120.40 131.25 2jqz s VAL 39 Ca 0.06 -0.19 0.03 0.00 -2.93 0.00 0.00 61.98 58.95 2jqz s VAL 39 Cb -0.14 -3.64 -0.01 0.00 -1.53 0.00 0.00 36.38 31.05 2jqz s VAL 39 CO -0.11 0.04 -0.09 0.68 -3.33 0.00 0.00 175.10 172.30 2jqz s VAL 40 N -1.64 0.67 -0.32 2.04 -7.23 -0.66 -2.48 120.40 110.78 2jqz s VAL 40 Ca 0.38 -0.55 -0.02 0.00 -1.81 0.00 0.00 61.98 59.98 2jqz s VAL 40 Cb -0.12 -0.60 0.06 0.00 0.56 0.00 0.00 36.38 36.28 2jqz s VAL 40 CO 0.26 0.06 0.04 -0.69 -0.31 0.00 0.00 175.10 174.46 2jqz s VAL 41 N -0.48 3.07 -1.14 1.32 1.01 -0.93 -2.63 120.40 120.62 2jqz s VAL 41 Ca 0.01 -1.50 -0.22 0.00 0.00 0.00 0.00 61.98 60.26 2jqz s VAL 41 Cb -0.05 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.49 2jqz s VAL 41 CO 0.00 -0.22 1.80 -0.62 0.00 0.00 0.00 175.10 176.06 2jqz s ASP 42 N 1.35 5.81 0.00 3.32 2.15 -1.25 -1.58 116.67 126.46 2jqz s ASP 42 Ca -0.02 -1.68 0.00 0.00 0.43 0.00 0.00 52.55 51.27 2jqz s ASP 42 Cb -0.20 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 39.84 2jqz s ASP 42 CO -0.02 -2.21 0.00 0.61 -0.17 0.00 0.00 175.17 173.38 2jqz n GLY 43 N 6.05 -0.05 0.00 2.66 0.00 -1.26 -4.68 105.19 107.90 2jqz n GLY 43 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 2jqz n GLY 43 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jqz n SER 44 N 0.00 0.45 -0.82 1.61 2.88 -1.00 -5.01 113.62 111.73 2jqz n SER 44 Ca 0.00 -0.03 -0.11 0.00 -1.33 0.00 0.00 58.87 57.40 2jqz n SER 44 Cb 0.00 0.15 -0.05 0.00 -0.75 0.00 0.00 64.21 63.56 2jqz n SER 44 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jqz n GLY 45 N 0.28 1.12 3.64 0.46 0.00 -0.62 -4.95 105.19 105.13 2jqz n GLY 45 Ca 0.00 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 2jqz n GLY 45 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jqz s GLN 46 N -2.74 4.12 0.07 1.61 0.74 -1.26 -4.84 119.66 117.36 2jqz s GLN 46 Ca 0.00 1.02 0.09 0.00 0.05 0.00 0.00 55.36 56.52 2jqz s GLN 46 Cb 0.00 -3.69 -0.03 0.00 1.10 0.00 0.00 33.01 30.39 2jqz s GLN 46 CO 0.00 -0.69 -0.25 0.00 -0.55 0.00 0.00 175.29 173.80 2jqz s HIS 48 N -0.90 0.97 -0.07 0.00 3.76 -1.03 -4.96 115.29 113.06 2jqz s HIS 48 Ca 0.11 -1.28 -0.24 0.00 -0.15 0.00 0.00 55.06 53.50 2jqz s HIS 48 Cb -0.10 -0.49 0.05 0.00 1.11 0.00 0.00 32.58 33.15 2jqz s HIS 48 CO 0.03 -0.59 0.55 -1.54 -0.85 0.00 0.00 174.74 172.34 2jqz s SER 49 N -3.10 -0.51 0.05 1.40 1.04 -1.26 -0.60 113.70 110.73 2jqz s SER 49 Ca 0.31 0.62 0.02 0.00 0.48 0.00 0.00 55.95 57.38 2jqz s SER 49 Cb 0.07 0.60 -0.04 0.00 0.10 0.00 0.00 66.02 66.75 2jqz s SER 49 CO 0.06 -0.48 0.07 0.42 0.98 0.00 0.00 173.24 174.29 2jqz s THR 50 N -0.93 4.52 0.99 2.02 -4.23 0.21 -4.93 115.64 113.29 2jqz s THR 50 Ca -0.10 -0.67 -0.15 0.00 -1.18 0.00 0.00 61.69 59.59 2jqz s THR 50 Cb -0.02 -3.13 -0.01 0.00 1.34 0.00 0.00 72.50 70.67 2jqz s THR 50 CO 0.06 0.21 -0.05 -0.90 -0.54 0.00 0.00 174.62 173.40 2jqz n ASP 51 N 0.73 -3.10 -4.86 3.99 5.75 -1.26 -2.82 116.55 114.98 2jqz n ASP 51 Ca -0.10 0.20 -0.34 0.00 -0.01 0.00 0.00 54.79 54.54 2jqz n ASP 51 Cb 0.52 -1.02 -0.06 0.00 -1.03 0.00 0.00 41.12 39.53 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 -2.26 4.95 -0.36 2.12 2.01 -1.26 -4.39 115.64 116.46 2jqz s THR 52 Ca 0.52 0.61 -0.07 0.00 0.31 0.00 0.00 61.69 63.05 2jqz s THR 52 Cb -0.17 -3.68 0.04 0.00 0.01 0.00 0.00 72.50 