#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g9x s GLY 5 N 0.00 2.91 -0.01 7.39 0.00 -1.26 -4.94 107.32 111.41 3g9x s GLY 5 Ca 0.00 1.07 0.15 0.00 0.00 0.00 0.00 44.72 45.94 3g9x s GLY 5 CO 0.00 1.62 0.51 -1.30 0.00 0.00 0.00 173.10 173.93 3g9x n THR 6 N 0.21 0.00 -2.05 0.90 -2.24 -1.26 -4.90 114.28 104.95 3g9x n THR 6 Ca 0.03 -0.23 -0.28 0.00 -2.27 0.00 0.00 64.05 61.30 3g9x n THR 6 Cb 0.45 0.65 0.07 0.00 -2.10 0.00 0.00 70.33 69.40 3g9x n THR 6 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3g9x s GLY 7 N -2.96 1.63 -0.56 3.38 0.00 -1.26 -4.79 107.32 102.76 3g9x s GLY 7 Ca 0.01 -0.69 0.05 0.00 0.00 0.00 0.00 44.72 44.09 3g9x s GLY 7 CO 0.62 -0.27 0.47 0.33 0.00 0.00 0.00 173.10 174.25 3g9x n PHE 8 N -3.05 1.44 -1.88 1.90 7.35 -1.26 -4.93 117.46 117.02 3g9x n PHE 8 Ca 0.07 -3.86 -0.38 0.00 -0.76 0.00 0.00 57.45 52.52 3g9x n PHE 8 Cb 0.60 -0.27 -0.01 0.00 0.35 0.00 0.00 39.48 40.14 3g9x n PHE 8 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 3g9x n PRO 9 N 2.08 4.29 -4.48 -7.13 -0.04 -1.26 -4.84 135.00 123.62 3g9x n PRO 9 Ca 0.25 -3.23 -0.24 0.00 -0.04 0.00 0.00 63.50 60.23 3g9x n PRO 9 Cb 0.42 -2.59 -0.17 0.00 -0.04 0.00 0.00 33.50 31.13 3g9x n PRO 9 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3g9x s PHE 10 N -0.96 1.41 0.41 0.54 0.08 -1.26 -5.13 117.98 113.07 3g9x s PHE 10 Ca 0.56 -0.54 -0.26 0.00 0.12 0.00 0.00 56.93 56.82 3g9x s PHE 10 Cb 0.21 -1.06 -0.08 0.00 -0.57 0.00 0.00 43.02 41.51 3g9x s PHE 10 CO -0.10 -0.30 1.27 -0.51 -0.10 0.00 0.00 175.22 175.48 3g9x s ASP 11 N 0.79 6.32 0.31 1.36 1.01 -1.26 -4.98 116.67 120.23 3g9x s ASP 11 Ca -0.12 2.58 -0.28 0.00 0.71 0.00 0.00 52.55 55.44 3g9x s ASP 11 Cb -0.15 -2.63 -0.09 0.00 1.01 0.00 0.00 42.92 41.05 3g9x s ASP 11 CO 0.02 -0.83 1.05 -2.16 0.21 0.00 0.00 175.17 173.46 3g9x s PRO 12 N -2.28 4.55 0.10 8.23 0.04 -1.26 -4.62 135.00 139.75 3g9x s PRO 12 Ca 0.57 1.65 0.08 0.00 0.04 0.00 0.00 61.00 63.34 3g9x s PRO 12 Cb -0.36 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.14 3g9x s PRO 12 CO 0.46 0.17 -0.21 -1.01 0.04 0.00 0.00 177.00 176.46 3g9x s HIS 13 N -1.33 1.77 0.01 0.56 3.76 -0.89 -5.01 115.29 114.18 3g9x s HIS 13 Ca 0.48 -0.42 0.02 0.00 -0.15 0.00 0.00 55.06 54.99 3g9x s HIS 13 Cb -0.28 -0.98 -0.01 0.00 1.11 0.00 0.00 32.58 32.43 3g9x s HIS 13 CO 0.35 0.20 -0.08 0.71 -0.85 0.00 0.00 174.74 175.07 3g9x s TYR 14 N -1.15 0.67 -0.01 1.40 2.02 -1.26 -0.89 117.35 118.14 3g9x s TYR 14 Ca 0.06 -0.24 0.01 0.00 -0.37 0.00 0.00 57.07 56.53 3g9x s TYR 14 Cb -0.10 -0.42 -0.00 0.00 -0.40 0.00 0.00 41.96 41.04 3g9x s TYR 14 CO 0.04 -0.02 -0.04 0.54 -1.57 0.00 0.00 175.55 174.49 3g9x s VAL 15 N -0.56 0.36 -0.22 0.71 0.11 -0.56 -4.96 120.40 115.26 3g9x s VAL 15 Ca -0.01 -0.19 -0.15 0.00 -2.93 0.00 0.00 61.98 58.70 3g9x s VAL 15 Cb -0.05 -0.31 -0.04 0.00 -1.53 0.00 0.00 36.38 34.45 3g9x s VAL 15 CO 0.00 0.11 0.38 -0.70 -3.33 0.00 0.00 175.10 171.55 3g9x s GLU 16 N -0.05 4.13 -0.16 1.54 2.12 -1.26 -0.82 118.70 124.19 3g9x s GLU 16 Ca 0.01 0.13 0.00 0.00 0.36 0.00 0.00 54.97 55.48 3g9x s GLU 16 Cb -0.02 -3.57 0.03 0.00 0.26 0.00 0.00 34.13 30.83 3g9x s GLU 16 CO -0.00 -0.10 -0.13 0.08 -0.54 0.00 0.00 175.26 174.57 3g9x s VAL 17 N 1.50 1.59 -1.49 3.70 1.01 -0.01 -4.84 120.40 121.85 3g9x s VAL 17 Ca 0.17 -0.75 -0.10 0.00 0.00 0.00 0.00 61.98 61.30 3g9x s VAL 17 Cb -0.15 -1.55 0.07 0.00 0.00 0.00 0.00 36.38 34.74 3g9x s VAL 17 CO 0.08 0.36 0.83 0.18 0.00 0.00 0.00 175.10 176.55 3g9x n LEU 18 N 4.75 -2.54 0.00 3.92 4.77 -1.26 -1.44 117.00 125.19 3g9x n LEU 18 Ca -0.16 -0.84 0.00 0.00 -0.03 0.00 0.00 56.01 54.97 3g9x n LEU 18 Cb 0.49 -2.49 0.00 0.00 -2.33 0.00 0.00 43.42 39.09 3g9x n LEU 18 CO 0.21 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 3g9x n GLY 19 N -1.66 1.02 3.02 -0.72 0.00 -1.26 -5.00 105.19 100.59 3g9x n GLY 19 Ca -0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 3g9x n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g9x s GLU 20 N -0.11 0.46 0.04 1.61 0.41 -0.52 -5.11 118.70 115.47 3g9x s GLU 20 Ca 0.00 -0.60 -0.22 0.00 -0.41 0.00 0.00 54.97 53.74 3g9x s GLU 20 Cb 0.00 -0.25 -0.06 0.00 -1.78 0.00 0.00 34.13 32.05 3g9x s GLU 20 CO 0.00 0.05 0.65 1.03 -0.49 0.00 0.00 175.26 176.50 3g9x s ARG 21 N -1.24 4.37 -0.13 1.61 0.52 -1.26 -0.83 118.95 121.99 3g9x s ARG 21 Ca -0.08 0.87 -0.01 0.00 -0.52 0.00 0.00 55.73 55.98 3g9x s ARG 21 Cb -0.08 -3.32 -0.02 0.00 0.52 0.00 0.00 34.95 32.04 3g9x s ARG 21 CO 0.00 0.41 -0.09 -1.64 0.02 0.00 0.00 175.30 174.00 3g9x s MET 22 N -0.40 3.42 0.25 3.54 -1.94 -0.00 -0.51 119.30 123.66 3g9x s MET 22 Ca 0.33 -0.61 -0.17 0.00 -1.71 0.00 0.00 55.69 53.52 3g9x s MET 22 Cb -0.20 -2.72 -0.08 0.00 2.01 0.00 0.00 34.83 33.84 3g9x s MET 22 CO 0.20 0.27 0.71 -1.58 -0.01 0.00 0.00 175.02 174.61 3g9x s HIS 23 N 0.23 3.55 -0.01 -0.03 2.46 -1.26 -1.50 115.29 118.72 3g9x s HIS 23 Ca -0.06 1.29 -0.21 0.00 0.47 0.00 0.00 55.06 56.56 3g9x s HIS 23 Cb -0.15 -2.56 0.04 0.00 -0.13 0.00 0.00 32.58 29.78 3g9x s HIS 23 CO 0.04 0.26 0.45 1.52 -2.47 0.00 0.00 174.74 174.54 3g9x s TYR 24 N -1.68 -0.35 0.25 3.88 1.13 -0.07 -0.65 117.35 119.86 3g9x s TYR 24 Ca 0.47 0.51 -0.30 0.00 -1.41 0.00 0.00 57.07 56.34 3g9x s TYR 24 Cb -0.14 0.23 -0.09 0.00 -1.10 0.00 0.00 41.96 40.85 3g9x s TYR 24 CO 0.20 -0.51 0.97 0.08 -2.51 0.00 0.00 175.55 173.77 3g9x s VAL 25 N -1.61 3.98 -0.27 -3.49 1.01 -0.52 -2.09 120.40 117.41 3g9x s VAL 25 Ca -0.11 1.99 -0.01 0.00 0.00 0.00 0.00 61.98 63.86 3g9x s VAL 25 Cb -0.02 -4.27 0.13 0.00 0.00 0.00 0.00 36.38 32.22 3g9x s VAL 25 CO 0.04 0.48 0.32 -0.62 0.00 0.00 0.00 175.10 175.32 3g9x s ASP 26 N -1.13 1.13 0.20 3.32 -1.08 -1.25 -1.50 116.67 116.35 3g9x s ASP 26 Ca 0.42 -0.43 0.03 0.00 -0.52 0.00 0.00 52.55 52.05 3g9x s ASP 26 Cb -0.27 0.71 -0.05 0.00 -1.46 0.00 0.00 42.92 41.86 3g9x s ASP 26 CO 0.33 -0.36 -0.01 0.68 0.52 0.00 0.00 175.17 176.33 3g9x s VAL 27 N 2.42 0.90 0.00 1.11 -7.23 -0.76 -4.99 120.40 111.86 3g9x s VAL 27 Ca 0.10 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 3g9x s VAL 27 Cb -0.14 -2.19 0.00 0.00 0.56 0.00 0.00 36.38 34.61 3g9x s VAL 27 CO -0.26 -0.44 0.00 0.61 -0.31 0.00 0.00 175.10 174.70 3g9x n GLY 28 N -0.32 0.19 3.76 2.32 0.00 -1.26 -0.61 105.19 109.27 3g9x n GLY 28 Ca -0.06 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 43.72 3g9x n GLY 28 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3g9x s PRO 29 N -1.61 3.03 0.00 1.61 0.04 -1.26 -4.68 135.00 132.13 3g9x s PRO 29 Ca 0.00 1.66 0.20 0.00 0.04 0.00 0.00 61.00 62.91 3g9x s PRO 29 Cb 0.00 -1.95 0.42 0.00 0.04 0.00 0.00 34.50 33.01 3g9x s PRO 29 CO 0.00 -1.12 1.36 0.54 0.04 0.00 0.00 177.00 177.82 3g9x n ARG 30 N -1.71 2.45 -0.84 4.56 3.00 -1.26 -3.46 116.66 119.40 3g9x n ARG 30 Ca 0.12 -2.25 0.05 0.00 -0.01 0.00 0.00 57.85 55.77 3g9x n ARG 30 Cb 0.51 -1.47 0.36 0.00 0.00 0.00 0.00 32.46 31.86 3g9x n ARG 30 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 