#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 0.88 -0.06 1.61 0.02 -1.26 -4.91 135.00 131.27 2jqz s PRO 11 Ca 0.00 0.94 0.01 0.00 0.02 0.00 0.00 61.00 61.97 2jqz s PRO 11 Cb 0.00 -1.76 -0.03 0.00 0.02 0.00 0.00 34.50 32.73 2jqz s PRO 11 CO 0.00 -2.54 -0.06 0.14 -0.33 0.00 0.00 177.00 174.22 2jqz s VAL 12 N -2.81 3.80 -0.61 3.83 -7.23 -0.52 -4.77 120.40 112.08 2jqz s VAL 12 Ca 0.65 -0.49 -0.23 0.00 -1.81 0.00 0.00 61.98 60.10 2jqz s VAL 12 Cb -0.20 -2.57 0.06 0.00 0.56 0.00 0.00 36.38 34.23 2jqz s VAL 12 CO 0.58 0.57 0.92 -0.75 -0.31 0.00 0.00 175.10 176.11 2jqz s LYS 13 N -0.92 3.18 -0.13 4.82 2.47 -1.26 -0.47 119.74 127.42 2jqz s LYS 13 Ca 0.13 -0.67 -0.02 0.00 -1.56 0.00 0.00 55.97 53.86 2jqz s LYS 13 Cb -0.11 -4.16 -0.02 0.00 -1.46 0.00 0.00 37.83 32.07 2jqz s LYS 13 CO 0.03 -1.66 -0.08 -1.17 0.16 0.00 0.00 175.35 172.63 2jqz s LEU 14 N 3.88 3.04 -0.20 5.43 0.20 -0.44 -0.93 118.68 129.66 2jqz s LEU 14 Ca 0.24 -0.19 -0.07 0.00 0.69 0.00 0.00 54.13 54.81 2jqz s LEU 14 Cb -0.16 -1.71 -0.03 0.00 -0.43 0.00 0.00 46.19 43.86 2jqz s LEU 14 CO 0.13 0.20 0.04 0.00 -0.29 0.00 0.00 176.35 176.43 2jqz s ARG 15 N 0.18 3.80 -0.43 1.98 1.70 -1.01 -2.22 118.95 122.96 2jqz s ARG 15 Ca -0.04 -0.43 -0.12 0.00 -0.47 0.00 0.00 55.73 54.67 2jqz s ARG 15 Cb -0.14 -3.19 0.06 0.00 -0.57 0.00 0.00 34.95 31.11 2jqz s ARG 15 CO 0.04 0.11 0.30 -1.17 -1.08 0.00 0.00 175.30 173.50 2jqz s LEU 16 N 0.78 5.25 -0.44 -1.89 0.20 -0.69 -2.57 118.68 119.31 2jqz s LEU 16 Ca 0.02 -1.29 -0.22 0.00 0.69 0.00 0.00 54.13 53.33 2jqz s LEU 16 Cb -0.14 -2.08 0.02 0.00 -0.43 0.00 0.00 46.19 43.57 2jqz s LEU 16 CO 0.02 -0.54 0.73 -0.89 -0.29 0.00 0.00 176.35 175.38 2jqz s THR 17 N 1.55 4.72 -0.98 3.68 2.01 -0.18 -2.34 115.64 124.10 2jqz s THR 17 Ca 0.03 0.33 -0.22 0.00 0.31 0.00 0.00 61.69 62.14 2jqz s THR 17 Cb -0.22 -4.27 0.06 0.00 0.01 0.00 0.00 72.50 68.08 2jqz s THR 17 CO 0.05 -0.66 1.37 -0.69 -0.69 0.00 0.00 174.62 174.01 2jqz s VAL 18 N 3.10 4.06 0.01 3.82 1.01 0.39 -0.83 120.40 131.97 2jqz s VAL 18 Ca 0.27 -0.84 -0.26 0.00 0.00 0.00 0.00 61.98 61.16 2jqz s VAL 18 Cb -0.13 -4.99 -0.15 0.00 0.00 0.00 0.00 36.38 31.11 2jqz s VAL 18 CO 0.21 -1.85 1.10 0.25 0.00 0.00 0.00 175.10 174.81 2jqz h LEU 19 N 12.35 -0.71 -7.91 3.92 5.85 -1.54 -0.81 115.31 126.46 2jqz h LEU 19 Ca 0.16 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.96 2jqz h LEU 19 Cb 1.02 0.18 -0.05 0.00 0.37 0.00 0.00 40.66 42.18 2jqz h LEU 19 CO 1.36 -0.34 0.34 0.00 -0.34 0.00 0.00 178.44 179.46 2jqz s ALA 21 N -3.28 0.95 0.29 0.00 0.00 -0.78 -0.37 121.76 118.58 2jqz s ALA 21 Ca 0.13 -0.86 0.11 0.00 0.00 0.00 0.00 51.96 51.34 2jqz s ALA 21 Cb -0.04 -0.07 -0.05 0.00 0.00 0.00 0.00 23.12 22.96 2jqz s ALA 21 CO 0.06 0.12 -0.14 0.15 0.00 0.00 0.00 175.76 175.95 2jqz s LYS 22 N -1.50 1.82 -0.80 0.00 -0.14 0.04 -3.19 119.74 115.97 2jqz s LYS 22 Ca -0.04 -1.75 -0.02 0.00 -1.36 0.00 0.00 55.97 52.81 2jqz s LYS 22 Cb -0.09 -1.83 0.00 0.00 -1.68 0.00 0.00 37.83 34.23 2jqz s LYS 22 CO 0.01 0.29 0.61 -1.71 -0.76 0.00 0.00 175.35 173.80 2jqz n ASN 23 N -0.71 -5.14 -4.69 2.83 4.05 -1.15 -0.53 115.26 109.91 2jqz n ASN 23 Ca -0.05 -0.84 -0.42 0.00 0.45 0.00 0.00 54.58 53.71 2jqz n ASN 23 Cb 0.61 -1.99 -0.03 0.00 1.23 0.00 0.00 39.78 39.60 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 -4.74 4.28 -0.22 1.20 1.98 -0.11 -3.00 118.68 118.07 2jqz s LEU 24 Ca 0.02 1.72 -0.29 0.00 -2.89 0.00 0.00 54.13 52.69 2jqz s LEU 24 Cb -0.00 -3.56 -0.04 0.00 0.66 0.00 0.00 46.19 43.25 2jqz s LEU 24 CO 0.88 -0.50 1.92 0.54 -1.89 0.00 0.00 176.35 177.31 2jqz s VAL 25 N 1.94 3.31 -2.00 1.68 0.11 -1.02 -4.71 120.40 119.70 2jqz s VAL 25 Ca 0.53 0.33 0.13 0.00 -2.93 0.00 0.00 61.98 60.04 2jqz s VAL 25 Cb -0.22 -3.36 0.37 0.00 -1.53 0.00 0.00 36.38 31.63 2jqz s VAL 25 CO 0.22 -0.19 1.22 2.29 -3.33 0.00 0.00 175.10 175.31 2jqz n LYS 26 N 8.26 0.58 0.00 1.54 2.85 -1.26 -4.62 118.16 125.50 2jqz n LYS 26 Ca 0.24 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.50 2jqz n LYS 26 Cb 0.45 -1.35 0.00 0.00 -0.65 0.00 0.00 35.03 33.48 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 -0.85 0.00 -3.52 -1.58 4.76 -1.26 -4.28 118.16 111.43 2jqz n LYS 27 