68.70 2jqz s THR 52 CO 0.71 0.18 0.14 -0.69 -0.69 0.00 0.00 174.62 174.27 2jqz s VAL 53 N -1.53 3.97 0.32 3.82 1.01 0.70 -4.98 120.40 123.70 2jqz s VAL 53 Ca 0.39 -1.14 -0.29 0.00 0.00 0.00 0.00 61.98 60.94 2jqz s VAL 53 Cb -0.14 -3.27 -0.11 0.00 0.00 0.00 0.00 36.38 32.86 2jqz s VAL 53 CO 0.20 -0.24 1.54 -0.54 0.00 0.00 0.00 175.10 176.05 2jqz s LYS 54 N 1.43 4.14 0.00 2.72 1.02 -1.26 -3.19 119.74 124.59 2jqz s LYS 54 Ca -0.00 2.54 0.00 0.00 0.02 0.00 0.00 55.97 58.53 2jqz s LYS 54 Cb -0.20 -3.02 0.00 0.00 -0.52 0.00 0.00 37.83 34.10 2jqz s LYS 54 CO 0.03 -0.57 0.00 0.27 -0.92 0.00 0.00 175.35 174.17 2jqz n ASN 55 N 1.61 0.00 -4.03 2.83 2.04 -1.15 -4.93 115.26 111.63 2jqz n ASN 55 Ca 0.05 0.00 -0.09 0.00 -0.44 0.00 0.00 54.58 54.11 2jqz n ASN 55 Cb 0.38 0.00 -0.09 0.00 -2.53 0.00 0.00 39.78 37.54 2jqz n ASN 55 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 2jqz s THR 56 N 0.00 0.15 0.00 5.53 -1.32 -0.83 -4.93 115.64 114.23 2jqz s THR 56 Ca 0.00 -1.63 0.00 0.00 -1.21 0.00 0.00 61.69 58.85 2jqz s THR 56 Cb 0.00 -1.68 0.00 0.00 -1.51 0.00 0.00 72.50 69.31 2jqz s THR 56 CO 0.00 -0.66 0.67 0.18 -2.21 0.00 0.00 174.62 172.60 2jqz n LEU 57 N -0.04 1.27 -2.75 9.08 4.77 -1.26 -4.33 117.00 123.74 2jqz n LEU 57 Ca -0.11 -1.27 -0.04 0.00 -0.03 0.00 0.00 56.01 54.56 2jqz n LEU 57 Cb 0.62 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.73 2jqz n LEU 57 CO 0.27 0.32 0.15 -0.67 -1.33 0.00 0.00 177.39 176.13 2jqz n ASP 58 N -0.21 -3.29 -4.12 -1.43 -0.08 -1.26 -1.15 116.55 105.01 2jqz n ASP 58 Ca 0.00 -2.78 -0.29 0.00 -1.51 0.00 0.00 54.79 50.22 2jqz n ASP 58 Cb 0.16 1.68 0.19 0.00 2.34 0.00 0.00 41.12 45.49 2jqz n ASP 58 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 2jqz s PRO 59 N 0.87 0.62 -0.14 -0.67 0.04 -1.16 -4.88 135.00 129.67 2jqz s PRO 59 Ca 0.30 -0.69 -0.30 0.00 0.04 0.00 0.00 61.00 60.35 2jqz s PRO 59 Cb 0.02 -1.94 0.11 0.00 0.04 0.00 0.00 34.50 32.73 2jqz s PRO 59 CO -0.06 -2.36 0.89 -1.59 0.04 0.00 0.00 177.00 173.92 2jqz s LYS 60 N -5.78 0.74 0.00 4.56 0.00 -1.26 -1.54 119.74 116.45 2jqz s LYS 60 Ca 0.75 0.25 0.00 0.00 0.00 0.00 0.00 55.97 56.97 2jqz s LYS 60 Cb -0.03 0.35 0.00 0.00 0.00 0.00 0.00 37.83 38.15 2jqz s LYS 60 CO 0.52 -0.21 0.00 0.91 0.00 0.00 0.00 175.35 176.56 2jqz n TRP 61 N 0.99 0.00 -2.57 1.78 8.01 -1.07 -4.98 117.44 119.59 2jqz n TRP 61 Ca -0.13 0.00 -0.10 0.00 -1.31 0.00 0.00 57.50 55.96 2jqz n TRP 61 Cb 0.57 0.00 -0.00 0.00 -2.01 0.00 0.00 31.31 29.87 2jqz n TRP 61 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.69 176.95 2jqz n ASN 62 N -0.83 -3.05 -4.40 -0.99 0.23 -0.81 -4.92 115.26 100.49 2jqz n ASN 62 Ca 0.00 0.21 -0.30 0.00 -0.53 0.00 0.00 54.58 53.95 2jqz n ASN 62 Cb 0.11 -2.62 -0.14 0.00 -2.08 0.00 0.00 39.78 35.05 2jqz n ASN 62 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 2jqz s GLN 63 N -5.15 1.90 0.33 -3.83 -0.21 -1.20 -4.93 119.66 106.59 2jqz s GLN 63 Ca 0.05 -1.07 0.10 0.00 0.02 0.00 0.00 55.36 54.46 2jqz s GLN 63 Cb -0.03 -2.07 -0.06 0.00 1.00 0.00 0.00 33.01 31.85 2jqz s GLN 63 CO 0.06 0.52 -0.08 -3.38 -2.12 0.00 0.00 175.29 170.29 2jqz s HIS 64 N -0.88 2.43 -0.03 0.91 -3.43 -1.26 -0.54 115.29 112.49 2jqz s HIS 64 Ca 0.13 -0.46 0.07 0.00 -0.80 0.00 0.00 55.06 54.01 2jqz s HIS 64 Cb -0.10 -1.35 -0.02 0.00 -1.43 0.00 