3g9x n ASP 31 N 1.32 5.25 0.00 0.55 5.68 -1.26 -4.97 116.55 123.13 3g9x n ASP 31 Ca 0.18 -3.01 0.00 0.00 -0.50 0.00 0.00 54.79 51.46 3g9x n ASP 31 Cb 0.56 -0.67 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 3g9x n ASP 31 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3g9x n GLY 32 N 0.28 5.43 3.63 6.12 0.00 -1.26 -5.12 105.19 114.27 3g9x n GLY 32 Ca 0.29 -1.34 -0.39 0.00 0.00 0.00 0.00 46.02 44.58 3g9x n GLY 32 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g9x s THR 33 N 0.25 5.11 0.58 2.61 2.01 -1.26 -5.00 115.64 119.93 3g9x s THR 33 Ca 0.00 0.83 -0.15 0.00 0.31 0.00 0.00 61.69 62.68 3g9x s THR 33 Cb 0.00 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.66 3g9x s THR 33 CO 0.00 0.13 1.03 -2.16 -0.69 0.00 0.00 174.62 172.93 3g9x s PRO 34 N 2.02 3.56 -0.27 4.92 0.04 -1.26 -4.48 135.00 139.52 3g9x s PRO 34 Ca 0.20 1.01 -0.07 0.00 0.04 0.00 0.00 61.00 62.18 3g9x s PRO 34 Cb -0.15 -2.07 -0.01 0.00 0.04 0.00 0.00 34.50 32.30 3g9x s PRO 34 CO 0.09 -0.60 0.08 0.08 0.04 0.00 0.00 177.00 176.69 3g9x s VAL 35 N -2.70 4.17 -0.28 -0.36 1.01 0.16 -1.08 120.40 121.32 3g9x s VAL 35 Ca 0.60 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 62.08 3g9x s VAL 35 Cb -0.13 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 3g9x s VAL 35 CO 0.39 0.22 0.12 -0.22 0.00 0.00 0.00 175.10 175.61 3g9x s LEU 36 N 1.57 3.79 -0.25 3.92 2.96 0.28 -0.91 118.68 130.04 3g9x s LEU 36 Ca 0.05 -0.34 -0.09 0.00 -0.22 0.00 0.00 54.13 53.53 3g9x s LEU 36 Cb -0.16 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.51 3g9x s LEU 36 CO 0.03 -0.11 0.13 -0.36 -1.32 0.00 0.00 176.35 174.73 3g9x s PHE 37 N 1.63 3.21 -0.24 5.38 0.40 -0.06 -0.84 117.98 127.46 3g9x s PHE 37 Ca 0.06 -0.01 0.02 0.00 -0.60 0.00 0.00 56.93 56.39 3g9x s PHE 37 Cb -0.16 -2.27 0.05 0.00 0.51 0.00 0.00 43.02 41.15 3g9x s PHE 37 CO 0.05 -0.12 -0.10 -0.51 0.70 0.00 0.00 175.22 175.24 3g9x s LEU 38 N 1.37 2.93 0.89 -0.37 1.43 -0.12 -3.90 118.68 120.90 3g9x s LEU 38 Ca 0.06 -1.19 -0.13 0.00 -1.03 0.00 0.00 54.13 51.84 3g9x s LEU 38 Cb -0.15 -1.41 0.13 0.00 0.03 0.00 0.00 46.19 44.80 3g9x s LEU 38 CO 0.06 -0.18 1.20 -1.38 0.23 0.00 0.00 176.35 176.29 3g9x s HIS 39 N 1.23 2.41 0.00 0.29 -3.43 -1.26 -2.45 115.29 112.09 3g9x s HIS 39 Ca -0.06 0.65 0.00 0.00 -0.80 0.00 0.00 55.06 54.85 3g9x s HIS 39 Cb -0.18 -3.63 0.00 0.00 -1.43 0.00 0.00 32.58 27.33 3g9x s HIS 39 CO -0.07 -2.21 0.00 0.41 -2.00 0.00 0.00 174.74 170.87 3g9x n GLY 40 N -3.10 5.33 3.79 -1.38 0.00 -1.25 -2.11 105.19 106.46 3g9x n GLY 40 Ca 0.10 -1.42 -0.36 0.00 0.00 0.00 0.00 46.02 44.34 3g9x n GLY 40 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3g9x s ASN 41 N 1.00 6.42 -0.69 1.61 2.47 -1.26 -1.59 114.94 122.90 3g9x s ASN 41 Ca 0.00 0.49 -0.00 0.00 0.42 0.00 0.00 52.86 53.77 3g9x s ASN 41 Cb 0.00 -2.14 0.40 0.00 -1.45 0.00 0.00 41.25 38.06 3g9x s ASN 41 CO 0.00 0.24 1.81 -0.81 -3.72 0.00 0.00 177.10 174.62 3g9x n PRO 42 N 2.85 2.92 -0.06 0.43 -0.04 -1.26 -4.99 135.00 134.85 3g9x n PRO 42 Ca -0.16 -3.67 0.00 0.00 -0.04 0.00 0.00 63.50 59.63 3g9x n PRO 42 Cb 0.53 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 3g9x n PRO 42 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3g9x n THR 43 N -0.65 0.00 -3.26 0.52 -2.24 -0.62 -5.00 114.28 103.03 3g9x n THR 43 Ca 0.53 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 62.30 3g9x n THR 43 Cb 0.48 -0.95 0.01 0.00 -2.10 0.00 0.00 70.33 67.77 3g9x n THR 43 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3g9x n SER 44 N -0.15 -0.44 0.32 3.42 3.41 -1.26 -4.46 113.62 114.45 3g9x n SER 44 Ca 0.00 -1.29 0.18 0.00 -0.26 0.00 0.00 58.87 57.51 3g9x n SER 44 Cb 0.00 0.73 0.99 0.00 -0.26 0.00 0.00 64.21 65.67 3g9x n SER 44 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3g9x h SER 45 N 0.41 0.00 -0.78 4.04 4.64 -1.85 -1.07 113.55 118.93 3g9x h SER 45 Ca -0.07 0.00 0.17 0.00 -0.47 0.00 0.00 61.79 61.42 3g9x h SER 45 Cb 0.25 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.29 3g9x h SER 45 CO 0.08 0.00 0.52 0.22 -0.87 0.00 0.00 176.83 176.79 3g9x h TYR 46 N 0.00 0.44 -0.02 4.77 3.20 -1.95 -0.99 116.97 122.42 3g9x h TYR 46 Ca 0.00 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.89 3g9x h TYR 46 Cb 0.27 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.40 3g9x h TYR 46 CO 0.00 0.15 0.02 1.25 -1.64 0.00 0.00 178.16 177.94 3g9x h LEU 47 N 0.36 0.00 -1.72 2.82 5.85 -1.59 -2.14 115.31 118.88 3g9x h LEU 47 Ca 0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.11 3g9x h LEU 47 Cb 0.98 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.01 3g9x h LEU 47 CO -0.12 0.00 0.00 0.79 -0.34 0.00 0.00 178.44 178.77 3g9x n TRP 48 N -4.14 0.25 0.00 1.25 7.02 -0.38 -4.63 117.44 116.82 3g9x n TRP 48 Ca -0.02 -0.13 0.09 0.00 -1.02 0.00 0.00 57.50 56.42 3g9x n TRP 48 Cb 0.11 0.00 0.50 0.00 -2.42 0.00 0.00 31.31 29.50 3g9x n TRP 48 CO 0.00 0.00 0.00 0.07 -2.02 0.00 0.00 177.69 175.74 3g9x h ARG 49 N 3.62 0.38 -0.03 -0.99 0.11 -1.42 -1.13 114.38 114.91 3g9x h ARG 49 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 3g9x h ARG 49 Cb 0.79 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 31.78 3g9x h ARG 49 CO 0.00 0.25 -0.13 0.09 0.10 0.00 0.00 179.97 180.28 3g9x n ASN 50 N -4.48 2.64 -0.12 0.08 3.02 -1.26 -4.33 115.26 110.82 3g9x n ASN 50 Ca 0.05 -1.83 -0.25 0.00 -0.03 0.00 0.00 54.58 52.52 3g9x n ASN 50 Cb 0.22 0.13 -0.11 0.00 -0.61 0.00 0.00 39.78 39.41 3g9x n ASN 50 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3g9x n ILE 51 N 0.90 1.55 -0.29 2.41 5.41 -0.54 -4.51 119.36 124.29 3g9x n ILE 51 Ca 0.13 -0.36 0.11 0.00 1.00 0.00 0.00 62.75 63.63 3g9x n ILE 51 Cb 0.55 -1.82 0.27 0.00 -0.71 0.00 0.00 39.64 37.93 3g9x n ILE 51 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3g9x h ILE 52 N -0.72 0.41 0.00 1.39 2.04 -1.46 -1.39 117.51 117.79 3g9x h ILE 52 Ca -0.57 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 3g9x h ILE 52 Cb 1.63 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.81 3g9x h ILE 52 CO -0.27 0.05 -0.01 -0.65 0.00 0.00 0.00 178.15 177.28 3g9x h PRO 53 N 0.29 0.00 0.00 2.37 0.11 -1.79 0.13 132.00 133.11 3g9x h PRO 53 Ca 0.53 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.49 3g9x h PRO 53 Cb 1.01 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 3g9x h PRO 53 CO -0.58 0.01 -0.70 0.45 -0.21 0.00 0.00 178.00 176.97 3g9x h HIS 54 N 0.00 0.00 0.05 0.65 3.86 -1.52 -3.38 115.15 114.82 3g9x h HIS 54 Ca -0.00 0.00 -0.38 0.00 -1.16 0.00 0.00 60.37 58.83 3g9x h HIS 54 Cb 0.09 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.51 3g9x h HIS 54 CO 0.00 0.70 -2.25 0.28 0.86 0.00 0.00 177.93 177.52 3g9x n VAL 55 N -3.57 1.62 -0.29 2.45 0.31 -0.13 -4.48 118.33 114.24 3g9x n VAL 55 Ca -0.00 -0.62 0.25 0.00 -0.01 0.00 0.00 64.34 63.96 3g9x n VAL 55 Cb 0.72 -1.52 0.59 0.00 -0.91 0.00 0.00 33.84 32.72 3g9x n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g9x