#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gj6 s PRO 7 N 0.00 4.38 0.17 3.49 0.02 -1.26 -5.08 135.00 136.73 3gj6 s PRO 7 Ca 0.00 1.09 0.01 0.00 0.02 0.00 0.00 61.00 62.11 3gj6 s PRO 7 Cb 0.00 -2.75 -0.04 0.00 0.02 0.00 0.00 34.50 31.73 3gj6 s PRO 7 CO 0.00 0.29 0.33 -1.14 -0.33 0.00 0.00 177.00 176.15 3gj6 s GLN 8 N -2.18 3.48 -0.46 5.54 0.74 -1.26 -5.07 119.66 120.45 3gj6 s GLN 8 Ca 0.49 -0.46 -0.20 0.00 0.05 0.00 0.00 55.36 55.24 3gj6 s GLN 8 Cb -0.16 -2.91 0.03 0.00 1.10 0.00 0.00 33.01 31.07 3gj6 s GLN 8 CO 0.21 0.47 0.62 0.08 -0.55 0.00 0.00 175.29 176.12 3gj6 s VAL 9 N -1.79 4.86 0.01 1.34 1.01 -1.26 -5.05 120.40 119.53 3gj6 s VAL 9 Ca 0.37 -0.13 -0.00 0.00 0.00 0.00 0.00 61.98 62.21 3gj6 s VAL 9 Cb -0.11 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 32.04 3gj6 s VAL 9 CO 0.29 -0.65 -0.01 0.00 0.00 0.00 0.00 175.10 174.73 3gj6 s GLN 10 N 2.70 0.19 0.04 2.72 -2.07 -1.26 -0.51 119.66 121.47 3gj6 s GLN 10 Ca 0.19 -0.34 0.07 0.00 -1.82 0.00 0.00 55.36 53.47 3gj6 s GLN 10 Cb -0.16 0.07 -0.02 0.00 -1.09 0.00 0.00 33.01 31.81 3gj6 s GLN 10 CO 0.16 -0.03 -0.21 -0.06 -1.32 0.00 0.00 175.29 173.82 3gj6 s PHE 11 N -0.85 1.88 -0.16 9.60 0.08 0.20 -4.97 117.98 123.76 3gj6 s PHE 11 Ca -0.09 -0.38 -0.29 0.00 0.12 0.00 0.00 56.93 56.29 3gj6 s PHE 11 Cb -0.06 -1.13 -0.00 0.00 -0.57 0.00 0.00 43.02 41.26 3gj6 s PHE 11 CO -0.00 0.08 1.06 0.21 -0.10 0.00 0.00 175.22 176.46 3gj6 s LYS 12 N -1.11 4.33 -0.24 0.44 2.20 -1.26 -0.03 119.74 124.07 3gj6 s LYS 12 Ca 0.08 1.42 -0.01 0.00 -0.36 0.00 0.00 55.97 57.10 3gj6 s LYS 12 Cb -0.09 -3.61 0.03 0.00 -1.51 0.00 0.00 37.83 32.65 3gj6 s LYS 12 CO 0.01 -0.50 -0.09 -1.17 -0.36 0.00 0.00 175.35 173.24 3gj6 s LEU 13 N 2.69 3.03 -0.01 5.43 0.20 -0.86 -1.58 118.68 127.58 3gj6 s LEU 13 Ca 0.47 -0.89 -0.19 0.00 0.69 0.00 0.00 54.13 54.22 3gj6 s LEU 13 Cb -0.18 -1.62 -0.06 0.00 -0.43 0.00 0.00 46.19 43.91 3gj6 s LEU 13 CO 0.13 -0.11 0.53 0.68 -0.29 0.00 0.00 176.35 177.28 3gj6 s VAL 14 N 1.29 4.94 -0.36 1.68 -7.23 -0.92 -0.47 120.40 119.33 3gj6 s VAL 14 Ca -0.00 1.10 -0.03 0.00 -1.81 0.00 0.00 61.98 61.24 3gj6 s VAL 14 Cb -0.16 -3.86 0.08 0.00 0.56 0.00 0.00 36.38 33.00 3gj6 s VAL 14 CO -0.06 0.47 0.13 -0.22 -0.31 0.00 0.00 175.10 175.10 3gj6 s LEU 15 N -0.45 4.69 0.30 1.32 0.20 -1.04 -2.20 118.68 121.50 3gj6 s LEU 15 Ca 0.28 -1.66 0.11 0.00 0.69 0.00 0.00 54.13 53.55 3gj6 s LEU 15 Cb -0.18 -1.80 -0.06 0.00 -0.43 0.00 0.00 46.19 43.73 3gj6 s LEU 15 CO 0.16 -0.42 -0.15 0.68 -0.29 0.00 0.00 176.35 176.32 3gj6 s VAL 16 N 1.22 2.34 0.00 1.68 -7.23 -0.90 -4.66 120.40 112.85 3gj6 s VAL 16 Ca 0.03 -2.32 0.00 0.00 -1.81 0.00 0.00 61.98 57.88 3gj6 s VAL 16 Cb -0.21 -2.43 0.00 0.00 0.56 0.00 0.00 36.38 34.30 3gj6 s VAL 16 CO -0.02 -0.33 0.00 0.61 -0.31 0.00 0.00 175.10 175.05 3gj6 n GLY 17 N -0.68 3.00 3.52 2.32 0.00 -1.26 -1.37 105.19 110.72 3gj6 n GLY 17 Ca -0.05 -1.39 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 3gj6 n GLY 17 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gj6 n ASP 18 N 0.00 -0.31 -4.76 1.61 9.92 -1.25 -4.92 116.55 116.83 3gj6 n ASP 18 Ca 0.00 0.82 -0.39 0.00 -0.53 0.00 0.00 54.79 54.69 3gj6 n ASP 18 Cb 0.00 -1.24 0.01 0.00 -0.64 0.00 0.00 41.12 39.25 3gj6 n ASP 18 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 3gj6 s GLY 19 N -1.10 2.88 0.00 0.44 0.00 -1.26 -2.89 107.32 105.39 3gj6 s GLY 19 Ca 0.69 1.20 0.00 0.00 0.00 0.00 0.00 44.72 46.61 3gj6 s GLY 19 CO 0.53 1.74 0.00 0.61 0.00 0.00 0.00 173.10 175.99 3gj6 n GLY 20 N 0.62 0.91 0.20 0.20 0.00 -1.26 -4.91 105.19 100.95 3gj6 n GLY 20 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 3gj6 n GLY 20 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3gj6 h THR 21 N 0.00 0.00 0.00 2.61 1.35 -1.89 -3.48 112.91 111.50 3gj6 h THR 21 Ca 0.00 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 3gj6 h THR 21 Cb 0.00 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 3gj6 h THR 21 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3gj6 n GLY 22 N 0.86 1.24 0.30 5.82 0.00 -1.26 -4.61 105.19 107.54 3gj6 n GLY 22 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 3gj6 n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gj6 h LYS 23 N 0.47 -0.32 -0.02 1.61 1.57 -1.91 0.01 116.57 117.97 3gj6 h LYS 23 Ca 0.00 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3gj6 h LYS 23 Cb 0.00 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 3gj6 h LYS 23 CO 0.00 -0.21 0.01 1.15 -0.57 0.00 0.00 179.45 179.82 3gj6 h THR 24 N -0.33 1.00 -1.09 -0.16 2.02 -1.95 -0.67 112.91 111.72 3gj6 h THR 24 Ca 0.11 -0.01 0.29 0.00 0.77 0.00 0.00 66.41 67.57 3gj6 h THR 24 Cb 0.50 0.97 -0.09 0.00 -1.74 0.00 0.00 68.15 67.79 3gj6 h THR 24 CO -0.34 0.00 0.71 0.74 0.37 0.00 0.00 175.52 177.00 3gj6 h THR 25 N 0.02 0.46 0.03 3.16 2.02 -1.91 -2.58 112.91 114.11 3gj6 h THR 25 Ca 0.01 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 3gj6 h THR 25 Cb 0.00 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.55 3gj6 h THR 25 CO -0.01 0.06 -0.01 0.15 0.37 0.00 0.00 175.52 176.07 3gj6 h PHE 26 N 0.30 -0.03 -0.23 3.16 3.57 0.47 -3.25 116.94 120.94 3gj6 h PHE 26 Ca 0.61 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 62.18 3gj6 h PHE 26 Cb 1.72 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 40.47 3gj6 h PHE 26 CO -0.00 0.43 0.21 -0.24 -2.23 0.00 0.00 178.31 176.48 3gj6 h VAL 27 N -0.99 0.61 0.00 1.41 3.04 -1.29 -2.24 116.25 116.79 3gj6 h VAL 27 Ca -0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3gj6 h VAL 27 Cb 0.48 0.84 0.00 0.00 -2.01 0.00 0.00 31.29 30.60 3gj6 h VAL 27 CO 0.01 0.00 0.00 0.11 -1.01 0.00 0.00 177.57 176.68 3gj6 h LYS 28 N 0.00 0.00 -0.04 4.17 1.57 -1.51 -3.23 116.57 117.54 3gj6 h LYS 28 Ca 0.11 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3gj6 h LYS 28 Cb 0.53 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 3gj6 h LYS 28 CO -0.00 0.00 0.13 0.00 -0.57 0.00 0.00 179.45 179.01 3gj6 h ARG 29 N 0.00 0.00 -4.72 3.15 2.47 -1.43 -3.38 114.38 110.47 3gj6 h ARG 29 Ca 0.00 0.00 -0.70 0.00 -1.26 0.00 0.00 59.98 58.02 3gj6 h ARG 29 Cb 0.66 0.00 -0.20 0.00 -1.65 0.00 0.00 29.97 28.78 3gj6 h ARG 29 CO 0.00 0.00 0.01 -1.58 0.56 0.00 0.00 179.97 178.96 3gj6 s HIS 30 N -4.26 3.06 0.21 3.04 2.46 -1.22 -0.76 115.29 117.82 3gj6 s HIS 30 Ca -0.04 -0.80 -0.08 0.00 0.47 0.00 0.00 55.06 54.60 3gj6 s HIS 30 Cb 0.12 -3.70 0.29 0.00 -0.13 0.00 0.00 32.58 29.16 3gj6 s HIS 30 CO 0.41 -1.11 1.78 -0.07 -2.47 0.00 0.00 174.74 173.28 3gj6 h LEU 31 N 9.65 0.41 -0.28 8.88 3.38 -1.65 0.23 115.31 135.92 3gj6 h LEU 31 Ca -0.29 0.06 -0.20 0.00 0.09 0.00 0.00 57.88 57.55 3gj6 h LEU 31 Cb 1.09 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3gj6 h LEU 31 CO 1.01 0.25 -0.63 0.74 0.09 0.00 0.00 178.44 179.90 3gj6 h THR 32 N 0.56 1.28 -0.19 0.22 2.02 -1.92 -1.82 112.91 113.07 3gj6 h THR 32 Ca 0.32 -1.84 0.01 0.00 0.77 0.00 0.00 66.41 65.67 3gj6 h THR 32 Cb 0.32 1.