#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tj6 s SER 10 N 0.00 6.76 0.25 0.00 0.15 -1.26 -2.58 113.70 117.02 1tj6 s SER 10 Ca 0.00 0.91 0.17 0.00 0.70 0.00 0.00 55.95 57.73 1tj6 s SER 10 Cb 0.00 -2.32 0.05 0.00 -1.71 0.00 0.00 66.02 62.05 1tj6 s SER 10 CO 0.00 -0.02 1.32 1.88 1.20 0.00 0.00 173.24 177.61 1tj6 h TYR 11 N 6.70 0.00 -1.75 3.44 0.05 -0.90 -3.47 116.97 121.04 1tj6 h TYR 11 Ca -0.41 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.39 1tj6 h TYR 11 Cb 1.18 0.00 -0.23 0.00 1.01 0.00 0.00 36.73 38.70 1tj6 h TYR 11 CO 0.63 0.43 0.36 0.00 -1.05 0.00 0.00 178.16 178.53 1tj6 s ALA 12 N -3.01 -1.88 -0.03 3.88 0.00 -1.21 -4.40 121.76 115.11 1tj6 s ALA 12 Ca 0.03 1.72 -0.01 0.00 0.00 0.00 0.00 51.96 53.69 1tj6 s ALA 12 Cb 0.08 -0.90 0.03 0.00 0.00 0.00 0.00 23.12 22.33 1tj6 s ALA 12 CO 0.75 -0.30 0.06 0.50 0.00 0.00 0.00 175.76 176.77 1tj6 s ARG 13 N -0.39 -0.02 0.21 0.00 3.52 -1.26 -1.51 118.95 119.51 1tj6 s ARG 13 Ca -0.02 0.26 -0.00 0.00 -0.13 0.00 0.00 55.73 55.84 1tj6 s ARG 13 Cb -0.03 -0.27 -0.04 0.00 -1.56 0.00 0.00 34.95 33.05 1tj6 s ARG 13 CO 0.01 -0.19 0.11 0.14 -0.81 0.00 0.00 175.30 174.55 1tj6 s VAL 14 N 1.25 0.24 -0.25 7.11 -7.23 -0.34 -4.99 120.40 116.19 1tj6 s VAL 14 Ca -0.07 -1.99 -0.08 0.00 -1.81 0.00 0.00 61.98 58.02 1tj6 s VAL 14 Cb -0.13 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.28 1tj6 s VAL 14 CO -0.04 -0.06 0.11 -0.13 -0.31 0.00 0.00 175.10 174.67 1tj6 s ARG 15 N -4.10 3.77 0.24 4.82 0.52 -1.26 -0.76 118.95 122.20 1tj6 s ARG 15 Ca 0.37 -0.42 -0.06 0.00 -0.52 0.00 0.00 55.73 55.10 1tj6 s ARG 15 Cb 0.07 -3.42 -0.02 0.00 0.52 0.00 0.00 34.95 32.11 1tj6 s ARG 15 CO 0.11 -0.15 0.33 0.00 0.02 0.00 0.00 175.30 175.62 1tj6 s ALA 16 N 1.55 0.56 -0.24 2.13 0.00 -0.44 -4.34 121.76 120.98 1tj6 s ALA 16 Ca 0.06 -1.35 -0.09 0.00 0.00 0.00 0.00 51.96 50.58 1tj6 s ALA 16 Cb -0.15 1.23 -0.04 0.00 0.00 0.00 0.00 23.12 24.16 1tj6 s ALA 16 CO 0.06 -0.73 0.13 0.08 0.00 0.00 0.00 175.76 175.29 1tj6 s VAL 17 N -3.92 4.94 0.15 0.00 1.01 -0.17 -0.39 120.40 122.02 1tj6 s VAL 17 Ca 0.31 0.04 -0.30 0.00 0.00 0.00 0.00 61.98 62.03 1tj6 s VAL 17 Cb 0.03 -3.31 -0.07 0.00 0.00 0.00 0.00 36.38 33.02 1tj6 s VAL 17 CO 0.13 0.33 1.14 -0.69 0.00 0.00 0.00 175.10 176.01 1tj6 s VAL 18 N 1.32 3.85 0.17 2.92 1.01 -1.26 -1.01 120.40 127.40 1tj6 s VAL 18 Ca 0.06 1.51 0.09 0.00 0.00 0.00 0.00 61.98 63.64 1tj6 s VAL 18 Cb -0.15 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 1tj6 s VAL 18 CO 0.06 0.22 -0.13 -0.04 0.00 0.00 0.00 175.10 175.21 1tj6 s MET 19 N 0.02 1.95 0.03 2.72 -1.94 0.47 -0.70 119.30 121.85 1tj6 s MET 19 Ca 0.52 -1.28 -0.02 0.00 -1.71 0.00 0.00 55.69 53.20 1tj6 s MET 19 Cb -0.30 -2.12 -0.02 0.00 2.01 0.00 0.00 34.83 34.40 1tj6 s MET 19 CO 0.34 0.44 0.02 -0.08 -0.01 0.00 0.00 175.02 175.72 1tj6 s THR 20 N -1.60 0.14 -0.16 2.05 -1.32 -0.30 -2.17 115.64 112.29 1tj6 s THR 20 Ca 0.23 -1.13 -0.07 0.00 -1.21 0.00 0.00 61.69 59.52 1tj6 s THR 20 Cb -0.09 -0.70 -0.04 0.00 -1.51 0.00 0.00 72.50 70.16 1tj6 s THR 20 CO 0.14 -0.62 0.06 -0.60 -2.21 0.00 0.00 174.62 171.39 1tj6 s ARG 21 N -2.27 3.75 -0.24 7.08 3.52 -1.26 -0.41 118.95 129.13 1tj6 s ARG 21 Ca -0.08 -0.32 -0.29 0.00 -0.13 0.00 0.00 55.73 54.91 1tj6 s ARG 21 Cb -0.04 -3.15 0.01 0.00 -1.56 0.00 0.00 34.95 30.21 1tj6 s ARG 21 CO -0.04 0.41 1.09 0.34 -0.81 0.00 0.00 175.30 176.29 1tj6 s ASP 22 N -0.03 7.04 0.27 -2.12 2.15 0.63 -4.94 116.67 119.67 1tj6 s ASP 22 Ca 0.06 1.37 0.10 0.00 0.43 0.00 0.00 52.55 54.51 1tj6 s ASP 22 Cb -0.12 -2.54 0.35 0.00 -0.30 0.00 0.00 42.92 40.31 1tj6 s ASP 22 CO 0.01 -0.73 1.61 -0.78 -0.17 0.00 0.00 175.17 175.11 1tj6 h ASP 23 N 7.72 0.03 0.04 -0.34 3.58 -1.94 0.99 116.42 126.50 1tj6 h ASP 23 Ca -0.21 -0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.23 1tj6 h