h ALA 56 N 0.08 2.50 -0.41 3.52 0.00 -1.21 -1.46 119.26 122.29 3g9x h ALA 56 Ca -0.51 0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.49 3g9x h ALA 56 Cb 1.97 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.78 3g9x h ALA 56 CO -0.01 -0.85 0.28 -1.35 0.00 0.00 0.00 179.25 177.33 3g9x h PRO 57 N 0.26 0.24 0.00 0.00 0.11 -1.78 -3.25 132.00 127.58 3g9x h PRO 57 Ca 0.54 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.57 3g9x h PRO 57 Cb 1.63 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.67 3g9x h PRO 57 CO -0.17 0.16 -1.58 -1.13 -0.21 0.00 0.00 178.00 175.07 3g9x n SER 58 N -4.47 2.48 -3.91 -2.05 3.41 -0.64 -4.92 113.62 103.53 3g9x n SER 58 Ca 0.06 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.56 3g9x n SER 58 Cb 0.30 1.22 -0.11 0.00 -0.26 0.00 0.00 64.21 65.36 3g9x n SER 58 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3g9x s HIS 59 N -2.57 0.10 0.34 7.33 3.76 -0.69 -4.86 115.29 118.70 3g9x s HIS 59 Ca -0.04 -0.22 -0.29 0.00 -0.15 0.00 0.00 55.06 54.36 3g9x s HIS 59 Cb 0.06 -0.09 -0.11 0.00 1.11 0.00 0.00 32.58 33.55 3g9x s HIS 59 CO 0.44 -0.18 1.51 0.50 -0.85 0.00 0.00 174.74 176.16 3g9x s ARG 60 N -1.05 4.14 -0.16 1.40 3.52 -1.22 -3.83 118.95 121.74 3g9x s ARG 60 Ca -0.12 2.54 0.01 0.00 -0.13 0.00 0.00 55.73 58.04 3g9x s ARG 60 Cb -0.07 -3.00 0.01 0.00 -1.56 0.00 0.00 34.95 30.33 3g9x s ARG 60 CO 0.00 -0.53 -0.20 0.00 -0.81 0.00 0.00 175.30 173.76 3g9x s ILE 62 N 1.02 1.99 -0.37 0.00 1.01 -0.09 -1.83 121.20 122.94 3g9x s ILE 62 Ca -0.02 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.72 3g9x s ILE 62 Cb -0.15 -1.79 0.12 0.00 0.01 0.00 0.00 42.46 40.65 3g9x s ILE 62 CO -0.06 0.53 0.17 0.00 0.00 0.00 0.00 174.94 175.59 3g9x s ALA 63 N 1.15 1.60 0.52 9.38 0.00 -0.56 -0.88 121.76 132.97 3g9x s ALA 63 Ca 0.01 -2.02 -0.17 0.00 0.00 0.00 0.00 51.96 49.78 3g9x s ALA 63 Cb -0.14 -1.71 -0.07 0.00 0.00 0.00 0.00 23.12 21.20 3g9x s ALA 63 CO -0.09 -1.90 1.00 -1.25 0.00 0.00 0.00 175.76 173.52 3g9x s PRO 64 N 1.06 3.85 -0.21 0.00 0.04 -1.25 -1.43 135.00 137.06 3g9x s PRO 64 Ca 0.14 1.04 -0.20 0.00 0.04 0.00 0.00 61.00 62.02 3g9x s PRO 64 Cb -0.21 -2.12 -0.03 0.00 0.04 0.00 0.00 34.50 32.18 3g9x s PRO 64 CO -0.11 -0.36 0.57 -0.51 0.04 0.00 0.00 177.00 176.63 3g9x s ASP 65 N -2.88 6.61 0.76 6.66 1.01 0.18 -4.34 116.67 124.67 3g9x s ASP 65 Ca 0.60 0.73 -0.15 0.00 0.71 0.00 0.00 52.55 54.45 3g9x s ASP 65 Cb -0.11 -2.32 0.02 0.00 1.01 0.00 0.00 42.92 41.52 3g9x s ASP 65 CO 0.30 -0.24 0.89 0.18 0.21 0.00 0.00 175.17 176.50 3g9x n LEU 66 N 5.02 2.86 -4.71 1.23 4.77 -1.26 -4.50 117.00 120.42 3g9x n LEU 66 Ca -0.03 0.60 -0.43 0.00 -0.03 0.00 0.00 56.01 56.13 3g9x n LEU 66 Cb 0.50 -1.37 -0.01 0.00 -2.33 0.00 0.00 43.42 40.21 3g9x n LEU 66 CO 0.43 -2.31 0.96 0.00 -1.33 0.00 0.00 177.39 175.14 3g9x n ILE 67 N -2.76 1.80 -0.97 -0.08 0.13 -1.26 -1.02 119.36 115.21 3g9x n ILE 67 Ca 0.12 -0.45 0.00 0.00 -1.10 0.00 0.00 62.75 61.32 3g9x n ILE 67 Cb 0.50 -1.62 0.00 0.00 -0.84 0.00 0.00 39.64 37.68 3g9x n ILE 67 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 3g9x n GLY 68 N 1.00 0.84 3.29 4.50 0.00 -0.26 -5.00 105.19 109.57 3g9x n GLY 68 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 3g9x n GLY 68 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g9x s MET 69 N -0.09 1.21 6.25 1.61 -1.94 -0.18 -4.88 119.30 121.27 3g9x s MET 69 Ca 0.00 -1.57 0.00 0.00 -1.71 0.00 0.00 55.69 52.41 3g9x s MET 69 Cb 0.00 -0.65 0.00 0.00 2.01 0.00 0.00 34.83 36.19 3g9x s MET 69 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.02 175.42 3g9x n GLY 70 N -0.31 3.13 0.84 -0.03 0.00 -1.26 -1.37 105.19 106.18 3g9x n GLY 70 Ca -0.08 -0.26 0.11 0.00 0.00 0.00 0.00 46.02 45.79 3g9x n GLY 70 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3g9x n LYS 71 N 14.00 2.09 -1.45 1.61 5.02 -1.26 -4.62 118.16 133.55 3g9x n LYS 71 Ca 0.00 -1.65 -0.31 0.00 -2.02 0.00 0.00 58.31 54.33 3g9x n LYS 71 Cb 0.00 -1.44 0.07 0.00 -0.02 0.00 0.00 35.03 33.64 3g9x n LYS 71 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3g9x s SER 72 N -1.46 4.93 1.03 4.39 0.01 -0.47 -4.45 113.70 117.67 3g9x s SER 72 Ca 0.35 1.76 -0.12 0.00 1.31 0.00 0.00 55.95 59.25 3g9x s SER 72 Cb 0.19 -2.51 0.21 0.00 0.21 0.00 0.00 66.02 64.11 3g9x s SER 72 CO 0.28 -1.75 1.08 -1.81 0.41 0.00 0.00 173.24 171.45 3g9x s ASP 73 N -3.45 2.20 -0.57 2.44 -0.00 0.34 -4.50 116.67 113.12 3g9x s ASP 73 Ca 0.60 1.61 0.07 0.00 -0.00 0.00 0.00 52.55 54.83 3g9x s ASP 73 Cb -0.16 -2.28 0.26 0.00 -0.00 0.00 0.00 42.92 40.74 3g9x s ASP 73 CO 0.54 -3.46 0.71 0.29 -0.00 0.00 0.00 175.17 173.25 3g9x n LYS 74 N -4.43 2.15 -0.92 8.23 5.02 -1.26 -1.10 118.16 125.84 3g9x n LYS 74 Ca 0.06 -4.34 -0.33 0.00 -2.02 0.00 0.00 58.31 51.69 3g9x n LYS 74 Cb 0.54 -2.01 0.14 0.00 -0.02 0.00 0.00 35.03 33.68 3g9x n LYS 74 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3g9x n PRO 75 N 0.88 -0.09 -2.35 1.97 -0.04 -1.26 -4.87 135.00 129.24 3g9x n PRO 75 Ca 0.28 0.05 -0.42 0.00 -0.04 0.00 0.00 63.50 63.37 3g9x n PRO 75 Cb 0.44 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 3g9x n PRO 75 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3g9x n ASP 76 N -3.49 6.46 -4.95 3.54 2.03 -1.26 -4.94 116.55 113.94 3g9x n ASP 76 Ca 0.13 -3.22 -0.23 0.00 0.52 0.00 0.00 54.79 51.98 3g9x n ASP 76 Cb 0.51 -1.38 0.04 0.00 -0.72 0.00 0.00 41.12 39.57 3g9x n ASP 76 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3g9x s LEU 77 N -1.58 3.21 0.39 -2.67 1.43 -1.26 -4.98 118.68 113.22 3g9x s LEU 77 Ca 0.43 0.26 0.21 0.00 -1.03 0.00 0.00 54.13 54.00 3g9x s LEU 77 Cb 0.13 -3.08 0.59 0.00 0.03 0.00 0.00 46.19 43.86 3g9x s LEU 77 CO -0.02 -1.18 1.68 0.44 0.23 0.00 0.00 176.35 177.51 3g9x h ASP 78 N -0.09 0.00 -3.97 2.29 3.32 -1.99 -3.48 116.42 112.50 3g9x h ASP 78 Ca -0.44 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.29 3g9x h ASP 78 Cb 1.29 0.00 0.07 0.00 0.22 0.00 0.00 39.33 40.90 3g9x h ASP 78 CO 0.56 0.29 -0.50 -1.22 -1.72 0.00 0.00 179.24 176.66 3g9x n TYR 79 N -3.31 -1.76 -0.79 4.55 4.01 -1.26 -4.79 117.16 113.80 3g9x n TYR 79 Ca 0.01 0.52 -0.31 0.00 -0.16 0.00 0.00 57.90 57.96 3g9x n TYR 79 Cb 0.54 -3.91 0.15 0.00 -0.31 0.00 0.00 39.34 35.81 3g9x n TYR 79 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3g9x s PHE 80 N -3.10 1.74 0.27 -0.72 0.08 -1.26 -4.60 117.98 110.39 3g9x s PHE 80 Ca 0.30 1.76 0.01 0.00 0.12 0.00 0.00 56.93 59.12 3g9x s PHE 80 Cb -0.13 -3.32 0.61 0.00 -0.57 0.00 0.00 43.02 39.61 3g9x s PHE 80 CO 0.37 -2.69 1.73 0.35 -0.10 0.00 0.00 175.22 174.88 3g9x h PHE 81 N -1.72 0.68 -0.63 0.36 3.57 -1.94 -0.26 116.94 116.99 3g9x h PHE 81 Ca -0.43 0.04 0.09 0.00 3.53 0.00 0.00 57.97 61.19 3g9x h PHE 81 Cb 1.27 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.80 3g9x h PHE 81 CO 0.51 0.06 0.42 0.22 -2.23 0.00 0.00 178.31 177.29 3g9x h ASP 82 N 0.50 0.46 -0.22 0.41 3.58 -1.99 0.26 116.42 119.42 3g9x h ASP 82 Ca 