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.50 3gj6 h THR 32 CO -0.25 0.59 0.10 1.23 0.37 0.00 0.00 175.52 177.56 3gj6 h GLY 33 N 0.72 0.25 0.64 2.16 0.00 -1.49 -1.26 103.07 104.09 3gj6 h GLY 33 Ca -0.01 -0.08 0.08 0.00 0.00 0.00 0.00 47.33 47.33 3gj6 h GLY 33 CO 0.13 0.07 0.58 -2.09 0.00 0.00 0.00 176.54 175.23 3gj6 h GLU 34 N 0.21 0.99 0.00 4.80 4.57 -0.80 -0.03 114.58 124.31 3gj6 h GLU 34 Ca 0.07 -0.06 -0.07 0.00 -1.18 0.00 0.00 59.36 58.13 3gj6 h GLU 34 Cb 0.00 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 3gj6 h GLU 34 CO -0.04 0.65 -0.66 0.66 -1.18 0.00 0.00 179.01 178.44 3gj6 h SER 35 N 1.02 0.00 -0.02 1.04 4.64 -1.07 -3.27 113.55 115.89 3gj6 h SER 35 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 3gj6 h SER 35 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3gj6 h SER 35 CO -0.21 0.27 -0.05 -0.62 -0.87 0.00 0.00 176.83 175.35 3gj6 n GLU 36 N -3.00 1.68 -1.38 4.77 1.02 -0.50 -5.00 120.64 118.24 3gj6 n GLU 36 Ca -0.00 -1.55 -0.36 0.00 -0.02 0.00 0.00 57.16 55.23 3gj6 n GLU 36 Cb 0.66 -1.37 0.08 0.00 -0.02 0.00 0.00 31.44 30.79 3gj6 n GLU 36 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3gj6 n LYS 37 N 0.93 0.53 -4.72 3.49 2.85 -0.04 -4.73 118.16 116.48 3gj6 n LYS 37 Ca 0.11 0.24 -0.32 0.00 -1.05 0.00 0.00 58.31 57.29 3gj6 n LYS 37 Cb 0.47 -2.22 -0.07 0.00 -0.65 0.00 0.00 35.03 32.56 3gj6 n LYS 37 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3gj6 s LYS 38 N -3.29 2.17 -0.29 -1.58 1.02 0.15 -4.94 119.74 112.97 3gj6 s LYS 38 Ca 0.73 -2.39 -0.04 0.00 0.02 0.00 0.00 55.97 54.30 3gj6 s LYS 38 Cb -0.35 -1.31 0.10 0.00 -0.52 0.00 0.00 37.83 35.75 3gj6 s LYS 38 CO 0.50 -0.42 0.13 -0.47 -0.92 0.00 0.00 175.35 174.17 3gj6 s TYR 39 N -2.96 0.37 -0.52 3.18 5.04 -1.26 -1.25 117.35 119.96 3gj6 s TYR 39 Ca 0.07 -0.93 -0.28 0.00 -2.44 0.00 0.00 57.07 53.48 3gj6 s TYR 39 Cb 0.01 -0.92 0.01 0.00 0.35 0.00 0.00 41.96 41.41 3gj6 s TYR 39 CO 0.04 -0.83 1.43 0.08 -1.34 0.00 0.00 175.55 174.93 3gj6 s VAL 40 N 2.05 3.80 -0.42 3.14 1.01 0.01 -4.87 120.40 125.12 3gj6 s VAL 40 Ca 0.09 0.72 0.23 0.00 0.00 0.00 0.00 61.98 63.03 3gj6 s VAL 40 Cb -0.16 -4.34 0.18 0.00 0.00 0.00 0.00 36.38 32.05 3gj6 s VAL 40 CO -0.35 -1.03 1.39 0.00 0.00 0.00 0.00 175.10 175.10 3gj6 h ALA 41 N 11.12 0.77 -0.02 5.51 0.00 -1.97 -1.88 119.26 132.79 3gj6 h ALA 41 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3gj6 h ALA 41 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3gj6 h ALA 41 CO 1.15 0.00 0.00 0.25 0.00 0.00 0.00 179.25 180.65 3gj6 n THR 42 N -2.75 0.02 -0.43 0.00 -2.24 -1.26 -3.63 114.28 103.99 3gj6 n THR 42 Ca 0.03 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3gj6 n THR 42 Cb 0.52 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 3gj6 n THR 42 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3gj6 n LEU 43 N -0.66 0.00 -3.12 3.22 4.77 -1.20 -5.06 117.00 114.95 3gj6 n LEU 43 Ca 0.19 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.14 3gj6 n LEU 43 Cb 0.14 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.24 3gj6 n LEU 43 CO 0.15 0.00 0.28 0.61 -1.33 0.00 0.00 177.39 177.10 3gj6 n GLY 44 N 0.00 -1.23 3.48 -0.72 0.00 -0.78 -4.89 105.19 101.05 3gj6 n GLY 44 Ca 0.00 0.49 -0.07 0.00 0.00 0.00 0.00 46.02 46.44 3gj6 n GLY 44 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gj6 s VAL 45 N -3.04 -0.27 -0.31 1.61 1.01 -0.78 -2.31 120.40 116.30 3gj6 s VAL 45 Ca 0.05 0.05 -0.15 0.00 0.00 0.00 0.00 61.98 61.93 3gj6 s VAL 45 Cb -0.01 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 3gj6 s VAL 45 CO 0.76 0.02 0.38 -1.61 0.00 0.00 0.00 175.10 174.65 3gj6 s GLU 46 N 1.93 3.75 -0.06 2.72 2.02 -0.65 -0.81 118.70 127.61 3gj6 s GLU 46 Ca -0.08 -0.22 -0.20 0.00 0.02 0.00 0.00 54.97 54.49 3gj6 s GLU 46 Cb -0.08 -3.74 -0.05 0.00 0.10 0.00 0.00 34.13 30.36 3gj6 s GLU 46 CO -0.17 -0.43 0.57 0.08 0.02 0.00 0.00 175.26 175.33 3gj6 s VAL 47 N 2.07 5.04 -0.32 2.63 1.01 -0.38 -1.13 120.40 129.32 3gj6 s VAL 47 Ca 0.14 1.17 0.03 0.00 0.00 0.00 0.00 61.98 63.31 3gj6 s VAL 47 Cb -0.16 -3.91 0.08 0.00 0.00 0.00 0.00 36.38 32.40 3gj6 s VAL 47 CO 0.11 0.36 0.01 -1.00 0.00 0.00 0.00 175.10 174.58 3gj6 s HIS 48 N 0.27 3.55 -0.52 5.22 3.76 -0.13 0.30 115.29 127.73 3gj6 s HIS 48 Ca 0.30 -2.64 -0.27 0.00 -0.15 0.00 0.00 55.06 52.31 3gj6 s HIS 48 Cb -0.17 -2.56 -0.02 0.00 1.11 0.00 0.00 32.58 30.94 3gj6 s HIS 48 CO 0.15 -0.92 1.80 -2.14 -0.85 0.00 0.00 174.74 172.78 3gj6 s PRO 49 N 1.02 2.91 -0.49 8.40 0.02 -1.26 -2.26 135.00 143.34 3gj6 s PRO 49 Ca 0.03 0.84 -0.15 0.00 0.02 0.00 0.00 61.00 61.74 3gj6 s PRO 49 Cb -0.20 -4.30 0.09 0.00 0.02 0.00 0.00 34.50 30.11 3gj6 s PRO 49 CO -0.06 -2.39 0.42 -0.51 -0.33 0.00 0.00 177.00 174.13 3gj6 s LEU 50 N 8.12 5.76 0.04 -5.54 1.43 -0.02 -3.51 118.68 124.96 3gj6 s LEU 50 Ca 0.69 -1.45 -0.24 0.00 -1.03 0.00 0.00 54.13 52.10 3gj6 s LEU 50 Cb -0.15 -2.19 -0.05 0.00 0.03 0.00 0.00 46.19 43.83 3gj6 s LEU 50 CO 0.25 -0.70 0.75 -0.69 0.23 0.00 0.00 176.35 176.19 3gj6 s VAL 51 N 1.63 4.76 0.02 -1.59 1.01 -1.26 -1.52 120.40 123.45 3gj6 s VAL 51 Ca 0.04 1.59 0.07 0.00 0.00 0.00 0.00 61.98 63.68 3gj6 s VAL 51 Cb -0.26 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.01 3gj6 s VAL 51 CO 0.06 0.36 -0.22 -0.36 0.00 0.00 0.00 175.10 174.94 3gj6 s PHE 52 N -0.03 1.96 -0.45 5.22 0.40 0.05 -4.86 117.98 120.27 3gj6 s PHE 52 Ca 0.38 -0.38 -0.15 0.00 -0.60 0.00 0.00 56.93 56.18 3gj6 s PHE 52 Cb -0.20 -1.20 0.06 0.00 0.51 0.00 0.00 43.02 42.19 3gj6 s PHE 52 CO 0.22 0.05 0.35 -1.01 0.70 0.00 0.00 175.22 175.54 3gj6 s HIS 53 N -0.69 3.25 0.38 0.36 3.76 -1.26 -0.78 115.29 120.31 3gj6 s HIS 53 Ca 0.09 -0.92 -0.01 0.00 -0.15 0.00 0.00 55.06 54.07 3gj6 s HIS 53 Cb -0.09 -3.00 -0.03 0.00 1.11 0.00 0.00 32.58 30.57 3gj6 s HIS 53 CO 0.01 -0.75 0.60 0.95 -0.85 0.00 0.00 174.74 174.70 3gj6 s THR 54 N 1.62 5.00 -1.60 1.30 -4.23 0.21 0.17 115.64 118.12 3gj6 s THR 54 Ca 0.04 -0.34 0.04 0.00 -1.18 0.00 0.00 61.69 60.25 3gj6 s THR 54 Cb -0.23 -3.84 0.09 0.00 1.34 0.00 0.00 72.50 69.86 3gj6 s THR 54 CO 0.07 -0.60 0.89 -0.46 -0.54 0.00 0.00 174.62 173.98 3gj6 n ASN 55 N -1.89 0.00 -0.00 3.99 2.04 0.94 -0.18 115.26 120.16 3gj6 n ASN 55 Ca -0.03 0.11 0.06 0.00 -0.44 0.00 0.00 54.58 54.28 3gj6 n ASN 55 Cb 0.56 -0.20 -0.07 0.00 -2.53 0.00 0.00 39.78 37.54 3gj6 n ASN 55 CO 0.00 0.00 0.00 -1.14 -0.44 0.00 0.00 177.26 175.68 3gj6 n ARG 56 N -1.20 2.68 0.00 -3.83 3.00 -1.26 -5.02 116.66 111.03 3gj6 n ARG 56 Ca 0.02 -0.02 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 3gj6 n ARG 56 Cb 0.03 -1.09 0.00 0.00 0.00 0.00 0.00 32.46 31.40 3gj6 n ARG 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3gj6 n GLY 57 N 1.37 0.88 3.73 5.14 0.00 0.75 -5.10 105.19 111.95 3gj6 n GLY 57 Ca 0.01 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.59 3gj6 n GLY 57 