#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 6.86 0.38 -1.12 1.04 -1.26 -4.48 113.70 115.12 1tj6 s SER 10 Ca 0.00 1.67 0.21 0.00 0.48 0.00 0.00 55.95 58.31 1tj6 s SER 10 Cb 0.00 -2.53 0.55 0.00 0.10 0.00 0.00 66.02 64.14 1tj6 s SER 10 CO 0.00 -0.42 1.67 1.88 0.98 0.00 0.00 173.24 177.35 1tj6 h TYR 11 N 1.71 0.00 -1.56 5.02 0.05 -0.88 -3.47 116.97 117.84 1tj6 h TYR 11 Ca -0.49 0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.37 1tj6 h TYR 11 Cb 1.18 0.00 -0.24 0.00 1.01 0.00 0.00 36.73 38.68 1tj6 h TYR 11 CO 0.62 0.29 0.53 0.00 -1.05 0.00 0.00 178.16 178.56 1tj6 s ALA 12 N -3.35 -1.95 -0.12 3.88 0.00 -1.20 -4.31 121.76 114.71 1tj6 s ALA 12 Ca 0.03 1.66 -0.05 0.00 0.00 0.00 0.00 51.96 53.59 1tj6 s ALA 12 Cb 0.09 -0.90 0.06 0.00 0.00 0.00 0.00 23.12 22.36 1tj6 s ALA 12 CO 0.68 -0.29 0.26 0.50 0.00 0.00 0.00 175.76 176.91 1tj6 s ARG 13 N -0.78 0.16 0.04 0.00 3.52 -1.26 -1.47 118.95 119.17 1tj6 s ARG 13 Ca -0.00 0.68 -0.01 0.00 -0.13 0.00 0.00 55.73 56.27 1tj6 s ARG 13 Cb -0.02 -0.07 -0.03 0.00 -1.56 0.00 0.00 34.95 33.27 1tj6 s ARG 13 CO -0.01 -0.25 -0.02 0.14 -0.81 0.00 0.00 175.30 174.35 1tj6 s VAL 14 N 2.07 0.19 -0.32 7.11 -7.23 -0.39 -4.99 120.40 116.85 1tj6 s VAL 14 Ca -0.02 -1.58 -0.12 0.00 -1.81 0.00 0.00 61.98 58.45 1tj6 s VAL 14 Cb -0.11 -1.22 -0.03 0.00 0.56 0.00 0.00 36.38 35.57 1tj6 s VAL 14 CO -0.08 -0.87 0.23 -0.13 -0.31 0.00 0.00 175.10 173.93 1tj6 s ARG 15 N -3.35 3.68 0.23 4.82 0.52 -1.26 -0.30 118.95 123.30 1tj6 s ARG 15 Ca 0.02 -0.51 -0.06 0.00 -0.52 0.00 0.00 55.73 54.66 1tj6 s ARG 15 Cb 0.04 -3.75 -0.02 0.00 0.52 0.00 0.00 34.95 31.74 1tj6 s ARG 15 CO -0.08 -0.34 0.31 0.00 0.02 0.00 0.00 175.30 175.21 1tj6 s ALA 16 N 1.75 0.53 -0.30 2.13 0.00 -0.15 -4.27 121.76 121.44 1tj6 s ALA 16 Ca 0.07 -1.33 -0.11 0.00 0.00 0.00 0.00 51.96 50.59 1tj6 s ALA 16 Cb -0.17 1.23 -0.03 0.00 0.00 0.00 0.00 23.12 24.15 1tj6 s ALA 16 CO 0.11 -0.72 0.20 0.08 0.00 0.00 0.00 175.76 175.42 1tj6 s VAL 17 N -4.01 5.17 0.20 0.00 1.01 -0.13 -0.61 120.40 122.03 1tj6 s VAL 17 Ca 0.31 -0.04 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 1tj6 s VAL 17 Cb 0.03 -3.54 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 1tj6 s VAL 17 CO 0.12 0.15 1.29 -0.69 0.00 0.00 0.00 175.10 175.96 1tj6 s VAL 18 N 1.72 3.28 0.25 2.92 1.01 -1.26 -1.01 120.40 127.31 1tj6 s VAL 18 Ca 0.06 1.06 0.10 0.00 0.00 0.00 0.00 61.98 63.21 1tj6 s VAL 18 Cb -0.17 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1tj6 s VAL 18 CO 0.10 0.16 -0.10 -0.04 0.00 0.00 0.00 175.10 175.22 1tj6 s MET 19 N -0.15 2.00 0.04 2.72 -1.94 -0.12 -0.76 119.30 121.08 1tj6 s MET 19 Ca 0.56 -1.50 -0.12 0.00 -1.71 0.00 0.00 55.69 52.92 1tj6 s MET 19 Cb -0.36 -2.02 0.01 0.00 2.01 0.00 0.00 34.83 34.48 1tj6 s MET 19 CO 0.38 0.37 0.25 -0.08 -0.01 0.00 0.00 175.02 175.94 1tj6 s THR 20 N -2.19 0.09 0.62 2.05 -1.32 -0.17 -3.16 115.64 111.57 1tj6 s THR 20 Ca 0.29 -0.77 -0.18 0.00 -1.21 0.00 0.00 61.69 59.81 1tj6 s THR 20 Cb -0.07 -0.92 -0.02 0.00 -1.51 0.00 0.00 72.50 69.98 1tj6 s THR 20 CO 0.17 -0.43 1.21 -0.13 -2.21 0.00 0.00 174.62 173.22 1tj6 s ARG 21 N -2.54 2.80 0.00 7.08 1.81 -1.26 -0.58 118.95 126.26 1tj6 s ARG 21 Ca -0.05 1.80 0.00 0.00 -1.72 0.00 0.00 55.73 55.76 1tj6 s ARG 21 Cb -0.01 -1.91 0.00 0.00 -0.45 0.00 0.00 34.95 32.58 1tj6 s ARG 21 CO -0.03 -1.33 0.00 -0.40 -0.68 0.00 0.00 175.30 172.85 1tj6 n ASP 22 N -1.85 0.44 -0.72 0.23 5.68 -0.88 -4.72 116.55 114.74 1tj6 n ASP 22 Ca 0.13 0.00 0.10 0.00 -0.50 0.00 0.00 54.79 54.53 