0.50 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.95 3g9x h ASP 82 Cb 0.83 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.78 3g9x h ASP 82 CO -0.44 0.28 0.12 0.44 -2.88 0.00 0.00 179.24 176.76 3g9x h ASP 83 N 0.51 0.27 -0.73 2.28 3.32 -1.39 -1.79 116.42 118.89 3g9x h ASP 83 Ca 0.29 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 3g9x h ASP 83 Cb 0.45 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.90 3g9x h ASP 83 CO -0.09 0.27 0.44 0.45 -1.72 0.00 0.00 179.24 178.60 3g9x h HIS 84 N 0.25 0.97 -0.21 4.55 3.86 -0.92 -1.58 115.15 122.07 3g9x h HIS 84 Ca 0.08 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.29 3g9x h HIS 84 Cb 0.06 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.20 3g9x h HIS 84 CO -0.04 0.65 0.13 0.28 0.86 0.00 0.00 177.93 179.81 3g9x h VAL 85 N 1.02 1.04 -0.30 2.45 2.07 -0.80 -0.04 116.25 121.68 3g9x h VAL 85 Ca 0.27 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.69 3g9x h VAL 85 Cb -0.04 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 3g9x h VAL 85 CO -0.05 0.05 0.18 0.03 0.02 0.00 0.00 177.57 177.80 3g9x h ARG 86 N 0.26 0.41 -0.38 1.57 3.08 -0.94 0.54 114.38 118.92 3g9x h ARG 86 Ca 0.08 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 59.98 3g9x h ARG 86 Cb -0.02 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 3g9x h ARG 86 CO -0.03 0.31 -0.22 1.88 -1.07 0.00 0.00 179.97 180.84 3g9x h TYR 87 N 0.39 0.95 -0.25 3.04 -1.99 -1.15 -1.99 116.97 115.97 3g9x h TYR 87 Ca 0.11 -0.24 -0.16 0.00 2.00 0.00 0.00 58.73 60.44 3g9x h TYR 87 Cb 0.01 -0.21 -0.01 0.00 2.00 0.00 0.00 36.73 38.51 3g9x h TYR 87 CO -0.04 1.01 -0.49 1.25 -0.00 0.00 0.00 178.16 179.89 3g9x h LEU 88 N 0.61 0.73 -0.55 3.88 5.85 -0.91 0.10 115.31 125.02 3g9x h LEU 88 Ca 0.08 -0.36 0.06 0.00 0.84 0.00 0.00 57.88 58.50 3g9x h LEU 88 Cb 0.78 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 3g9x h LEU 88 CO 0.06 1.09 0.25 0.44 -0.34 0.00 0.00 178.44 179.95 3g9x h ASP 89 N 0.53 0.32 -0.09 1.25 3.32 -0.82 -0.85 116.42 120.08 3g9x h ASP 89 Ca 0.03 0.05 -0.14 0.00 0.02 0.00 0.00 57.03 56.98 3g9x h ASP 89 Cb 1.04 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 3g9x h ASP 89 CO 0.10 0.21 -0.43 0.00 -1.72 0.00 0.00 179.24 177.40 3g9x h ALA 90 N 1.33 0.77 -0.09 3.45 0.00 -1.08 -2.35 119.26 121.29 3g9x h ALA 90 Ca 0.26 -0.46 0.03 0.00 0.00 0.00 0.00 54.91 54.74 3g9x h ALA 90 Cb 0.22 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3g9x h ALA 90 CO -0.21 0.66 -0.11 0.35 0.00 0.00 0.00 179.25 179.94 3g9x h PHE 91 N 0.51 -0.27 -0.73 0.00 3.57 -0.52 0.28 116.94 119.77 3g9x h PHE 91 Ca 0.04 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 3g9x h PHE 91 Cb 0.96 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.80 3g9x h PHE 91 CO 0.04 -0.17 0.43 0.82 -2.23 0.00 0.00 178.31 177.21 3g9x h ILE 92 N -0.14 1.21 -0.25 1.41 2.04 -1.01 -1.84 117.51 118.93 3g9x h ILE 92 Ca 0.07 -0.49 -0.12 0.00 1.00 0.00 0.00 64.86 65.32 3g9x h ILE 92 Cb 0.25 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 3g9x h ILE 92 CO -0.18 0.23 -0.37 -0.33 0.00 0.00 0.00 178.15 177.50 3g9x h GLU 93 N 1.00 0.55 -0.15 2.37 4.39 -1.25 -2.78 114.58 118.71 3g9x h GLU 93 Ca 0.26 -0.26 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 3g9x h GLU 93 Cb -0.01 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 3g9x h GLU 93 CO -0.05 0.84 -0.08 0.00 -1.16 0.00 0.00 179.01 178.56 3g9x h ALA 94 N 1.14 1.59 -0.00 3.43 0.00 -0.36 -0.67 119.26 124.38 3g9x h ALA 94 Ca 0.05 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3g9x h ALA 94 Cb 0.85 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3g9x h ALA 94 CO 0.07 0.30 -0.05 1.28 0.00 0.00 0.00 179.25 180.85 3g9x n LEU 95 N -4.32 0.33 -0.81 0.00 4.32 -0.75 -4.92 117.00 110.85 3g9x n LEU 95 Ca -0.01 0.03 -0.09 0.00 -0.02 0.00 0.00 56.01 55.92 3g9x n LEU 95 Cb 0.23 -0.15 -0.02 0.00 -1.62 0.00 0.00 43.42 41.86 3g9x n LEU 95 CO 0.37 0.06 -0.10 0.61 -1.22 0.00 0.00 177.39 177.11 3g9x n GLY 96 N 1.20 0.63 3.77 -0.72 0.00 -0.26 -4.96 105.19 104.85 3g9x n GLY 96 Ca 0.17 -0.59 -0.40 0.00 0.00 0.00 0.00 46.02 45.21 3g9x n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g9x s LEU 97 N -2.23 4.37 0.00 0.99 1.43 -1.06 -4.98 118.68 117.20 3g9x s LEU 97 Ca 0.00 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.62 3g9x s LEU 97 Cb 0.00 -3.76 0.00 0.00 0.03 0.00 0.00 46.19 42.46 3g9x s LEU 97 CO 0.00 -0.52 0.00 -0.62 0.23 0.00 0.00 176.35 175.44 3g9x n GLU 98 N 0.63 0.00 -3.36 1.70 1.02 -1.26 -4.84 120.64 114.53 3g9x n GLU 98 Ca 0.01 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.85 3g9x n GLU 98 Cb 0.44 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.81 3g9x n GLU 98 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 3g9x s GLU 99 N 0.58 3.74 0.10 3.49 1.03 -1.26 -4.80 118.70 121.58 3g9x s GLU 99 Ca 0.00 0.19 -0.01 0.00 0.03 0.00 0.00 54.97 55.17 3g9x s GLU 99 Cb 0.00 -2.64 -0.04 0.00 -0.80 0.00 0.00 34.13 30.66 3g9x s GLU 99 CO 0.00 0.26 0.03 0.14 -1.33 0.00 0.00 175.26 174.37 3g9x s VAL 100 N -1.94 0.15 -0.12 1.83 -7.23 0.41 -4.18 120.40 109.31 3g9x s VAL 100 Ca 0.46 -1.84 -0.03 0.00 -1.81 0.00 0.00 61.98 58.76 3g9x s VAL 100 Cb -0.11 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.97 3g9x s VAL 100 CO 0.25 -0.66 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.66 3g9x s VAL 101 N -4.00 4.02 -0.13 1.32 1.01 -0.24 -0.65 120.40 121.74 3g9x s VAL 101 Ca 0.17 -0.33 -0.07 0.00 0.00 0.00 0.00 61.98 61.75 3g9x s VAL 101 Cb 0.07 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.69 3g9x s VAL 101 CO -0.03 0.54 0.14 -0.76 0.00 0.00 0.00 175.10 174.99 3g9x s LEU 102 N -0.17 4.35 -0.23 3.92 1.43 -0.53 -0.56 118.68 126.90 3g9x s LEU 102 Ca 0.04 0.43 -0.00 0.00 -1.03 0.00 0.00 54.13 53.57 3g9x s LEU 102 Cb -0.13 -2.07 0.06 0.00 0.03 0.00 0.00 46.19 44.08 3g9x s LEU 102 CO 0.02 0.38 -0.03 -0.69 0.23 0.00 0.00 176.35 176.26 3g9x s VAL 103 N -0.82 1.29 0.04 -1.59 1.01 -0.02 -0.47 120.40 119.83 3g9x s VAL 103 Ca 0.14 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 61.06 3g9x s VAL 103 Cb -0.12 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 3g9x s VAL 103 CO 0.03 -0.13 -0.06 0.27 0.00 0.00 0.00 175.10 175.21 3g9x s ILE 104 N 1.50 0.45 -0.07 2.22 -4.36 -0.15 -0.94 121.20 119.85 3g9x s ILE 104 Ca -0.05 -1.19 -0.06 0.00 -0.26 0.00 0.00 60.65 59.10 3g9x s ILE 104 Cb -0.18 -0.71 0.02 0.00 1.25 0.00 0.00 42.46 42.83 3g9x s ILE 104 CO -0.07 -0.50 0.18 -2.28 0.24 0.00 0.00 174.94 172.51 3g9x s HIS 105 N -1.81 -0.20 0.00 1.37 2.46 -1.02 -2.53 115.29 113.55 3g9x s HIS 105 Ca -0.08 0.49 0.00 0.00 0.47 0.00 0.00 55.06 55.94 3g9x s HIS 105 Cb -0.07 0.05 0.00 0.00 -0.13 0.00 0.00 32.58 32.43 3g9x s HIS 105 CO -0.01 -0.11 0.00 -3.47 -2.47 0.00 0.00 174.74 168.68 3g9x n ASP 106 N 3.16 0.00 0.28 9.88 -0.08 -0.85 -0.30 116.55 128.64 3g9x n ASP 106 Ca -0.14 0.00 0.15 0.00 -1.51 0.00 0.00 54.79 53.29 3g9x n ASP 106 