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gj6 s PRO 58 N -1.25 4.49 -0.03 1.61 0.02 -1.26 0.67 135.00 139.26 3gj6 s PRO 58 Ca 0.00 1.78 0.03 0.00 0.02 0.00 0.00 61.00 62.83 3gj6 s PRO 58 Cb 0.00 -3.30 -0.00 0.00 0.02 0.00 0.00 34.50 31.22 3gj6 s PRO 58 CO 0.00 -0.12 -0.12 0.96 -0.33 0.00 0.00 177.00 177.39 3gj6 s ILE 59 N 0.42 0.98 -0.28 2.83 -4.36 0.04 -4.57 121.20 116.27 3gj6 s ILE 59 Ca 0.55 -0.49 -0.06 0.00 -0.26 0.00 0.00 60.65 60.38 3gj6 s ILE 59 Cb -0.30 -0.85 0.00 0.00 1.25 0.00 0.00 42.46 42.56 3gj6 s ILE 59 CO 0.33 0.29 0.06 -0.75 0.24 0.00 0.00 174.94 175.11 3gj6 s LYS 60 N 0.02 3.21 -0.33 0.37 2.20 0.33 -0.77 119.74 124.77 3gj6 s LYS 60 Ca -0.01 -0.77 -0.20 0.00 -0.36 0.00 0.00 55.97 54.62 3gj6 s LYS 60 Cb -0.08 -3.31 -0.00 0.00 -1.51 0.00 0.00 37.83 32.92 3gj6 s LYS 60 CO 0.01 -0.37 0.64 -0.06 -0.36 0.00 0.00 175.35 175.20 3gj6 s PHE 61 N 1.51 3.18 -1.09 4.03 0.08 -0.57 -0.63 117.98 124.49 3gj6 s PHE 61 Ca 0.03 0.48 -0.17 0.00 0.12 0.00 0.00 56.93 57.40 3gj6 s PHE 61 Cb -0.16 -3.07 0.14 0.00 -0.57 0.00 0.00 43.02 39.35 3gj6 s PHE 61 CO 0.02 -0.55 1.34 -0.80 -0.10 0.00 0.00 175.22 175.13 3gj6 s ASN 62 N 1.71 6.83 -0.22 1.36 0.02 0.95 -0.84 114.94 124.76 3gj6 s ASN 62 Ca 0.25 -2.46 -0.29 0.00 -1.02 0.00 0.00 52.86 49.34 3gj6 s ASN 62 Cb -0.15 -2.43 -0.01 0.00 0.02 0.00 0.00 41.25 38.69 3gj6 s ASN 62 CO 0.13 -0.97 1.25 -0.69 0.02 0.00 0.00 177.10 176.85 3gj6 s VAL 63 N 2.51 4.28 -0.41 1.60 1.01 -0.96 -2.02 120.40 126.40 3gj6 s VAL 63 Ca 0.40 1.51 -0.25 0.00 0.00 0.00 0.00 61.98 63.64 3gj6 s VAL 63 Cb -0.03 -4.10 0.02 0.00 0.00 0.00 0.00 36.38 32.27 3gj6 s VAL 63 CO -0.04 -0.27 0.87 0.26 0.00 0.00 0.00 175.10 175.92 3gj6 s TRP 64 N 3.78 3.02 -0.08 5.22 0.52 0.38 -0.96 118.94 130.83 3gj6 s TRP 64 Ca 0.54 0.49 -0.01 0.00 0.02 0.00 0.00 56.10 57.14 3gj6 s TRP 64 Cb -0.19 -3.70 -0.03 0.00 -1.15 0.00 0.00 33.47 28.40 3gj6 s TRP 64 CO 0.17 -0.92 -0.01 0.34 0.02 0.00 0.00 176.95 176.54 3gj6 s ASP 65 N 2.04 5.10 0.54 2.95 2.15 -0.28 -2.48 116.67 126.68 3gj6 s ASP 65 Ca 0.35 0.10 -0.16 0.00 0.43 0.00 0.00 52.55 53.26 3gj6 s ASP 65 Cb -0.12 -1.40 -0.07 0.00 -0.30 0.00 0.00 42.92 41.04 3gj6 s ASP 65 CO 0.21 0.37 1.01 0.42 -0.17 0.00 0.00 175.17 177.01 3gj6 s THR 66 N -0.89 4.28 -0.36 1.71 -4.23 -1.26 -1.63 115.64 113.26 3gj6 s THR 66 Ca 0.14 1.10 0.01 0.00 -1.18 0.00 0.00 61.69 61.76 3gj6 s THR 66 Cb -0.11 -3.60 0.36 0.00 1.34 0.00 0.00 72.50 70.49 3gj6 s THR 66 CO 0.03 -0.61 1.80 0.00 -0.54 0.00 0.00 174.62 175.29 3gj6 n ALA 67 N -1.69 4.99 -0.37 3.99 0.00 -0.98 -4.79 120.51 121.65 3gj6 n ALA 67 Ca 0.07 -2.05 0.00 0.00 0.00 0.00 0.00 53.44 51.47 3gj6 n ALA 67 Cb 0.54 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.59 3gj6 n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gj6 n GLY 68 N -0.32 0.79 0.00 0.00 0.00 -1.26 -4.95 105.19 99.45 3gj6 n GLY 68 Ca 0.40 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.43 3gj6 n GLY 68 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3gj6 n GLN 69 N -2.00 0.03 0.17 1.61 3.00 -1.26 -2.73 117.38 116.20 3gj6 n GLN 69 Ca 0.00 0.32 0.05 0.00 -0.01 0.00 0.00 57.00 57.37 3gj6 n GLN 69 Cb 0.00 -1.50 0.18 0.00 0.00 0.00 0.00 30.24 28.92 3gj6 n GLN 69 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.06 178.11 3gj6 h GLU 70 N 0.00 0.00 0.00 -1.09 9.09 -1.93 -3.09 114.58 117.56 3gj6 h GLU 70 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 3gj6 h GLU 70 Cb 0.04 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.14 3gj6 h GLU 70 CO 0.00 0.38 -0.01 0.87 0.05 0.00 0.00 179.01 180.30 3gj6 h LYS 71 N 0.00 0.00 -0.20 1.06 1.57 -1.91 -2.99 116.57 114.11 3gj6 h LYS 71 Ca -0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.63 3gj6 h LYS 71 Cb 1.14 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.34 3gj6 h LYS 71 CO 0.05 0.01 -0.56 1.19 -0.57 0.00 0.00 179.45 179.56 3gj6 n PHE 72 N -3.11 0.71 0.00 -1.35 3.72 -1.17 -5.06 117.46 111.21 3gj6 n PHE 72 Ca -0.01 -1.68 0.00 0.00 -0.05 0.00 0.00 57.45 55.70 3gj6 n PHE 72 Cb 0.18 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.44 3gj6 n PHE 72 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gj6 n GLY 73 N -1.02 0.70 3.86 1.37 0.00 -1.13 -5.10 105.19 103.88 3gj6 n GLY 73 Ca 0.26 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.80 3gj6 n GLY 73 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gj6 s GLY 74 N 0.00 1.83 0.47 -0.02 0.00 -1.26 -4.32 107.32 104.02 3gj6 s GLY 74 Ca 0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 44.72 44.58 3gj6 s GLY 74 CO 0.00 0.21 0.84 1.08 0.00 0.00 0.00 173.10 175.24 3gj6 s LEU 75 N -4.57 3.66 0.32 0.66 1.43 -1.26 -5.00 118.68 113.92 3gj6 s LEU 75 Ca 0.55 1.19 -0.18 0.00 -1.03 0.00 0.00 54.13 54.66 3gj6 s LEU 75 Cb -0.10 -4.12 -0.09 0.00 0.03 0.00 0.00 46.19 41.90 3gj6 s LEU 75 CO 0.42 -0.54 0.80 -0.13 0.23 0.00 0.00 176.35 177.12 3gj6 s ARG 76 N -4.31 4.16 0.31 1.70 0.52 -1.26 -4.96 118.95 115.12 3gj6 s ARG 76 Ca 0.52 0.87 0.08 0.00 -0.52 0.00 0.00 55.73 56.68 3gj6 s ARG 76 Cb -0.10 -2.52 0.85 0.00 0.52 0.00 0.00 34.95 33.70 3gj6 s ARG 76 CO 0.38 0.19 1.72 -0.44 0.02 0.00 0.00 175.30 177.17 3gj6 h ASP 77 N 2.55 0.59 -0.38 0.23 3.32 -1.99 0.53 116.42 121.27 3gj6 h ASP 77 Ca -0.48 0.14 0.11 0.00 0.02 0.00 0.00 57.03 56.82 3gj6 h ASP 77 Cb 1.18 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 3gj6 h ASP 77 CO 0.64 0.07 0.72 1.23 -1.72 0.00 0.00 179.24 180.19 3gj6 h GLY 78 N 0.53 0.00 0.59 2.75 0.00 -1.97 0.78 103.07 105.74 3gj6 h GLY 78 Ca 0.63 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.72 3gj6 h GLY 78 CO -0.49 0.00 -1.18 -1.82 0.00 0.00 0.00 176.54 173.05 3gj6 h TYR 79 N 0.00 0.47 0.00 5.60 3.20 -0.31 -3.36 116.97 122.57 3gj6 h TYR 79 Ca 0.18 -0.34 0.00 0.00 3.14 0.00 0.00 58.73 61.71 3gj6 h TYR 79 Cb 1.62 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.87 3gj6 h TYR 79 CO 0.00 1.46 -0.06 1.88 -1.64 0.00 0.00 178.16 179.80 3gj6 h TYR 80 N -0.35 0.00 -2.20 -3.82 0.05 -1.09 -3.45 116.97 106.11 3gj6 h TYR 80 Ca -0.24 0.00 -0.62 0.00 0.05 0.00 0.00 58.73 57.92 3gj6 h TYR 80 Cb 1.70 0.00 0.11 0.00 1.01 0.00 0.00 36.73 39.55 3gj6 h TYR 80 CO 0.15 0.00 0.01 -0.89 -1.05 0.00 0.00 178.16 176.38 3gj6 n ILE 81 N -2.67 2.00 -0.61 -2.88 5.41 0.08 -1.45 119.36 119.24 3gj6 n ILE 81 Ca 0.05 -0.50 -0.02 0.00 1.00 0.00 0.00 62.75 63.28 3gj6 n ILE 81 Cb 0.48 -0.81 -0.01 0.00 -0.71 0.00 0.00 39.64 38.59 3gj6 n ILE 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3gj6 n GLN 82 N 0.77 -1.84 -1.60 0.38 3.00 -1.26 -4.90 117.38 111.93 3gj6 n GLN 82 Ca 0.11 0.29 -0.44 0.00 -0.01 0.00 0.00 57.00 56.95 3gj6 n GLN 82 Cb 0.31 -3.83 -0.01 0.00 0.00 0.00 0.00 30.24 26.70 3gj6 n GLN 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3gj6 n ALA 83 N 0.36 -0.03 -0.24 -1.58 0.00 -0.53 -4.65 120.51 113.84 3gj6 n ALA 83 Ca -0.02 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.81 3gj6 n ALA 83 