1tj6 n ASP 22 Cb 0.50 0.00 0.31 0.00 -1.14 0.00 0.00 41.12 40.79 1tj6 n ASP 22 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1tj6 n ASP 23 N 0.00 2.14 -4.63 -1.12 5.75 -1.26 -4.88 116.55 112.56 1tj6 n ASP 23 Ca 0.00 -1.82 -0.28 0.00 -0.01 0.00 0.00 54.79 52.68 1tj6 n ASP 23 Cb 0.00 -0.16 0.12 0.00 -1.03 0.00 0.00 41.12 40.05 1tj6 n ASP 23 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1tj6 s SER 24 N -1.47 4.07 0.41 -1.12 1.04 -1.26 -4.99 113.70 110.38 1tj6 s SER 24 Ca 0.33 0.47 0.22 0.00 0.48 0.00 0.00 55.95 57.44 1tj6 s SER 24 Cb 0.18 -0.83 0.79 0.00 0.10 0.00 0.00 66.02 66.27 1tj6 s SER 24 CO 0.26 -2.13 1.77 0.77 0.98 0.00 0.00 173.24 174.89 1tj6 h SER 25 N -1.14 0.00 0.00 7.02 4.64 -2.05 -3.37 113.55 118.64 1tj6 h SER 25 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1tj6 h SER 25 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1tj6 h SER 25 CO 0.54 0.29 0.00 0.61 -0.87 0.00 0.00 176.83 177.40 1tj6 n GLY 26 N 0.23 -0.50 3.92 -0.77 0.00 -1.26 -5.13 105.19 101.69 1tj6 n GLY 26 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 1.54 0.02 -0.02 0.00 -1.26 -5.01 107.32 102.59 1tj6 s GLY 27 Ca 0.00 -0.71 0.05 0.00 0.00 0.00 0.00 44.72 44.06 1tj6 s GLY 27 CO 0.00 -0.51 -0.14 -0.98 0.00 0.00 0.00 173.10 171.47 1tj6 s TRP 28 N -2.76 1.21 0.32 1.90 0.52 -1.26 -2.07 118.94 116.80 1tj6 s TRP 28 Ca 0.49 -0.30 0.10 0.00 0.02 0.00 0.00 56.10 56.41 1tj6 s TRP 28 Cb -0.10 -0.74 -0.06 0.00 -1.15 0.00 0.00 33.47 31.42 1tj6 s TRP 28 CO 0.43 0.01 -0.07 -0.51 0.02 0.00 0.00 176.95 176.83 1tj6 s LEU 29 N -0.82 2.82 -0.04 2.99 1.43 0.25 -4.87 118.68 120.44 1tj6 s LEU 29 Ca 0.03 -1.05 -0.30 0.00 -1.03 0.00 0.00 54.13 51.78 1tj6 s LEU 29 Cb -0.07 -1.20 -0.04 0.00 0.03 0.00 0.00 46.19 44.91 1tj6 s LEU 29 CO 0.01 -0.15 1.30 -1.10 0.23 0.00 0.00 176.35 176.64 1tj6 s GLN 30 N -3.63 4.31 0.10 1.70 -0.21 -1.26 -0.99 119.66 119.68 1tj6 s GLN 30 Ca 0.33 1.81 -0.31 0.00 0.02 0.00 0.00 55.36 57.20 1tj6 s GLN 30 Cb -0.01 -3.58 -0.11 0.00 1.00 0.00 0.00 33.01 30.31 1tj6 s GLN 30 CO 0.17 -0.52 1.85 -0.11 -2.12 0.00 0.00 175.29 174.56 1tj6 n LEU 31 N 5.39 4.00 -0.79 2.90 0.00 0.06 -1.85 117.00 126.70 1tj6 n LEU 31 Ca 0.12 0.98 -0.10 0.00 0.00 0.00 0.00 56.01 57.01 1tj6 n LEU 31 Cb 0.45 -1.53 -0.04 0.00 0.00 0.00 0.00 43.42 42.30 1tj6 n LEU 31 CO 0.57 0.15 -0.10 0.61 0.00 0.00 0.00 177.39 178.62 1tj6 n GLY 32 N 4.26 1.03 0.53 -3.96 0.00 -1.26 -2.20 105.19 103.60 1tj6 n GLY 32 Ca 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.18 0.68 2.51 -0.02 0.00 -0.77 -4.98 105.19 102.42 1tj6 n GLY 33 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.05 0.10 0.00 -0.02 0.00 -0.93 -4.96 105.19 97.33 1tj6 n GLY 34 Ca 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.48 3.82 -0.02 0.00 -1.26 -4.97 105.19 100.28 1tj6 n GLY 35 Ca 0.00 -1.46 -0.35 0.00 0.00 0.00 0.00 46.02 44.21 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 -4.15 4.18 0.11 0.99 1.43 -1.26 -4.56 118.68 115.42 1tj6 s LEU 36 Ca 0.00 1.53 0.09 0.00 -1.03 0.00 0.00 54.13 54.73 1tj6 s LEU 36 Cb 0.00 -4.02 -0.04 0.00 0.03 0.00 0.00 46.19 42.16 1tj6 s LEU 36 CO 0.00 -0.14 -0.24 -0.44 0.23 0.00 0.00 176.35 175.77 1tj6 s SER 37 N -1.92 2.87 -0.37 2.29 0.01 0.22 -1.29 113.70 115.51 1tj6 s SER 37 Ca 0.52 -0.70 -0.25 0.00 1.31 0.00 0.00 55.95 56.83 1tj6 s SER 37 Cb -0.14 -0.18 0.01 0.00 0.21 0.00 0.00 66.02 65.92 1tj6 s SER 37 CO 0.19 0.12 0.87 -0.55 0.41 0.00 0.00 173.24 174.28 1tj6 s SER 38 N -1.89 6.62 -0.20 2.44 0.15 0.38 -0.98 113.70 