ASP 23 Cb 1.07 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 42.11 1tj6 h ASP 23 CO 0.99 0.64 -0.02 0.77 -2.88 0.00 0.00 179.24 178.73 1tj6 h SER 24 N 0.02 -0.05 0.63 2.28 4.64 -1.96 -3.35 113.55 115.77 1tj6 h SER 24 Ca -0.01 -0.49 -0.25 0.00 -0.47 0.00 0.00 61.79 60.58 1tj6 h SER 24 Cb 1.09 0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 63.15 1tj6 h SER 24 CO 0.08 0.48 -1.52 0.77 -0.87 0.00 0.00 176.83 175.77 1tj6 h SER 25 N -0.59 0.00 0.00 4.97 4.64 -1.99 -3.47 113.55 117.10 1tj6 h SER 25 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1tj6 h SER 25 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1tj6 h SER 25 CO 0.01 0.89 0.00 0.61 -0.87 0.00 0.00 176.83 177.47 1tj6 n GLY 26 N 1.48 1.69 3.80 -0.77 0.00 0.34 -5.04 105.19 106.69 1tj6 n GLY 26 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1tj6 n GLY 26 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tj6 s GLY 27 N -1.90 2.12 0.11 -0.02 0.00 -1.25 -4.69 107.32 101.70 1tj6 s GLY 27 Ca 0.00 0.42 -0.05 0.00 0.00 0.00 0.00 44.72 45.10 1tj6 s GLY 27 CO 0.00 0.75 0.34 -0.98 0.00 0.00 0.00 173.10 173.22 1tj6 s TRP 28 N -2.44 3.50 0.21 1.90 0.52 -1.26 -0.27 118.94 121.10 1tj6 s TRP 28 Ca 0.64 0.53 0.08 0.00 0.02 0.00 0.00 56.10 57.37 1tj6 s TRP 28 Cb -0.17 -1.98 -0.05 0.00 -1.15 0.00 0.00 33.47 30.12 1tj6 s TRP 28 CO 0.38 0.48 -0.16 -0.51 0.02 0.00 0.00 176.95 177.17 1tj6 s LEU 29 N -2.51 2.55 -0.26 2.99 1.43 0.45 -4.90 118.68 118.43 1tj6 s LEU 29 Ca 0.38 -1.00 -0.28 0.00 -1.03 0.00 0.00 54.13 52.20 1tj6 s LEU 29 Cb -0.12 -0.74 0.01 0.00 0.03 0.00 0.00 46.19 45.36 1tj6 s LEU 29 CO 0.24 -0.13 1.03 -1.10 0.23 0.00 0.00 176.35 176.62 1tj6 s GLN 30 N -3.51 4.19 0.20 1.70 -0.21 -1.26 -1.15 119.66 119.62 1tj6 s GLN 30 Ca 0.22 1.22 -0.32 0.00 0.02 0.00 0.00 55.36 56.50 1tj6 s GLN 30 Cb -0.02 -3.67 -0.12 0.00 1.00 0.00 0.00 33.01 30.20 1tj6 s GLN 30 CO 0.08 -0.70 1.68 -0.11 -2.12 0.00 0.00 175.29 174.12 1tj6 n LEU 31 N 6.44 3.78 -1.98 2.90 7.94 0.12 -1.20 117.00 135.01 1tj6 n LEU 31 Ca 0.11 1.07 -0.20 0.00 -1.11 0.00 0.00 56.01 55.88 1tj6 n LEU 31 Cb 0.46 -1.54 -0.04 0.00 0.53 0.00 0.00 43.42 42.84 1tj6 n LEU 31 CO 0.54 0.06 -0.23 0.61 -1.11 0.00 0.00 177.39 177.26 1tj6 n GLY 32 N 3.74 0.49 2.11 -3.96 0.00 -1.26 -1.89 105.19 104.42 1tj6 n GLY 32 Ca 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 1tj6 n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tj6 n GLY 33 N -0.82 0.48 7.00 -0.02 0.00 -0.34 -4.91 105.19 106.58 1tj6 n GLY 33 Ca -0.22 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1tj6 n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tj6 n GLY 34 N -2.54 0.02 0.00 -0.02 0.00 -0.79 -4.98 105.19 96.88 1tj6 n GLY 34 Ca -0.01 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.01 1tj6 n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tj6 n GLY 35 N 0.00 -0.64 3.77 -0.02 0.00 -1.26 -4.98 105.19 102.07 1tj6 n GLY 35 Ca 0.00 -1.48 -0.38 0.00 0.00 0.00 0.00 46.02 44.16 1tj6 n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tj6 s LEU 36 N -1.67 4.26 0.11 0.99 1.43 -1.26 -4.62 118.68 117.91 1tj6 s LEU 36 Ca 0.00 2.25 0.10 0.00 -1.03 0.00 0.00 54.13 55.44 1tj6 s LEU 36 Cb 0.00 -3.98 -0.04 0.00 0.03 0.00 0.00 46.19 42.20 1tj6 s LEU 36 CO 0.00 -0.51 -0.23 -0.44 0.23 0.00 0.00 176.35 175.40 1tj6 s SER 37 N -1.20 3.57 -0.33 2.29 0.01 0.48 -1.52 113.70 117.00 1tj6 s SER 37 Ca 0.55 -0.64 -0.28 0.00 1.31 0.00 0.00 55.95 56.89 1tj6 s SER 37 Cb -0.29 -0.38 0.02 0.00 0.21 0.00 0.00 66.02 65.58 1tj6 s SER 37 CO 0.36 0.19 1.03 -0.55 0.41 0.00 0.00 173.24 174.68 1tj6 s SER 38 N -1.97 6.86 -0.15 2.44 0.15 0.18 -1.33 113.70 119.87 1tj6 s SER 38 Ca 0.15 0.92 0.02 0.00 0.70 0.00 0.00 55.95 57.75 1tj6 s SER 38 Cb -0.10 -2.52 0.01 0.00 -1.71 0.00 0.00 66.02 61.70 1tj6 s SER 38 CO 0.07 -0.86 -0.21 -0.69 1.20 0.00 0.00 173.24 172.75 1tj6 s VAL 39 N 3.59 2.09 0.12 4.45 1.01 0.07 -1.32 120.40 130.41 1tj6 s VAL 39 Ca 0.43 -0.96 0.11 0.00 0.00 0.00 0.00 61.98 61.56 1tj6 s VAL 39 Cb -0.12 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 1tj6 s VAL 39 CO 0.16 0.54 -0.27 0.42 0.00 0.00 0.00 175.10 175.96 1tj6 s THR 40 N 0.98 2.24 -0.23 3.92 -4.23 0.06 -1.20 115.64 117.19 1tj6 s THR 40 Ca -0.03 -1.73 -0.04 0.00 -1.18 0.00 0.00 61.69 58.71 1tj6 s THR 40 Cb -0.15 -1.98 -0.00 0.00 1.34 0.00 0.00 72.50 71.71 1tj6 s THR 40 CO -0.06 0.10 -0.04 0.54 -0.54 0.00 0.00 174.62 174.62 1tj6 s VAL 41 N -1.05 3.30 0.14 2.29 0.11 -0.57 -1.66 120.40 122.97 1tj6 s VAL 41 Ca 0.14 -0.58 -0.03 0.00 -2.93 0.00 0.00 61.98 58.58 1tj6 s VAL 41 Cb -0.10 -2.53 -0.03 0.00 -1.53 0.00 0.00 36.38 32.19 1tj6 s VAL 41 CO 0.06 0.39 0.12 -0.94 -3.33 0.00 0.00 175.10 171.40 1tj6 s SER 42 N 1.46 0.23 0.78 3.54 1.04 0.03 -0.17 113.70 120.61 1tj6 s SER 42 Ca 0.05 -1.12 -0.14 0.00 0.48 0.00 0.00 55.95 55.22 1tj6 s SER 42 Cb -0.15 0.34 0.06 0.00 0.10 0.00 0.00 66.02 66.38 1tj6 s SER 42 CO -0.04 -0.78 1.19 0.29 0.98 0.00 0.00 173.24 174.89 1tj6 n LYS 43 N -0.13 0.33 -1.99 4.02 4.01 -1.07 -0.70 118.16 122.63 1tj6 n LYS 43 Ca -0.06 0.19 -0.37 0.00 -0.51 0.00 0.00 58.31 57.56 1tj6 n LYS 43 Cb 0.64 -2.43 0.03 0.00 -0.51 0.00 0.00 35.03 32.75 1tj6 n LYS 43 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1tj6 s THR 44 N -2.00 2.55 -0.78 -0.18 -1.32 -1.25 -4.49 115.64 108.17 1tj6 s THR 44 Ca 0.75 0.37 0.27 0.00 -1.21 0.00 0.00 61.69 61.86 1tj6 s THR 44 Cb -0.31 -3.17 0.26 0.00 -1.51 0.00 0.00 72.50 67.78 1tj6 s THR 44 CO 0.49 -0.05 1.77 0.18 -2.21 0.00 0.00 174.62 174.81 1tj6 n LEU 45 N -1.29 0.66 -3.41 9.08 4.32 -1.26 -4.45 117.00 120.65 1tj6 n LEU 45 Ca 0.12 0.54 -0.26 0.00 -0.02 0.00 0.00 56.01 56.38 1tj6 n LEU 45 Cb 0.48 -0.34 -0.08 0.00 -1.62 0.00 0.00 43.42 41.86 1tj6 n LEU 45 CO 0.47 -0.14 -0.10 0.00 -1.22 0.00 0.00 177.39 176.40 1tj6 n GLN 46 N -2.11 1.61 0.05 3.23 6.02 -1.26 -4.94 117.38 119.98 1tj6 n GLN 46 Ca 0.06 -4.03 0.12 0.00 -0.01 0.00 0.00 57.00 53.14 1tj6 n GLN 46 Cb 0.41 -1.87 0.47 0.00 1.02 0.00 0.00 30.24 30.27 1tj6 n GLN 46 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1tj6 n PRO 47 N 1.40 0.11 0.00 -1.09 -0.04 -1.26 -5.00 135.00 129.11 1tj6 n PRO 47 Ca 0.26 0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.91 1tj6 n PRO 47 Cb 0.45 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1tj6 n PRO 47 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tj6 n GLY 48 N 0.83 2.34 1.10 0.55 0.00 -1.26 -3.08 105.19 105.67 1tj6 n GLY 48 Ca 0.05 -0.50 0.10 0.00 0.00 0.00 0.00 46.02 45.67 1tj6 n GLY 48 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1tj6 n ASP 49 N 2.00 3.58 -4.96 1.61 5.75 -1.26 -4.96 116.55 118.31 1tj6 n ASP 49 Ca 0.00 -1.99 -0.22 0.00 -0.01 0.00 0.00 54.79 52.56 1tj6 n ASP 49 Cb 0.00 -0.39 -0.00 0.00 -1.03 0.00 0.00 41.12 39.70 1tj6 n ASP 49 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1tj6 s SER 50 N -1.02 6.05 0.12 -1.12 0.15 -1.18 -5.01 113.70 111.69 1tj6 s SER 50 Ca 0.40 0.22 -0.22 0.00 0.70 0.00 0.00 55.95 57.04 1tj6 s SER 50 Cb 0.21 -1.65 -0.06 0.00 -1.71 0.00 0.00 66.02 62.81 1tj6 s SER 50 CO 0.27 -0.46 1.69 1.23 1.20 0.00 0.00 173.24 177.17 1tj6 h GLY 51 N 0.68 -0.02 0.00 9.45 0.00 -1.85 -3.46 103.07 107.87 1tj6 h GLY 51 Ca -0.48 0.11 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1tj6 h GLY 51 CO 0.58 -0.10 0.00 0.61 0.00 0.00 0.00 176.54 177.63 1tj6 n GLY 52 N -1.23 1.32 0.48 4.60 0.00 -1.26 -4.96 105.19 104.14 1tj6 n GLY 52 Ca -0.04 0.47 0.11 0.00 0.00 0.00 0.00 46.02 46.56 1tj6 n GLY 52 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tj6 n THR 53 N 0.00 0.00 -4.19 2.61 -2.24 -1.26 -0.89 114.28 108.31 1tj6 n THR 53 Ca 0.00 -0.27 -0.14 