Cb 0.24 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.64 3gj6 n ALA 83 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3gj6 n GLN 84 N 0.69 1.23 0.00 0.00 6.02 -0.62 -4.99 117.38 119.72 3gj6 n GLN 84 Ca 0.09 -0.96 0.00 0.00 -0.01 0.00 0.00 57.00 56.12 3gj6 n GLN 84 Cb 0.33 -0.88 0.00 0.00 1.02 0.00 0.00 30.24 30.71 3gj6 n GLN 84 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3gj6 s ALA 86 N -2.00 -1.48 -0.08 0.00 0.00 -0.99 -2.16 121.76 115.06 3gj6 s ALA 86 Ca 0.00 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.55 3gj6 s ALA 86 Cb 0.00 0.63 0.01 0.00 0.00 0.00 0.00 23.12 23.76 3gj6 s ALA 86 CO 0.00 -0.64 -0.17 0.42 0.00 0.00 0.00 175.76 175.37 3gj6 s ILE 87 N -3.12 1.48 -0.16 0.00 1.01 -0.94 -2.20 121.20 117.27 3gj6 s ILE 87 Ca -0.02 -0.68 -0.06 0.00 0.00 0.00 0.00 60.65 59.89 3gj6 s ILE 87 Cb -0.00 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 3gj6 s ILE 87 CO -0.07 0.43 0.03 -0.63 0.00 0.00 0.00 174.94 174.70 3gj6 s ILE 88 N 0.52 4.49 -0.01 2.92 1.01 0.44 -2.12 121.20 128.44 3gj6 s ILE 88 Ca -0.16 -0.15 0.07 0.00 0.00 0.00 0.00 60.65 60.41 3gj6 s ILE 88 Cb -0.16 -2.99 -0.02 0.00 0.01 0.00 0.00 42.46 39.30 3gj6 s ILE 88 CO 0.06 0.49 -0.22 -0.32 0.00 0.00 0.00 174.94 174.95 3gj6 s MET 89 N 0.18 1.76 0.27 2.79 1.75 -0.47 0.17 119.30 125.75 3gj6 s MET 89 Ca 0.02 -0.79 0.02 0.00 -1.25 0.00 0.00 55.69 53.70 3gj6 s MET 89 Cb -0.13 -1.71 -0.05 0.00 2.84 0.00 0.00 34.83 35.77 3gj6 s MET 89 CO 0.01 0.47 0.06 -0.59 -0.65 0.00 0.00 175.02 174.32 3gj6 s PHE 90 N -0.53 1.65 -0.25 4.11 -0.71 -0.54 -3.88 117.98 117.83 3gj6 s PHE 90 Ca 0.08 -1.06 -0.11 0.00 -1.04 0.00 0.00 56.93 54.81 3gj6 s PHE 90 Cb -0.08 -1.00 -0.05 0.00 -1.21 0.00 0.00 43.02 40.68 3gj6 s PHE 90 CO -0.01 -0.18 0.17 0.34 -1.34 0.00 0.00 175.22 174.21 3gj6 s ASP 91 N -3.35 6.06 0.00 1.98 2.15 -1.26 -1.57 116.67 120.67 3gj6 s ASP 91 Ca 0.35 0.06 0.20 0.00 0.43 0.00 0.00 52.55 53.59 3gj6 s ASP 91 Cb 0.08 -2.11 0.90 0.00 -0.30 0.00 0.00 42.92 41.49 3gj6 s ASP 91 CO 0.13 0.02 1.65 1.33 -0.17 0.00 0.00 175.17 178.13 3gj6 n VAL 92 N 4.59 0.56 1.37 1.11 0.24 -1.05 -1.46 118.33 123.69 3gj6 n VAL 92 Ca -0.15 0.14 0.13 0.00 -2.04 0.00 0.00 64.34 62.43 3gj6 n VAL 92 Cb 0.52 -0.79 0.43 0.00 -1.47 0.00 0.00 33.84 32.53 3gj6 n VAL 92 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3gj6 n THR 93 N -1.46 0.00 -3.58 3.34 -2.24 -1.26 -1.25 114.28 107.83 3gj6 n THR 93 Ca 0.06 -0.24 -0.29 0.00 -2.27 0.00 0.00 64.05 61.31 3gj6 n THR 93 Cb 0.22 0.57 -0.15 0.00 -2.10 0.00 0.00 70.33 68.88 3gj6 n THR 93 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3gj6 s SER 94 N -2.15 3.62 0.37 3.42 0.15 -0.53 -4.71 113.70 113.86 3gj6 s SER 94 Ca 0.33 -1.46 0.06 0.00 0.70 0.00 0.00 55.95 55.58 3gj6 s SER 94 Cb 0.20 -0.48 0.77 0.00 -1.71 0.00 0.00 66.02 64.79 3gj6 s SER 94 CO 0.39 -0.42 1.99 0.03 1.20 0.00 0.00 173.24 176.43 3gj6 h ARG 95 N 8.21 0.69 -0.44 5.44 3.08 -1.86 -2.61 114.38 126.89 3gj6 h ARG 95 Ca -0.16 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 59.80 3gj6 h ARG 95 Cb 1.01 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 3gj6 h ARG 95 CO 0.44 0.46 0.07 -0.24 -1.07 0.00 0.00 179.97 179.62 3gj6 h VAL 96 N 0.71 1.21 -0.51 2.04 3.04 -1.95 -0.41 116.25 120.37 3gj6 h VAL 96 Ca 0.26 -0.79 -0.02 0.00 -1.01 0.00 0.00 66.70 65.15 3gj6 h VAL 96 Cb 0.15 0.80 -0.03 0.00 -2.01 0.00 0.00 31.29 30.20 3gj6 h VAL 96 CO -0.08 0.28 0.23 0.71 -1.01 0.00 0.00 177.57 177.71 3gj6 h THR 97 N 0.66 1.18 -0.17 3.17 1.35 -1.77 0.00 112.91 117.32 3gj6 h THR 97 Ca 0.14 -0.52 -0.15 0.00 -0.55 0.00 0.00 66.41 65.34 3gj6 h THR 97 Cb 0.30 0.54 -0.01 0.00 -1.73 0.00 0.00 68.15 67.26 3gj6 h THR 97 CO 0.00 0.21 -0.51 0.22 -0.25 0.00 0.00 175.52 175.19 3gj6 h TYR 98 N 0.72 0.58 0.00 4.73 3.20 -1.24 -3.07 116.97 121.89 3gj6 h TYR 98 Ca 0.18 -0.19 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 3gj6 h TYR 98 Cb 0.10 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.25 3gj6 h TYR 98 CO 0.01 0.88 -0.14 0.87 -1.64 0.00 0.00 178.16 178.14 3gj6 h LYS 99 N 0.37 0.00 -0.07 1.82 1.57 -0.05 -2.34 116.57 117.87 3gj6 h LYS 99 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3gj6 h LYS 99 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.33 3gj6 h LYS 99 CO 0.09 0.14 0.00 0.09 -0.57 0.00 0.00 179.45 179.20 3gj6 n ASN 100 N -3.30 1.44 -0.15 0.86 5.03 -0.12 -4.32 115.26 114.71 3gj6 n ASN 100 Ca 0.00 -1.55 -0.08 0.00 0.87 0.00 0.00 54.58 53.82 3gj6 n ASN 100 Cb 0.38 -0.04 0.01 0.00 -1.02 0.00 0.00 39.78 39.11 3gj6 n ASN 100 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 3gj6 h VAL 101 N 2.12 1.14 -0.94 2.41 2.07 -1.36 -2.07 116.25 119.62 3gj6 h VAL 101 Ca 0.00 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.26 3gj6 h VAL 101 Cb 0.46 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 3gj6 h VAL 101 CO 0.00 0.14 0.62 -0.65 0.02 0.00 0.00 177.57 177.70 3gj6 h PRO 102 N 0.59 1.14 -0.15 1.57 0.11 -1.78 -0.85 132.00 132.62 3gj6 h PRO 102 Ca 0.16 -0.07 0.04 0.00 0.11 0.00 0.00 66.00 66.24 3gj6 h PRO 102 Cb -0.01 -0.26 -0.04 0.00 0.11 0.00 0.00 31.00 30.80 3gj6 h PRO 102 CO -0.03 0.75 -0.11 -0.91 -0.21 0.00 0.00 178.00 177.49 3gj6 h ASN 103 N 1.17 -0.34 -0.18 -2.05 -0.26 -1.66 -1.09 115.58 111.18 3gj6 h ASN 103 Ca 0.38 0.07 -0.00 0.00 -0.56 0.00 0.00 56.30 56.19 3gj6 h ASN 103 Cb 0.04 0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.47 3gj6 h ASN 103 CO -0.12 -0.14 0.10 -0.50 -1.06 0.00 0.00 177.43 175.70 3gj6 h TRP 104 N -0.11 0.25 -0.84 1.19 4.06 -0.96 -2.64 115.95 116.89 3gj6 h TRP 104 Ca 0.09 -0.01 0.14 0.00 2.06 0.00 0.00 58.89 61.17 3gj6 h TRP 104 Cb 0.25 -0.08 -0.09 0.00 -1.00 0.00 0.00 29.16 28.24 3gj6 h TRP 104 CO -0.24 0.24 0.44 1.25 -3.56 0.00 0.00 178.44 176.57 3gj6 h HIS 105 N 0.19 0.77 0.43 0.49 2.76 -0.79 -2.23 115.15 116.76 3gj6 h HIS 105 Ca 0.06 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.25 3gj6 h HIS 105 Cb 0.07 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 28.82 3gj6 h HIS 105 CO -0.04 0.20 -0.21 -0.09 -1.30 0.00 0.00 177.93 176.49 3gj6 h ARG 106 N 0.64 -0.55 0.00 5.26 2.43 -1.05 -1.67 114.38 119.43 3gj6 h ARG 106 Ca 0.45 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.66 3gj6 h ARG 106 Cb 0.62 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 3gj6 h ARG 106 CO -0.35 -0.31 0.08 -0.25 -1.51 0.00 0.00 179.97 177.63 3gj6 n ASP 107 N -5.29 0.52 -0.03 -3.80 8.00 -0.90 -1.61 116.55 113.44 3gj6 n ASP 107 Ca -0.11 0.72 -0.02 0.00 0.71 0.00 0.00 54.79 56.09 3gj6 n ASP 107 Cb 0.27 -0.76 -0.01 0.00 -0.02 0.00 0.00 41.12 40.61 3gj6 n ASP 107 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3gj6 n LEU 108 N -2.23 0.87 -0.33 0.64 7.94 -0.89 -4.07 117.00 118.93 3gj6 n LEU 108 Ca -0.01 0.43 0.18 0.00 -1.11 0.00 0.00 56.01 55.50 3gj6 n LEU 108 Cb 0.11 -0.68 0.39 0.00 0.53 0.00 0.00 43.42 43.77 3gj6 n LEU 108 CO 0.09 -0.49 1.10 