120.22 1tj6 s SER 38 Ca 0.10 0.46 -0.03 0.00 0.70 0.00 0.00 55.95 57.18 1tj6 s SER 38 Cb -0.10 -2.43 -0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1tj6 s SER 38 CO 0.05 -0.81 -0.08 -0.69 1.20 0.00 0.00 173.24 172.90 1tj6 s VAL 39 N 3.33 3.11 0.04 4.45 1.01 0.59 -1.34 120.40 131.59 1tj6 s VAL 39 Ca 0.35 -0.59 0.09 0.00 0.00 0.00 0.00 61.98 61.84 1tj6 s VAL 39 Cb -0.12 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 1tj6 s VAL 39 CO 0.18 0.45 -0.26 -0.89 0.00 0.00 0.00 175.10 174.59 1tj6 s THR 40 N 1.32 2.12 -0.21 3.92 2.01 0.11 -1.26 115.64 123.65 1tj6 s THR 40 Ca 0.04 -1.36 -0.03 0.00 0.31 0.00 0.00 61.69 60.64 1tj6 s THR 40 Cb -0.14 -1.81 -0.01 0.00 0.01 0.00 0.00 72.50 70.55 1tj6 s THR 40 CO -0.04 0.38 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.53 1tj6 s VAL 41 N -0.79 3.35 0.03 3.82 1.01 -0.54 -0.96 120.40 126.32 1tj6 s VAL 41 Ca 0.11 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 1tj6 s VAL 41 Cb -0.10 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.76 1tj6 s VAL 41 CO 0.02 0.44 0.09 -0.94 0.00 0.00 0.00 175.10 174.70 1tj6 s SER 42 N 1.35 0.17 -0.01 3.32 1.04 -0.42 -0.13 113.70 119.02 1tj6 s SER 42 Ca 0.04 -0.50 -0.01 0.00 0.48 0.00 0.00 55.95 55.96 1tj6 s SER 42 Cb -0.14 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.15 1tj6 s SER 42 CO -0.03 -0.48 0.13 -1.59 0.98 0.00 0.00 173.24 172.25 1tj6 s LYS 43 N -2.40 3.23 -0.07 4.02 -2.85 -1.26 -0.81 119.74 119.60 1tj6 s LYS 43 Ca -0.07 -0.41 0.03 0.00 -1.00 0.00 0.00 55.97 54.52 1tj6 s LYS 43 Cb -0.02 -2.97 0.01 0.00 -2.06 0.00 0.00 37.83 32.79 1tj6 s LYS 43 CO -0.04 0.66 -0.15 -0.08 0.10 0.00 0.00 175.35 175.84 1tj6 s THR 44 N -1.26 1.34 0.00 3.79 -1.32 -1.26 -5.01 115.64 111.93 1tj6 s THR 44 Ca 0.25 -0.60 0.00 0.00 -1.21 0.00 0.00 61.69 60.13 1tj6 s THR 44 Cb -0.12 -1.20 0.00 0.00 -1.51 0.00 0.00 72.50 69.66 1tj6 s THR 44 CO 0.16 0.40 0.00 0.00 -2.21 0.00 0.00 174.62 172.97 1tj6 n LEU 45 N 3.74 0.00 -1.23 9.08 -0.00 -1.26 -4.89 117.00 122.44 1tj6 n LEU 45 Ca -0.22 0.00 0.14 0.00 -0.00 0.00 0.00 56.01 55.93 1tj6 n LEU 45 Cb 0.52 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.88 1tj6 n LEU 45 CO 0.26 -0.12 -0.42 -1.84 -0.00 0.00 0.00 177.39 175.27 1tj6 n GLU 54 N 1.00 -2.46 -4.13 1.47 -0.00 -1.26 -5.35 120.64 109.91 1tj6 n GLU 54 Ca 0.00 1.93 -0.30 0.00 -0.00 0.00 0.00 57.16 58.79 1tj6 n GLU 54 Cb 0.00 -3.04 -0.16 0.00 -0.00 0.00 0.00 31.44 28.24 1tj6 n GLU 54 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 1tj6 s PHE 55 N -3.85 2.24 -0.02 -1.84 0.40 -1.26 -4.36 117.98 109.28 1tj6 s PHE 55 Ca 0.00 -1.23 0.06 0.00 -0.60 0.00 0.00 56.93 55.15 1tj6 s PHE 55 Cb 0.00 -1.62 -0.01 0.00 0.51 0.00 0.00 43.02 41.90 1tj6 s PHE 55 CO 0.00 -0.65 -0.19 -1.17 0.70 0.00 0.00 175.22 173.91 1tj6 s LEU 56 N 1.36 2.02 -0.27 -0.37 2.96 0.01 -0.94 118.68 123.45 1tj6 s LEU 56 Ca 0.03 -0.34 -0.09 0.00 -0.22 0.00 0.00 54.13 53.51 1tj6 s LEU 56 Cb -0.13 -0.97 -0.03 0.00 0.50 0.00 0.00 46.19 45.56 1tj6 s LEU 56 CO -0.09 0.22 0.12 -0.69 -1.32 0.00 0.00 176.35 174.59 1tj6 s VAL 57 N -0.37 4.71 -0.12 1.68 1.01 -0.05 -1.30 120.40 125.95 1tj6 s VAL 57 Ca 0.06 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.98 1tj6 s VAL 57 Cb -0.08 -3.24 0.01 0.00 0.00 0.00 0.00 36.38 33.07 1tj6 s VAL 57 CO -0.00 0.28 -0.17 -2.28 0.00 0.00 0.00 175.10 172.92 1tj6 s HIS 58 N 1.67 2.21 -0.17 5.22 2.46 -0.14 -1.06 115.29 125.48 1tj6 s HIS 58 Ca 0.06 -1.09 0.01 0.00 0.47 0.00 0.00 55.06 54.52 1tj6 s HIS 58 Cb -0.16 -1.56 0.02 