0.00 32.58 29.68 2jqz s HIS 64 CO 0.04 0.58 -0.25 0.71 -2.00 0.00 0.00 174.74 173.82 2jqz s TYR 65 N -2.57 2.25 -0.87 0.38 2.02 -0.65 -4.92 117.35 112.99 2jqz s TYR 65 Ca 0.33 -0.49 -0.08 0.00 -0.37 0.00 0.00 57.07 56.46 2jqz s TYR 65 Cb 0.01 -1.46 0.22 0.00 -0.40 0.00 0.00 41.96 40.33 2jqz s TYR 65 CO 0.17 -0.08 0.79 -0.51 -1.57 0.00 0.00 175.55 174.35 2jqz s ASP 66 N -0.47 6.42 0.75 2.29 1.11 -1.26 -1.33 116.67 124.19 2jqz s ASP 66 Ca 0.06 -3.17 -0.03 0.00 0.18 0.00 0.00 52.55 49.59 2jqz s ASP 66 Cb -0.11 -2.07 0.14 0.00 1.07 0.00 0.00 42.92 41.95 2jqz s ASP 66 CO 0.00 -0.38 0.91 0.18 1.18 0.00 0.00 175.17 177.06 2jqz n LEU 67 N 3.21 0.00 -4.28 1.23 7.99 -0.80 -4.82 117.00 119.52 2jqz n LEU 67 Ca 0.17 -1.69 -0.21 0.00 -0.01 0.00 0.00 56.01 54.27 2jqz n LEU 67 Cb 0.41 -0.61 -0.12 0.00 -0.11 0.00 0.00 43.42 42.99 2jqz n LEU 67 CO 0.37 -0.99 -0.48 -0.31 -1.51 0.00 0.00 177.39 174.47 2jqz s TYR 68 N -2.77 1.62 -0.06 -1.77 2.02 -1.26 -1.02 117.35 114.10 2jqz s TYR 68 Ca 0.58 -0.49 -0.00 0.00 -0.37 0.00 0.00 57.07 56.79 2jqz s TYR 68 Cb -0.03 -0.84 0.03 0.00 -0.40 0.00 0.00 41.96 40.71 2jqz s TYR 68 CO 0.39 0.21 -0.01 0.42 -1.57 0.00 0.00 175.55 174.99 2jqz s ILE 69 N -1.80 0.42 -0.12 2.71 -1.09 0.55 -4.81 121.20 117.05 2jqz s ILE 69 Ca 0.10 0.04 0.00 0.00 -2.23 0.00 0.00 60.65 58.56 2jqz s ILE 69 Cb -0.07 -0.53 0.02 0.00 -1.58 0.00 0.00 42.46 40.31 2jqz s ILE 69 CO 0.04 0.24 -0.10 -0.83 -1.23 0.00 0.00 174.94 173.07 2jqz s GLY 70 N 1.58 0.91 0.00 6.18 0.00 -1.26 -0.64 107.32 114.10 2jqz s GLY 70 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.07 2jqz s GLY 70 CO -0.04 0.65 0.00 1.17 0.00 0.00 0.00 173.10 174.88 2jqz n LYS 71 N 4.76 0.00 -2.55 2.90 3.00 -1.26 -2.20 118.16 122.81 2jqz n LYS 71 Ca -0.15 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 57.94 2jqz n LYS 71 Cb 0.50 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.54 2jqz n LYS 71 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2jqz n SER 72 N 1.42 3.77 -4.95 3.14 2.88 -1.26 -5.02 113.62 113.60 2jqz n SER 72 Ca 0.00 -3.44 -0.23 0.00 -1.33 0.00 0.00 58.87 53.87 2jqz n SER 72 Cb 0.00 -0.48 -0.01 0.00 -0.75 0.00 0.00 64.21 62.96 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 -3.41 6.27 0.04 -3.46 2.15 -0.94 -4.94 116.67 112.38 2jqz s ASP 73 Ca 0.42 0.36 -0.08 0.00 0.43 0.00 0.00 52.55 53.68 2jqz s ASP 73 Cb 0.41 -1.96 -0.00 0.00 -0.30 0.00 0.00 42.92 41.07 2jqz s ASP 73 CO -0.12 -0.28 0.16 -0.94 -0.17 0.00 0.00 175.17 173.81 2jqz s SER 74 N -4.04 0.09 0.02 -0.34 1.04 -1.26 -2.82 113.70 106.40 2jqz s SER 74 Ca 0.39 -0.44 0.05 0.00 0.48 0.00 0.00 55.95 56.43 2jqz s SER 74 Cb -0.09 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.27 2jqz s SER 74 CO 0.35 -0.54 -0.14 -0.69 0.98 0.00 0.00 173.24 173.20 2jqz s VAL 75 N -2.62 1.09 -0.15 5.02 1.01 -0.94 -3.94 120.40 119.89 2jqz s VAL 75 Ca -0.05 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 2jqz s VAL 75 Cb -0.01 -0.97 0.04 0.00 0.00 0.00 0.00 36.38 35.44 2jqz s VAL 75 CO -0.04 0.10 -0.05 -0.89 0.00 0.00 0.00 175.10 174.22 2jqz s THR 76 N -0.67 1.04 -0.38 3.92 2.01 -1.08 -2.23 115.64 118.26 2jqz s THR 76 Ca 0.03 -0.51 -0.18 0.00 0.31 0.00 0.00 61.69 61.33 2jqz s THR 76 Cb -0.07 -1.19 0.01 0.00 0.01 0.00 0.00 72.50 71.26 2jqz s THR 76 CO 0.01 0.18 