0.00 -2.27 0.00 0.00 64.05 61.38 1tj6 n THR 53 Cb 0.00 1.25 -0.11 0.00 -2.10 0.00 0.00 70.33 69.38 1tj6 n THR 53 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1tj6 s GLU 54 N -2.43 0.90 0.35 -0.78 -1.05 -1.26 -4.45 118.70 109.97 1tj6 s GLU 54 Ca 0.18 -1.25 0.04 0.00 -0.15 0.00 0.00 54.97 53.79 1tj6 s GLU 54 Cb 0.18 -0.51 -0.03 0.00 -0.44 0.00 0.00 34.13 33.32 1tj6 s GLU 54 CO 0.56 0.07 0.15 -0.59 0.95 0.00 0.00 175.26 176.40 1tj6 s PHE 55 N -2.80 1.71 -0.06 4.83 -0.71 0.18 -3.84 117.98 117.29 1tj6 s PHE 55 Ca 0.09 -1.34 0.03 0.00 -1.04 0.00 0.00 56.93 54.67 1tj6 s PHE 55 Cb -0.01 -0.98 0.00 0.00 -1.21 0.00 0.00 43.02 40.83 1tj6 s PHE 55 CO -0.00 -0.44 -0.15 -1.17 -1.34 0.00 0.00 175.22 172.12 1tj6 s LEU 56 N -3.47 1.79 -0.21 -1.99 2.96 0.12 -1.03 118.68 116.86 1tj6 s LEU 56 Ca 0.32 -0.33 -0.05 0.00 -0.22 0.00 0.00 54.13 53.85 1tj6 s LEU 56 Cb 0.04 -0.89 -0.02 0.00 0.50 0.00 0.00 46.19 45.82 1tj6 s LEU 56 CO 0.17 0.09 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.60 1tj6 s VAL 57 N 0.35 3.87 -0.05 1.68 1.01 -0.29 -0.79 120.40 126.18 1tj6 s VAL 57 Ca -0.10 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.55 1tj6 s VAL 57 Cb -0.14 -2.76 0.02 0.00 0.00 0.00 0.00 36.38 33.51 1tj6 s VAL 57 CO 0.03 0.42 -0.04 -2.28 0.00 0.00 0.00 175.10 173.23 1tj6 s HIS 58 N 1.17 0.80 -0.11 5.22 2.46 -0.66 -0.57 115.29 123.60 1tj6 s HIS 58 Ca 0.03 -0.24 0.00 0.00 0.47 0.00 0.00 55.06 55.32 1tj6 s HIS 58 Cb -0.14 -0.73 0.02 0.00 -0.13 0.00 0.00 32.58 31.60 1tj6 s HIS 58 CO 0.01 -0.23 -0.09 0.20 -2.47 0.00 0.00 174.74 172.16 1tj6 s GLY 59 N 1.10 0.83 -0.21 1.59 0.00 0.58 -0.76 107.32 110.45 1tj6 s GLY 59 Ca -0.08 -0.54 -0.00 0.00 0.00 0.00 0.00 44.72 44.10 1tj6 s GLY 59 CO -0.01 0.67 -0.13 1.85 0.00 0.00 0.00 173.10 175.49 1tj6 s GLU 60 N 1.51 2.92 0.16 2.90 2.12 -0.43 -1.33 118.70 126.55 1tj6 s GLU 60 Ca 0.02 -0.90 -0.30 0.00 0.36 0.00 0.00 54.97 54.14 1tj6 s GLU 60 Cb -0.13 -2.78 -0.08 0.00 0.26 0.00 0.00 34.13 31.39 1tj6 s GLU 60 CO -0.06 -0.30 1.31 0.50 -0.54 0.00 0.00 175.26 176.16 1tj6 s ARG 61 N 1.30 4.39 0.01 4.30 3.52 0.67 -0.64 118.95 132.49 1tj6 s ARG 61 Ca 0.02 2.02 -0.23 0.00 -0.13 0.00 0.00 55.73 57.41 1tj6 s ARG 61 Cb -0.15 -3.22 -0.18 0.00 -1.56 0.00 0.00 34.95 29.84 1tj6 s ARG 61 CO -0.08 -0.28 1.26 -0.07 -0.81 0.00 0.00 175.30 175.31 1tj6 h LEU 62 N 5.84 0.25 -0.84 -0.88 3.38 -1.60 -0.06 115.31 121.40 1tj6 h LEU 62 Ca -0.44 -0.54 -0.04 0.00 0.09 0.00 0.00 57.88 56.95 1tj6 h LEU 62 Cb 1.21 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.85 1tj6 h LEU 62 CO 0.80 0.75 0.33 -0.09 0.09 0.00 0.00 178.44 180.31 1tj6 h ARG 63 N -0.23 1.18 -0.06 1.13 2.43 -1.93 -3.10 114.38 113.80 1tj6 h ARG 63 Ca 0.01 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1tj6 h ARG 63 Cb 0.70 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1tj6 h ARG 63 CO 0.03 0.94 0.00 -0.40 -1.51 0.00 0.00 179.97 179.03 1tj6 n ASP 64 N -4.28 2.57 -4.12 -3.80 5.75 -1.25 -5.01 116.55 106.41 1tj6 n ASP 64 Ca 0.07 -2.86 -0.30 0.00 -0.01 0.00 0.00 54.79 51.70 1tj6 n ASP 64 Cb 0.18 -0.37 -0.04 0.00 -1.03 0.00 0.00 41.12 39.85 1tj6 n ASP 64 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1tj6 n LYS 65 N -1.06 -2.62 -4.58 0.11 4.01 -0.06 -4.92 118.16 109.03 1tj6 n LYS 65 Ca 0.14 0.31 -0.33 0.00 -0.51 0.00 0.00 58.31 57.93 1tj6 n LYS 65 Cb 0.61 -4.44 -0.16 0.00 -0.51 0.00 0.00 35.03 30.53 1tj6 n LYS 65 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1tj6 s THR 66 N -3.88 2.52 -0.31 -0.18 2.01 -1.05 -4.90 115.64 109.84 1tj6 s THR 66 Ca 0.20 -0.82 -0.29 0.00 0.31 0.00 0.00 61.69 61.08 1tj6 s THR 66 Cb -0.11 -2.05 -0.00 0.00 0.01 0.00 0.00 72.50 70.35 1tj6 s THR 66 CO 0.93 0.52 1.42 -0.69 -0.69 0.00 0.00 174.62 176.11 1tj6 s VAL 67 N 0.79 3.96 -0.33 3.82 1.01 -1.26 -0.24 120.40 128.15 