Ca 0.10 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.16 2jqz n LYS 27 Cb 0.04 0.00 -0.09 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 6.24 0.18 4.39 1.01 -1.26 -4.98 116.67 118.24 2jqz s ASP 28 Ca 0.00 0.27 -0.14 0.00 0.71 0.00 0.00 52.55 53.39 2jqz s ASP 28 Cb 0.00 -2.17 0.14 0.00 1.01 0.00 0.00 42.92 41.91 2jqz s ASP 28 CO 0.00 -0.04 1.73 0.15 0.21 0.00 0.00 175.17 177.23 2jqz h PHE 29 N 7.65 0.19 0.00 4.23 3.57 -2.02 0.30 116.94 130.87 2jqz h PHE 29 Ca -0.36 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.17 2jqz h PHE 29 Cb 1.17 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.89 2jqz h PHE 29 CO 0.70 0.04 0.00 0.34 -2.23 0.00 0.00 178.31 177.15 2jqz n PHE 30 N -5.07 0.00 -4.34 0.41 7.35 -1.26 -4.75 117.46 109.81 2jqz n PHE 30 Ca 0.04 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.53 2jqz n PHE 30 Cb 0.20 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 39.94 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 -2.00 1.73 0.02 -4.13 0.52 0.11 -5.18 118.95 110.01 2jqz s ARG 31 Ca 0.17 -2.01 0.00 0.00 -0.52 0.00 0.00 55.73 53.38 2jqz s ARG 31 Cb 0.08 0.06 -0.01 0.00 0.52 0.00 0.00 34.95 35.59 2jqz s ARG 31 CO 0.13 -0.57 -0.02 -0.51 0.02 0.00 0.00 175.30 174.35 2jqz s LEU 32 N -3.41 2.17 0.30 2.53 2.01 -1.26 -4.55 118.68 116.48 2jqz s LEU 32 Ca 0.36 -0.37 0.02 0.00 0.01 0.00 0.00 54.13 54.15 2jqz s LEU 32 Cb 0.03 0.06 -0.03 0.00 0.01 0.00 0.00 46.19 46.26 2jqz s LEU 32 CO 0.22 -0.21 0.48 -2.16 1.01 0.00 0.00 176.35 175.68 2jqz s PRO 33 N -1.06 3.47 -0.59 1.29 0.04 -1.26 -4.74 135.00 132.14 2jqz s PRO 33 Ca -0.11 -0.47 0.04 0.00 0.04 0.00 0.00 61.00 60.50 2jqz s PRO 33 Cb -0.07 -2.75 0.15 0.00 0.04 0.00 0.00 34.50 31.87 2jqz s PRO 33 CO -0.01 0.26 0.38 -0.51 0.04 0.00 0.00 177.00 177.16 2jqz s ASP 34 N -3.95 4.21 0.36 6.66 1.11 -1.26 -2.78 116.67 121.02 2jqz s ASP 34 Ca 0.38 -3.38 -0.28 0.00 0.18 0.00 0.00 52.55 49.45 2jqz s ASP 34 Cb -0.09 -1.44 -0.10 0.00 1.07 0.00 0.00 42.92 42.35 2jqz s ASP 34 CO 0.33 -0.16 1.37 -2.16 1.18 0.00 0.00 175.17 175.73 2jqz s PRO 35 N -0.74 4.19 0.10 8.23 0.04 -1.19 -0.75 135.00 144.88 2jqz s PRO 35 Ca 0.22 2.33 -0.14 0.00 0.04 0.00 0.00 61.00 63.45 2jqz s PRO 35 Cb -0.13 -2.97 0.02 0.00 0.04 0.00 0.00 34.50 31.47 2jqz s PRO 35 CO -0.10 -0.37 0.33 -0.59 0.04 0.00 0.00 177.00 176.31 2jqz s PHE 36 N -1.16 -0.10 0.13 0.56 -0.12 -0.84 -0.28 117.98 116.18 2jqz s PHE 36 Ca 0.52 -0.22 0.08 0.00 -0.05 0.00 0.00 56.93 57.25 2jqz s PHE 36 Cb -0.42 0.15 -0.04 0.00 -0.63 0.00 0.00 43.02 42.08 2jqz s PHE 36 CO 0.56 -0.63 -0.09 0.00 -0.05 0.00 0.00 175.22 175.01 2jqz s ALA 37 N -3.62 2.96 -0.18 1.99 0.00 -1.13 -1.35 121.76 120.44 2jqz s ALA 37 Ca 0.02 -1.31 -0.04 0.00 0.00 0.00 0.00 51.96 50.63 2jqz s ALA 37 Cb 0.02 -0.86 0.08 0.00 0.00 0.00 0.00 23.12 22.37 2jqz s ALA 37 CO -0.10 0.59 0.24 0.21 0.00 0.00 0.00 175.76 176.70 2jqz s LYS 38 N -2.42 0.18 0.19 0.00 2.20 0.63 -0.36 119.74 120.17 2jqz s LYS 38 Ca 0.23 0.42 -0.07 0.00 -0.36 0.00 0.00 55.97 56.19 2jqz s LYS 38 Cb -0.10 -0.72 -0.06 0.00 -1.51 0.00 0.00 37.83 35.43 2jqz s LYS 38 CO 0.14 -0.52 0.46 0.54 -0.36 0.00 0.00 175.35 175.62 2jqz s VAL 39 N 2.37 5.06 0.01 4.02 0.11 0.19 -0.43 120.40 131.74 2jqz s VAL 39 Ca 0.05 0.21 0.03 0.00 -2.93 0.00 0.00 61.98 59.35 2jqz s VAL 39 Cb -0.14 -3.63 -0.01 0.00 -1.53 0.00 0.00 36.38 31.06 2jqz s VAL 39 CO -0.11 -0.04 -0.10 0.68 -3.33 0.00 0.00 175.10 172.20 2jqz s VAL 40 N -1.76 0.80 -0.45 2.04 -7.23 -0.67 -2.62 120.40 110.51 2jqz s VAL 40 Ca 0.44 -0.65 -0.13 0.00 -1.81 0.00 0.00 61.98 59.83 2jqz s VAL 40 Cb -0.12 -0.71 0.08 0.00 0.56 0.00 0.00 36.38 36.19 2jqz s VAL 40 CO 0.24 0.07 0.33 -0.69 -0.31 0.00 0.00 175.10 174.73 2jqz s VAL 41 N -0.55 4.77 -1.01 1.32 1.01 -1.14 -2.69 120.40 122.11 2jqz s VAL 41 Ca 0.01 -1.22 -0.24 0.00 0.00 0.00 0.00 61.98 60.53 2jqz s VAL 41 Cb -0.06 -3.88 -0.08 0.00 0.00 0.00 0.00 36.38 32.36 2jqz s VAL 41 CO 0.00 -0.55 2.00 1.51 0.00 0.00 0.00 175.10 178.06 2jqz s ASP 42 N 2.38 4.86 0.00 3.32 1.47 -1.25 -1.77 116.67 125.69 2jqz s ASP 42 Ca 0.04 -1.01 0.00 0.00 1.18 0.00 0.00 52.55 52.76 2jqz s ASP 42 Cb -0.24 -2.57 0.00 0.00 -0.34 0.00 0.00 42.92 39.77 2jqz s ASP 42 