0.51 -0.63 -0.69 0.00 0.00 174.62 174.00 2jqz s ILE 77 N 1.67 5.01 -0.13 1.82 1.01 -0.29 -1.66 121.20 128.63 2jqz s ILE 77 Ca 0.02 0.13 -0.01 0.00 0.00 0.00 0.00 60.65 60.79 2jqz s ILE 77 Cb -0.14 -4.01 -0.02 0.00 0.01 0.00 0.00 42.46 38.29 2jqz s ILE 77 CO -0.08 -0.32 -0.11 -0.94 0.00 0.00 0.00 174.94 173.50 2jqz s SER 78 N 1.81 4.24 -0.01 3.58 1.04 -0.29 -0.33 113.70 123.74 2jqz s SER 78 Ca 0.18 -0.25 -0.04 0.00 0.48 0.00 0.00 55.95 56.31 2jqz s SER 78 Cb -0.16 -1.57 -0.04 0.00 0.10 0.00 0.00 66.02 64.35 2jqz s SER 78 CO 0.14 0.19 0.20 -0.69 0.98 0.00 0.00 173.24 174.06 2jqz s VAL 79 N 0.21 5.41 0.04 5.02 1.01 -0.31 -0.22 120.40 131.55 2jqz s VAL 79 Ca -0.06 -0.05 0.02 0.00 0.00 0.00 0.00 61.98 61.89 2jqz s VAL 79 Cb -0.15 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 2jqz s VAL 79 CO 0.04 0.36 -0.08 0.26 0.00 0.00 0.00 175.10 175.69 2jqz s TRP 80 N -1.30 0.65 -0.66 5.22 0.52 -0.39 -2.46 118.94 120.53 2jqz s TRP 80 Ca 0.26 -0.44 -0.22 0.00 0.02 0.00 0.00 56.10 55.72 2jqz s TRP 80 Cb -0.13 -0.39 0.07 0.00 -1.15 0.00 0.00 33.47 31.87 2jqz s TRP 80 CO 0.17 -0.07 0.96 -0.80 0.02 0.00 0.00 176.95 177.23 2jqz s ASN 81 N -1.38 6.18 0.35 2.95 0.02 0.74 -1.85 114.94 121.95 2jqz s ASN 81 Ca -0.08 -1.04 0.17 0.00 -1.02 0.00 0.00 52.86 50.89 2jqz s ASN 81 Cb -0.09 -2.41 1.18 0.00 0.02 0.00 0.00 41.25 39.95 2jqz s ASN 81 CO 0.00 -1.42 1.62 -0.74 0.02 0.00 0.00 177.10 176.58 2jqz h HIS 82 N 9.54 0.81 0.11 2.20 -0.00 -1.21 0.15 115.15 126.74 2jqz h HIS 82 Ca -0.28 0.04 0.01 0.00 -0.00 0.00 0.00 60.37 60.14 2jqz h HIS 82 Cb 1.07 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 28.28 2jqz h HIS 82 CO 0.97 -0.34 -0.12 0.87 -0.00 0.00 0.00 177.93 179.31 2jqz h LYS 83 N 0.14 -0.25 0.00 5.26 1.79 -1.91 -2.79 116.57 118.81 2jqz h LYS 83 Ca 0.78 0.02 -0.14 0.00 -2.18 0.00 0.00 60.65 59.13 2jqz h LYS 83 Cb 1.91 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 32.60 2jqz h LYS 83 CO -0.71 -0.17 -0.65 0.87 -1.08 0.00 0.00 179.45 177.71 2jqz h LYS 84 N -0.26 0.00 -0.28 3.15 1.79 -1.16 -2.46 116.57 117.35 2jqz h LYS 84 Ca 0.01 0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.56 2jqz h LYS 84 Cb 0.26 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.89 2jqz h LYS 84 CO -0.04 0.65 0.21 -0.84 -1.08 0.00 0.00 179.45 178.35 2jqz h ILE 85 N 0.00 0.81 0.06 1.86 3.07 -0.69 0.84 117.51 123.46 2jqz h ILE 85 Ca -0.01 0.00 -0.24 0.00 1.55 0.00 0.00 64.86 66.16 2jqz h ILE 85 Cb 1.47 0.85 -0.01 0.00 -0.27 0.00 0.00 36.82 38.86 2jqz h ILE 85 CO 0.09 0.00 -1.13 -0.74 -1.05 0.00 0.00 178.15 175.31 2jqz h HIS 86 N 0.00 0.25 -0.51 0.16 2.76 -1.34 -3.21 115.15 113.25 2jqz h HIS 86 Ca 0.13 -0.18 0.15 0.00 -2.20 0.00 0.00 60.37 58.27 2jqz h HIS 86 Cb 0.55 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.48 2jqz h HIS 86 CO 0.00 1.14 0.43 -0.22 -1.30 0.00 0.00 177.93 177.98 2jqz h LYS 87 N 0.04 0.00 -2.64 5.26 1.63 0.11 -3.48 116.57 117.50 2jqz h LYS 87 Ca -0.08 0.00 0.30 0.00 -0.85 0.00 0.00 60.65 60.02 2jqz h LYS 87 Cb 1.88 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 33.40 2jqz h LYS 87 CO 0.17 0.00 -0.65 1.17 -3.45 0.00 0.00 179.45 176.68 2jqz n LYS 88 N -4.07 -2.44 -2.69 1.90 3.00 -0.65 -4.89 118.16 108.33 2jqz n LYS 88 Ca 0.09 1.78 -0.09 0.00 -0.00 0.00 0.00 58.31 60.10 2jqz n LYS 88 