1tj6 s VAL 67 Ca -0.06 1.06 0.04 0.00 0.00 0.00 0.00 61.98 63.01 1tj6 s VAL 67 Cb -0.15 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1tj6 s VAL 67 CO -0.00 -0.50 0.41 2.30 0.00 0.00 0.00 175.10 177.31 1tj6 n ILE 68 N 6.50 0.00 -3.68 2.22 -5.35 -0.44 -4.95 119.36 113.65 1tj6 n ILE 68 Ca 0.16 -0.46 -0.19 0.00 -0.27 0.00 0.00 62.75 61.99 1tj6 n ILE 68 Cb 0.47 1.04 -0.18 0.00 -1.74 0.00 0.00 39.64 39.23 1tj6 n ILE 68 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1tj6 s LEU 69 N -1.14 0.22 -0.24 7.28 2.96 -1.00 -4.97 118.68 121.79 1tj6 s LEU 69 Ca 0.03 0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 54.00 1tj6 s LEU 69 Cb 0.03 -0.11 0.11 0.00 0.50 0.00 0.00 46.19 46.72 1tj6 s LEU 69 CO 0.09 -0.24 0.27 -0.70 -1.32 0.00 0.00 176.35 174.45 1tj6 s GLU 70 N 2.06 0.26 -0.10 1.98 2.12 -1.25 -0.31 118.70 123.46 1tj6 s GLU 70 Ca 0.03 0.16 0.01 0.00 0.36 0.00 0.00 54.97 55.53 1tj6 s GLU 70 Cb -0.12 -0.93 0.02 0.00 0.26 0.00 0.00 34.13 33.36 1tj6 s GLU 70 CO -0.03 -0.76 -0.11 0.00 -0.54 0.00 0.00 175.26 173.82 1tj6 s VAL 72 N 1.24 4.96 0.24 0.00 1.01 -1.26 -1.14 120.40 125.45 1tj6 s VAL 72 Ca -0.03 0.73 0.09 0.00 0.00 0.00 0.00 61.98 62.77 1tj6 s VAL 72 Cb -0.14 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 1tj6 s VAL 72 CO -0.04 -0.15 -0.16 -0.76 0.00 0.00 0.00 175.10 173.99 1tj6 s LEU 73 N 2.55 2.57 0.00 3.92 1.43 -0.19 -4.97 118.68 123.99 1tj6 s LEU 73 Ca 0.23 -1.03 0.04 0.00 -1.03 0.00 0.00 54.13 52.34 1tj6 s LEU 73 Cb -0.15 -0.84 -0.01 0.00 0.03 0.00 0.00 46.19 45.21 1tj6 s LEU 73 CO 0.12 -0.09 0.14 0.54 0.23 0.00 0.00 176.35 177.29 1tj6 n ARG 74 N -0.49 0.46 0.30 1.70 1.74 -1.26 -0.65 116.66 118.46 1tj6 n ARG 74 Ca -0.07 -2.21 0.18 0.00 -0.77 0.00 0.00 57.85 54.99 1tj6 n ARG 74 Cb 0.60 1.54 0.94 0.00 -1.02 0.00 0.00 32.46 34.52 1tj6 n ARG 74 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1tj6 h ARG 75 N 0.00 0.00 0.00 5.56 0.11 -1.94 -2.09 114.38 116.02 1tj6 h ARG 75 Ca -0.18 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.90 1tj6 h ARG 75 Cb 0.79 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.87 1tj6 h ARG 75 CO 0.27 0.03 0.00 -0.40 0.10 0.00 0.00 179.97 179.97 1tj6 n ASP 76 N -3.31 0.00 -4.67 0.08 5.75 -1.26 -4.93 116.55 108.21 1tj6 n ASP 76 Ca -0.02 -0.40 -0.45 0.00 -0.01 0.00 0.00 54.79 53.91 1tj6 n ASP 76 Cb 0.17 -0.15 -0.03 0.00 -1.03 0.00 0.00 41.12 40.07 1tj6 n ASP 76 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1tj6 n LEU 77 N -1.15 3.17 -4.37 -2.12 7.94 -0.79 -4.97 117.00 114.71 1tj6 n LEU 77 Ca 0.15 1.11 -0.37 0.00 -1.11 0.00 0.00 56.01 55.79 1tj6 n LEU 77 Cb 0.14 -1.44 -0.13 0.00 0.53 0.00 0.00 43.42 42.53 1tj6 n LEU 77 CO 0.16 -0.34 -0.29 -0.69 -1.11 0.00 0.00 177.39 175.12 1tj6 s VAL 78 N 0.46 4.01 -0.39 1.96 1.01 -1.26 -5.06 120.40 121.12 1tj6 s VAL 78 Ca 0.74 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 62.16 1tj6 s VAL 78 Cb -0.66 -2.98 0.08 0.00 0.00 0.00 0.00 36.38 32.83 1tj6 s VAL 78 CO 0.43 0.20 0.18 -0.47 0.00 0.00 0.00 175.10 175.45 1tj6 s TYR 79 N 1.53 3.42 -0.13 5.22 5.04 -1.26 -4.54 117.35 126.63 1tj6 s TYR 79 Ca 0.04 -1.94 -0.22 0.00 -2.44 0.00 0.00 57.07 52.50 1tj6 s TYR 79 Cb -0.16 -2.89 -0.03 0.00 0.35 0.00 0.00 41.96 39.23 1tj6 s TYR 79 CO 0.02 -0.89 0.68 -0.80 -1.34 0.00 0.00 175.55 173.22 1tj6 s ASN 80 N 1.83 6.85 -0.32 4.32 0.01 0.08 -4.94 114.94 122.77 1tj6 s ASN 80 Ca 0.03 1.03 -0.03 0.00 -0.71 0.00 0.00 52.86 53.19 1tj6 s ASN 80 Cb -0.22 -2.39 0.05 0.00 0.41 0.00 0.00 41.25 39.10 1tj6 s ASN 80 CO -0.01 -0.21 0.03 -0.54 -1.51 0.00 0.00 177.10 174.87 1tj6 s LYS 81 N 1.40 2.41 -0.25 -0.60 1.02 -1.26 -0.79 119.74 121.67 1tj6 s LYS 81 Ca 0.34 -1.31 -0.11 0.00 0.02 0.00 0.00 55.97 54.91 1tj6 s LYS 81 Cb -0.17 -3.26 -0.15 0.00 -0.52 0.00 0.00 37.83 33.73 1tj6 s LYS 81 CO 0.14 -0.67 -0.18 