0.00 -0.13 0.00 0.00 32.58 30.75 1tj6 s HIS 58 CO 0.07 -0.54 -0.17 0.20 -2.47 0.00 0.00 174.74 171.83 1tj6 s GLY 59 N 0.97 1.28 -0.21 1.59 0.00 0.76 -0.71 107.32 111.00 1tj6 s GLY 59 Ca -0.06 -1.10 -0.01 0.00 0.00 0.00 0.00 44.72 43.55 1tj6 s GLY 59 CO -0.02 0.42 -0.12 1.85 0.00 0.00 0.00 173.10 175.22 1tj6 s GLU 60 N 1.37 2.97 0.15 2.90 2.12 -0.45 -1.23 118.70 126.54 1tj6 s GLU 60 Ca 0.04 -0.87 -0.31 0.00 0.36 0.00 0.00 54.97 54.19 1tj6 s GLU 60 Cb -0.13 -2.80 -0.09 0.00 0.26 0.00 0.00 34.13 31.36 1tj6 s GLU 60 CO -0.12 -0.29 1.45 0.50 -0.54 0.00 0.00 175.26 176.26 1tj6 s ARG 61 N 1.32 4.29 0.21 4.30 3.52 0.35 -0.47 118.95 132.48 1tj6 s ARG 61 Ca 0.03 2.19 -0.06 0.00 -0.13 0.00 0.00 55.73 57.76 1tj6 s ARG 61 Cb -0.15 -3.20 0.17 0.00 -1.56 0.00 0.00 34.95 30.22 1tj6 s ARG 61 CO -0.08 -0.48 1.68 -0.07 -0.81 0.00 0.00 175.30 175.55 1tj6 h LEU 62 N 6.49 0.93 -1.64 -0.88 3.38 -1.53 0.39 115.31 122.45 1tj6 h LEU 62 Ca -0.43 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.24 1tj6 h LEU 62 Cb 1.21 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 1tj6 h LEU 62 CO 0.86 1.00 -0.20 0.08 0.09 0.00 0.00 178.44 180.27 1tj6 h ARG 63 N 0.87 0.00 0.00 1.13 0.11 -1.91 -3.35 114.38 111.22 1tj6 h ARG 63 Ca 0.16 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.24 1tj6 h ARG 63 Cb 0.55 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.63 1tj6 h ARG 63 CO 0.03 0.20 0.00 -0.40 0.10 0.00 0.00 179.97 179.90 1tj6 n ASP 64 N -4.07 0.00 -1.58 0.08 5.75 -1.22 -5.03 116.55 110.48 1tj6 n ASP 64 Ca -0.02 -1.00 -0.18 0.00 -0.01 0.00 0.00 54.79 53.58 1tj6 n ASP 64 Cb 0.28 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.31 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 0.00 -1.30 -2.61 0.11 4.01 0.12 -4.97 118.16 113.52 1tj6 n LYS 65 Ca 0.00 1.04 -0.42 0.00 -0.51 0.00 0.00 58.31 58.43 1tj6 n LYS 65 Cb 0.38 -5.38 -0.03 0.00 -0.51 0.00 0.00 35.03 29.49 1tj6 n LYS 65 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1tj6 s THR 66 N -2.74 4.50 -0.34 -0.18 -1.32 -1.25 -4.73 115.64 109.59 1tj6 s THR 66 Ca 0.00 1.85 -0.26 0.00 -1.21 0.00 0.00 61.69 62.06 1tj6 s THR 66 Cb 0.00 -4.18 0.01 0.00 -1.51 0.00 0.00 72.50 66.82 1tj6 s THR 66 CO 0.00 0.17 0.95 -0.69 -2.21 0.00 0.00 174.62 172.84 1tj6 s VAL 67 N 0.82 4.60 -0.48 5.08 1.01 -1.26 -0.49 120.40 129.67 1tj6 s VAL 67 Ca 0.53 1.36 0.04 0.00 0.00 0.00 0.00 61.98 63.92 1tj6 s VAL 67 Cb -0.24 -4.32 0.03 0.00 0.00 0.00 0.00 36.38 31.84 1tj6 s VAL 67 CO 0.29 -0.46 0.59 2.30 0.00 0.00 0.00 175.10 177.81 1tj6 n ILE 68 N 5.86 0.00 -3.70 2.22 -5.35 -0.36 -4.95 119.36 113.08 1tj6 n ILE 68 Ca 0.08 -0.49 -0.17 0.00 -0.27 0.00 0.00 62.75 61.90 1tj6 n ILE 68 Cb 0.48 1.08 -0.16 0.00 -1.74 0.00 0.00 39.64 39.29 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 -0.50 0.36 -0.28 7.28 2.96 -1.05 -4.96 118.68 122.49 1tj6 s LEU 69 Ca 0.04 0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 54.11 1tj6 s LEU 69 Cb 0.03 0.06 0.13 0.00 0.50 0.00 0.00 46.19 46.91 1tj6 s LEU 69 CO 0.06 -0.21 0.26 -1.61 -1.32 0.00 0.00 176.35 173.53 1tj6 s GLU 70 N 1.83 0.29 -0.18 1.98 2.02 -1.24 -0.17 118.70 123.23 1tj6 s GLU 70 Ca -0.00 -0.19 0.00 0.00 0.02 0.00 0.00 54.97 54.80 1tj6 s GLU 70 Cb -0.12 -0.77 0.04 0.00 0.10 0.00 0.00 34.13 33.37 1tj6 s GLU 70 CO -0.04 -1.00 -0.09 0.00 0.02 0.00 0.00 175.26 174.15 1tj6 s VAL 72 N 1.51 4.80 0.52 0.00 1.01 -1.26 -0.87 120.40 126.10 1tj6 s VAL 72 Ca 0.01 1.71 -0.20 0.00 0.00 0.00 0.00 61.98 63.49 1tj6 s VAL 72 Cb -0.15 -4.18 -0.07 0.00 