Cb 0.64 -2.93 0.04 0.00 0.00 0.00 0.00 35.03 32.79 2jqz n LYS 88 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 2jqz n GLN 89 N -3.86 -1.47 0.00 1.64 7.27 -1.26 -3.06 117.38 116.65 2jqz n GLN 89 Ca -0.02 0.68 0.00 0.00 0.07 0.00 0.00 57.00 57.72 2jqz n GLN 89 Cb 0.53 -4.48 0.00 0.00 2.41 0.00 0.00 30.24 28.70 2jqz n GLN 89 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2jqz n GLY 90 N -1.34 1.95 3.73 1.69 0.00 -1.26 -4.95 105.19 105.01 2jqz n GLY 90 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.62 3.51 0.00 4.61 0.00 -1.17 -4.12 121.76 123.96 2jqz s ALA 91 Ca 0.00 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.02 2jqz s ALA 91 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2jqz s ALA 91 CO 0.00 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.66 2jqz n GLY 92 N 2.52 0.06 3.84 0.00 0.00 -1.22 -3.01 105.19 107.40 2jqz n GLY 92 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.69 3.56 0.00 1.61 5.36 -1.26 -0.18 117.98 126.38 2jqz s PHE 93 Ca 0.00 1.10 0.00 0.00 -0.96 0.00 0.00 56.93 57.07 2jqz s PHE 93 Cb 0.00 -2.41 0.00 0.00 -0.34 0.00 0.00 43.02 40.27 2jqz s PHE 93 CO 0.00 0.36 0.00 1.28 -1.46 0.00 0.00 175.22 175.40 2jqz n LEU 94 N 0.52 0.00 -3.66 6.12 4.77 -1.03 -4.48 117.00 119.24 2jqz n LEU 94 Ca -0.03 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.87 2jqz n LEU 94 Cb 0.52 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 2jqz n LEU 94 CO 0.43 0.00 0.06 -0.83 -1.33 0.00 0.00 177.39 175.72 2jqz s GLY 95 N -1.93 -0.40 -0.24 -0.72 0.00 -1.15 -4.35 107.32 98.53 2jqz s GLY 95 Ca 0.00 1.62 -0.09 0.00 0.00 0.00 0.00 44.72 46.25 2jqz s GLY 95 CO 0.00 2.36 0.12 0.00 0.00 0.00 0.00 173.10 175.57 2jqz s VAL 97 N 1.19 4.74 -0.08 0.00 0.11 0.55 -4.71 120.40 122.19 2jqz s VAL 97 Ca 0.06 -0.06 0.01 0.00 -2.93 0.00 0.00 61.98 59.06 2jqz s VAL 97 Cb -0.14 -3.09 0.02 0.00 -1.53 0.00 0.00 36.38 31.64 2jqz s VAL 97 CO 0.05 0.52 -0.11 -0.60 -3.33 0.00 0.00 175.10 171.63 2jqz s ARG 98 N -0.16 1.70 -0.03 1.54 3.52 -1.26 -1.14 118.95 123.12 2jqz s ARG 98 Ca 0.07 -0.38 0.06 0.00 -0.13 0.00 0.00 55.73 55.35 2jqz s ARG 98 Cb -0.12 -1.51 -0.01 0.00 -1.56 0.00 0.00 34.95 31.75 2jqz s ARG 98 CO 0.01 -0.07 -0.21 -0.51 -0.81 0.00 0.00 175.30 173.71 2jqz s LEU 99 N 1.00 2.01 0.00 -0.88 2.01 -0.94 -5.04 118.68 116.84 2jqz s LEU 99 Ca -0.08 -0.41 0.00 0.00 0.01 0.00 0.00 54.13 53.65 2jqz s LEU 99 Cb -0.15 -1.15 0.00 0.00 0.01 0.00 0.00 46.19 44.91 2jqz s LEU 99 CO -0.00 0.23 0.00 0.18 1.01 0.00 0.00 176.35 177.77 2jqz n LEU 100 N 2.82 0.00 -0.06 1.79 4.77 -1.26 -2.20 117.00 122.85 2jqz n LEU 100 Ca -0.17 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.69 2jqz n LEU 100 Cb 0.52 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.55 2jqz n LEU 100 CO 0.24 -0.49 0.67 0.77 -1.33 0.00 0.00 177.39 177.25 2jqz h SER 101 N 0.00 0.37 -0.33 -1.43 4.64 -1.89 0.20 113.55 115.12 2jqz h SER 101 Ca 0.00 -0.41 -0.12 0.00 -0.47 0.00 0.00 61.79 60.79 2jqz h SER 101 Cb 0.00 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 2jqz h SER 101 CO 0.00 0.70 -0.24 -0.55 -0.87 0.00 0.00 176.83 175.87 2jqz h ASN 102 N 0.05 0.84 -0.16 4.97 7.08 -1.95 -2.45 115.58 123.96 2jqz h ASN 102 Ca 0.04 -0.31 -0.15 0.00 -3.08 0.00 0.00 56.30 52.80 2jqz h ASN 102 Cb 0.56 -0.23 -0.01 0.00 -2.08 0.00 0.00 38.32 36.56 2jqz h ASN 102 CO 0.02 1.04 -0.41 0.00 -2.08 0.00 0.00 177.43 176.00 2jqz h ALA 103 N 1.02 0.73 -0.66 4.14 0.00 -1.92 -2.80 119.26 119.77 2jqz h ALA 103 Ca 0.09 -0.45 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 2jqz h ALA 103 Cb 0.77 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2jqz h ALA 103 CO 0.06 0.66 0.28 0.82 0.00 0.00 0.00 179.25 181.08 2jqz h ILE 104 N 0.57 1.23 0.32 0.00 5.03 -0.38 -1.58 117.51 122.69 2jqz h ILE 104 Ca 0.04 -0.68 -0.02 0.00 -0.12 0.00 0.00 64.86 64.09 2jqz h ILE 104 Cb 0.96 0.41 0.00 0.00 -3.03 0.00 0.00 36.82 35.16 2jqz h ILE 104 CO 0.09 0.28 -0.15 -1.13 -0.68 0.00 0.00 178.15 176.55 2jqz h ASN 105 N 0.95 -0.36 -0.87 1.72 -1.24 -1.34 0.46 115.58 114.90 2jqz h ASN 105 Ca 0.23 -0.16 0.11 0.00 0.71 0.00 0.00 56.30 57.18 2jqz h ASN 105 Cb 0.16 0.09 -0.08 0.00 0.73 0.00 0.00 38.32 39.22 2jqz h ASN 105 CO -0.02 0.10 0.50 0.03 -1.29 0.00 0.00 177.43 176.75 2jqz h ARG 106 N -0.97 0.79 -0.01 6.67 3.08 -1.52 -1.16 114.38 121.26 2jqz h ARG 106 Ca -0.04 -0.05 -0.22 0.00 0.07 0.00 0.00 59.98 59.74 2jqz h ARG 106 Cb 0.50 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.38 2jqz h ARG 106 CO 0.07 0.52 -0.92 -0.07 -1.07 0.00 0.00 179.97 178.51 2jqz h LEU 107 N 0.81 0.56 -1.96 3.04 4.07 -1.34 -2.70 115.31 117.79 2jqz h LEU 107 Ca 0.43 -0.44 0.22 0.00 0.08 0.00 0.00 57.88 58.18 2jqz h LEU 107 Cb 0.44 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.98 2jqz h LEU 107 CO -0.27 1.23 0.61 0.07 -1.08 0.00 0.00 178.44 178.99 2jqz h LYS 108 N 0.26 0.00 0.00 1.13 2.10 0.12 0.23 116.57 120.41 2jqz h LYS 108 Ca -0.08 0.00 -0.24 0.00 -2.00 0.00 0.00 60.65 58.33 2jqz h LYS 108 Cb 1.54 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.83 2jqz h LYS 108 CO 0.16 0.00 -2.10 -3.47 -2.00 0.00 0.00 179.45 172.04 2jqz n ASP 109 N -4.09 0.18 0.04 7.07 -0.08 -1.13 -2.92 116.55 115.62 2jqz n ASP 109 Ca 0.16 0.08 -0.11 0.00 -1.51 0.00 0.00 54.79 53.41 2jqz n ASP 109 Cb 0.88 1.05 -0.07 0.00 2.34 0.00 0.00 41.12 45.33 2jqz n ASP 109 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 2jqz h THR 110 N 0.00 0.00 0.00 5.18 1.35 -0.20 -3.47 112.91 115.77 2jqz h THR 110 Ca -0.34 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2jqz h THR 110 Cb 1.82 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 2jqz h THR 110 CO 0.03 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 2jqz n GLY 111 N -1.32 0.88 3.65 5.82 0.00 -1.09 -4.98 105.19 108.15 2jqz n GLY 111 Ca -0.05 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.17 1.61 2.02 -1.26 -4.28 117.35 113.06 2jqz s TYR 112 Ca 0.00 0.46 -0.09 0.00 -0.37 0.00 0.00 57.07 57.06 2jqz s TYR 112 Cb 0.00 0.32 0.06 0.00 -0.40 0.00 0.00 41.96 41.93 2jqz s TYR 112 CO 0.00 -0.10 0.41 -0.65 -1.57 0.00 0.00 175.55 173.64 2jqz s GLN 113 N 0.55 0.39 -0.48 -0.62 -1.52 0.71 -4.84 119.66 113.86 2jqz s GLN 113 Ca -0.00 0.79 -0.10 0.00 -1.95 0.00 0.00 55.36 54.09 2jqz s GLN 113 Cb -0.04 -0.02 0.12 0.00 -0.22 0.00 0.00 33.01 32.85 2jqz s GLN 113 CO -0.12 -0.16 0.37 1.03 -0.25 0.00 0.00 175.29 176.16 2jqz s ARG 114 N 1.39 2.54 -0.32 2.91 0.52 -1.26 -0.38 118.95 124.35 2jqz s ARG 114 Ca -0.09 -1.76 -0.13 0.00 -0.52 0.00 0.00 55.73 53.22 2jqz s ARG 114 Cb -0.08 -3.98 -0.03 0.00 0.52 0.00 0.00 34.95 31.38 2jqz s ARG 