0.28 -0.92 0.00 0.00 175.35 174.00 1tj6 n VAL 82 N 4.65 1.54 -4.40 3.17 0.31 -0.59 -5.02 118.33 117.99 1tj6 n VAL 82 Ca -0.12 -0.39 -0.20 0.00 -0.01 0.00 0.00 64.34 63.62 1tj6 n VAL 82 Cb 0.43 -1.79 -0.09 0.00 -0.91 0.00 0.00 33.84 31.48 1tj6 n VAL 82 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1tj6 s THR 83 N -2.49 0.62 0.22 2.52 -4.23 -1.07 -4.99 115.64 106.22 1tj6 s THR 83 Ca -0.35 -2.00 0.34 0.00 -1.18 0.00 0.00 61.69 58.50 1tj6 s THR 83 Cb 0.11 -2.56 0.34 0.00 1.34 0.00 0.00 72.50 71.74 1tj6 s THR 83 CO 0.55 0.00 2.03 -0.65 -0.54 0.00 0.00 174.62 176.02 1tj6 h PRO 84 N 2.13 0.00 0.00 3.99 0.11 -1.98 -2.84 132.00 133.41 1tj6 h PRO 84 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1tj6 h PRO 84 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1tj6 h PRO 84 CO 0.59 0.00 -0.14 0.25 -0.21 0.00 0.00 178.00 178.49 1tj6 n THR 85 N -2.72 1.19 -3.64 -1.15 -2.24 -1.26 -4.26 114.28 100.20 1tj6 n THR 85 Ca -0.02 -1.41 -0.20 0.00 -2.27 0.00 0.00 64.05 60.16 1tj6 n THR 85 Cb 0.09 0.10 -0.17 0.00 -2.10 0.00 0.00 70.33 68.25 1tj6 n THR 85 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1tj6 s PHE 86 N -1.76 -0.02 0.14 4.78 5.36 -1.07 -0.86 117.98 124.56 1tj6 s PHE 86 Ca 0.18 0.26 0.06 0.00 -0.96 0.00 0.00 56.93 56.47 1tj6 s PHE 86 Cb 0.16 -0.44 -0.04 0.00 -0.34 0.00 0.00 43.02 42.36 1tj6 s PHE 86 CO 0.02 -0.31 -0.13 -1.01 -1.46 0.00 0.00 175.22 172.32 1tj6 s HIS 87 N 2.22 1.41 0.19 10.12 3.76 -0.91 -1.55 115.29 130.54 1tj6 s HIS 87 Ca 0.04 -0.59 -0.19 0.00 -0.15 0.00 0.00 55.06 54.17 1tj6 s HIS 87 Cb -0.13 -0.72 0.04 0.00 1.11 0.00 0.00 32.58 32.87 1tj6 s HIS 87 CO -0.06 0.16 0.55 -3.38 -0.85 0.00 0.00 174.74 171.17 1tj6 s HIS 88 N -2.46 -0.23 0.38 1.40 -3.43 0.03 -1.05 115.29 109.94 1tj6 s HIS 88 Ca 0.12 -0.10 -0.09 0.00 -0.80 0.00 0.00 55.06 54.19 1tj6 s HIS 88 Cb -0.03 0.46 0.04 0.00 -1.43 0.00 0.00 32.58 31.61 1tj6 s HIS 88 CO 0.03 -0.92 0.66 1.67 -2.00 0.00 0.00 174.74 174.18 1tj6 s TRP 89 N -3.85 0.59 0.10 0.38 -2.14 0.17 -0.75 118.94 113.45 1tj6 s TRP 89 Ca 0.07 -1.07 0.02 0.00 2.66 0.00 0.00 56.10 57.78 1tj6 s TRP 89 Cb -0.01 0.43 -0.04 0.00 -3.10 0.00 0.00 33.47 30.75 1tj6 s TRP 89 CO -0.05 -1.41 -0.07 -0.98 -2.66 0.00 0.00 176.95 171.78 1tj6 s ARG 90 N -2.49 0.86 -0.22 3.25 1.70 -1.26 -1.33 118.95 119.46 1tj6 s ARG 90 Ca 0.23 -1.34 -0.00 0.00 -0.47 0.00 0.00 55.73 54.14 1tj6 s ARG 90 Cb -0.03 -0.25 0.06 0.00 -0.57 0.00 0.00 34.95 34.15 1tj6 s ARG 90 CO 0.16 -0.01 -0.04 0.42 -1.08 0.00 0.00 175.30 174.76 1tj6 s ILE 91 N -3.56 1.30 0.00 4.99 1.01 -0.08 -4.93 121.20 119.93 1tj6 s ILE 91 Ca 0.12 -1.04 0.00 0.00 0.00 0.00 0.00 60.65 59.73 1tj6 s ILE 91 Cb 0.05 -1.60 0.00 0.00 0.01 0.00 0.00 42.46 40.92 1tj6 s ILE 91 CO -0.04 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.41 1tj6 n GLY 92 N 4.76 3.59 0.34 6.18 0.00 -1.26 -1.30 105.19 117.50 1tj6 n GLY 92 Ca -0.11 0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.08 1tj6 n GLY 92 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tj6 n ASP 93 N 5.42 1.08 -4.74 1.61 8.00 -1.26 -4.88 116.55 121.77 1tj6 n ASP 93 Ca 0.00 -1.29 -0.39 0.00 0.71 0.00 0.00 54.79 53.82 1tj6 n ASP 93 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 1tj6 n ASP 93 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1tj6 s LYS 94 N -2.06 4.38 -0.03 -1.24 1.02 -0.42 -5.05 119.74 116.33 1tj6 s LYS 94 Ca 0.39 0.80 0.06 0.00 0.02 0.00 0.00 55.97 57.24 1tj6 s LYS 94 Cb 0.21 -3.39 -0.02 0.00 -0.52 0.00 0.00 37.83 34.11 1tj6 s LYS 94 CO 0.36 0.25 -0.22 0.15 -0.92 0.00 0.00 175.35 174.97 1tj6 s LYS 95 N 0.20 2.26 0.02 1.68 -0.14 -1.26 -0.90 119.74 121.60 1tj6 s LYS 95 Ca 0.34 -0.84 0.00 0.00 -1.36 0.00 0.00 55.97 54.11 1tj6 s LYS 95 Cb -0.18 -2.17 -0.02 0.00 -1.68 0.00 0.00 37.83 33.78 1tj6 s LYS 95 CO 0.18 0.58 -0.03 -0.06 -0.76 0.00 0.00 175.35 175.26 1tj6 s PHE 96 N -0.65 0.22 0.39 3.18 0.08 -0.44 -4.37 117.98 116.38 1tj6 s PHE 96 Ca 0.10 -0.42 -0.11 0.00 0.12 0.00 0.00 56.93 56.62 1tj6 s PHE 96 Cb -0.10 -0.16 0.04 0.00 -0.57 0.00 0.00 43.02 42.23 1tj6 s PHE 96 CO -0.00 -0.15 0.71 0.41 -0.10 0.00 0.00 175.22 176.09 1tj6 n GLY 97 N 1.90 1.30 2.83 4.36 0.00 -0.92 -0.65 105.19 114.01 1tj6 n GLY 97 Ca -0.21 -1.37 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 1tj6 n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tj6 s LEU 98 N 0.00 1.63 -0.25 0.99 1.43 -0.22 -0.40 118.68 121.86 1tj6 s LEU 98 Ca 0.20 0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.23 1tj6 s LEU 98 Cb -0.04 -0.05 -0.03 0.00 0.03 0.00 0.00 46.19 46.10 1tj6 s LEU 98 CO 0.15 -0.05 0.10 -0.89 0.23 0.00 0.00 176.35 175.89 1tj6 s THR 99 N 0.43 4.59 0.36 5.49 2.01 -0.18 -2.14 115.64 126.20 1tj6 s THR 99 Ca -0.04 -0.08 -0.03 0.00 0.31 0.00 0.00 61.69 61.86 1tj6 s THR 99 Cb -0.05 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.26 1tj6 s THR 99 CO -0.01 0.33 0.61 -0.36 -0.69 0.00 0.00 174.62 174.49 1tj6 s PHE 100 N 1.56 3.51 -0.14 4.92 0.08 -0.03 -1.00 117.98 126.86 1tj6 s PHE 100 Ca 0.06 0.57 0.24 0.00 0.12 0.00 0.00 56.93 57.92 1tj6 s PHE 100 Cb -0.15 -2.07 0.61 0.00 -0.57 0.00 0.00 43.02 40.84 1tj6 s PHE 100 CO 0.05 0.05 1.70 1.96 -0.10 0.00 0.00 175.22 178.87 1tj6 h GLN 101 N 0.97 0.00 -2.93 0.44 4.20 -1.89 -3.47 115.11 112.42 1tj6 h GLN 101 Ca -0.48 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.18 1tj6 h GLN 101 Cb 1.20 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.84 1tj6 h GLN 101 CO 0.63 0.16 0.05 -1.54 -0.67 0.00 0.00 178.83 177.47 1tj6 s SER 102 N -6.16 -0.43 0.42 1.46 1.04 -1.26 -5.03 113.70 103.74 1tj6 s SER 102 Ca 0.04 0.05 0.11 0.00 0.48 0.00 0.00 55.95 56.63 1tj6 s SER 102 Cb 0.08 0.51 0.97 0.00 0.10 0.00 0.00 66.02 67.67 1tj6 s SER 102 CO 0.65 -0.80 2.00 -0.65 0.98 0.00 0.00 173.24 175.43 1tj6 h PRO 103 N 2.54 0.45 -0.49 4.02 0.11 -1.90 -2.50 132.00 134.23 1tj6 h PRO 103 Ca -0.32 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.65 1tj6 h PRO 103 Cb 1.24 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1tj6 h PRO 103 CO 0.42 0.30 -0.13 0.00 -0.21 0.00 0.00 178.00 178.38 1tj6 h ALA 104 N 1.71 0.85 -0.51 -0.75 0.00 -1.96 -0.96 119.26 117.64 1tj6 h ALA 104 Ca 0.24 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1tj6 h ALA 104 Cb 0.35 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1tj6 h ALA 104 CO -0.07 0.65 0.19 -0.44 0.00 0.00 0.00 179.25 179.58 1tj6 h ASP 105 N 0.82 0.71 -0.86 0.00 5.19 -1.86 -0.94 116.42 119.48 1tj6 h ASP 105 Ca 0.13 -0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1tj6 h ASP 105 Cb 0.67 -0.18 -0.04 0.00 0.18 0.00 0.00 39.33 39.95 1tj6 h ASP 105 CO 0.05 0.69 0.54 0.00 -3.12 0.00 0.00 179.24 177.40 1tj6 h ALA 106 N 1.04 1.09 -0.77 3.45 0.00 -1.17 -0.61 119.26 122.30 1tj6 h ALA 106 Ca 0.17 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1tj6 h ALA 106 Cb 0.21 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1tj6 h ALA 106 CO -0.01 0.53 0.28 0.00 0.00 0.00 0.00 179.25 180.05 1tj6 h ARG 107 N 1.18 1.18 -0.52 0.00 3.08 -0.83 -0.97 114.38 117.48 1tj6 h ARG 107 Ca 0.31 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 1tj6 h ARG 107 Cb -0.08 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.76 1tj6 h ARG 107 CO -0.06 0.97 0.19 0.00 -1.07 0.00 0.00 179.97 180.00 1tj6 h ALA 108 N 1.15 0.68 -0.35 0.04 0.00 -0.69 -0.36 119.26 119.73 1tj6 h ALA 108 Ca 0.25 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1tj6 h ALA 108 Cb 0.26 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1tj6 h ALA 108 CO -0.02 0.32 -0.06 0.35 0.00 0.00 0.00 179.25 179.84 1tj6 h PHE 109 N 0.71 0.74 -1.00 0.00 3.57 -0.92 -1.03 116.94 119.01 1tj6 h PHE 109 