CO 0.05 -3.13 0.00 0.61 0.68 0.00 0.00 175.17 173.38 2jqz n GLY 43 N 6.40 0.94 3.44 2.12 0.00 -1.26 -4.54 105.19 112.29 2jqz n GLY 43 Ca 0.43 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.21 2jqz n GLY 43 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jqz s SER 44 N 0.00 2.43 -0.81 1.61 0.01 -0.73 -5.07 113.70 111.14 2jqz s SER 44 Ca 0.00 -1.70 0.01 0.00 1.31 0.00 0.00 55.95 55.56 2jqz s SER 44 Cb 0.00 0.54 0.35 0.00 0.21 0.00 0.00 66.02 67.11 2jqz s SER 44 CO 0.00 -0.98 1.65 0.61 0.41 0.00 0.00 173.24 174.93 2jqz n GLY 45 N -0.82 5.83 3.19 3.44 0.00 -1.26 -4.48 105.19 111.08 2jqz n GLY 45 Ca -0.02 -2.61 -0.35 0.00 0.00 0.00 0.00 46.02 43.05 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 -3.99 2.69 0.03 1.61 -0.21 -1.26 -5.05 119.66 113.48 2jqz s GLN 46 Ca 0.46 -1.08 0.07 0.00 0.02 0.00 0.00 55.36 54.84 2jqz s GLN 46 Cb 0.32 -3.04 -0.02 0.00 1.00 0.00 0.00 33.01 31.27 2jqz s GLN 46 CO -0.24 -0.47 -0.22 0.00 -2.12 0.00 0.00 175.29 172.24 2jqz s HIS 48 N -0.73 1.09 -0.00 0.00 3.76 -1.08 -4.96 115.29 113.36 2jqz s HIS 48 Ca 0.08 -1.27 -0.23 0.00 -0.15 0.00 0.00 55.06 53.50 2jqz s HIS 48 Cb -0.09 -0.58 0.05 0.00 1.11 0.00 0.00 32.58 33.07 2jqz s HIS 48 CO 0.01 -0.52 0.51 -1.54 -0.85 0.00 0.00 174.74 172.35 2jqz s SER 49 N -3.13 -0.43 0.07 1.40 1.04 -1.26 -0.64 113.70 110.75 2jqz s SER 49 Ca 0.31 0.32 0.04 0.00 0.48 0.00 0.00 55.95 57.11 2jqz s SER 49 Cb 0.07 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.61 2jqz s SER 49 CO 0.07 -0.60 -0.00 0.42 0.98 0.00 0.00 173.24 174.11 2jqz s THR 50 N -1.72 4.04 0.99 2.02 -4.23 0.52 -4.94 115.64 112.32 2jqz s THR 50 Ca -0.09 -0.91 -0.15 0.00 -1.18 0.00 0.00 61.69 59.35 2jqz s THR 50 Cb -0.02 -2.90 -0.01 0.00 1.34 0.00 0.00 72.50 70.91 2jqz s THR 50 CO 0.04 0.17 -0.06 -0.90 -0.54 0.00 0.00 174.62 173.33 2jqz n ASP 51 N 0.74 -3.14 -4.88 3.99 5.68 -1.26 -2.83 116.55 114.85 2jqz n ASP 51 Ca -0.11 0.21 -0.32 0.00 -0.50 0.00 0.00 54.79 54.06 2jqz n ASP 51 Cb 0.52 -1.02 -0.05 0.00 -1.14 0.00 0.00 41.12 39.43 2jqz n ASP 51 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2jqz s THR 52 N -2.26 5.06 -0.33 2.12 2.01 -1.26 -4.35 115.64 116.63 2jqz s THR 52 Ca 0.51 0.29 -0.04 0.00 0.31 0.00 0.00 61.69 62.77 2jqz s THR 52 Cb -0.17 -3.63 0.05 0.00 0.01 0.00 0.00 72.50 68.76 2jqz s THR 52 CO 0.71 0.04 0.07 -0.69 -0.69 0.00 0.00 174.62 174.06 2jqz s VAL 53 N -1.67 3.34 0.23 3.82 1.01 0.62 -4.98 120.40 122.77 2jqz s VAL 53 Ca 0.42 -1.38 -0.30 0.00 0.00 0.00 0.00 61.98 60.72 2jqz s VAL 53 Cb -0.12 -2.96 -0.10 0.00 0.00 0.00 0.00 36.38 33.21 2jqz s VAL 53 CO 0.22 -0.21 1.41 -0.54 0.00 0.00 0.00 175.10 175.97 2jqz s LYS 54 N 1.30 4.30 0.00 2.72 3.01 -1.26 -3.14 119.74 126.66 2jqz s LYS 54 Ca -0.02 2.23 0.00 0.00 -1.01 0.00 0.00 55.97 57.17 2jqz s LYS 54 Cb -0.20 -3.13 0.00 0.00 -1.01 0.00 0.00 37.83 33.48 2jqz s LYS 54 CO -0.00 -0.38 0.00 0.27 0.51 0.00 0.00 175.35 175.75 2jqz n ASN 55 N 2.46 -2.48 -3.66 2.83 0.23 -1.12 -4.97 115.26 108.56 2jqz n ASN 55 Ca 0.07 0.19 -0.15 0.00 -0.53 0.00 0.00 54.58 54.16 2jqz n ASN 55 Cb 0.41 -0.57 -0.08 0.00 -2.08 0.00 0.00 39.78 37.46 2jqz n ASN 55 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2jqz s THR 56 N -0.28 0.02 -0.68 5.53 -1.32 -1.16 -4.99 115.64 112.76 2jqz s THR 56 Ca 0.00 -0.20 0.09 0.00 -1.21 0.00 0.00 61.69 60.37 2jqz s THR 56 Cb 0.00 -0.78 0.26 0.00 -1.51 0.00 0.00 72.50 70.47 2jqz s THR 56 CO 0.00 -0.11 1.21 0.18 -2.21 0.00 0.00 174.62 173.69 2jqz n LEU 57 N 1.45 2.80 -2.83 9.08 4.77 -1.26 -4.65 117.00 126.34 2jqz n LEU 57 Ca -0.19 -2.08 -0.03 0.00 -0.03 0.00 0.00 56.01 53.68 2jqz n LEU 57 Cb 0.56 -0.21 0.01 0.00 -2.33 0.00 0.00 43.42 41.45 2jqz n LEU 57 CO 0.20 0.68 0.17 -0.62 -1.33 0.00 0.00 177.39 176.49 2jqz s ASP 58 N -1.09 -1.30 0.92 -1.43 2.15 -1.26 -0.94 116.67 113.72 2jqz s ASP 58 Ca 0.20 -1.36 -0.11 0.00 0.43 0.00 0.00 52.55 51.71 2jqz s ASP 58 Cb 0.11 1.70 0.19 0.00 -0.30 0.00 0.00 42.92 44.62 2jqz s ASP 58 CO 0.12 -0.07 1.14 -0.81 -0.17 0.00 0.00 175.17 175.38 2jqz n PRO 59 N 3.20 -0.86 -3.58 4.34 -0.04 -1.19 -4.89 135.00 131.97 2jqz n PRO 59 Ca 0.16 -2.09 -0.14 0.00 -0.04 0.00 0.00 63.50 61.39 2jqz n PRO 59 Cb 0.57 -1.07 -0.06 0.00 -0.04 0.00 0.00 33.50 32.90 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 -5.46 0.79 0.00 0.54 0.00 -1.26 -1.86 119.74 112.49 2jqz s LYS 60 Ca 0.67 0.41 0.00 0.00 0.00 0.00 0.00 55.97 57.06 2jqz s LYS 60 Cb -0.02 0.38 0.00 0.00 0.00 0.00 0.00 37.83 38.18 2jqz s LYS 60 CO 0.47 -0.20 0.00 0.91 0.00 0.00 0.00 175.35 176.52 2jqz n TRP 61 N 1.39 0.00 -1.92 1.78 8.01 -1.09 -4.98 117.44 120.63 2jqz n TRP 61 Ca -0.14 0.00 -0.08 0.00 -1.31 0.00 0.00 57.50 55.96 2jqz n TRP 61 Cb 0.57 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 29.85 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 -0.96 -2.66 -4.61 -0.99 6.94 -0.32 -4.91 115.26 107.75 2jqz n ASN 62 Ca 0.00 0.25 -0.31 0.00 -0.02 0.00 0.00 54.58 54.50 2jqz n ASN 62 Cb 0.15 -2.45 -0.10 0.00 -2.36 0.00 0.00 39.78 35.02 2jqz n ASN 62 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2jqz s GLN 63 N -4.00 2.47 0.25 -3.83 -0.21 -1.17 -4.90 119.66 108.27 2jqz s GLN 63 Ca 0.00 -0.80 0.09 0.00 0.02 0.00 0.00 55.36 54.66 2jqz s GLN 63 Cb 0.00 -2.48 -0.05 0.00 1.00 0.00 0.00 33.01 31.48 2jqz s GLN 63 CO 0.00 0.57 -0.13 -3.38 -2.12 0.00 0.00 175.29 170.23 2jqz s HIS 64 N -1.10 1.94 -0.03 0.91 -3.43 -1.26 -0.46 115.29 111.86 2jqz s HIS 64 Ca 0.20 -0.54 0.07 0.00 -0.80 0.00 0.00 55.06 53.98 2jqz s HIS 64 Cb -0.11 -0.95 -0.02 0.00 -1.43 0.00 0.00 32.58 30.07 2jqz s HIS 64 CO 0.11 0.43 -0.24 0.71 -2.00 0.00 0.00 174.74 173.75 2jqz s TYR 65 N -2.86 2.21 -0.36 0.38 2.02 -0.99 -4.93 117.35 112.82 2jqz s TYR 65 Ca 0.27 -0.51 -0.08 0.00 -0.37 0.00 0.00 57.07 56.38 2jqz s TYR 65 Cb -0.00 -1.44 0.05 0.00 -0.40 0.00 0.00 41.96 40.17 2jqz s TYR 65 CO 0.11 -0.10 0.16 -0.51 -1.57 0.00 0.00 175.55 173.63 2jqz s ASP 66 N -0.40 5.46 0.14 2.29 1.11 -1.26 -1.71 116.67 122.31 2jqz s ASP 66 Ca 0.04 -1.21 0.08 0.00 0.18 0.00 0.00 52.55 51.64 2jqz s ASP 66 Cb -0.11 -1.92 -0.04 0.00 1.07 0.00 0.00 42.92 41.92 2jqz s ASP 66 CO 0.01 -0.39 -0.18 -0.76 1.18 0.00 0.00 175.17 175.03 2jqz s LEU 67 N 1.43 2.40 0.25 1.23 1.43 -0.94 -4.95 118.68 119.53 2jqz s LEU 67 Ca 0.00 -0.81 -0.10 0.00 -1.03 0.00 0.00 54.13 52.19 2jqz s LEU 67 Cb -0.20 -0.76 -0.07 0.00 0.03 0.00 0.00 46.19 45.18 2jqz s LEU 67 CO 0.03 -0.04 0.58 -0.31 0.23 0.00 0.00 176.35 176.84 2jqz s TYR 68 N -1.88 3.42 -0.22 0.29 2.02 -1.26 -1.33 117.35 118.40 2jqz s TYR 68 Ca 0.12 0.91 0.01 0.00 -0.37 0.00 0.00 57.07 57.73 2jqz s TYR 68 Cb -0.06 -2.29 0.05 0.00 -0.40 0.00 0.00 41.96 39.26 2jqz s TYR 68 CO 0.05 0.22 -0.07 0.42 -1.57 0.00 0.00 175.55 174.61 2jqz s ILE 69 N -1.88 1.56 0.00 2.71 -1.09 0.38 -4.86 121.20 118.01 2jqz s ILE 69 Ca 0.48 -1.15 0.00 0.00 -2.23 0.00 0.00 60.65 57.75 2jqz s ILE 69 Cb -0.11 -1.77 0.00 0.00 -1.58 0.00 0.00 42.46 39.00 2jqz s ILE 69 CO 0.22 -0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.52 2jqz n GLY 70 N 4.67 -1.66 0.41 6.18 0.00 -1.26 -1.44 105.19 112.10 2jqz n GLY 70 Ca -0.13 -1.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.49 -2.20 1.61 1.63 -2.00 -3.22 116.57 111.90 2jqz h LYS 71 Ca 0.00 0.03 -0.59 0.00 -0.85 0.00 0.00 60.65 59.25 2jqz h LYS 71 Cb 0.00 0.11 -0.42 0.00 -0.60 0.00 0.00 32.23 31.33 2jqz h LYS 71 CO 0.00 -0.33 -0.68 -1.13 -3.45 0.00 0.00 179.45 173.86 2jqz n SER 72 N -5.44 3.58 -4.46 4.20 3.41 -1.26 -5.07 113.62 108.59 2jqz n SER 72 Ca -0.04 -3.45 -0.23 0.00 -0.26 0.00 0.00 58.87 54.89 2jqz n SER 72 Cb 0.37 -0.63 -0.10 0.00 -0.26 0.00 0.00 64.21 63.59 2jqz n SER 72 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2jqz s ASP 73 N -2.73 3.34 0.23 4.04 1.11 -1.22 -5.04 116.67 116.40 2jqz s ASP 73 Ca 0.43 -1.08 -0.06 0.00 0.18 0.00 0.00 52.55 52.02 2jqz s ASP 73 Cb 0.21 -0.27 -0.02 0.00 1.07 0.00 0.00 42.92 43.91 2jqz s ASP 73 CO -0.07 -0.09 0.31 -0.44 1.18 0.00 0.00 175.17 176.05 2jqz s SER 74 N -3.49 0.14 0.00 0.27 0.01 -1.26 -3.42 113.70 105.95 2jqz s SER 74 Ca 0.29 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.34 2jqz s SER 74 Cb -0.02 0.49 -0.00 0.00 0.21 0.00 0.00 66.02 66.70 2jqz s SER 74 CO 0.13 -1.01 -0.01 -0.69 0.41 0.00 0.00 173.24 172.08 2jqz s VAL 75 N -4.01 0.08 -0.14 3.43 1.01 -0.94 -3.81 120.40 116.02 2jqz s VAL 75 Ca 0.31 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 