Cb 0.58 0.00 0.78 0.00 2.34 0.00 0.00 41.12 44.82 3g9x n ASP 106 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 3g9x h TRP 107 N 0.00 0.00 -0.07 -0.67 4.06 -1.91 0.30 115.95 117.66 3g9x h TRP 107 Ca 0.00 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.90 3g9x h TRP 107 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 3g9x h TRP 107 CO 0.00 0.08 -0.19 0.78 -3.56 0.00 0.00 178.44 175.55 3g9x h GLY 108 N 1.09 0.13 1.30 1.49 0.00 -0.11 -1.04 103.07 105.94 3g9x h GLY 108 Ca -0.00 -0.08 -0.21 0.00 0.00 0.00 0.00 47.33 47.04 3g9x h GLY 108 CO 0.01 0.08 -0.75 1.48 0.00 0.00 0.00 176.54 177.36 3g9x h SER 109 N 0.11 0.81 -0.45 0.19 4.64 -0.26 0.12 113.55 118.72 3g9x h SER 109 Ca 0.02 -0.53 -0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3g9x h SER 109 Cb 0.41 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 3g9x h SER 109 CO 0.03 1.31 0.26 0.00 -0.87 0.00 0.00 176.83 177.56 3g9x h ALA 110 N 0.68 0.57 -0.18 5.18 0.00 -1.18 0.17 119.26 124.50 3g9x h ALA 110 Ca -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3g9x h ALA 110 Cb 1.36 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3g9x h ALA 110 CO 0.15 0.07 0.11 -0.07 0.00 0.00 0.00 179.25 179.51 3g9x h LEU 111 N 0.59 0.21 -0.27 0.00 3.38 -1.15 -1.30 115.31 116.77 3g9x h LEU 111 Ca 0.16 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 3g9x h LEU 111 Cb 0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3g9x h LEU 111 CO -0.03 0.17 0.00 1.23 0.09 0.00 0.00 178.44 179.90 3g9x h GLY 112 N 0.23 0.52 1.31 0.83 0.00 -0.47 -0.71 103.07 104.78 3g9x h GLY 112 Ca 0.06 -0.38 -0.09 0.00 0.00 0.00 0.00 47.33 46.92 3g9x h GLY 112 CO -0.01 0.35 -0.09 0.74 0.00 0.00 0.00 176.54 177.53 3g9x h PHE 113 N 0.27 0.90 -0.58 5.60 0.04 -0.69 0.47 116.94 122.95 3g9x h PHE 113 Ca 0.08 -0.16 -0.08 0.00 2.80 0.00 0.00 57.97 60.60 3g9x h PHE 113 Cb 0.42 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.32 3g9x h PHE 113 CO 0.04 0.87 0.03 1.25 -0.60 0.00 0.00 178.31 179.90 3g9x h HIS 114 N 0.75 1.05 -0.41 -0.55 2.76 -1.13 -0.54 115.15 117.07 3g9x h HIS 114 Ca 0.13 -0.16 -0.10 0.00 -2.20 0.00 0.00 60.37 58.04 3g9x h HIS 114 Cb 0.58 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 3g9x h HIS 114 CO 0.03 0.92 -0.13 2.35 -1.30 0.00 0.00 177.93 179.80 3g9x h TRP 115 N 0.91 0.92 -0.43 5.26 7.01 -0.87 -2.79 115.95 125.95 3g9x h TRP 115 Ca 0.17 -0.21 -0.02 0.00 2.11 0.00 0.00 58.89 60.94 3g9x h TRP 115 Cb 0.48 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.30 3g9x h TRP 115 CO 0.03 0.95 0.17 0.00 -2.79 0.00 0.00 178.44 176.80 3g9x h ALA 116 N 0.84 0.56 -0.95 2.65 0.00 -0.66 0.37 119.26 122.07 3g9x h ALA 116 Ca 0.10 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.95 3g9x h ALA 116 Cb 0.67 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 3g9x h ALA 116 CO 0.05 0.16 0.62 -0.22 0.00 0.00 0.00 179.25 179.85 3g9x h LYS 117 N 0.55 1.03 0.00 0.00 3.64 -1.07 -0.92 116.57 119.80 3g9x h LYS 117 Ca 0.14 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3g9x h LYS 117 Cb 0.19 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3g9x h LYS 117 CO -0.01 0.68 -0.10 0.00 -2.27 0.00 0.00 179.45 177.75 3g9x h ARG 118 N 1.06 0.00 -1.29 1.90 3.08 -1.15 -3.37 114.38 114.60 3g9x h ARG 118 Ca 0.42 0.00 -0.42 0.00 0.07 0.00 0.00 59.98 60.05 3g9x h ARG 118 Cb 0.25 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 29.90 3g9x h ARG 118 CO -0.17 0.00 -1.12 0.09 -1.07 0.00 0.00 179.97 177.69 3g9x n ASN 119 N -2.64 1.85 0.21 7.04 3.02 0.07 -4.97 115.26 119.85 3g9x n ASN 119 Ca 0.04 -2.93 0.05 0.00 -0.03 0.00 0.00 54.58 51.72 3g9x n ASN 119 Cb 0.48 -0.54 0.47 0.00 -0.61 0.00 0.00 39.78 39.58 3g9x n ASN 119 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3g9x h PRO 120 N 2.95 0.00 0.00 3.52 0.13 -1.38 -1.21 132.00 136.00 3g9x h PRO 120 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3g9x h PRO 120 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3g9x h PRO 120 CO 0.56 0.27 0.00 -0.85 -0.23 0.00 0.00 178.00 177.74 3g9x n GLU 121 N -4.05 0.03 -0.14 0.86 0.00 -1.26 -2.70 120.64 113.38 3g9x n GLU 121 Ca -0.02 0.26 0.10 0.00 0.00 0.00 0.00 57.16 57.50 3g9x n GLU 121 Cb 0.33 -1.55 0.17 0.00 0.00 0.00 0.00 31.44 30.40 3g9x n GLU 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 3g9x n ARG 122 N -1.60 2.27 -3.91 3.44 1.74 -0.46 -4.88 116.66 113.26 3g9x n ARG 122 Ca 0.04 -2.08 -0.35 0.00 -0.77 0.00 0.00 57.85 54.68 3g9x n ARG 122 Cb 0.19 -1.44 -0.14 0.00 -1.02 0.00 0.00 32.46 30.05 3g9x n ARG 122 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3g9x s VAL 123 N -1.42 3.16 -0.55 1.55 1.01 -1.10 -0.45 120.40 122.60 3g9x s VAL 123 Ca 0.32 -0.96 0.23 0.00 0.00 0.00 0.00 61.98 61.58 3g9x s VAL 123 Cb 0.20 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 3g9x s VAL 123 CO 0.28 0.15 1.18 0.29 0.00 0.00 0.00 175.10 176.99 3g9x n LYS 124 N 4.72 0.35 -3.61 2.72 4.76 0.18 -4.97 118.16 122.31 3g9x n LYS 124 Ca -0.16 0.06 -0.04 0.00 -2.87 0.00 0.00 58.31 55.30 3g9x n LYS 124 Cb 0.47 -1.68 -0.03 0.00 -1.84 0.00 0.00 35.03 31.95 3g9x n LYS 124 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3g9x s GLY 125 N -3.79 -0.20 -0.11 0.72 0.00 -1.26 -4.36 107.32 98.31 3g9x s GLY 125 Ca 0.04 1.92 -0.02 0.00 0.00 0.00 0.00 44.72 46.67 3g9x s GLY 125 CO 0.76 0.71 0.00 -0.42 0.00 0.00 0.00 173.10 174.15 3g9x s ILE 126 N -1.97 0.49 -0.22 0.90 1.01 -0.37 -1.46 121.20 119.58 3g9x s ILE 126 Ca 0.08 -0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.53 3g9x s ILE 126 Cb -0.01 -0.72 -0.05 0.00 0.01 0.00 0.00 42.46 41.69 3g9x s ILE 126 CO -0.05 0.15 0.15 0.00 0.00 0.00 0.00 174.94 175.20 3g9x s ALA 127 N 1.91 3.65 0.09 9.38 0.00 0.37 -0.94 121.76 136.23 3g9x s ALA 127 Ca 0.03 -0.78 -0.01 0.00 0.00 0.00 0.00 51.96 51.21 3g9x s ALA 127 Cb -0.13 -2.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 3g9x s ALA 127 CO -0.06 -0.02 0.02 0.00 0.00 0.00 0.00 175.76 175.70 3g9x s MET 129 N -3.99 0.66 -1.31 0.00 0.23 -1.05 -1.38 119.30 112.46 3g9x s MET 129 Ca 0.16 0.87 -0.13 0.00 -1.03 0.00 0.00 55.69 55.56 3g9x s MET 129 Cb 0.08 0.28 0.01 0.00 -1.53 0.00 0.00 34.83 33.67 3g9x s MET 129 CO -0.04 -0.09 0.51 0.39 -2.03 0.00 0.00 175.02 173.77 3g9x n GLU 130 N 2.87 -1.73 -3.57 3.16 -0.58 -1.26 -4.00 120.64 115.53 3g9x n GLU 130 Ca -0.15 0.30 -0.21 0.00 -0.42 0.00 0.00 57.16 56.69 3g9x n GLU 130 Cb 0.56 -3.86 -0.01 0.00 -0.57 0.00 0.00 31.44 27.57 3g9x n GLU 130 CO 0.00 0.00 0.00 -0.59 -0.48 0.00 0.00 177.13 176.06 3g9x s PHE 131 N -3.80 3.27 -0.12 -0.32 -0.12 -1.26 -2.01 117.98 113.62 3g9x s PHE 131 Ca 0.24 -0.05 -0.24 0.00 -0.05 0.00 0.00 56.93 56.84 3g9x s PHE 131 Cb -0.10 -1.89 -0.03 0.00 -0.63 0.00 0.00 43.02 40.37 3g9x s PHE 131 CO 0.92 0.11 0.73 0.42 -0.05 0.00 0.00 175.22 177.34 3g9x s ILE 132 N -2.17 4.99 0.22 -4.49 1.01 -1.26 -4.77 121.20 114.72 3g9x s ILE 132 Ca 0.41 1.46 0.05 0.00 0.00 0.00 0.00 60.65 62.57 3g9x s ILE 132 Cb -0.09 -4.05 -0.05 0.00 0.01 0.00 0.00 42.46 38.27 3g9x s ILE 132 CO 0.32 0.15 -0.06 0.00 0.00 0.00 0.00 174.94 175.35 3g9x s ARG 133 N 1.45 1.31 0.42 2.79 1.70 -1.26 -4.81 118.95 120.55 3g9x s ARG 133 Ca 0.36 -1.63 -0.25 0.00 -0.47 0.00 0.00 55.73 53.74 3g9x s ARG 133 Cb -0.17 -0.79 -0.08 0.00 -0.57 0.00 0.00 34.95 33.34 3g9x s ARG 133 CO 0.15 0.01 1.23 -2.14 -1.08 0.00 0.00 175.30 173.46 3g9x s PRO 134 N -3.78 3.90 -0.52 3.89 0.02 -1.26 -4.77 135.00 132.48 3g9x s PRO 134 Ca 0.25 1.96 -0.08 0.00 0.02 0.00 0.00 61.00 63.15 3g9x s PRO 134 Cb 0.04 -2.62 0.13 0.00 0.02 0.00 0.00 34.50 32.07 3g9x s PRO 134 CO 0.07 -0.48 0.39 -0.06 -0.33 0.00 0.00 177.00 176.58 3g9x s PHE 135 N -1.38 3.47 0.40 6.54 0.08 -0.17 -4.99 117.98 121.93 3g9x s PHE 135 Ca 0.59 -2.07 0.10 0.00 0.12 0.00 0.00 56.93 55.68 3g9x s PHE 135 Cb -0.33 -3.46 0.82 0.00 -0.57 0.00 0.00 43.02 39.48 3g9x s PHE 135 CO 0.42 -0.97 1.94 -1.35 -0.10 0.00 0.00 175.22 175.16 3g9x h PRO 136 N 8.13 0.22 -4.78 0.24 0.11 -1.94 0.51 132.00 134.49 3g9x h PRO 136 Ca -0.14 -0.05 -0.28 0.00 0.11 0.00 0.00 66.00 65.64 3g9x h PRO 136 Cb 1.05 -0.03 -0.15 0.00 0.11 0.00 0.00 31.00 31.98 3g9x h PRO 136 CO 0.81 0.35 -0.66 0.95 -0.21 0.00 0.00 178.00 179.24 3g9x s THR 137 N -4.76 0.62 0.61 -1.15 -4.23 -1.26 -3.59 115.64 101.87 3g9x s THR 137 Ca -0.05 -1.98 0.38 0.00 -1.18 0.00 0.00 61.69 58.85 3g9x s THR 137 Cb 0.16 -2.16 0.40 0.00 1.34 0.00 0.00 72.50 72.24 3g9x s THR 137 CO 0.73 -0.43 2.30 -0.50 -0.54 0.00 0.00 174.62 176.18 3g9x h TRP 138 N 2.68 0.00 0.00 3.99 4.06 -1.94 -1.79 115.95 122.95 3g9x h TRP 138 Ca -0.37 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.56 3g9x h TRP 138 Cb 1.21 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.36 3g9x h TRP 138 CO 0.52 0.01 -0.09 -0.44 -3.56 0.00 0.00 178.44 174.87 3g9x h ASP 139 N 0.00 0.00 0.65 -3.49 3.32 -1.96 -2.23 116.42 112.71 3g9x h ASP 139 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3g9x h ASP 139 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3g9x h ASP 139 CO 0.00 0.09 -0.26 1.21 -1.72 0.00 0.00 179.24 178.56 3g9x n GLU 140 N -3.33 0.12 -2.65 3.56 4.07 -0.67 -4.79 120.64 116.95 3g9x n GLU 140 Ca -0.01 -0.05 -0.40 0.00 -0.06 0.00 0.00 57.16 56.64 3g9x n GLU 140 Cb 0.29 -1.50 -0.05 0.00 -0.06 0.00 0.00 31.44 30.11 3g9x n GLU 140 CO 0.00 0.00 0.00 -0.46 -0.06 0.00 0.00 177.13 176.61 3g9x s TRP 141 N -2.91 3.83 0.25 4.31 -0.11 -0.84 -4.97 118.94 118.49 3g9x s TRP 141 Ca 0.15 1.84 -0.31 0.00 1.22 0.00 0.00 56.10 59.00 3g9x s TRP 141 Cb 0.18 -3.09 -0.11 0.00 -1.50 0.00 0.00 33.47 28.96 3g9x s TRP 141 CO 0.60 0.09 1.63 -1.25 -4.62 0.00 0.00 176.95 173.40 3g9x s PRO 142 N -1.32 4.14 0.28 5.86 0.04 -1.26 -4.85 135.00 137.88 3g9x s PRO 142 Ca 0.43 2.55 0.01 0.00 0.04 0.00 0.00 61.00 64.03 3g9x s PRO 142 Cb -0.28 -3.06 0.54 0.00 0.04 0.00 0.00 34.50 31.74 3g9x s PRO 142 CO 0.35 -0.66 1.82 1.49 0.04 0.00 0.00 177.00 180.04 3g9x h GLU 143 N 5.78 0.90 0.00 4.56 4.22 -1.91 -1.74 114.58 126.39 3g9x h GLU 143 Ca -0.45 -0.05 -0.01 0.00 0.08 0.00 0.00 59.36 58.93 3g9x h GLU 143 Cb 1.21 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 3g9x h GLU 143 CO 0.87 0.60 -0.05 0.27 -2.18 0.00 0.00 179.01 178.51 3g9x h PHE 144 N 0.93 0.00 -0.19 0.92 -0.00 -2.03 -2.29 116.94 114.28 3g9x h PHE 144 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.46 3g9x h PHE 144 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.46 3g9x h PHE 144 CO -0.02 0.05 0.00 0.00 -0.00 0.00 0.00 178.31 178.34 3g9x n ALA 145 N -2.23 2.36 0.15 12.09 0.00 -0.69 -4.72 120.51 127.47 3g9x n ALA 145 Ca -0.02 -0.85 -0.13 0.00 0.00 0.00 0.00 53.44 52.44 3g9x n ALA 145 Cb 0.16 -0.48 -0.08 0.00 0.00 0.00 0.00 19.45 19.06 3g9x n ALA 145 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3g9x h ARG 146 N 2.53 -0.40 -0.98 0.00 2.43 -1.02 -1.96 114.38 114.97 3g9x h ARG 146 Ca 0.00 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.21 3g9x h ARG 146 Cb 0.65 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.24 3g9x h ARG 146 CO 0.00 -0.07 0.65 0.93 -1.51 0.00 0.00 179.97 179.97 3g9x h GLU 147 N -0.83 1.30 -0.16 0.20 5.08 -1.85 -0.28 114.58 118.04 3g9x h GLU 147 Ca -0.04 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3g9x h GLU 147 Cb 0.52 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 3g9x h GLU 147 CO 0.07 0.86 0.11 1.15 -1.00 0.00 0.00 179.01 180.20 3g9x h THR 148 N 1.34 1.05 0.00 1.13 2.02 -1.85 -1.32 112.91 115.27 3g9x h THR 148 Ca 0.36 -0.12 -0.13 0.00 0.77 0.00 0.00 66.41 67.30 3g9x h THR 148 Cb -0.15 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 3g9x h THR 148 CO -0.08 0.05 -0.62 -0.26 0.37 0.00 0.00 175.52 174.99 3g9x h PHE 149 N 0.21 0.00 -0.79 3.16 -1.00 -1.08 0.17 116.94 117.61 3g9x h PHE 149 Ca 0.06 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.82 3g9x h PHE 149 Cb -0.01 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.52 3g9x h PHE 149 CO -0.06 0.62 0.40 1.96 -1.61 0.00 0.00 178.31 179.61 3g9x h GLN 150 N 0.00 1.11 -0.32 1.51 4.20 -0.83 -1.95 115.11 118.83 3g9x h GLN 150 Ca -0.01 -0.14 -0.17 0.00 0.06 0.00 0.00 58.65 58.39 3g9x h GLN 150 Cb 1.13 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.70 3g9x h GLN 150 CO 0.08 0.84 -0.48 0.00 -0.67 0.00 0.00 178.83 178.60 3g9x h ALA 151 N 1.33 0.53 -0.79 3.87 0.00 -0.73 -3.07 119.26 120.40 3g9x h ALA 151 Ca 0.27 -0.49 0.09 0.00 0.00 0.00 0.00 54.91 54.79 3g9x h ALA 151 Cb 0.08 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 3g9x h ALA 151 CO -0.04 0.68 0.51 0.74 0.00 0.00 0.00 179.25 181.14 3g9x h PHE 152 N 0.69 0.77 -0.68 0.00 0.05 -0.74 -2.39 116.94 114.64 3g9x h PHE 152 Ca 0.03 0.02 -0.38 0.00 3.82 0.00 0.00 57.97 61.46 3g9x h PHE 152 Cb 1.08 -0.25 -0.14 0.00 2.00 0.00 0.00 35.95 38.64 3g9x h PHE 152 CO 0.07 0.37 0.21 0.54 -0.18 0.00 0.00 178.31 179.31 3g9x n ARG 153 N -4.50 2.15 -4.09 1.51 1.74 -0.75 -4.34 116.66 108.37 3g9x n ARG 153 Ca 0.13 -1.81 -0.10 0.00 -0.77 0.00 0.00 57.85 55.30 3g9x n ARG 153 Cb 0.32 -1.97 -0.11 0.00 -1.02 0.00 0.00 32.46 29.68 3g9x n ARG 153 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3g9x s THR 154 N -1.44 0.44 -0.43 0.55 -4.23 -1.17 -5.01 115.64 104.35 3g9x s THR 154 Ca 0.53 -1.53 0.23 0.00 -1.18 0.00 0.00 61.69 59.75 3g9x s THR 154 Cb 0.33 -1.15 0.28 0.00 1.34 0.00 0.00 72.50 73.31 3g9x s THR 154 CO -0.13 -0.73 1.53 0.00 -0.54 0.00 0.00 174.62 174.76 3g9x h ALA 155 N 3.66 0.92 -0.96 3.99 0.00 -1.89 -3.02 119.26 121.96 3g9x h ALA 155 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3g9x h ALA 155 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3g9x h ALA 155 CO 0.55 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.40 3g9x n ASP 156 N -2.97 0.00 -0.18 0.00 5.75 -1.26 -4.40 116.55 113.49 3g9x n ASP 156 Ca 0.04 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.80 3g9x n ASP 156 Cb 0.53 -0.27 0.20 0.00 -1.03 0.00 0.00 41.12 40.55 3g9x n ASP 156 