Ca 0.17 -0.15 0.01 0.00 3.53 0.00 0.00 57.97 61.53 1tj6 h PHE 109 Cb 0.24 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.75 1tj6 h PHE 109 CO 0.01 0.81 0.66 0.22 -2.23 0.00 0.00 178.31 177.78 1tj6 h ASP 110 N 0.46 1.15 -0.73 0.41 3.58 -1.00 0.04 116.42 120.33 1tj6 h ASP 110 Ca 0.09 -0.03 -0.05 0.00 0.42 0.00 0.00 57.03 57.46 1tj6 h ASP 110 Cb 0.56 -0.29 -0.03 0.00 1.72 0.00 0.00 39.33 41.29 1tj6 h ASP 110 CO 0.03 0.84 0.26 0.03 -2.88 0.00 0.00 179.24 177.52 1tj6 h ARG 111 N 1.35 1.11 -0.43 0.28 3.08 -0.75 -1.72 114.38 117.30 1tj6 h ARG 111 Ca 0.36 -0.22 0.01 0.00 0.07 0.00 0.00 59.98 60.21 1tj6 h ARG 111 Cb -0.15 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 29.71 1tj6 h ARG 111 CO -0.08 0.93 0.27 0.78 -1.07 0.00 0.00 179.97 180.80 1tj6 h GLY 112 N 1.06 0.61 0.94 0.04 0.00 -0.33 0.81 103.07 106.20 1tj6 h GLY 112 Ca 0.24 -0.21 0.01 0.00 0.00 0.00 0.00 47.33 47.38 1tj6 h GLY 112 CO -0.01 0.19 0.35 -2.22 0.00 0.00 0.00 176.54 174.84 1tj6 h ILE 113 N 0.54 1.10 -0.57 2.60 1.08 -0.81 -0.66 117.51 120.80 1tj6 h ILE 113 Ca 0.17 -0.24 -0.10 0.00 -0.39 0.00 0.00 64.86 64.29 1tj6 h ILE 113 Cb -0.02 0.34 -0.02 0.00 -3.07 0.00 0.00 36.82 34.05 1tj6 h ILE 113 CO -0.06 0.13 -0.05 0.03 -0.69 0.00 0.00 178.15 177.50 1tj6 h ARG 114 N 0.70 1.04 -0.48 2.37 3.08 -0.95 -1.35 114.38 118.80 1tj6 h ARG 114 Ca 0.21 -0.35 -0.04 0.00 0.07 0.00 0.00 59.98 59.87 1tj6 h ARG 114 Cb -0.03 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 1tj6 h ARG 114 CO -0.07 1.04 0.16 0.00 -1.07 0.00 0.00 179.97 180.04 1tj6 h ARG 115 N 0.94 0.74 -0.50 0.04 2.47 -0.62 -0.65 114.38 116.79 1tj6 h ARG 115 Ca 0.16 -0.15 -0.02 0.00 -1.26 0.00 0.00 59.98 58.71 1tj6 h ARG 115 Cb 0.61 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.80 1tj6 h ARG 115 CO 0.04 0.69 0.25 0.00 0.56 0.00 0.00 179.97 181.50 1tj6 h ALA 116 N 1.02 0.64 -0.55 0.04 0.00 -0.77 -1.84 119.26 117.80 1tj6 h ALA 116 Ca 0.16 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1tj6 h ALA 116 Cb 0.25 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1tj6 h ALA 116 CO -0.01 0.19 0.08 0.82 0.00 0.00 0.00 179.25 180.34 1tj6 h ILE 117 N 0.66 1.25 0.00 0.00 2.04 -1.11 -2.75 117.51 117.60 1tj6 h ILE 117 Ca 0.17 -0.97 -0.04 0.00 1.00 0.00 0.00 64.86 65.02 1tj6 h ILE 117 Cb 0.10 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1tj6 h ILE 117 CO -0.02 0.35 -0.17 1.05 0.00 0.00 0.00 178.15 179.36 1tj6 h GLU 118 N 0.80 0.00 -0.00 2.37 4.11 -0.57 -2.69 114.58 118.60 1tj6 h GLU 118 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.60 1tj6 h GLU 118 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1tj6 h GLU 118 CO 0.01 0.17 -0.55 -0.25 0.07 0.00 0.00 179.01 178.47 1tj6 n ASP 119 N -3.45 1.01 -4.75 3.06 9.92 -0.74 -4.92 116.55 116.69 1tj6 n ASP 119 Ca -0.01 -0.81 -0.42 0.00 -0.53 0.00 0.00 54.79 53.03 1tj6 n ASP 119 Cb 0.35 0.43 -0.01 0.00 -0.64 0.00 0.00 41.12 41.25 1tj6 n ASP 119 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1tj6 n LEU 120 N -1.02 4.38 -5.01 0.64 4.77 -1.02 -4.90 117.00 114.84 1tj6 n LEU 120 Ca 0.08 1.18 -0.17 0.00 -0.03 0.00 0.00 56.01 57.06 1tj6 n LEU 120 Cb 0.36 -1.58 0.01 0.00 -2.33 0.00 0.00 43.42 39.88 1tj6 n LEU 120 CO 0.33 0.06 0.18 -0.94 -1.33 0.00 0.00 177.39 175.69 1tj6 s SER 121 N 0.17 5.60 0.89 -1.43 1.04 -0.06 -5.01 113.70 114.91 1tj6 s SER 121 Ca 0.59 -0.40 -0.10 0.00 0.48 0.00 0.00 55.95 56.52 1tj6 s SER 121 Cb -0.50 -0.65 0.13 0.00 0.10 0.00 0.00 66.02 65.10 1tj6 s SER 121 CO 0.56 -0.82 1.13 0.00 0.98 0.00 0.00 173.24 175.09 1tj6 s GLN 122 N -4.40 1.21 0.00 4.02 -2.07 -1.26 -4.34 119.66 112.82 1tj6 s GLN 122 Ca 0.55 1.44 0.26 0.00 -1.82 0.00 0.00 55.36 55.80 1tj6 s GLN 122 Cb -0.10 -1.76 0.72 0.00 -1.09 0.00 0.00 33.01 30.79 1tj6 s GLN 122 CO 0.34 -2.46 1.56 0.41 -1.32 0.00 0.00 175.29 173.82