2jqz s VAL 75 Cb 0.03 -0.10 0.04 0.00 0.00 0.00 0.00 36.38 36.35 2jqz s VAL 75 CO 0.12 -0.03 -0.05 -0.89 0.00 0.00 0.00 175.10 174.24 2jqz s THR 76 N -0.17 1.00 -0.26 3.92 2.01 -1.10 -2.31 115.64 118.74 2jqz s THR 76 Ca -0.01 -0.45 -0.20 0.00 0.31 0.00 0.00 61.69 61.34 2jqz s THR 76 Cb -0.01 -1.13 -0.02 0.00 0.01 0.00 0.00 72.50 71.35 2jqz s THR 76 CO -0.00 0.21 0.62 -0.63 -0.69 0.00 0.00 174.62 174.13 2jqz s ILE 77 N 1.70 4.98 -0.20 1.82 1.01 -0.11 -1.67 121.20 128.73 2jqz s ILE 77 Ca 0.03 1.08 -0.04 0.00 0.00 0.00 0.00 60.65 61.72 2jqz s ILE 77 Cb -0.14 -3.93 -0.02 0.00 0.01 0.00 0.00 42.46 38.38 2jqz s ILE 77 CO -0.08 0.01 -0.04 -0.94 0.00 0.00 0.00 174.94 173.90 2jqz s SER 78 N 1.50 4.46 0.01 3.58 1.04 0.43 0.01 113.70 124.71 2jqz s SER 78 Ca 0.26 -0.31 -0.12 0.00 0.48 0.00 0.00 55.95 56.26 2jqz s SER 78 Cb -0.15 -1.75 -0.05 0.00 0.10 0.00 0.00 66.02 64.16 2jqz s SER 78 CO 0.09 0.04 0.36 -0.69 0.98 0.00 0.00 173.24 174.01 2jqz s VAL 79 N 1.14 5.13 0.09 5.02 1.01 -1.18 -0.27 120.40 131.34 2jqz s VAL 79 Ca 0.02 0.60 0.06 0.00 0.00 0.00 0.00 61.98 62.66 2jqz s VAL 79 Cb -0.15 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 2jqz s VAL 79 CO -0.00 0.49 -0.16 0.26 0.00 0.00 0.00 175.10 175.69 2jqz s TRP 80 N -1.18 1.38 -0.71 5.22 0.52 -0.46 -1.31 118.94 122.41 2jqz s TRP 80 Ca 0.25 -0.46 -0.18 0.00 0.02 0.00 0.00 56.10 55.73 2jqz s TRP 80 Cb -0.15 -0.77 0.13 0.00 -1.15 0.00 0.00 33.47 31.53 2jqz s TRP 80 CO 0.14 0.11 0.82 -0.80 0.02 0.00 0.00 176.95 177.23 2jqz s ASN 81 N -1.87 6.38 0.35 2.95 0.02 -0.04 -1.98 114.94 120.75 2jqz s ASN 81 Ca 0.01 -1.75 0.15 0.00 -1.02 0.00 0.00 52.86 50.25 2jqz s ASN 81 Cb -0.09 -2.31 1.14 0.00 0.02 0.00 0.00 41.25 40.01 2jqz s ASN 81 CO 0.03 -1.03 1.61 -0.74 0.02 0.00 0.00 177.10 176.99 2jqz h HIS 82 N 8.90 0.74 0.05 2.20 -0.00 -1.22 0.33 115.15 126.14 2jqz h HIS 82 Ca -0.13 0.04 0.01 0.00 -0.00 0.00 0.00 60.37 60.29 2jqz h HIS 82 Cb 1.06 -0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 28.31 2jqz h HIS 82 CO 0.95 -0.35 -0.07 0.87 -0.00 0.00 0.00 177.93 179.33 2jqz h LYS 83 N 0.13 -0.15 0.00 5.26 1.79 -1.90 -2.84 116.57 118.87 2jqz h LYS 83 Ca 0.76 0.01 -0.13 0.00 -2.18 0.00 0.00 60.65 59.11 2jqz h LYS 83 Cb 1.85 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 32.51 2jqz h LYS 83 CO -0.72 -0.10 -0.60 0.87 -1.08 0.00 0.00 179.45 177.82 2jqz h LYS 84 N -0.15 0.00 -0.27 3.15 1.79 -0.85 -2.37 116.57 117.87 2jqz h LYS 84 Ca 0.01 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.53 2jqz h LYS 84 Cb 0.16 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.80 2jqz h LYS 84 CO -0.04 0.60 0.18 -0.84 -1.08 0.00 0.00 179.45 178.28 2jqz h ILE 85 N 0.00 0.96 0.00 1.86 3.07 -0.43 0.58 117.51 123.55 2jqz h ILE 85 Ca -0.01 -0.06 -0.14 0.00 1.55 0.00 0.00 64.86 66.20 2jqz h ILE 85 Cb 1.43 0.77 -0.02 0.00 -0.27 0.00 0.00 36.82 38.72 2jqz h ILE 85 CO 0.08 0.03 -0.84 0.45 -1.05 0.00 0.00 178.15 176.82 2jqz h HIS 86 N 0.17 0.00 0.00 0.16 3.86 -1.40 -3.20 115.15 114.74 2jqz h HIS 86 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 2jqz h HIS 86 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.72 2jqz h HIS 86 CO -0.00 0.61 0.03 1.17 0.86 0.00 0.00 177.93 180.60 2jqz n LYS 87 N -3.16 0.00 -0.94 2.45 3.00 0.20 -4.94 118.16 114.77 2jqz n LYS 87 Ca -0.02 0.47 0.13 0.00 -0.00 0.00 0.00 58.31 58.89 2jqz n LYS 87 Cb 0.80 -1.53 -0.03 0.00 0.00 0.00 0.00 35.03 34.27 2jqz n LYS 87 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2jqz n LYS 88 N -1.47 -1.91 0.00 1.64 4.76 -1.00 -4.87 118.16 115.30 2jqz n LYS 88 Ca -0.00 1.28 0.00 0.00 -2.87 0.00 0.00 58.31 56.72 2jqz n LYS 88 Cb 0.03 -2.32 0.00 0.00 -1.84 0.00 0.00 35.03 30.90 2jqz n LYS 88 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2jqz n GLN 89 N -3.18 0.00 0.22 1.97 3.00 -1.26 -2.53 117.38 115.60 2jqz n GLN 89 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 57.00 57.13 2jqz n GLN 89 Cb 0.43 0.00 0.76 0.00 0.00 0.00 0.00 30.24 31.43 2jqz n GLN 89 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 2jqz h GLY 90 N 0.00 0.00 -4.55 1.08 0.00 -1.95 -3.43 103.07 94.23 2jqz h GLY 90 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 2jqz h GLY 90 