0.58 -1.11 0.00 0.00 177.39 177.56 3gj6 h VAL 109 N -0.48 0.42 -0.99 1.96 2.07 -1.08 0.86 116.25 119.01 3gj6 h VAL 109 Ca 0.00 -0.14 0.20 0.00 0.82 0.00 0.00 66.70 67.58 3gj6 h VAL 109 Cb 0.25 -0.03 -0.10 0.00 -1.52 0.00 0.00 31.29 29.89 3gj6 h VAL 109 CO 0.00 0.08 0.62 -0.09 0.02 0.00 0.00 177.57 178.19 3gj6 h ARG 110 N 0.41 0.63 0.01 1.57 2.43 -1.49 -2.59 114.38 115.35 3gj6 h ARG 110 Ca 0.65 -0.04 -0.37 0.00 -0.81 0.00 0.00 59.98 59.41 3gj6 h ARG 110 Cb 1.34 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 30.68 3gj6 h ARG 110 CO -0.55 0.42 -2.32 0.28 -1.51 0.00 0.00 179.97 176.28 3gj6 n VAL 111 N -4.69 1.47 -3.75 0.20 0.31 0.57 -4.68 118.33 107.77 3gj6 n VAL 111 Ca 0.23 -0.74 -0.33 0.00 -0.01 0.00 0.00 64.34 63.49 3gj6 n VAL 111 Cb 0.63 -0.93 -0.09 0.00 -0.91 0.00 0.00 33.84 32.54 3gj6 n VAL 111 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gj6 n GLU 113 N 2.17 0.66 -3.49 0.00 -0.58 -1.00 -3.68 120.64 114.72 3gj6 n GLU 113 Ca 0.21 0.24 -0.26 0.00 -0.42 0.00 0.00 57.16 56.93 3gj6 n GLU 113 Cb 0.36 -1.85 0.02 0.00 -0.57 0.00 0.00 31.44 29.40 3gj6 n GLU 113 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 3gj6 n ASN 114 N 4.71 -5.80 -4.40 1.62 5.15 -1.26 -5.02 115.26 110.26 3gj6 n ASN 114 Ca 0.28 -0.37 -0.23 0.00 -0.60 0.00 0.00 54.58 53.66 3gj6 n ASN 114 Cb 0.05 -2.50 -0.11 0.00 -0.53 0.00 0.00 39.78 36.70 3gj6 n ASN 114 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3gj6 s ILE 115 N -2.34 2.14 0.29 -1.44 -4.36 -1.24 -5.11 121.20 109.15 3gj6 s ILE 115 Ca 0.19 -2.18 -0.29 0.00 -0.26 0.00 0.00 60.65 58.10 3gj6 s ILE 115 Cb -0.02 -2.11 -0.10 0.00 1.25 0.00 0.00 42.46 41.48 3gj6 s ILE 115 CO 0.86 -0.37 1.40 -2.84 0.24 0.00 0.00 174.94 174.23 3gj6 s PRO 116 N -3.21 4.28 -0.00 0.37 0.02 -1.26 -4.93 135.00 130.27 3gj6 s PRO 116 Ca 0.23 2.30 0.01 0.00 0.02 0.00 0.00 61.00 63.57 3gj6 s PRO 116 Cb -0.05 -3.08 -0.00 0.00 0.02 0.00 0.00 34.50 31.39 3gj6 s PRO 116 CO 0.10 -0.35 -0.04 0.42 -0.33 0.00 0.00 177.00 176.80 3gj6 s ILE 117 N -0.56 0.34 -0.07 2.83 1.01 -1.24 -2.33 121.20 121.17 3gj6 s ILE 117 Ca 0.55 -0.18 0.05 0.00 0.00 0.00 0.00 60.65 61.07 3gj6 s ILE 117 Cb -0.42 -0.29 -0.01 0.00 0.01 0.00 0.00 42.46 41.76 3gj6 s ILE 117 CO 0.49 0.10 -0.23 -0.69 0.00 0.00 0.00 174.94 174.61 3gj6 s VAL 118 N -0.09 2.25 -0.14 2.92 1.01 -0.94 -3.44 120.40 121.97 3gj6 s VAL 118 Ca 0.02 -0.99 -0.10 0.00 0.00 0.00 0.00 61.98 60.90 3gj6 s VAL 118 Cb -0.02 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.48 3gj6 s VAL 118 CO -0.00 0.57 0.19 -0.22 0.00 0.00 0.00 175.10 175.64 3gj6 s LEU 119 N -0.12 4.31 -0.07 3.92 2.96 -0.27 -0.42 118.68 129.00 3gj6 s LEU 119 Ca -0.04 0.45 0.02 0.00 -0.22 0.00 0.00 54.13 54.33 3gj6 s LEU 119 Cb -0.14 -2.18 0.01 0.00 0.50 0.00 0.00 46.19 44.38 3gj6 s LEU 119 CO 0.04 0.27 -0.12 0.00 -1.32 0.00 0.00 176.35 175.22 3gj6 s GLY 121 N 0.72 1.91 0.71 0.00 0.00 -0.78 -1.46 107.32 108.42 3gj6 s GLY 121 Ca -0.13 -2.33 -0.11 0.00 0.00 0.00 0.00 44.72 42.14 3gj6 s GLY 121 CO 0.03 1.40 1.08 0.21 0.00 0.00 0.00 173.10 175.83 3gj6 s ASN 122 N 3.54 5.32 -0.75 1.64 2.47 -0.61 0.34 114.94 126.89 3gj6 s ASN 122 Ca 0.08 1.02 0.00 0.00 0.42 0.00 0.00 52.86 54.38 3gj6 s ASN 122 Cb -0.26 -1.79 0.00 0.00 -1.45 0.00 0.00 41.25 37.75 3gj6 s ASN 122 CO 0.05 -1.39 0.00 0.29 -3.72 0.00 0.00 177.10 172.33 3gj6 n LYS 123 N -3.00 -0.69 0.00 0.43 5.02 -0.97 -2.54 118.16 116.40 3gj6 n LYS 123 Ca 0.07 0.43 0.08 0.00 -2.02 0.00 0.00 58.31 56.87 3gj6 n LYS 123 Cb 0.58 -4.41 0.45 0.00 -0.02 0.00 0.00 35.03 31.62 3gj6 n LYS 123 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 3gj6 n VAL 124 N -3.97 0.36 0.11 -0.18 0.24 -1.06 -2.57 118.33 111.25 3gj6 n VAL 124 Ca -0.10 0.09 -0.04 0.00 -2.04 0.00 0.00 64.34 62.25 3gj6 n VAL 124 Cb 0.57 -0.82 0.11 0.00 -1.47 0.00 0.00 33.84 32.23 3gj6 n VAL 124 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 3gj6 h ASP 125 N 0.00 0.13 -3.53 -1.34 2.03 -1.91 -3.45 116.42 108.36 3gj6 h ASP 125 Ca 0.00 -0.08 -0.52 0.00 -0.73 0.00 0.00 57.03 55.69 3gj6 h ASP 125 Cb 0.11 -0.04 0.05 0.00 -0.83 0.00 0.00 39.33 38.62 3gj6 h ASP 125 CO 0.00 0.77 0.68 -0.63 -1.03 0.00 0.00 179.24 179.03 3gj6 s ILE 126 N -3.55 2.88 -0.00 4.15 1.01 -1.06 -4.87 121.20 119.76 3gj6 s ILE 126 Ca -0.02 0.78 -0.24 0.00 0.00 0.00 0.00 60.65 61.16 3gj6 s ILE 126 Cb 0.12 -3.49 -0.15 0.00 0.01 0.00 0.00 42.46 38.95 3gj6 s ILE 126 CO 0.79 0.14 1.08 0.11 0.00 0.00 0.00 174.94 177.06 3gj6 h LYS 127 N 4.66 -0.60 -5.82 2.79 1.57 -1.91 -3.37 116.57 113.90 3gj6 h LYS 127 Ca -0.46 0.04 -0.44 0.00 -1.87 0.00 0.00 60.65 57.92 3gj6 h LYS 127 Cb 1.22 0.14 -0.07 0.00 0.08 0.00 0.00 32.23 33.60 3gj6 h LYS 127 CO 0.74 -0.29 1.19 0.34 -0.57 0.00 0.00 179.45 180.86 3gj6 s ASP 128 N -4.85 5.76 0.24 0.86 2.15 -1.26 -4.95 116.67 114.61 3gj6 s ASP 128 Ca -0.13 -1.27 -0.14 0.00 0.43 0.00 0.00 52.55 51.45 3gj6 s ASP 128 Cb 0.02 -2.57 -0.08 0.00 -0.30 0.00 0.00 42.92 39.99 3gj6 s ASP 128 CO 0.45 -2.22 0.63 -0.60 -0.17 0.00 0.00 175.17 173.26 3gj6 s ARG 129 N 5.96 3.96 -0.14 4.34 3.52 -1.26 -4.83 118.95 130.50 3gj6 s ARG 129 Ca 0.60 0.51 0.01 0.00 -0.13 0.00 0.00 55.73 56.72 3gj6 s ARG 129 Cb -0.02 -2.68 -0.09 0.00 -1.56 0.00 0.00 34.95 30.60 3gj6 s ARG 129 CO -0.01 0.32 -0.13 1.63 -0.81 0.00 0.00 175.30 176.30 3gj6 n LYS 130 N 0.12 0.35 -3.25 5.12 4.76 -0.38 -4.85 118.16 120.04 3gj6 n LYS 130 Ca -0.00 0.08 -0.46 0.00 -2.87 0.00 0.00 58.31 55.06 3gj6 n LYS 130 Cb 0.52 -1.27 -0.01 0.00 -1.84 0.00 0.00 35.03 32.43 3gj6 n LYS 130 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3gj6 s VAL 131 N -2.28 5.56 1.17 -0.18 1.01 -0.49 -5.00 120.40 120.19 3gj6 s VAL 131 Ca -0.19 -2.64 -0.17 0.00 0.00 0.00 0.00 61.98 58.98 3gj6 s VAL 131 Cb 0.05 -4.59 0.27 0.00 0.00 0.00 0.00 36.38 32.11 3gj6 s VAL 131 CO 0.32 -1.19 1.08 -0.54 0.00 0.00 0.00 175.10 174.77 3gj6 s LYS 132 N 0.21 -0.93 0.29 2.72 -0.14 -1.26 -4.86 119.74 115.76 3gj6 s LYS 132 Ca 0.26 0.20 -0.01 0.00 -1.36 0.00 0.00 55.97 55.05 3gj6 s LYS 132 Cb -0.09 -1.61 0.43 0.00 -1.68 0.00 0.00 37.83 34.88 3gj6 s LYS 132 CO -0.08 -3.57 1.86 0.00 -0.76 0.00 0.00 175.35 172.80 3gj6 h ALA 133 N -2.49 1.27 -0.08 5.17 0.00 -1.94 -2.47 119.26 118.72 3gj6 h ALA 133 Ca -0.49 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.23 3gj6 h ALA 133 Cb 1.32 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3gj6 h ALA 133 CO 0.42 0.53 -0.03 0.87 0.00 0.00 0.00 179.25 181.04 3gj6 h LYS 134 N 0.84 0.11 0.00 0.00 1.57 -1.92 -1.93 116.57 115.25 3gj6 h LYS 134 Ca 0.19 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.86 3gj6 h LYS 134 Cb 0.21 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3gj6 h LYS 134 CO -0.01 0.16 -0.48 0.77 -0.57 0.00 0.00 179.45 179.31 3gj6 h SER 135 N 0.12 0.00 -3.38 0.86 0.02 -1.79 -3.43 113.55 105.95 3gj6 h SER 135 Ca 0.03 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.41 3gj6 h SER 135 