0.00 0.00 0.00 36.38 31.99 1tj6 s VAL 72 CO -0.08 -0.09 1.12 -0.76 0.00 0.00 0.00 175.10 175.29 1tj6 s LEU 73 N 2.83 3.81 0.07 3.92 1.43 -0.11 -5.01 118.68 125.62 1tj6 s LEU 73 Ca 0.38 2.15 0.02 0.00 -1.03 0.00 0.00 54.13 55.65 1tj6 s LEU 73 Cb -0.15 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.51 1tj6 s LEU 73 CO 0.08 -1.08 -0.07 -0.13 0.23 0.00 0.00 176.35 175.37 1tj6 s ARG 74 N -3.18 0.68 0.45 1.70 3.00 -1.26 -4.74 118.95 115.60 1tj6 s ARG 74 Ca 0.70 -1.05 0.12 0.00 0.00 0.00 0.00 55.73 55.50 1tj6 s ARG 74 Cb -0.23 -0.24 1.03 0.00 0.00 0.00 0.00 34.95 35.51 1tj6 s ARG 74 CO 0.27 0.01 2.06 0.07 0.00 0.00 0.00 175.30 177.71 1tj6 h ARG 75 N 3.71 0.19 -0.62 3.54 -0.00 -1.97 -2.99 114.38 116.25 1tj6 h ARG 75 Ca -0.36 -0.02 0.00 0.00 -0.00 0.00 0.00 59.98 59.60 1tj6 h ARG 75 Cb 1.18 -0.04 0.00 0.00 -0.00 0.00 0.00 29.97 31.11 1tj6 h ARG 75 CO 0.53 0.19 0.00 -0.40 -0.00 0.00 0.00 179.97 180.29 1tj6 n ASP 76 N -4.44 2.97 -4.75 0.08 5.75 -1.26 -4.97 116.55 109.93 1tj6 n ASP 76 Ca -0.01 -2.29 -0.38 0.00 -0.01 0.00 0.00 54.79 52.10 1tj6 n ASP 76 Cb 0.14 -0.46 0.04 0.00 -1.03 0.00 0.00 41.12 39.81 1tj6 n ASP 76 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1tj6 s LEU 77 N -1.29 3.80 -0.18 -2.12 0.20 -1.13 -4.92 118.68 113.05 1tj6 s LEU 77 Ca 0.28 2.71 -0.05 0.00 0.69 0.00 0.00 54.13 57.76 1tj6 s LEU 77 Cb 0.19 -4.34 -0.03 0.00 -0.43 0.00 0.00 46.19 41.58 1tj6 s LEU 77 CO 0.13 -1.62 -0.00 -0.69 -0.29 0.00 0.00 176.35 173.88 1tj6 s VAL 78 N -1.34 4.11 -0.11 1.68 1.01 -0.55 -4.97 120.40 120.23 1tj6 s VAL 78 Ca 0.73 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1tj6 s VAL 78 Cb -0.39 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.18 1tj6 s VAL 78 CO 0.45 0.46 -0.10 -0.47 0.00 0.00 0.00 175.10 175.44 1tj6 s TYR 79 N 0.62 1.59 -0.24 5.22 6.14 -1.26 -0.42 117.35 129.00 1tj6 s TYR 79 Ca -0.00 -0.76 -0.01 0.00 0.64 0.00 0.00 57.07 56.94 1tj6 s TYR 79 Cb -0.14 -1.25 0.03 0.00 0.42 0.00 0.00 41.96 41.02 1tj6 s TYR 79 CO 0.02 -0.47 -0.09 1.21 0.64 0.00 0.00 175.55 176.86 1tj6 s ASN 80 N 1.38 4.11 -1.17 4.32 3.84 0.54 -5.01 114.94 122.96 1tj6 s ASN 80 Ca -0.01 -0.88 -0.15 0.00 0.21 0.00 0.00 52.86 52.03 1tj6 s ASN 80 Cb -0.13 -1.62 0.15 0.00 -0.55 0.00 0.00 41.25 39.09 1tj6 s ASN 80 CO -0.05 -0.11 1.42 -0.54 -2.79 0.00 0.00 177.10 175.03 1tj6 s LYS 81 N 1.30 3.98 0.12 0.43 1.02 -1.26 -1.45 119.74 123.87 1tj6 s LYS 81 Ca 0.00 -2.32 -0.17 0.00 0.02 0.00 0.00 55.97 53.51 1tj6 s LYS 81 Cb -0.16 -5.11 -0.03 0.00 -0.52 0.00 0.00 37.83 32.01 1tj6 s LYS 81 CO -0.06 -1.85 1.63 0.28 -0.92 0.00 0.00 175.35 174.43 1tj6 h VAL 82 N 5.05 1.21 -4.14 3.17 2.07 -1.78 -3.45 116.25 118.39 1tj6 h VAL 82 Ca 0.30 -0.71 -0.38 0.00 0.82 0.00 0.00 66.70 66.74 1tj6 h VAL 82 Cb 0.90 1.02 -0.14 0.00 -1.52 0.00 0.00 31.29 31.55 1tj6 h VAL 82 CO 1.26 0.24 -0.57 0.42 0.02 0.00 0.00 177.57 178.94 1tj6 s THR 83 N -5.36 0.26 -1.23 2.57 -4.23 -0.86 -4.99 115.64 101.80 1tj6 s THR 83 Ca -0.13 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.47 1tj6 s THR 83 Cb 0.09 -2.52 0.12 0.00 1.34 0.00 0.00 72.50 71.53 1tj6 s THR 83 CO 0.75 0.00 1.23 -2.65 -0.54 0.00 0.00 174.62 173.41 1tj6 n PRO 84 N -0.51 0.07 -0.07 3.99 -0.02 -1.26 -2.73 135.00 134.46 1tj6 n PRO 84 Ca 0.02 0.27 0.02 0.00 -2.02 0.00 0.00 63.50 61.78 1tj6 n PRO 84 Cb 0.65 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.65 1tj6 n PRO 84 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1tj6 n THR 85 N -1.39 0.73 -3.59 3.45 -2.24 -1.26 -4.26 114.28 