CO 0.00 0.00 0.86 0.00 0.00 0.00 0.00 176.54 177.40 2jqz s ALA 91 N -3.73 3.76 0.00 3.60 0.00 -1.05 -3.90 121.76 120.44 2jqz s ALA 91 Ca -0.03 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.30 2jqz s ALA 91 Cb 0.08 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2jqz s ALA 91 CO 0.25 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.64 2jqz n GLY 92 N 3.51 0.22 3.85 0.00 0.00 -1.20 -3.47 105.19 108.09 2jqz n GLY 92 Ca 0.13 0.00 -0.34 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 -0.70 3.54 0.07 1.61 5.36 -1.25 -0.86 117.98 125.76 2jqz s PHE 93 Ca 0.00 1.05 0.00 0.00 -0.96 0.00 0.00 56.93 57.03 2jqz s PHE 93 Cb 0.00 -2.38 -0.04 0.00 -0.34 0.00 0.00 43.02 40.26 2jqz s PHE 93 CO 0.00 0.35 -0.04 -0.51 -1.46 0.00 0.00 175.22 173.56 2jqz s LEU 94 N -2.26 2.49 -0.47 6.12 1.43 -0.43 -4.34 118.68 121.22 2jqz s LEU 94 Ca 0.42 -1.01 -0.44 0.00 -1.03 0.00 0.00 54.13 52.07 2jqz s LEU 94 Cb -0.14 0.09 -0.19 0.00 0.03 0.00 0.00 46.19 45.98 2jqz s LEU 94 CO 0.20 -0.55 1.53 0.61 0.23 0.00 0.00 176.35 178.37 2jqz n GLY 95 N 0.04 0.17 3.72 -3.19 0.00 -1.26 -4.12 105.19 100.56 2jqz n GLY 95 Ca -0.13 0.96 -0.35 0.00 0.00 0.00 0.00 46.02 46.50 2jqz n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jqz s VAL 97 N 0.15 4.85 -0.05 0.00 0.11 0.10 -4.67 120.40 120.89 2jqz s VAL 97 Ca 0.08 -0.02 0.05 0.00 -2.93 0.00 0.00 61.98 59.16 2jqz s VAL 97 Cb -0.11 -3.17 -0.00 0.00 -1.53 0.00 0.00 36.38 31.56 2jqz s VAL 97 CO -0.01 0.48 -0.19 -0.60 -3.33 0.00 0.00 175.10 171.45 2jqz s ARG 98 N 0.22 2.05 -0.05 1.54 3.52 -1.26 -0.93 118.95 124.03 2jqz s ARG 98 Ca 0.05 -0.68 0.01 0.00 -0.13 0.00 0.00 55.73 54.97 2jqz s ARG 98 Cb -0.12 -1.74 0.02 0.00 -1.56 0.00 0.00 34.95 31.55 2jqz s ARG 98 CO 0.00 0.26 -0.06 -0.51 -0.81 0.00 0.00 175.30 174.18 2jqz s LEU 99 N 0.06 1.39 0.00 -0.88 1.43 -0.98 -5.03 118.68 114.67 2jqz s LEU 99 Ca -0.06 -0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 52.86 2jqz s LEU 99 Cb -0.13 -0.51 0.09 0.00 0.03 0.00 0.00 46.19 45.67 2jqz s LEU 99 CO 0.03 -0.04 0.58 0.18 0.23 0.00 0.00 176.35 177.33 2jqz n LEU 100 N 4.00 0.00 -0.09 1.79 4.77 -1.26 -2.22 117.00 123.99 2jqz n LEU 100 Ca -0.25 -1.01 -0.10 0.00 -0.03 0.00 0.00 56.01 54.63 2jqz n LEU 100 Cb 0.51 -0.40 -0.03 0.00 -2.33 0.00 0.00 43.42 41.17 2jqz n LEU 100 CO 0.24 -0.83 0.91 0.77 -1.33 0.00 0.00 177.39 177.14 2jqz h SER 101 N -0.50 0.37 -0.42 -1.43 4.64 -1.94 0.34 113.55 114.61 2jqz h SER 101 Ca -0.19 -0.13 -0.04 0.00 -0.47 0.00 0.00 61.79 60.95 2jqz h SER 101 Cb 0.64 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 2jqz h SER 101 CO 0.18 0.40 0.10 0.78 -0.87 0.00 0.00 176.83 177.43 2jqz h ASN 102 N 0.32 0.64 -0.73 4.97 4.21 -1.95 -2.36 115.58 120.68 2jqz h ASN 102 Ca 0.10 -0.23 -0.07 0.00 1.21 0.00 0.00 56.30 57.31 2jqz h ASN 102 Cb 0.13 -0.17 -0.03 0.00 -1.12 0.00 0.00 38.32 37.13 2jqz h ASN 102 CO -0.01 0.71 0.20 0.00 -1.29 0.00 0.00 177.43 177.03 2jqz h ALA 103 N 0.96 0.96 -0.74 -0.83 0.00 -1.89 -2.74 119.26 114.98 2jqz h ALA 103 Ca 0.13 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.82 2jqz h ALA 103 Cb 0.31 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2jqz h ALA 103 CO 0.00 0.67 0.49 0.82 0.00 0.00 0.00 179.25 181.23 2jqz h ILE 104 N 1.10 1.15 0.34 0.00 5.03 -0.02 0.24 117.51 125.35 2jqz h ILE 104 Ca 0.23 -0.33 -0.02 0.00 -0.12 0.00 0.00 64.86 64.63 2jqz h ILE 104 Cb 0.35 0.12 0.00 0.00 -3.03 0.00 0.00 36.82 34.26 2jqz h ILE 104 CO -0.00 0.17 -0.16 0.78 -0.68 0.00 0.00 178.15 178.26 2jqz h ASN 105 N 0.95 -0.39 -0.70 1.72 4.21 -1.16 0.29 115.58 120.51 2jqz h ASN 105 Ca 0.28 -0.14 0.02 0.00 1.21 0.00 0.00 56.30 57.67 2jqz h ASN 105 Cb -0.04 0.10 -0.04 0.00 -1.12 0.00 0.00 38.32 37.22 2jqz h ASN 105 CO -0.07 0.06 0.45 0.03 -1.29 0.00 0.00 177.43 176.61 2jqz h ARG 106 N -0.98 0.86 -0.24 0.81 3.08 -1.38 -2.57 114.38 113.96 2jqz h ARG 106 Ca -0.05 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.79 2jqz h ARG 106 Cb 0.51 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2jqz h ARG 106 CO 0.08 0.57 -0.46 -0.07 -1.07 0.00 0.00 179.97 179.02 2jqz h LEU 107 N 0.89 0.82 -1.96 3.04 3.38 -0.61 -2.46 115.31 118.42 2jqz h LEU 107 Ca 0.27 -0.54 0.20 0.00 0.09 