Cb 0.13 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.62 3gj6 h SER 135 CO 0.01 0.48 1.00 -0.63 -1.14 0.00 0.00 176.83 176.55 3gj6 s ILE 136 N -3.24 4.07 0.00 3.27 1.01 -0.73 -4.71 121.20 120.87 3gj6 s ILE 136 Ca 0.02 1.12 0.00 0.00 0.00 0.00 0.00 60.65 61.79 3gj6 s ILE 136 Cb 0.09 -4.32 0.00 0.00 0.01 0.00 0.00 42.46 38.24 3gj6 s ILE 136 CO 0.72 -0.76 0.00 0.52 0.00 0.00 0.00 174.94 175.42 3gj6 n VAL 137 N 6.78 0.00 -0.32 2.92 0.31 -1.26 -4.87 118.33 121.89 3gj6 n VAL 137 Ca 0.15 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.58 3gj6 n VAL 137 Cb 0.48 0.00 0.27 0.00 -0.91 0.00 0.00 33.84 33.68 3gj6 n VAL 137 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 3gj6 h PHE 138 N 0.00 0.86 0.00 3.52 3.57 -1.97 0.81 116.94 123.74 3gj6 h PHE 138 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 3gj6 h PHE 138 Cb 0.00 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.50 3gj6 h PHE 138 CO 0.00 0.17 0.00 1.12 -2.23 0.00 0.00 178.31 177.37 3gj6 h HIS 139 N 0.65 0.00 -0.76 0.41 2.07 -1.89 -3.03 115.15 112.60 3gj6 h HIS 139 Ca 0.52 0.00 0.17 0.00 -2.85 0.00 0.00 60.37 58.20 3gj6 h HIS 139 Cb 0.79 0.00 -0.14 0.00 2.57 0.00 0.00 27.41 30.64 3gj6 h HIS 139 CO -0.07 0.00 -0.08 0.00 -3.07 0.00 0.00 177.93 174.71 3gj6 h ARG 140 N 0.00 0.05 -7.31 5.12 -0.00 -1.10 -3.39 114.38 107.75 3gj6 h ARG 140 Ca 0.00 -0.00 -0.51 0.00 -0.50 0.00 0.00 59.98 58.97 3gj6 h ARG 140 Cb 0.47 -0.01 0.10 0.00 0.00 0.00 0.00 29.97 30.53 3gj6 h ARG 140 CO 0.00 0.03 0.35 0.15 0.00 0.00 0.00 179.97 180.51 3gj6 s LYS 141 N -6.17 2.76 6.69 0.04 3.01 -1.15 -4.92 119.74 120.01 3gj6 s LYS 141 Ca -0.14 1.07 0.00 0.00 -1.01 0.00 0.00 55.97 55.89 3gj6 s LYS 141 Cb 0.22 -1.96 0.00 0.00 -1.01 0.00 0.00 37.83 35.08 3gj6 s LYS 141 CO 0.75 -1.25 0.00 1.63 0.51 0.00 0.00 175.35 177.00 3gj6 n LYS 142 N -3.10 0.00 -2.89 1.68 5.02 -1.26 -4.19 118.16 113.41 3gj6 n LYS 142 Ca 0.08 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.24 3gj6 n LYS 142 Cb 0.53 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.55 3gj6 n LYS 142 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3gj6 n ASN 143 N 5.35 0.87 -3.77 4.39 5.15 -1.26 -5.02 115.26 120.97 3gj6 n ASN 143 Ca 0.00 -2.87 -0.30 0.00 -0.60 0.00 0.00 54.58 50.81 3gj6 n ASN 143 Cb 0.00 -0.40 -0.14 0.00 -0.53 0.00 0.00 39.78 38.72 3gj6 n ASN 143 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3gj6 s LEU 144 N -2.79 2.92 0.39 1.20 2.01 -1.26 -3.71 118.68 117.44 3gj6 s LEU 144 Ca 0.32 -2.40 -0.23 0.00 0.01 0.00 0.00 54.13 51.83 3gj6 s LEU 144 Cb 0.40 -1.11 -0.10 0.00 0.01 0.00 0.00 46.19 45.40 3gj6 s LEU 144 CO -0.02 -0.31 0.98 -1.58 1.01 0.00 0.00 176.35 176.43 3gj6 s GLN 145 N 0.63 4.30 -0.02 1.70 2.00 -1.22 -4.66 119.66 122.38 3gj6 s GLN 145 Ca 0.15 1.31 0.04 0.00 -2.00 0.00 0.00 55.36 54.86 3gj6 s GLN 145 Cb -0.23 -2.47 -0.01 0.00 0.80 0.00 0.00 33.01 31.11 3gj6 s GLN 145 CO -0.06 0.01 -0.13 -0.47 -0.50 0.00 0.00 175.29 174.14 3gj6 s TYR 146 N -1.84 1.24 -0.01 1.67 5.04 -1.26 -1.11 117.35 121.08 3gj6 s TYR 146 Ca 0.57 -0.27 0.02 0.00 -2.44 0.00 0.00 57.07 54.95 3gj6 s TYR 146 Cb -0.16 -0.82 -0.00 0.00 0.35 0.00 0.00 41.96 41.33 3gj6 s TYR 146 CO 0.21 -0.06 -0.07 0.71 -1.34 0.00 0.00 175.55 175.00 3gj6 s TYR 147 N -0.16 0.65 0.38 4.97 2.02 -0.89 -4.99 117.35 119.32 3gj6 s TYR 147 Ca 0.02 -0.13 -0.27 0.00 -0.37 0.00 0.00 57.07 56.32 3gj6 s TYR 147 Cb -0.07 -0.44 -0.09 0.00 -0.40 0.00 0.00 41.96 40.96 3gj6 s TYR 147 CO 0.00 -0.04 1.28 -0.51 -1.57 0.00 0.00 175.55 174.71 3gj6 s ASP 148 N 0.00 6.51 0.11 2.29 1.01 -1.26 -1.87 116.67 123.47 3gj6 s ASP 148 Ca 0.00 2.61 -0.01 0.00 0.71 0.00 0.00 52.55 55.87 3gj6 s ASP 148 Cb -0.05 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.21 3gj6 s ASP 148 CO -0.00 -0.71 0.03 0.27 0.21 0.00 0.00 175.17 174.97 3gj6 s ILE 149 N -1.24 0.20 -0.34 0.77 -4.36 0.15 -4.73 121.20 111.66 3gj6 s ILE 149 Ca 0.54 -1.89 -0.00 0.00 -0.26 0.00 0.00 60.65 59.03 3gj6 s ILE 149 Cb -0.37 -1.91 0.13 0.00 1.25 0.00 0.00 42.46 41.56 3gj6 s ILE 149 CO 0.48 -0.61 0.22 -0.55 0.24 0.00 0.00 174.94 174.72 3gj6 s SER 150 N -3.03 2.83 0.26 4.36 0.15 -0.98 -2.30 113.70 115.00 3gj6 s SER 150 Ca 0.19 -1.88 -0.10 0.00 0.70 0.00 0.00 55.95 54.86 3gj6 s SER 150 Cb 0.07 -0.24 0.39 0.00 -1.71 0.00 0.00 66.02 64.53 3gj6 s SER 150 CO -0.01 -0.33 1.57 0.00 1.20 0.00 0.00 173.24 175.67 3gj6 h ALA 151 N 7.35 0.54 0.00 5.45 0.00 -1.93 -0.61 119.26 130.07 3gj6 h ALA 151 Ca -0.00 0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3gj6 h ALA 151 Cb 0.99 0.73 0.00 0.00 0.00 0.00 0.00 17.79 19.51 3gj6 h ALA 151 CO 0.29 -0.42 0.00 1.63 0.00 0.00 0.00 179.25 180.75 3gj6 n LYS 152 N -5.57 0.24 0.00 0.00 4.76 -1.26 -2.33 118.16 114.00 3gj6 n LYS 152 Ca 0.13 0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.68 3gj6 n LYS 152 Cb 0.45 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 3gj6 n LYS 152 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 3gj6 n SER 153 N -1.31 0.85 0.00 4.39 3.41 -0.54 -0.85 113.62 119.57 3gj6 n SER 153 Ca 0.09 -1.23 0.00 0.00 -0.26 0.00 0.00 58.87 57.46 3gj6 n SER 153 Cb 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 3gj6 n SER 153 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3gj6 n ASN 154 N -0.12 -2.74 -4.64 4.04 3.02 -0.35 -4.78 115.26 109.69 3gj6 n ASN 154 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 3gj6 n ASN 154 Cb 0.19 -2.01 -0.03 0.00 -0.61 0.00 0.00 39.78 37.32 3gj6 n ASN 154 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3gj6 s TYR 155 N -1.71 1.33 -0.42 3.10 5.04 -1.08 -1.36 117.35 122.26 3gj6 s TYR 155 Ca 0.00 -0.08 0.00 0.00 -2.44 0.00 0.00 57.07 54.55 3gj6 s TYR 155 Cb 0.00 -4.12 0.00 0.00 0.35 0.00 0.00 41.96 38.19 3gj6 s TYR 155 CO 0.00 -4.91 0.00 0.09 -1.34 0.00 0.00 175.55 169.39 3gj6 n ASN 156 N 8.77 -4.74 -0.32 4.32 3.02 -1.26 -2.32 115.26 122.73 3gj6 n ASN 156 Ca 0.23 0.10 0.07 0.00 -0.03 0.00 0.00 54.58 54.94 3gj6 n ASN 156 Cb 0.43 -2.59 0.17 0.00 -0.61 0.00 0.00 39.78 37.18 3gj6 n ASN 156 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 3gj6 h PHE 157 N 0.00 -0.31 0.00 3.10 3.57 -1.57 -1.76 116.94 119.97 3gj6 h PHE 157 Ca -0.08 0.08 -0.08 0.00 3.53 0.00 0.00 57.97 61.42 3gj6 h PHE 157 Cb 0.68 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 3gj6 h PHE 157 CO 0.38 -0.38 -0.37 1.05 -2.23 0.00 0.00 178.31 176.75 3gj6 h GLU 158 N 0.02 0.00 0.02 1.11 9.09 -1.91 -3.38 114.58 119.53 3gj6 h GLU 158 Ca 0.48 0.00 0.03 0.00 0.05 0.00 0.00 59.36 59.92 3gj6 h GLU 158 Cb 0.82 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.87 3gj6 h GLU 158 CO -0.90 0.37 -0.36 0.87 0.05 0.00 0.00 179.01 179.05 3gj6 h LYS 159 N 0.00 -0.51 -0.99 1.06 1.79 -1.72 -1.04 116.57 115.17 3gj6 h LYS 159 Ca -0.00 0.03 0.27 0.00 -2.18 0.00 0.00 60.65 58.77 3gj6 h LYS 159 Cb 1.05 0.12 -0.06 0.00 -1.58 0.00 0.00 32.23 31.75 3gj6 h LYS 159 CO 0.05 -0.34 