105.72 1tj6 n THR 85 Ca 0.03 -0.80 -0.23 0.00 -2.27 0.00 0.00 64.05 60.79 1tj6 n THR 85 Cb 0.09 0.52 -0.16 0.00 -2.10 0.00 0.00 70.33 68.68 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 -0.90 0.04 0.09 4.78 5.36 -1.11 -0.73 117.98 125.52 1tj6 s PHE 86 Ca 0.05 -0.07 0.10 0.00 -0.96 0.00 0.00 56.93 56.05 1tj6 s PHE 86 Cb 0.05 -0.56 -0.03 0.00 -0.34 0.00 0.00 43.02 42.13 1tj6 s PHE 86 CO 0.01 -0.49 -0.25 -1.01 -1.46 0.00 0.00 175.22 172.02 1tj6 s HIS 87 N 2.20 2.15 0.08 10.12 3.76 -0.98 -2.02 115.29 130.60 1tj6 s HIS 87 Ca 0.04 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.55 1tj6 s HIS 87 Cb -0.15 -1.21 -0.04 0.00 1.11 0.00 0.00 32.58 32.29 1tj6 s HIS 87 CO -0.09 0.23 -0.04 -3.38 -0.85 0.00 0.00 174.74 170.61 1tj6 s HIS 88 N -0.98 0.72 0.15 1.40 -3.43 -0.53 -1.08 115.29 111.54 1tj6 s HIS 88 Ca 0.11 -1.01 -0.07 0.00 -0.80 0.00 0.00 55.06 53.30 1tj6 s HIS 88 Cb -0.10 -0.46 -0.02 0.00 -1.43 0.00 0.00 32.58 30.57 1tj6 s HIS 88 CO 0.04 -0.28 0.21 1.67 -2.00 0.00 0.00 174.74 174.39 1tj6 s TRP 89 N -3.79 0.52 -0.01 0.38 -2.14 0.28 -0.34 118.94 113.84 1tj6 s TRP 89 Ca 0.10 -0.89 -0.00 0.00 2.66 0.00 0.00 56.10 57.97 1tj6 s TRP 89 Cb 0.07 -0.18 0.01 0.00 -3.10 0.00 0.00 33.47 30.27 1tj6 s TRP 89 CO -0.07 -0.65 0.01 0.50 -2.66 0.00 0.00 176.95 174.08 1tj6 s ARG 90 N -3.99 -0.02 -0.22 3.25 3.52 0.44 -1.32 118.95 120.62 1tj6 s ARG 90 Ca 0.18 0.08 0.01 0.00 -0.13 0.00 0.00 55.73 55.87 1tj6 s ARG 90 Cb 0.05 -0.10 0.05 0.00 -1.56 0.00 0.00 34.95 33.38 1tj6 s ARG 90 CO -0.00 -0.07 -0.07 0.42 -0.81 0.00 0.00 175.30 174.77 1tj6 s ILE 91 N 0.45 1.59 0.00 4.11 1.01 -0.47 -1.49 121.20 126.40 1tj6 s ILE 91 Ca -0.04 -1.15 0.00 0.00 0.00 0.00 0.00 60.65 59.46 1tj6 s ILE 91 Cb -0.05 -1.78 0.00 0.00 0.01 0.00 0.00 42.46 40.64 1tj6 s ILE 91 CO -0.01 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.54 1tj6 n GLY 92 N 4.67 3.41 0.55 6.18 0.00 -1.26 -1.94 105.19 116.80 1tj6 n GLY 92 Ca -0.13 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.81 1tj6 n GLY 92 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1tj6 n ASP 93 N 8.94 2.74 -4.69 1.61 5.75 -1.26 -4.97 116.55 124.67 1tj6 n ASP 93 Ca 0.00 -1.96 -0.40 0.00 -0.01 0.00 0.00 54.79 52.42 1tj6 n ASP 93 Cb 0.00 -0.19 -0.05 0.00 -1.03 0.00 0.00 41.12 39.86 1tj6 n ASP 93 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1tj6 s LYS 94 N -0.99 4.36 -0.09 0.11 3.01 -0.82 -5.06 119.74 120.26 1tj6 s LYS 94 Ca 0.20 0.90 0.04 0.00 -1.01 0.00 0.00 55.97 56.10 1tj6 s LYS 94 Cb 0.10 -3.51 -0.00 0.00 -1.01 0.00 0.00 37.83 33.41 1tj6 s LYS 94 CO 0.14 -0.13 -0.23 0.15 0.51 0.00 0.00 175.35 175.79 1tj6 s LYS 95 N 1.46 2.95 0.06 1.68 1.02 -1.26 -1.37 119.74 124.28 1tj6 s LYS 95 Ca 0.37 -0.86 0.04 0.00 0.02 0.00 0.00 55.97 55.54 1tj6 s LYS 95 Cb -0.17 -2.30 -0.03 0.00 -0.52 0.00 0.00 37.83 34.81 1tj6 s LYS 95 CO 0.15 0.24 -0.11 -0.06 -0.92 0.00 0.00 175.35 174.65 1tj6 s PHE 96 N 0.19 0.99 0.18 3.18 0.08 -0.43 -4.78 117.98 117.40 1tj6 s PHE 96 Ca -0.14 -0.49 -0.13 0.00 0.12 0.00 0.00 56.93 56.29 1tj6 s PHE 96 Cb -0.17 -0.57 0.01 0.00 -0.57 0.00 0.00 43.02 41.73 1tj6 s PHE 96 CO 0.07 -0.00 0.41 0.20 -0.10 0.00 0.00 175.22 175.80 1tj6 s GLY 97 N -1.72 0.18 -0.01 4.36 0.00 -1.19 -0.55 107.32 108.39 1tj6 s GLY 97 Ca -0.05 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.14 1tj6 s GLY 97 CO 0.01 -0.54 -0.00 1.08 0.00 0.00 0.00 173.10 173.65 1tj6 s LEU 98 N -2.92 1.76 -0.28 0.66 1.02 -0.24 -0.94 118.68 117.74 1tj6 s LEU 98 Ca 0.13 -0.01 -0.11 0.00 0.02 0.00 0.00 