0.00 0.00 57.88 57.90 2jqz h LEU 107 Cb -0.02 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2jqz h LEU 107 CO -0.09 1.21 0.57 0.07 0.09 0.00 0.00 178.44 180.29 2jqz h LYS 108 N 0.47 0.00 0.00 1.13 5.09 0.01 0.20 116.57 123.47 2jqz h LYS 108 Ca 0.01 0.00 -0.19 0.00 0.09 0.00 0.00 60.65 60.56 2jqz h LYS 108 Cb 1.07 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 33.36 2jqz h LYS 108 CO 0.10 0.00 -1.88 -0.40 -2.09 0.00 0.00 179.45 175.18 2jqz n ASP 109 N -4.03 0.35 0.15 7.07 5.68 -1.15 -2.79 116.55 121.83 2jqz n ASP 109 Ca 0.14 0.15 -0.10 0.00 -0.50 0.00 0.00 54.79 54.49 2jqz n ASP 109 Cb 0.83 0.92 -0.05 0.00 -1.14 0.00 0.00 41.12 41.68 2jqz n ASP 109 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 2jqz h THR 110 N 0.00 0.00 0.00 2.12 1.35 -0.11 -3.48 112.91 112.79 2jqz h THR 110 Ca -0.25 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 2jqz h THR 110 Cb 1.64 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 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 -1.29 1.01 3.44 5.82 0.00 -0.93 -4.96 105.19 108.27 2jqz n GLY 111 Ca -0.06 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.22 -0.03 1.61 2.02 -1.26 -4.22 117.35 113.24 2jqz s TYR 112 Ca 0.00 0.41 -0.01 0.00 -0.37 0.00 0.00 57.07 57.10 2jqz s TYR 112 Cb 0.00 0.13 0.03 0.00 -0.40 0.00 0.00 41.96 41.72 2jqz s TYR 112 CO 0.00 -0.11 0.05 -0.65 -1.57 0.00 0.00 175.55 173.27 2jqz s GLN 113 N 1.66 -0.05 -0.53 -0.62 -1.52 0.25 -4.86 119.66 114.00 2jqz s GLN 113 Ca -0.04 0.30 -0.14 0.00 -1.95 0.00 0.00 55.36 53.53 2jqz s GLN 113 Cb -0.02 -0.36 0.13 0.00 -0.22 0.00 0.00 33.01 32.54 2jqz s GLN 113 CO -0.14 -0.24 0.46 1.03 -0.25 0.00 0.00 175.29 176.14 2jqz s ARG 114 N 1.60 2.83 -0.16 2.91 0.52 -1.26 -1.07 118.95 124.32 2jqz s ARG 114 Ca -0.03 -1.76 -0.06 0.00 -0.52 0.00 0.00 55.73 53.37 2jqz s ARG 114 Cb -0.12 -4.17 -0.04 0.00 0.52 0.00 0.00 34.95 31.14 2jqz s ARG 114 CO -0.03 -1.28 0.03 -0.51 0.02 0.00 0.00 175.30 173.53 2jqz s LEU 115 N 1.46 3.66 -0.00 2.53 1.02 -0.22 -4.92 118.68 122.21 2jqz s LEU 115 Ca 0.04 0.06 -0.30 0.00 0.02 0.00 0.00 54.13 53.95 2jqz s LEU 115 Cb -0.28 -1.90 -0.05 0.00 0.02 0.00 0.00 46.19 43.98 2jqz s LEU 115 CO 0.01 0.22 1.28 -1.81 0.02 0.00 0.00 176.35 176.07 2jqz s ASP 116 N 0.08 6.97 -0.09 2.29 1.11 -1.26 -0.39 116.67 125.38 2jqz s ASP 116 Ca 0.04 1.99 -0.30 0.00 0.18 0.00 0.00 52.55 54.46 2jqz s ASP 116 Cb -0.13 -2.56 -0.02 0.00 1.07 0.00 0.00 42.92 41.28 2jqz s ASP 116 CO 0.01 -0.61 1.03 -0.76 1.18 0.00 0.00 175.17 176.02 2jqz s LEU 117 N 1.97 4.26 0.31 1.23 1.43 0.21 -4.83 118.68 123.26 2jqz s LEU 117 Ca 0.60 1.57 -0.19 0.00 -1.03 0.00 0.00 54.13 55.08 2jqz s LEU 117 Cb -0.29 -3.56 0.04 0.00 0.03 0.00 0.00 46.19 42.42 2jqz s LEU 117 CO 0.25 -0.45 0.78 0.00 0.23 0.00 0.00 176.35 177.17 2jqz n LYS 119 N -0.50 -1.18 -0.15 0.00 -0.00 -1.26 -3.58 118.16 111.49 2jqz n LYS 119 Ca -0.06 -0.31 0.28 0.00 -0.00 0.00 0.00 58.31 58.22 2jqz n LYS 119 Cb 0.59 -1.90 0.72 0.00 -0.00 0.00 0.00 35.03 34.44 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 -1.99 0.00 -7.03 -5.58 -0.00 -1.95 -3.45 115.31 95.31 2jqz h LEU 120 Ca -0.50 0.00 0.35 0.00 -0.00 0.00 0.00 57.88 57.72 2jqz h LEU 120 Cb 1.32 0.00 -0.17 0.00 -0.00 0.00 0.00 40.66 41.81 2jqz h LEU 120 CO 0.39 0.00 0.95 -0.83 -0.00 0.00 0.00 178.44 178.95 2jqz s GLY 121 N -3.90 -0.34 1.27 0.83 0.00 -1.26 -5.14 107.32 98.77 2jqz s GLY 121 Ca -0.05 1.40 -0.18 0.00 0.00 0.00 0.00 44.72 45.89 2jqz s GLY 121 CO 0.70 0.40 1.00 -4.14 0.00 0.00 0.00 173.10 171.05 2jqz s PRO 122 N -2.12 -1.77 0.00 2.90 0.02 -1.26 -3.42 135.00 129.35 2jqz s PRO 122 Ca 0.13 0.42 0.00 0.00 0.02 0.00 0.00 61.00 61.57 2jqz s PRO 122 Cb 0.03 -1.49 0.00 0.00 0.02 0.00 0.00 34.50 33.06 2jqz s PRO 122 CO -0.04 -4.18 0.00 0.09 -0.33 0.00 0.00 177.00 172.53 2jqz n ASN 123 N -5.18 0.00 -0.06 2.53 4.13 -1.26 -4.60 115.26 110.82 2jqz n ASN 123 Ca 0.08 0.00 -0.03 0.00 1.68 0.00 0.00 54.58 56.31 2jqz n ASN 123 Cb 0.57 -0.03 -0.02 0.00 -1.54 0.00 0.00 39.78 38.77 2jqz n ASN 123 CO 0.00 0.00 0.00 -0.78 0.28 0.00 0.00 177.26 176.76 2jqz h ASP 124 N 0.00 0.00 -6.08 6.41 3.58 -2.01 -3.49 116.42 114.82 2jqz h ASP 124 Ca 0.00 -0.12 -0.25 0.00 0.42 