0.68 -1.35 -1.08 0.00 0.00 179.45 177.41 3gj6 h PRO 160 N -0.53 0.17 0.17 3.15 0.11 -1.73 -2.00 132.00 131.34 3gj6 h PRO 160 Ca 0.05 -0.01 -0.32 0.00 0.11 0.00 0.00 66.00 65.83 3gj6 h PRO 160 Cb 0.60 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 31.68 3gj6 h PRO 160 CO -0.28 0.11 -1.60 0.74 -0.21 0.00 0.00 178.00 176.76 3gj6 h PHE 161 N 0.17 0.65 -0.17 0.65 0.04 -1.47 -2.68 116.94 114.13 3gj6 h PHE 161 Ca 0.50 -0.47 0.02 0.00 2.80 0.00 0.00 57.97 60.81 3gj6 h PHE 161 Cb 1.66 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 39.77 3gj6 h PHE 161 CO -0.00 1.63 0.06 1.25 -0.60 0.00 0.00 178.31 180.64 3gj6 h LEU 162 N -0.03 0.06 -1.01 1.54 5.85 -0.86 0.98 115.31 121.84 3gj6 h LEU 162 Ca -0.32 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.38 3gj6 h LEU 162 Cb 1.99 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 43.00 3gj6 h LEU 162 CO 0.15 0.06 0.26 -0.25 -0.34 0.00 0.00 178.44 178.32 3gj6 h TRP 163 N 0.14 0.98 -0.01 1.25 7.01 -1.47 -1.85 115.95 121.99 3gj6 h TRP 163 Ca 0.07 -0.06 -0.12 0.00 2.11 0.00 0.00 58.89 60.90 3gj6 h TRP 163 Cb 0.05 -0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 26.79 3gj6 h TRP 163 CO -0.11 0.75 -0.53 -0.07 -2.79 0.00 0.00 178.44 175.68 3gj6 h LEU 164 N 0.96 0.04 -0.25 0.65 3.38 -1.10 -3.20 115.31 115.80 3gj6 h LEU 164 Ca 0.22 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 58.03 3gj6 h LEU 164 Cb 0.18 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 3gj6 h LEU 164 CO -0.02 0.57 -0.38 0.00 0.09 0.00 0.00 178.44 178.70 3gj6 h ALA 165 N 1.43 0.38 -0.27 1.53 0.00 -0.09 -2.53 119.26 119.71 3gj6 h ALA 165 Ca -0.00 -0.44 0.05 0.00 0.00 0.00 0.00 54.91 54.51 3gj6 h ALA 165 Cb 0.96 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3gj6 h ALA 165 CO 0.07 0.47 0.19 0.00 0.00 0.00 0.00 179.25 179.98 3gj6 h ARG 166 N 0.43 0.16 0.23 0.00 3.08 -1.39 -0.88 114.38 116.00 3gj6 h ARG 166 Ca 0.02 -0.01 -0.32 0.00 0.07 0.00 0.00 59.98 59.75 3gj6 h ARG 166 Cb 0.97 -0.04 0.04 0.00 0.08 0.00 0.00 29.97 31.02 3gj6 h ARG 166 CO 0.09 0.11 -1.39 0.87 -1.07 0.00 0.00 179.97 178.58 3gj6 h LYS 167 N 0.17 0.53 0.00 0.04 1.79 -1.51 0.88 116.57 118.46 3gj6 h LYS 167 Ca 0.12 -0.88 -0.05 0.00 -2.18 0.00 0.00 60.65 57.66 3gj6 h LYS 167 Cb 0.27 0.32 -0.01 0.00 -1.58 0.00 0.00 32.23 31.24 3gj6 h LYS 167 CO -0.02 1.42 -0.23 -0.07 -1.08 0.00 0.00 179.45 179.47 3gj6 h LEU 168 N 0.11 0.00 0.02 2.94 3.38 -1.20 -3.11 115.31 117.44 3gj6 h LEU 168 Ca -0.24 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.39 3gj6 h LEU 168 Cb 2.09 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.78 3gj6 h LEU 168 CO 0.26 0.23 -2.07 -0.38 0.09 0.00 0.00 178.44 176.57 3gj6 n ILE 169 N -3.20 1.55 -2.70 1.22 2.08 -0.36 -5.00 119.36 112.95 3gj6 n ILE 169 Ca 0.02 -0.77 -0.07 0.00 0.56 0.00 0.00 62.75 62.49 3gj6 n ILE 169 Cb 0.57 -0.98 0.03 0.00 -0.75 0.00 0.00 39.64 38.51 3gj6 n ILE 169 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3gj6 n GLY 170 N 1.76 0.30 2.70 7.39 0.00 0.23 -5.03 105.19 112.53 3gj6 n GLY 170 Ca -0.28 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 3gj6 n GLY 170 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gj6 s ASP 171 N -3.29 3.75 0.17 1.61 -1.08 -0.75 -4.98 116.67 112.10 3gj6 s ASP 171 Ca 0.11 -2.14 0.11 0.00 -0.52 0.00 0.00 52.55 50.10 3gj6 s ASP 171 Cb -0.05 -0.89 0.58 0.00 -1.46 0.00 0.00 42.92 41.09 3gj6 s ASP 171 CO 0.26 -0.34 1.29 -2.65 0.52 0.00 0.00 175.17 174.25 3gj6 n PRO 172 N 4.18 0.07 -0.21 4.34 -0.02 -1.26 -1.64 135.00 140.45 3gj6 n PRO 172 Ca 0.04 0.55 0.06 0.00 -2.02 0.00 0.00 63.50 62.13 3gj6 n PRO 172 Cb 0.38 -1.78 0.15 0.00 -0.02 0.00 0.00 33.50 32.24 3gj6 n PRO 172 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3gj6 n ASN 173 N -1.86 2.97 -4.75 2.55 3.02 -1.26 -4.98 115.26 110.95 3gj6 n ASN 173 Ca -0.01 -2.39 -0.41 0.00 -0.03 0.00 0.00 54.58 51.74 3gj6 n ASN 173 Cb 0.07 -0.30 -0.02 0.00 -0.61 0.00 0.00 39.78 38.92 3gj6 n ASN 173 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3gj6 s LEU 174 N -1.69 4.39 0.09 3.41 2.96 -0.65 -5.02 118.68 122.17 3gj6 s LEU 174 Ca 0.25 2.66 0.06 0.00 -0.22 0.00 0.00 54.13 56.88 3gj6 s LEU 174 Cb 0.18 -3.63 -0.03 0.00 0.50 0.00 0.00 46.19 43.21 3gj6 s LEU 174 CO 0.10 -0.69 -0.15 -1.61 -1.32 0.00 0.00 176.35 172.69 3gj6 s GLU 175 N -0.49 0.93 -0.16 1.98 0.41 -1.26 -4.98 118.70 115.12 3gj6 s GLU 175 Ca 0.58 -1.09 -0.22 0.00 -0.41 0.00 0.00 54.97 53.83 3gj6 s GLU 175 Cb -0.42 -0.90 -0.02 0.00 -1.78 0.00 0.00 34.13 31.01 3gj6 s GLU 175 CO 0.44 0.19 0.69 -0.06 -0.49 0.00 0.00 175.26 176.03 3gj6 s PHE 176 N -1.64 3.43 0.13 1.61 0.08 -1.26 -0.04 117.98 120.29 3gj6 s PHE 176 Ca 0.03 1.07 -0.11 0.00 0.12 0.00 0.00 56.93 58.04 3gj6 s PHE 176 Cb -0.08 -2.85 -0.07 0.00 -0.57 0.00 0.00 43.02 39.46 3gj6 s PHE 176 CO 0.03 -0.13 1.43 -0.39 -0.10 0.00 0.00 175.22 176.05 3gj6 h VAL 177 N 5.09 1.27 -3.76 -0.44 -1.51 -0.54 -3.45 116.25 112.91 3gj6 h VAL 177 Ca -0.33 -1.69 -0.27 0.00 -1.23 0.00 0.00 66.70 63.19 3gj6 h VAL 177 Cb 1.15 1.56 -0.29 0.00 -2.13 0.00 0.00 31.29 31.59 3gj6 h VAL 177 CO 0.79 0.55 -0.73 0.00 -1.23 0.00 0.00 177.57 176.95 3gj6 s ALA 178 N -4.20 0.15 0.10 5.19 0.00 -1.25 -5.10 121.76 116.66 3gj6 s ALA 178 Ca -0.11 -0.05 -0.31 0.00 0.00 0.00 0.00 51.96 51.50 3gj6 s ALA 178 Cb 0.10 -0.06 -0.08 0.00 0.00 0.00 0.00 23.12 23.08 3gj6 s ALA 178 CO 0.89 0.03 1.48 1.41 0.00 0.00 0.00 175.76 179.56 3gj6 s MET 179 N 0.06 4.27 1.10 0.00 1.75 -1.26 -4.45 119.30 120.77 3gj6 s MET 179 Ca -0.00 2.17 -0.14 0.00 -1.25 0.00 0.00 55.69 56.47 3gj6 s MET 179 Cb -0.02 -3.33 0.20 0.00 2.84 0.00 0.00 34.83 34.52 3gj6 s MET 179 CO -0.00 -0.54 0.74 -2.30 -0.65 0.00 0.00 175.02 172.26 3gj6 n PRO 180 N 4.42 -1.76 -2.45 4.11 -0.02 -1.26 -4.88 135.00 133.16 3gj6 n PRO 180 Ca 0.13 -0.48 -0.43 0.00 -2.02 0.00 0.00 63.50 60.70 3gj6 n PRO 180 Cb 0.41 -2.06 -0.02 0.00 -0.02 0.00 0.00 33.50 31.81 3gj6 n PRO 180 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gj6 s ALA 181 N -2.40 3.57 0.00 3.55 0.00 -1.26 -5.01 121.76 120.22 3gj6 s ALA 181 Ca 0.64 0.32 0.07 0.00 0.00 0.00 0.00 51.96 52.99 3gj6 s ALA 181 Cb -0.21 -3.66 -0.03 0.00 0.00 0.00 0.00 23.12 19.22 3gj6 s ALA 181 CO 0.65 -1.35 -0.21 -0.51 0.00 0.00 0.00 175.76 174.34 3gj6 s LEU 182 N 3.74 2.42 0.31 0.00 1.43 -1.26 -2.35 118.68 122.97 3gj6 s LEU 182 Ca 0.54 -0.41 -0.29 0.00 -1.03 0.00 0.00 54.13 52.94 3gj6 s LEU 182 Cb -0.19 -1.44 -0.12 0.00 0.03 0.00 0.00 46.19 44.46 3gj6 s LEU 182 CO 0.16 0.29 1.46 0.00 0.23 0.00 0.00 176.35 178.50 3gj6 n ALA 183 N 1.99 1.90 -1.73 4.21 0.00 0.06 -4.90 120.51 122.05 3gj6 n ALA 183 Ca -0.16 0.37 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 3gj6 n ALA 183 Cb 0.52 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.59 3gj6 n ALA 183 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3gj6 n PRO 184 N 1.43 2.50 -1.57 0.00 -0.02 -1.26 -4.82 135.00 