54.13 54.16 1tj6 s LEU 98 Cb 0.01 -0.07 -0.04 0.00 0.02 0.00 0.00 46.19 46.11 1tj6 s LEU 98 CO -0.02 -0.02 0.18 -0.89 0.02 0.00 0.00 176.35 175.62 1tj6 s THR 99 N 0.26 5.14 0.33 5.49 2.01 -0.18 -2.31 115.64 126.38 1tj6 s THR 99 Ca -0.02 0.06 -0.11 0.00 0.31 0.00 0.00 61.69 61.93 1tj6 s THR 99 Cb -0.04 -3.47 -0.07 0.00 0.01 0.00 0.00 72.50 68.93 1tj6 s THR 99 CO -0.01 0.23 0.69 -0.36 -0.69 0.00 0.00 174.62 174.48 1tj6 s PHE 100 N 1.73 3.43 -0.58 4.92 0.08 0.09 -0.96 117.98 126.69 1tj6 s PHE 100 Ca 0.07 1.03 0.26 0.00 0.12 0.00 0.00 56.93 58.40 1tj6 s PHE 100 Cb -0.16 -2.40 0.80 0.00 -0.57 0.00 0.00 43.02 40.69 1tj6 s PHE 100 CO 0.10 0.07 1.75 1.96 -0.10 0.00 0.00 175.22 179.00 1tj6 h GLN 101 N 1.91 0.00 -2.57 0.44 4.20 -1.88 -3.47 115.11 113.73 1tj6 h GLN 101 Ca -0.47 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.18 1tj6 h GLN 101 Cb 1.18 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 28.80 1tj6 h GLN 101 CO 0.66 0.00 0.12 -1.54 -0.67 0.00 0.00 178.83 177.39 1tj6 s SER 102 N -4.83 -0.53 0.38 1.46 1.04 -1.26 -5.04 113.70 104.92 1tj6 s SER 102 Ca 0.08 0.31 0.08 0.00 0.48 0.00 0.00 55.95 56.91 1tj6 s SER 102 Cb 0.10 0.53 0.83 0.00 0.10 0.00 0.00 66.02 67.58 1tj6 s SER 102 CO 0.57 -0.73 1.96 -0.65 0.98 0.00 0.00 173.24 175.36 1tj6 h PRO 103 N 2.71 0.63 -0.77 4.02 0.11 -1.90 -2.49 132.00 134.31 1tj6 h PRO 103 Ca -0.30 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.78 1tj6 h PRO 103 Cb 1.21 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 1tj6 h PRO 103 CO 0.40 0.42 0.51 0.00 -0.21 0.00 0.00 178.00 179.11 1tj6 h ALA 104 N 1.63 0.97 -0.65 -0.75 0.00 -1.96 -1.67 119.26 116.83 1tj6 h ALA 104 Ca 0.31 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 1tj6 h ALA 104 Cb 0.38 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1tj6 h ALA 104 CO -0.10 0.39 0.22 -0.44 0.00 0.00 0.00 179.25 179.31 1tj6 h ASP 105 N 1.04 0.94 -0.55 0.00 5.19 -1.84 -1.29 116.42 119.91 1tj6 h ASP 105 Ca 0.28 -0.20 -0.07 0.00 -0.62 0.00 0.00 57.03 56.43 1tj6 h ASP 105 Cb -0.12 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 39.12 1tj6 h ASP 105 CO -0.06 0.89 0.11 0.00 -3.12 0.00 0.00 179.24 177.05 1tj6 h ALA 106 N 1.09 1.07 -0.29 3.45 0.00 -1.07 -0.47 119.26 123.04 1tj6 h ALA 106 Ca 0.21 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1tj6 h ALA 106 Cb 0.27 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1tj6 h ALA 106 CO -0.01 0.61 -0.15 0.00 0.00 0.00 0.00 179.25 179.70 1tj6 h ARG 107 N 0.90 0.61 -0.83 0.00 3.08 -1.09 -1.16 114.38 115.90 1tj6 h ARG 107 Ca 0.19 -0.27 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 1tj6 h ARG 107 Cb 0.38 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 1tj6 h ARG 107 CO 0.01 0.85 0.44 0.00 -1.07 0.00 0.00 179.97 180.20 1tj6 h ALA 108 N 0.75 1.06 -0.24 0.04 0.00 -0.98 -0.89 119.26 119.00 1tj6 h ALA 108 Ca 0.06 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1tj6 h ALA 108 Cb 0.67 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1tj6 h ALA 108 CO 0.04 0.58 -0.00 0.35 0.00 0.00 0.00 179.25 180.22 1tj6 h PHE 109 N 1.15 0.46 -0.71 0.00 3.57 -0.91 -1.45 116.94 119.06 1tj6 h PHE 109 Ca 0.29 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 1tj6 h PHE 109 Cb 0.04 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 1tj6 h PHE 109 CO 0.01 0.60 0.38 0.22 -2.23 0.00 0.00 178.31 177.28 1tj6 h ASP 110 N 0.19 0.89 -0.76 0.41 3.58 -1.09 -0.09 116.42 119.55 1tj6 h ASP 110 Ca 0.07 -0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.39 