114 CO -0.13 -1.21 0.28 -0.51 0.02 0.00 0.00 175.30 173.75 2jqz s LEU 115 N 1.39 4.33 0.13 2.53 2.01 0.33 -4.88 118.68 124.53 2jqz s LEU 115 Ca 0.05 -0.19 -0.31 0.00 0.01 0.00 0.00 54.13 53.69 2jqz s LEU 115 Cb -0.27 -2.23 -0.10 0.00 0.01 0.00 0.00 46.19 43.61 2jqz s LEU 115 CO -0.00 -0.22 1.64 -1.81 1.01 0.00 0.00 176.35 176.97 2jqz s ASP 116 N 1.73 6.55 -0.64 2.29 1.11 -1.26 -1.02 116.67 125.43 2jqz s ASP 116 Ca 0.09 2.62 -0.28 0.00 0.18 0.00 0.00 52.55 55.16 2jqz s ASP 116 Cb -0.17 -2.58 0.03 0.00 1.07 0.00 0.00 42.92 41.27 2jqz s ASP 116 CO 0.11 -0.88 1.25 -0.76 1.18 0.00 0.00 175.17 176.06 2jqz s LEU 117 N 1.80 3.33 0.34 1.23 1.43 0.17 -4.85 118.68 122.13 2jqz s LEU 117 Ca 0.73 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.77 2jqz s LEU 117 Cb -0.43 -2.92 -0.05 0.00 0.03 0.00 0.00 46.19 42.82 2jqz s LEU 117 CO 0.32 -1.64 0.10 0.00 0.23 0.00 0.00 176.35 175.36 2jqz s LYS 119 N -3.86 2.13 0.40 0.00 0.00 -1.26 -3.85 119.74 113.30 2jqz s LYS 119 Ca 0.33 1.39 0.15 0.00 0.00 0.00 0.00 55.97 57.84 2jqz s LYS 119 Cb 0.06 -1.87 1.01 0.00 0.00 0.00 0.00 37.83 37.04 2jqz s LYS 119 CO 0.15 -1.77 1.86 -0.07 0.00 0.00 0.00 175.35 175.52 2jqz h LEU 120 N -0.85 0.47 0.00 2.77 -0.00 -1.86 -3.46 115.31 112.37 2jqz h LEU 120 Ca -0.45 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.47 2jqz h LEU 120 Cb 1.25 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.87 2jqz h LEU 120 CO 0.50 0.20 0.00 0.61 -0.00 0.00 0.00 178.44 179.75 2jqz n GLY 121 N -1.49 0.40 3.73 0.83 0.00 -1.26 -5.10 105.19 102.30 2jqz n GLY 121 Ca 0.19 -0.90 -0.37 0.00 0.00 0.00 0.00 46.02 44.94 2jqz n GLY 121 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jqz n PRO 122 N -0.17 1.02 -1.13 1.61 -0.02 -1.26 -2.27 135.00 132.77 2jqz n PRO 122 Ca 0.00 0.41 -0.05 0.00 -2.02 0.00 0.00 63.50 61.84 2jqz n PRO 122 Cb 0.00 -2.53 -0.02 0.00 -0.02 0.00 0.00 33.50 30.93 2jqz n PRO 122 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2jqz n ASN 123 N -2.05 -5.89 -3.14 2.55 5.03 -1.26 -4.85 115.26 105.64 2jqz n ASN 123 Ca 0.16 0.11 -0.27 0.00 0.87 0.00 0.00 54.58 55.45 2jqz n ASN 123 Cb 0.48 -3.79 -0.06 0.00 -1.02 0.00 0.00 39.78 35.39 2jqz n ASN 123 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2jqz n ASP 124 N -1.08 3.94 -3.03 6.41 2.03 -0.96 -4.94 116.55 118.92 2jqz n ASP 124 Ca -0.05 -3.54 -0.14 0.00 0.52 0.00 0.00 54.79 51.58 2jqz n ASP 124 Cb 0.54 -0.61 0.02 0.00 -0.72 0.00 0.00 41.12 40.35 2jqz n ASP 124 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2jqz n ASN 125 N 0.24 -7.37 -3.61 1.67 4.13 -1.26 -4.51 115.26 104.55 2jqz n ASN 125 Ca 0.30 0.31 -0.41 0.00 1.68 0.00 0.00 54.58 56.46 2jqz n ASN 125 Cb 0.41 -4.52 -0.00 0.00 -1.54 0.00 0.00 39.78 34.13 2jqz n ASN 125 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2jqz n ASP 126 N -0.44 6.85 -2.91 6.41 5.75 -1.26 -4.71 116.55 126.23 2jqz n ASP 126 Ca 0.06 -3.06 -0.35 0.00 -0.01 0.00 0.00 54.79 51.43 2jqz n ASP 126 Cb 0.52 -1.44 0.02 0.00 -1.03 0.00 0.00 41.12 39.18 2jqz n ASP 126 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2jqz n THR 127 N 2.64 3.59 -4.77 2.12 -2.24 -1.26 -5.00 114.28 109.37 2jqz n THR 127 Ca 0.55 -4.93 -0.33 0.00 -2.27 0.00 0.00 64.05 57.07 2jqz n THR 127 Cb 0.29 -1.32 -0.07 0.00 -2.10 0.00 0.00 70.33 67.13 2jqz n THR 127 