131.27 3gj6 n PRO 184 Ca 0.07 0.89 -0.46 0.00 -2.02 0.00 0.00 63.50 61.98 3gj6 n PRO 184 Cb 0.36 -2.63 -0.04 0.00 -0.02 0.00 0.00 33.50 31.16 3gj6 n PRO 184 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3gj6 n PRO 185 N 1.97 1.79 0.23 0.52 -0.02 -1.26 -4.83 135.00 133.39 3gj6 n PRO 185 Ca 0.09 0.53 0.12 0.00 -2.02 0.00 0.00 63.50 62.22 3gj6 n PRO 185 Cb 0.35 -2.92 0.45 0.00 -0.02 0.00 0.00 33.50 31.36 3gj6 n PRO 185 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3gj6 h GLU 186 N 13.30 0.00 -5.33 -0.52 5.08 -1.31 -3.43 114.58 122.37 3gj6 h GLU 186 Ca -0.38 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.58 3gj6 h GLU 186 Cb 1.27 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.37 3gj6 h GLU 186 CO 0.97 0.13 -0.73 0.14 -1.00 0.00 0.00 179.01 178.53 3gj6 s VAL 187 N -3.53 1.43 0.25 3.13 -7.23 -0.93 -5.06 120.40 108.46 3gj6 s VAL 187 Ca 0.02 -2.07 -0.16 0.00 -1.81 0.00 0.00 61.98 57.96 3gj6 s VAL 187 Cb 0.09 -1.88 -0.08 0.00 0.56 0.00 0.00 36.38 35.07 3gj6 s VAL 187 CO 0.62 -0.63 0.69 -0.69 -0.31 0.00 0.00 175.10 174.77 3gj6 s VAL 188 N -2.99 4.68 -0.46 1.32 1.01 -1.26 -4.18 120.40 118.52 3gj6 s VAL 188 Ca 0.18 1.02 -0.06 0.00 0.00 0.00 0.00 61.98 63.11 3gj6 s VAL 188 Cb 0.00 -3.72 0.12 0.00 0.00 0.00 0.00 36.38 32.78 3gj6 s VAL 188 CO 0.03 0.04 0.30 -0.32 0.00 0.00 0.00 175.10 175.15 3gj6 s MET 189 N -2.44 2.30 0.01 2.72 1.75 -1.26 -4.93 119.30 117.45 3gj6 s MET 189 Ca 0.47 -1.86 -0.38 0.00 -1.25 0.00 0.00 55.69 52.67 3gj6 s MET 189 Cb -0.13 -3.78 -0.17 0.00 2.84 0.00 0.00 34.83 33.59 3gj6 s MET 189 CO 0.19 -1.14 1.37 -3.47 -0.65 0.00 0.00 175.02 171.32 3gj6 n ASP 190 N 4.65 1.54 0.30 1.11 2.03 -1.26 -4.84 116.55 120.08 3gj6 n ASP 190 Ca -0.04 1.12 0.17 0.00 0.52 0.00 0.00 54.79 56.56 3gj6 n ASP 190 Cb 0.41 -1.14 0.94 0.00 -0.72 0.00 0.00 41.12 40.60 3gj6 n ASP 190 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3gj6 h PRO 191 N 4.76 0.00 0.56 -0.67 0.11 -1.98 -1.94 132.00 132.84 3gj6 h PRO 191 Ca -0.48 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 3gj6 h PRO 191 Cb 1.35 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.46 3gj6 h PRO 191 CO 0.79 0.04 -0.27 0.00 -0.21 0.00 0.00 178.00 178.35 3gj6 h ALA 192 N 1.96 -0.81 -0.48 -0.75 0.00 -1.99 -1.83 119.26 115.37 3gj6 h ALA 192 Ca -0.00 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 54.84 3gj6 h ALA 192 Cb 0.14 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 18.13 3gj6 h ALA 192 CO 0.00 -0.75 -0.21 -0.07 0.00 0.00 0.00 179.25 178.22 3gj6 h LEU 193 N -1.12 -0.72 -1.06 0.00 3.38 -1.92 0.22 115.31 114.09 3gj6 h LEU 193 Ca -0.08 0.17 0.14 0.00 0.09 0.00 0.00 57.88 58.20 3gj6 h LEU 193 Cb 0.58 0.40 -0.09 0.00 0.09 0.00 0.00 40.66 41.64 3gj6 h LEU 193 CO 0.13 -0.24 0.62 0.00 0.09 0.00 0.00 178.44 179.04 3gj6 h ALA 194 N 1.23 1.61 -0.06 1.53 0.00 -1.42 0.47 119.26 122.62 3gj6 h ALA 194 Ca 0.22 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.05 3gj6 h ALA 194 Cb 0.45 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.08 3gj6 h ALA 194 CO -0.54 0.12 -0.43 0.00 0.00 0.00 0.00 179.25 178.40 3gj6 h ALA 195 N 1.57 0.13 -0.40 0.00 0.00 -0.20 -0.71 119.26 119.64 3gj6 h ALA 195 Ca 0.51 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3gj6 h ALA 195 Cb 0.61 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3gj6 h ALA 195 CO -0.28 0.27 0.21 0.37 0.00 0.00 0.00 179.25 179.82 3gj6 h GLN 196 N -0.10 0.57 -0.34 0.00 5.75 -0.24 -1.42 115.11 119.33 3gj6 h GLN 196 Ca -0.04 -0.07 -0.11 0.00 -0.15 0.00 0.00 58.65 58.28 3gj6 h GLN 196 Cb 1.10 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 29.53 3gj6 h GLN 196 CO 0.09 0.48 -0.23 1.88 -2.65 0.00 0.00 178.83 178.39 3gj6 h TYR 197 N 0.52 0.75 -0.32 3.99 0.05 -0.10 0.27 116.97 122.12 3gj6 h TYR 197 Ca 0.14 -0.17 -0.14 0.00 0.05 0.00 0.00 58.73 58.62 3gj6 h TYR 197 Cb 0.08 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 3gj6 h TYR 197 CO -0.02 0.84 -0.36 0.93 -1.05 0.00 0.00 178.16 178.50 3gj6 h GLU 198 N 0.58 0.73 -0.20 4.88 5.08 -1.07 -2.68 114.58 121.90 3gj6 h GLU 198 Ca 0.08 -0.36 -0.14 0.00 -1.00 0.00 0.00 59.36 57.94 3gj6 h GLU 198 Cb 0.71 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 3gj6 h GLU 198 CO 0.05 0.97 -0.47 1.25 -1.00 0.00 0.00 179.01 179.82 3gj6 h HIS 199 N 0.61 0.61 0.00 4.33 2.76 -0.87 -2.67 115.15 119.92 3gj6 h HIS 199 Ca 0.06 -0.19 0.00 0.00 -2.20 0.00 0.00 60.37 58.03 3gj6 h HIS 199 Cb 0.89 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 29.73 3gj6 h HIS 199 CO 0.05 0.88 0.00 -0.25 -1.30 0.00 0.00 177.93 177.30 3gj6 n ASP 200 N -3.99 0.03 0.01 3.26 8.00 0.90 -1.88 116.55 122.87 3gj6 n ASP 200 Ca -0.02 0.51 -0.21 0.00 0.71 0.00 0.00 54.79 55.77 3gj6 n ASP 200 Cb 0.55 -0.51 -0.14 0.00 -0.02 0.00 0.00 41.12 41.00 3gj6 n ASP 200 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3gj6 n LEU 201 N -1.53 2.61 0.07 0.64 4.77 -1.02 -4.03 117.00 118.50 3gj6 n LEU 201 Ca 0.04 0.22 -0.13 0.00 -0.03 0.00 0.00 56.01 56.12 3gj6 n LEU 201 Cb 0.22 -1.10 -0.09 0.00 -2.33 0.00 0.00 43.42 40.13 3gj6 n LEU 201 CO 0.18 0.85 0.57 -0.33 -1.33 0.00 0.00 177.39 177.32 3gj6 h GLU 202 N 0.07 -0.20 -0.06 3.23 5.08 -1.34 -2.72 114.58 118.64 3gj6 h GLU 202 Ca -0.42 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 3gj6 h GLU 202 Cb 2.04 0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.33 3gj6 h GLU 202 CO 0.09 0.18 0.00 0.28 -1.00 0.00 0.00 179.01 178.57 3gj6 n VAL 203 N -4.99 0.00 -0.02 3.13 0.31 -0.79 -1.11 118.33 114.85 3gj6 n VAL 203 Ca -0.09 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.22 3gj6 n VAL 203 Cb 0.25 -0.31 -0.02 0.00 -0.91 0.00 0.00 33.84 32.84 3gj6 n VAL 203 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gj6 n ALA 204 N -0.25 1.90 0.29 3.52 0.00 -1.13 -4.66 120.51 120.19 3gj6 n ALA 204 Ca 0.00 -0.21 0.18 0.00 0.00 0.00 0.00 53.44 53.41 3gj6 n ALA 204 Cb 0.02 0.34 0.78 0.00 0.00 0.00 0.00 19.45 20.58 3gj6 n ALA 204 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3gj6 h GLN 205 N 0.00 0.00 -0.46 0.00 1.08 -0.81 -2.83 115.11 112.09 3gj6 h GLN 205 Ca -0.10 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 3gj6 h GLN 205 Cb 1.18 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.60 3gj6 h GLN 205 CO -0.01 0.01 0.01 0.25 -0.95 0.00 0.00 178.83 178.14 3gj6 n THR 206 N -3.12 2.60 0.03 -0.54 -2.24 -1.12 -4.79 114.28 105.09 3gj6 n THR 206 Ca -0.00 -1.62 0.00 0.00 -2.27 0.00 0.00 64.05 60.16 3gj6 n THR 206 Cb 0.26 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 3gj6 n THR 206 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3gj6 n THR 207 N 0.13 0.40 0.01 4.28 -1.04 -1.07 -5.09 114.28 111.91 3gj6 n THR 207 Ca 0.26 0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.41 3gj6 n THR 207 Cb 1.09 -1.06 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 3gj6 n THR 207 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43