1tj6 h ASP 110 Cb 0.42 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 41.20 1tj6 h ASP 110 CO 0.01 0.74 0.39 0.03 -2.88 0.00 0.00 179.24 177.53 1tj6 h ARG 111 N 0.97 1.09 -0.37 0.28 2.47 -1.04 -1.18 114.38 116.59 1tj6 h ARG 111 Ca 0.25 -0.15 -0.02 0.00 -1.26 0.00 0.00 59.98 58.80 1tj6 h ARG 111 Cb 0.06 -0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 28.16 1tj6 h ARG 111 CO -0.04 0.83 0.18 0.78 0.56 0.00 0.00 179.97 182.28 1tj6 h GLY 112 N 1.07 0.58 0.88 0.04 0.00 -0.40 -0.45 103.07 104.80 1tj6 h GLY 112 Ca 0.26 -0.29 0.02 0.00 0.00 0.00 0.00 47.33 47.33 1tj6 h GLY 112 CO -0.04 0.28 0.34 -2.22 0.00 0.00 0.00 176.54 174.91 1tj6 h ILE 113 N 0.47 1.07 -0.49 2.60 1.08 -0.72 -1.35 117.51 120.16 1tj6 h ILE 113 Ca 0.13 -0.23 -0.11 0.00 -0.39 0.00 0.00 64.86 64.26 1tj6 h ILE 113 Cb 0.13 0.33 -0.02 0.00 -3.07 0.00 0.00 36.82 34.19 1tj6 h ILE 113 CO -0.02 0.12 -0.13 0.03 -0.69 0.00 0.00 178.15 177.47 1tj6 h ARG 114 N 0.68 0.91 -0.55 2.37 3.08 -0.97 -0.46 114.38 119.44 1tj6 h ARG 114 Ca 0.23 -0.33 -0.06 0.00 0.07 0.00 0.00 59.98 59.88 1tj6 h ARG 114 Cb 0.02 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1tj6 h ARG 114 CO -0.09 0.99 0.11 -0.09 -1.07 0.00 0.00 179.97 179.81 1tj6 h ARG 115 N 0.81 0.91 -0.60 0.04 9.65 -0.92 -1.28 114.38 122.99 1tj6 h ARG 115 Ca 0.13 -0.23 -0.02 0.00 -1.10 0.00 0.00 59.98 58.76 1tj6 h ARG 115 Cb 0.66 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 29.10 1tj6 h ARG 115 CO 0.05 0.87 0.32 0.00 2.80 0.00 0.00 179.97 184.00 1tj6 h ALA 116 N 1.00 0.77 -0.50 2.80 0.00 -0.85 -1.39 119.26 121.10 1tj6 h ALA 116 Ca 0.17 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1tj6 h ALA 116 Cb 0.39 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1tj6 h ALA 116 CO 0.01 0.31 0.00 0.82 0.00 0.00 0.00 179.25 180.39 1tj6 h ILE 117 N 0.82 1.25 -0.76 0.00 1.08 -0.92 0.21 117.51 119.19 1tj6 h ILE 117 Ca 0.21 -1.02 0.01 0.00 -0.39 0.00 0.00 64.86 63.67 1tj6 h ILE 117 Cb 0.07 0.86 -0.04 0.00 -3.07 0.00 0.00 36.82 34.65 1tj6 h ILE 117 CO -0.03 0.36 0.50 -0.08 -0.69 0.00 0.00 178.15 178.21 1tj6 h GLU 118 N 0.77 1.00 -0.06 2.37 4.81 -0.78 -0.42 114.58 122.28 1tj6 h GLU 118 Ca 0.15 -0.06 -0.18 0.00 -0.13 0.00 0.00 59.36 59.14 1tj6 h GLU 118 Cb 0.46 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1tj6 h GLU 118 CO 0.02 0.67 -0.73 -0.44 -0.73 0.00 0.00 179.01 177.80 1tj6 h ASP 119 N 1.03 0.38 -0.33 1.04 3.32 -0.61 -3.22 116.42 118.03 1tj6 h ASP 119 Ca 0.28 -0.25 -0.07 0.00 0.02 0.00 0.00 57.03 57.00 1tj6 h ASP 119 Cb -0.11 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 1tj6 h ASP 119 CO -0.06 0.98 -0.06 0.25 -1.72 0.00 0.00 179.24 178.63 1tj6 h LEU 120 N 0.22 0.63 -8.77 1.55 5.85 -0.41 -3.43 115.31 110.94 1tj6 h LEU 120 Ca -0.03 -0.35 -0.56 0.00 0.84 0.00 0.00 57.88 57.78 1tj6 h LEU 120 Cb 1.29 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 42.09 1tj6 h LEU 120 CO 0.12 0.84 0.98 -0.44 -0.34 0.00 0.00 178.44 179.59 1tj6 s SER 121 N -6.21 6.54 0.41 1.25 0.01 -0.18 -5.00 113.70 110.51 1tj6 s SER 121 Ca -0.13 0.66 0.07 0.00 1.31 0.00 0.00 55.95 57.86 1tj6 s SER 121 Cb 0.09 -2.55 -0.06 0.00 0.21 0.00 0.00 66.02 63.71 1tj6 s SER 121 CO 0.79 -1.30 0.13 -1.10 0.41 0.00 0.00 173.24 172.17 1tj6 s GLN 122 N 4.58 2.15 0.00 12.44 -1.52 -1.26 -4.92 119.66 131.13 1tj6 s GLN 122 Ca 0.53 -1.90 0.00 0.00 -1.95 0.00 0.00 55.36 52.04 1tj6 s GLN 122 Cb -0.10 -1.89 0.00 0.00 -0.22 0.00 0.00 33.01 30.79 1tj6 s GLN 122 CO 0.31 -0.08 0.00 0.41 -0.25 0.00 0.00 175.29 175.68