0.00 0.00 57.03 57.08 2jqz h ASP 124 Cb 0.00 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.06 2jqz h ASP 124 CO 0.00 0.62 -0.94 0.59 -2.88 0.00 0.00 179.24 176.64 2jqz n ASN 125 N -4.73 -6.41 -3.74 2.28 4.13 -1.25 -4.89 115.26 100.65 2jqz n ASN 125 Ca -0.03 0.07 -0.40 0.00 1.68 0.00 0.00 54.58 55.91 2jqz n ASN 125 Cb 0.11 -3.06 0.00 0.00 -1.54 0.00 0.00 39.78 35.29 2jqz n ASN 125 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2jqz n ASP 126 N -0.32 6.35 -3.36 6.41 -0.08 -1.26 -4.83 116.55 119.46 2jqz n ASP 126 Ca -0.02 -3.53 -0.19 0.00 -1.51 0.00 0.00 54.79 49.54 2jqz n ASP 126 Cb 0.60 -1.12 0.01 0.00 2.34 0.00 0.00 41.12 42.95 2jqz n ASP 126 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2jqz n THR 127 N 0.68 -6.75 -4.25 5.18 -2.24 -1.26 -4.95 114.28 100.69 2jqz n THR 127 Ca 0.34 0.13 -0.14 0.00 -2.27 0.00 0.00 64.05 62.11 2jqz n THR 127 Cb 0.32 -4.96 -0.10 0.00 -2.10 0.00 0.00 70.33 63.49 2jqz n THR 127 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2jqz s VAL 128 N -2.56 0.93 0.00 2.28 0.11 -1.26 -4.96 120.40 114.94 2jqz s VAL 128 Ca 0.14 -2.01 0.00 0.00 -2.93 0.00 0.00 61.98 57.18 2jqz s VAL 128 Cb -0.02 -1.98 0.00 0.00 -1.53 0.00 0.00 36.38 32.84 2jqz s VAL 128 CO 0.83 -0.62 0.00 -1.14 -3.33 0.00 0.00 175.10 170.84 2jqz n ARG 129 N -0.22 0.00 0.00 1.54 0.63 -1.26 -4.95 116.66 112.39 2jqz n ARG 129 Ca -0.09 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.84 2jqz n ARG 129 Cb 0.62 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.53 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 -0.75 3.37 5.14 0.00 -0.31 -2.45 105.19 110.19 2jqz n GLY 130 Ca 0.00 -1.06 -0.13 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.00 1.56 -0.25 1.61 1.11 0.32 0.65 119.66 122.66 2jqz s GLN 131 Ca 0.00 -1.66 -0.25 0.00 0.01 0.00 0.00 55.36 53.46 2jqz s GLN 131 Cb 0.00 0.37 0.07 0.00 -1.01 0.00 0.00 33.01 32.44 2jqz s GLN 131 CO 0.00 -0.60 0.72 -1.50 0.01 0.00 0.00 175.29 173.92 2jqz s ILE 132 N -3.71 0.00 -0.25 1.08 2.07 0.47 -0.78 121.20 120.08 2jqz s ILE 132 Ca 0.34 0.00 -0.03 0.00 -1.41 0.00 0.00 60.65 59.54 2jqz s ILE 132 Cb 0.03 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.63 2jqz s ILE 132 CO 0.16 0.00 -0.03 -0.69 -1.91 0.00 0.00 174.94 172.47 2jqz s VAL 133 N 0.26 3.21 0.41 4.00 1.01 0.50 -1.06 120.40 128.73 2jqz s VAL 133 Ca -0.01 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.17 2jqz s VAL 133 Cb -0.05 -2.59 -0.00 0.00 0.00 0.00 0.00 36.38 33.75 2jqz s VAL 133 CO 0.02 0.24 0.02 1.33 0.00 0.00 0.00 175.10 176.71 2jqz n VAL 134 N 4.74 0.00 -3.70 2.92 0.24 -0.23 -1.55 118.33 120.75 2jqz n VAL 134 Ca -0.17 -2.00 -0.13 0.00 -2.04 0.00 0.00 64.34 60.01 2jqz n VAL 134 Cb 0.48 0.44 -0.13 0.00 -1.47 0.00 0.00 33.84 33.16 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 -3.30 -0.05 -0.34 -1.34 1.04 -0.01 -0.58 113.70 109.12 2jqz s SER 135 Ca 0.02 0.56 -0.11 0.00 0.48 0.00 0.00 55.95 56.91 2jqz s SER 135 Cb 0.00 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.65 2jqz s SER 135 CO 0.02 -0.19 0.18 -0.76 0.98 0.00 0.00 173.24 173.47 2jqz s LEU 136 N 1.68 4.43 -0.06 2.42 2.01 -1.26 -1.02 118.68 126.88 2jqz s LEU 136 Ca -0.06 -0.73 -0.02 0.00 0.01 0.00 0.00 54.13 53.33 2jqz s LEU 136 Cb -0.11 -2.02 0.04 0.00 0.01 0.00 0.00 46.19 44.11 2jqz s LEU 136 CO -0.09 -0.29 0.13 -1.58 1.01 0.00 0.00 176.35 175.53 2jqz s GLN 137 N 1.60 0.06 -0.05 1.70 0.74 -1.06 -2.19 119.66 120.46 2jqz s GLN 137 Ca 0.04 0.37 -0.32 0.00 0.05 0.00 0.00 55.36 55.49 2jqz s GLN 137 Cb -0.18 -0.21 -0.10 0.00 1.10 0.00 0.00 33.01 33.62 2jqz s GLN 137 CO 0.07 -0.19 1.95 -1.13 -0.55 0.00 0.00 175.29 175.44 2jqz n SER 138 N 4.36 3.74 -4.88 6.67 3.41 -1.12 -2.40 113.62 123.40 2jqz n SER 138 Ca -0.24 0.90 -0.31 0.00 -0.26 0.00 0.00 58.87 58.96 2jqz n SER 138 Cb 0.51 -1.44 -0.05 0.00 -0.26 0.00 0.00 64.21 62.97 2jqz n SER 138 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2jqz s ARG 139 N 4.41 3.73 0.00 4.33 6.06 -0.10 -4.86 118.95 132.51 2jqz s ARG 139 Ca 0.92 0.15 0.00 0.00 -2.50 0.00 0.00 55.73 54.30 2jqz s ARG 139 Cb -0.57 -2.69 0.00 0.00 0.06 0.00 0.00 34.95 31.76 2jqz s ARG 139 CO 0.47 0.33 0.00 -3.47 -2.50 0.00 0.00 175.30 170.13