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2jqz s VAL 128 N -5.02 1.10 0.00 2.28 -7.23 -1.26 -4.91 120.40 105.36 2jqz s VAL 128 Ca 0.48 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.65 2jqz s VAL 128 Cb 0.37 -2.10 0.00 0.00 0.56 0.00 0.00 36.38 35.21 2jqz s VAL 128 CO -0.27 0.00 0.00 -1.14 -0.31 0.00 0.00 175.10 173.38 2jqz n ARG 129 N -1.29 0.00 -2.76 4.82 0.63 -1.23 -4.96 116.66 111.87 2jqz n ARG 129 Ca -0.20 0.00 -0.17 0.00 -0.92 0.00 0.00 57.85 56.56 2jqz n ARG 129 Cb 0.67 0.00 0.04 0.00 0.45 0.00 0.00 32.46 33.62 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 2.18 3.36 5.14 0.00 -0.98 -4.76 105.19 110.13 2jqz n GLY 130 Ca 0.00 -2.22 -0.15 0.00 0.00 0.00 0.00 46.02 43.65 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 -4.00 1.62 -0.24 1.61 1.11 0.24 0.45 119.66 120.45 2jqz s GLN 131 Ca 0.42 -1.74 -0.17 0.00 0.01 0.00 0.00 55.36 53.89 2jqz s GLN 131 Cb -0.03 0.36 0.07 0.00 -1.01 0.00 0.00 33.01 32.40 2jqz s GLN 131 CO 0.27 -0.62 0.62 -1.50 0.01 0.00 0.00 175.29 174.07 2jqz s ILE 132 N -3.61 -0.00 -0.19 1.08 2.07 -0.19 -0.90 121.20 119.46 2jqz s ILE 132 Ca 0.35 0.02 -0.09 0.00 -1.41 0.00 0.00 60.65 59.52 2jqz s ILE 132 Cb 0.03 -0.88 -0.04 0.00 0.13 0.00 0.00 42.46 41.69 2jqz s ILE 132 CO 0.19 0.01 0.10 -0.69 -1.91 0.00 0.00 174.94 172.63 2jqz s VAL 133 N 1.16 5.10 0.38 4.00 1.01 0.88 -0.51 120.40 132.41 2jqz s VAL 133 Ca -0.07 0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.04 2jqz s VAL 133 Cb -0.05 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 2jqz s VAL 133 CO -0.12 0.46 0.20 0.68 0.00 0.00 0.00 175.10 176.32 2jqz s VAL 134 N 0.30 0.31 -0.08 2.92 -7.23 0.49 -0.79 120.40 116.32 2jqz s VAL 134 Ca 0.06 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.19 2jqz s VAL 134 Cb -0.12 -2.39 0.04 0.00 0.56 0.00 0.00 36.38 34.47 2jqz s VAL 134 CO -0.01 0.00 0.17 -0.94 -0.31 0.00 0.00 175.10 174.01 2jqz s SER 135 N -3.51 0.08 -0.33 4.85 1.04 0.20 -0.20 113.70 115.83 2jqz s SER 135 Ca 0.31 0.36 -0.10 0.00 0.48 0.00 0.00 55.95 56.99 2jqz s SER 135 Cb 0.02 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.41 2jqz s SER 135 CO 0.20 -0.18 0.18 -0.76 0.98 0.00 0.00 173.24 173.66 2jqz s LEU 136 N 1.51 4.32 -0.07 2.42 2.01 -1.26 -1.02 118.68 126.60 2jqz s LEU 136 Ca -0.06 -0.64 -0.03 0.00 0.01 0.00 0.00 54.13 53.41 2jqz s LEU 136 Cb -0.12 -2.02 0.04 0.00 0.01 0.00 0.00 46.19 44.10 2jqz s LEU 136 CO -0.06 -0.25 0.14 -1.58 1.01 0.00 0.00 176.35 175.61 2jqz s GLN 137 N 1.61 0.07 0.72 1.70 0.74 -1.08 -2.87 119.66 120.55 2jqz s GLN 137 Ca 0.04 0.42 -0.13 0.00 0.05 0.00 0.00 55.36 55.74 2jqz s GLN 137 Cb -0.18 -0.22 0.03 0.00 1.10 0.00 0.00 33.01 33.75 2jqz s GLN 137 CO 0.07 -0.21 1.11 -1.54 -0.55 0.00 0.00 175.29 174.17 2jqz s SER 138 N 1.53 4.74 0.04 6.67 1.04 -1.20 -2.25 113.70 124.27 2jqz s SER 138 Ca -0.05 1.96 -0.14 0.00 0.48 0.00 0.00 55.95 58.19 2jqz s SER 138 Cb -0.12 -2.54 -0.06 0.00 0.10 0.00 0.00 66.02 63.40 2jqz s SER 138 CO -0.06 -1.88 0.43 -0.60 0.98 0.00 0.00 173.24 172.12 2jqz s ARG 139 N -4.42 3.91 0.00 4.02 3.00 -1.02 -4.84 118.95 119.59 2jqz s ARG 139 Ca 0.65 0.39 0.30 0.00 -1.00 0.00 0.00 55.73 56.07 2jqz s ARG 139 Cb -0.20 -3.14 1.39 0.00 0.00 0.00 0.00 34.95 33.00 2jqz s ARG 139 CO 0.48 0.64 1.93 -0.25 0.00 0.00 0.00 175.30 178.10