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 3g9x h VAL 157 N 0.00 1.22 -0.44 2.12 2.07 -1.83 -1.22 116.25 118.16 3g9x h VAL 157 Ca 0.00 -0.64 -0.10 0.00 0.82 0.00 0.00 66.70 66.78 3g9x h VAL 157 Cb 0.00 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 3g9x h VAL 157 CO 0.00 0.26 -0.12 1.23 0.02 0.00 0.00 177.57 178.96 3g9x h GLY 158 N 1.01 0.86 1.12 2.17 0.00 -1.29 0.23 103.07 107.17 3g9x h GLY 158 Ca 0.22 -0.66 -0.15 0.00 0.00 0.00 0.00 47.33 46.74 3g9x h GLY 158 CO -0.03 0.61 -0.33 3.21 0.00 0.00 0.00 176.54 180.01 3g9x h ARG 159 N 0.72 0.95 -0.17 4.80 3.08 -1.53 -0.70 114.38 121.53 3g9x h ARG 159 Ca 0.12 -0.47 0.03 0.00 0.07 0.00 0.00 59.98 59.72 3g9x h ARG 159 Cb 0.61 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 3g9x h ARG 159 CO 0.04 1.14 0.01 1.49 -1.07 0.00 0.00 179.97 181.58 3g9x h GLU 160 N 0.79 0.07 -0.01 0.04 4.81 -0.79 0.33 114.58 119.82 3g9x h GLU 160 Ca 0.08 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3g9x h GLU 160 Cb 0.92 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.29 3g9x h GLU 160 CO 0.09 0.04 -0.00 -0.07 -0.73 0.00 0.00 179.01 178.34 3g9x h LEU 161 N 0.07 0.02 0.16 1.64 3.38 -0.87 -1.26 115.31 118.44 3g9x h LEU 161 Ca 0.08 -0.42 -0.28 0.00 0.09 0.00 0.00 57.88 57.35 3g9x h LEU 161 Cb 0.09 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.84 3g9x h LEU 161 CO -0.12 0.43 -1.36 0.40 0.09 0.00 0.00 178.44 177.88 3g9x h ILE 162 N -0.39 1.16 0.00 1.22 2.04 -1.11 0.55 117.51 120.98 3g9x h ILE 162 Ca 0.00 -2.51 -0.11 0.00 1.00 0.00 0.00 64.86 63.24 3g9x h ILE 162 Cb 0.42 2.90 -0.02 0.00 -0.74 0.00 0.00 36.82 39.38 3g9x h ILE 162 CO 0.00 0.76 -0.62 0.40 0.00 0.00 0.00 178.15 178.69 3g9x h ILE 163 N -0.16 1.24 0.45 -0.67 2.04 -1.09 -2.87 117.51 116.45 3g9x h ILE 163 Ca -0.27 -2.17 -0.02 0.00 1.00 0.00 0.00 64.86 63.40 3g9x h ILE 163 Cb 1.88 2.59 0.00 0.00 -0.74 0.00 0.00 36.82 40.55 3g9x h ILE 163 CO 0.14 0.42 -0.21 -0.78 0.00 0.00 0.00 178.15 177.72 3g9x h ASP 164 N -1.00 -0.51 0.37 1.72 1.82 -1.33 -3.35 116.42 114.14 3g9x h ASP 164 Ca -0.17 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.49 3g9x h ASP 164 Cb 1.09 0.13 0.00 0.00 0.68 0.00 0.00 39.33 41.23 3g9x h ASP 164 CO -0.10 -0.32 -0.09 0.00 -1.61 0.00 0.00 179.24 177.11 3g9x n GLN 165 N -3.84 0.68 -3.31 0.28 6.02 -0.49 -4.87 117.38 111.85 3g9x n GLN 165 Ca -0.07 -0.21 -0.23 0.00 -0.01 0.00 0.00 57.00 56.47 3g9x n GLN 165 Cb 0.24 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 30.06 3g9x n GLN 165 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3g9x n ASN 166 N -0.97 -6.26 0.24 1.08 5.15 -0.91 -4.87 115.26 108.73 3g9x n ASN 166 Ca 0.15 -0.42 0.08 0.00 -0.60 0.00 0.00 54.58 53.79 3g9x n ASN 166 Cb 0.27 -4.99 0.61 0.00 -0.53 0.00 0.00 39.78 35.14 3g9x n ASN 166 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3g9x h ALA 167 N 1.01 1.61 -0.32 5.20 0.00 -1.02 -0.37 119.26 125.39 3g9x h ALA 167 Ca -0.55 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.09 3g9x h ALA 167 Cb 1.37 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 3g9x h ALA 167 CO 0.57 0.17 -0.40 0.35 0.00 0.00 0.00 179.25 179.94 3g9x h PHE 168 N 0.00 0.91 0.00 0.00 3.04 -1.81 -0.12 116.94 118.96 3g9x h PHE 168 Ca -0.00 -0.27 -0.01 0.00 3.98 0.00 0.00 57.97 61.67 3g9x h PHE 168 Cb 0.26 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 38.58 3g9x h PHE 168 CO 0.00 1.03 -0.05 0.82 -2.02 0.00 0.00 178.31 178.10 3g9x h ILE 169 N 0.62 1.71 0.00 1.41 2.04 -1.81 -1.61 117.51 119.87 3g9x h ILE 169 Ca 0.05 -2.13 -0.04 0.00 1.00 0.00 0.00 64.86 63.74 3g9x h ILE 169 Cb 0.95 3.15 -0.01 0.00 -0.74 0.00 0.00 36.82 40.17 3g9x h ILE 169 CO 0.09 0.56 -0.48 -0.33 0.00 0.00 0.00 178.15 177.99 3g9x h GLU 170 N -0.86 0.00 0.00 2.37 4.39 -1.17 -3.38 114.58 115.93 3g9x h GLU 170 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3g9x h GLU 170 Cb 0.94 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.59 3g9x h GLU 170 CO 0.01 0.15 0.00 0.41 -1.16 0.00 0.00 179.01 178.42 3g9x n GLY 171 N 1.18 -0.05 0.30 -3.84 0.00 -0.21 -4.71 105.19 97.86 3g9x n GLY 171 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 3g9x n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g9x h ALA 172 N -0.56 0.90 0.84 4.61 0.00 -1.13 -1.74 119.26 122.17 3g9x h ALA 172 Ca 0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3g9x h ALA 172 Cb 0.00 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.53 3g9x h ALA 172 CO 0.00 0.51 -0.40 1.25 0.00 0.00 0.00 179.25 180.61 3g9x h LEU 173 N 0.99 -0.95 -1.39 0.00 5.85 -1.47 -2.22 115.31 116.11 3g9x h LEU 173 Ca 0.23 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.92 3g9x h LEU 173 Cb 0.19 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 3g9x h LEU 173 CO -0.02 -0.67 -0.30 1.55 -0.34 0.00 0.00 178.44 178.66 3g9x h PRO 174 N -1.15 0.00 0.00 5.25 0.13 -1.74 -2.06 132.00 132.43 3g9x h PRO 174 Ca -0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 3g9x h PRO 174 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 3g9x h PRO 174 CO 0.19 0.30 0.00 0.87 -0.23 0.00 0.00 178.00 179.13 3g9x h LYS 175 N 0.00 0.00 -0.38 0.86 1.57 -1.20 -2.79 116.57 114.63 3g9x h LYS 175 Ca -0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.63 3g9x h LYS 175 Cb 0.56 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.79 3g9x h LYS 175 CO 0.04 0.00 0.02 0.00 -0.57 0.00 0.00 179.45 178.94 3g9x s VAL 177 N -3.09 1.78 -0.04 0.00 1.01 -1.05 -1.79 120.40 117.21 3g9x s VAL 177 Ca 0.45 -0.87 -0.26 0.00 0.00 0.00 0.00 61.98 61.29 3g9x s VAL 177 Cb 0.39 -1.54 -0.21 0.00 0.00 0.00 0.00 36.38 35.01 3g9x s VAL 177 CO 0.04 0.50 1.17 0.58 0.00 0.00 0.00 175.10 177.39 3g9x h VAL 178 N 5.60 1.47 -4.21 2.92 2.07 -1.88 -3.44 116.25 118.78 3g9x h VAL 178 Ca -0.25 -1.38 -0.50 0.00 0.82 0.00 0.00 66.70 65.39 3g9x h VAL 178 Cb 1.21 2.40 0.09 0.00 -1.52 0.00 0.00 31.29 33.47 3g9x h VAL 178 CO 0.47 0.36 0.37 0.00 0.02 0.00 0.00 177.57 178.79 3g9x s ARG 179 N -3.86 2.97 0.05 1.57 1.04 -1.26 -4.97 118.95 114.48 3g9x s ARG 179 Ca -0.16 1.30 -0.31 0.00 -1.04 0.00 0.00 55.73 55.52 3g9x s ARG 179 Cb 0.01 -1.98 -0.06 0.00 -2.04 0.00 0.00 34.95 30.88 3g9x s ARG 179 CO 0.68 -1.11 1.24 -1.25 -0.04 0.00 0.00 175.30 174.82 3g9x s PRO 180 N -4.15 4.39 0.37 3.89 0.05 -1.26 -5.01 135.00 133.29 3g9x s PRO 180 Ca 0.65 1.82 -0.27 0.00 0.05 0.00 0.00 61.00 63.25 3g9x s PRO 180 Cb -0.19 -3.37 -0.09 0.00 0.05 0.00 0.00 34.50 30.90 3g9x s PRO 180 CO 0.41 -0.33 1.24 -0.51 0.05 0.00 0.00 177.00 177.86 3g9x s LEU 181 N 1.30 4.30 0.65 -3.56 1.43 -1.26 -5.03 118.68 116.51 3g9x s LEU 181 Ca 0.60 2.53 -0.08 0.00 -1.03 0.00 0.00 54.13 56.14 3g9x s LEU 181 Cb -0.30 -3.84 0.02 0.00 0.03 0.00 0.00 46.19 42.10 3g9x s LEU 181 CO 0.28 -0.64 0.99 0.42 0.23 0.00 0.00 176.35 177.64 3g9x s THR 182 N -1.27 3.35 0.31 5.49 -4.23 -1.26 -4.88 115.64 113.16 3g9x s THR 182 Ca 0.53 0.13 0.00 0.00 -1.18 0.00 0.00 61.69 61.18 3g9x s THR 182 Cb -0.36 -3.38 0.20 0.00 1.34 0.00 0.00 72.50 70.30 3g9x s THR 182 CO 0.46 -0.44 1.91 -0.08 -0.54 0.00 0.00 174.62 175.92 3g9x h GLU 183 N -0.43 0.82 -0.39 3.99 4.57 -1.98 0.58 114.58 121.74 3g9x h GLU 183 Ca -0.45 -0.11 -0.01 0.00 -1.18 0.00 0.00 59.36 57.60 3g9x h GLU 183 Cb 1.27 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.69 3g9x h GLU 183 CO 0.62 0.66 0.20 0.28 -1.18 0.00 0.00 179.01 179.59 3g9x h VAL 184 N 0.82 1.16 -0.30 0.32 2.07 -1.98 0.79 116.25 119.13 3g9x h VAL 184 Ca 0.20 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 3g9x h VAL 184 Cb 0.13 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3g9x h VAL 184 CO -0.02 0.17 0.14 -0.33 0.02 0.00 0.00 177.57 177.55 3g9x h GLU 185 N 0.49 0.44 -0.86 1.57 5.08 -1.75 -2.02 114.58 117.52 3g9x h GLU 185 Ca 0.14 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 3g9x h GLU 185 Cb 0.09 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 3g9x h GLU 185 CO -0.02 0.42 0.55 0.52 -1.00 0.00 0.00 179.01 179.49 3g9x h MET 186 N 0.35 1.03 -0.46 2.33 2.86 -0.66 -1.75 114.93 118.63 3g9x h MET 186 Ca 0.10 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.64 3g9x h MET 186 Cb 0.13 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 3g9x h MET 186 CO -0.01 0.68 0.11 -0.44 1.06 0.00 0.00 176.91 178.31 3g9x h ASP 187 N 1.06 0.64 -0.71 1.22 3.32 -0.52 0.23 116.42 121.66 3g9x h ASP 187 Ca 0.35 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 3g9x h ASP 187 Cb 0.03 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 3g9x h ASP 187 CO -0.13 0.64 0.40 0.45 -1.72 0.00 0.00 179.24 178.88 3g9x h HIS 188 N 0.67 0.96 -0.13 4.55 3.86 -0.63 -1.86 115.15 122.56 3g9x h HIS 188 Ca 0.15 -0.02 -0.13 0.00 -1.16 0.00 0.00 60.37 59.22 3g9x h HIS 188 Cb 0.26 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 3g9x h HIS 188 CO 0.01 0.67 -0.48 1.88 0.86 0.00 0.00 177.93 180.87 3g9x h TYR 189 N 0.97 0.41 -0.04 2.45 0.05 -0.69 -3.18 116.97 116.94 3g9x h TYR 189 Ca 0.25 -0.13 -0.12 0.00 0.05 0.00 0.00 58.73 58.78 3g9x h TYR 189 Cb 0.01 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.66 3g9x h TYR 189 CO -0.01 0.76 -0.54 0.00 -1.05 0.00 0.00 178.16 177.32 3g9x h ARG 190 N 0.27 0.10 -0.65 4.88 3.08 -0.32 -3.38 114.38 118.36 3g9x h ARG 190 Ca 0.01 -0.06 0.10 0.00 0.07 0.00 0.00 59.98 60.10 3g9x h ARG 190 Cb 0.95 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.93 3g9x h ARG 190 CO 0.08 0.62 0.27 1.49 -1.07 0.00 0.00 179.97 181.36 3g9x h GLU 191 N 0.08 0.46 0.00 0.04 4.81 -1.32 -0.08 114.58 118.56 3g9x h GLU 191 Ca -0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3g9x h GLU 191 Cb 0.98 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.26 3g9x h GLU 191 CO 0.08 0.30 0.00 -1.35 -0.73 0.00 0.00 179.01 177.31 3g9x h PRO 192 N 0.47 0.00 0.00 0.92 0.11 -1.80 -3.21 132.00 128.50 3g9x h PRO 192 Ca 0.33 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.44 3g9x h PRO 192 Cb 0.40 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 3g9x h PRO 192 CO -0.30 0.00 -0.03 1.19 -0.21 0.00 0.00 178.00 178.65 3g9x n PHE 193 N -2.62 0.00 0.01 0.65 3.72 -0.06 -4.73 117.46 114.43 3g9x n PHE 193 Ca -0.00 -0.98 0.07 0.00 -0.05 0.00 0.00 57.45 56.48 3g9x n PHE 193 Cb 0.17 -0.15 0.48 0.00 -0.94 0.00 0.00 39.48 39.04 3g9x n PHE 193 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3g9x h LEU 194 N 0.02 0.37 -8.97 4.37 3.38 -1.51 -3.37 115.31 109.60 3g9x h LEU 194 Ca -0.00 -0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 3g9x h LEU 194 Cb 1.01 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.55 3g9x h LEU 194 CO 0.00 0.26 0.01 -0.54 0.09 0.00 0.00 178.44 178.26 3g9x s LYS 195 N -5.40 4.07 0.28 1.13 1.02 -1.26 -4.99 119.74 114.59 3g9x s LYS 195 Ca -0.08 0.35 0.01 0.00 0.02 0.00 0.00 55.97 56.28 3g9x s LYS 195 Cb 0.18 -3.65 0.63 0.00 -0.52 0.00 0.00 37.83 34.47 3g9x s LYS 195 CO 0.73 -0.36 1.71 -1.35 -0.92 0.00 0.00 175.35 175.16 3g9x h PRO 196 N 8.00 0.43 -0.02 -1.68 0.11 -1.85 -1.12 132.00 135.87 3g9x h PRO 196 Ca -0.29 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.81 3g9x h PRO 196 Cb 1.14 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 3g9x h PRO 196 CO 0.72 0.29 0.03 -0.24 -0.21 0.00 0.00 178.00 178.59 3g9x h VAL 197 N 0.44 0.53 0.00 3.15 3.04 -1.92 -0.91 116.25 120.58 3g9x h VAL 197 Ca 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.20 3g9x h VAL 197 Cb 0.89 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 3g9x h VAL 197 CO -0.48 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 176.55 3g9x n ASP 198 N -3.86 0.00 -0.48 3.17 8.00 -0.42 -3.55 116.55 119.41 3g9x n ASP 198 Ca -0.02 -0.92 0.09 0.00 0.71 0.00 0.00 54.79 54.65 3g9x n ASP 198 Cb 0.11 0.00 0.35 0.00 -0.02 0.00 0.00 41.12 41.57 3g9x n ASP 198 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3g9x n ARG 199 N -0.90 1.62 -0.25 -1.24 1.74 -0.35 -4.46 116.66 112.82 3g9x n ARG 199 Ca 0.15 -0.94 0.01 0.00 -0.77 0.00 0.00 57.85 56.30 3g9x n ARG 199 Cb 0.07 -1.35 0.08 0.00 -1.02 0.00 0.00 32.46 30.24 3g9x n ARG 199 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 3g9x h GLU 200 N 1.81 -0.01 -0.29 5.56 4.57 -1.80 -0.65 114.58 123.77 3g9x h GLU 200 Ca 0.00 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.21 3g9x h GLU 200 Cb 0.40 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 3g9x h GLU 200 CO 0.00 -0.01 0.20 -1.00 -1.18 0.00 0.00 179.01 177.02 3g9x h PRO 201 N -0.01 0.26 0.00 0.92 0.13 -1.88 -0.96 132.00 130.46 3g9x h PRO 201 Ca 0.34 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 65.38 3g9x h PRO 201 Cb 0.53 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.59 3g9x h PRO 201 CO -0.75 0.17 -0.37 -0.07 -0.23 0.00 0.00 178.00 176.75 3g9x h LEU 202 N 0.27 0.00 0.16 1.56 3.38 -1.44 -1.59 115.31 117.65 3g9x h LEU 202 Ca 0.12 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.74 3g9x h LEU 202 Cb 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3g9x h LEU 202 CO -0.02 0.37 -1.83 -0.25 0.09 0.00 0.00 178.44 176.80 3g9x h TRP 203 N 0.00 0.62 -0.53 1.13 7.01 -1.29 -3.39 115.95 119.51 3g9x h TRP 203 Ca -0.00 -0.45 -0.08 0.00 2.11 0.00 0.00 58.89 60.46 3g9x h TRP 203 Cb 0.70 -0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 27.72 3g9x h TRP 203 CO 0.00 1.70 -0.00 -0.09 -2.79 0.00 0.00 178.44 177.25 3g9x h ARG 204 N 0.09 0.90 -0.05 2.65 9.65 -1.10 -3.13 114.38 123.40 3g9x h ARG 204 Ca -0.37 -0.26 0.04 0.00 -1.10 0.00 0.00 59.98 58.29 3g9x h ARG 204 Cb 2.08 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 30.52 3g9x h ARG 204 CO 0.15 0.90 -0.22 0.74 2.80 0.00 0.00 179.97 184.34 3g9x h PHE 205 N 0.83 -0.57 0.00 2.20 0.04 -1.47 -1.17 116.94 116.81 3g9x h PHE 205 Ca 0.16 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.90 3g9x h PHE 205 Cb 0.50 0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.90 3g9x h PHE 205 CO 0.03 -0.30 -0.22 -1.00 -0.60 0.00 0.00 178.31 176.22 3g9x h PRO 206 N -0.32 0.00 0.00 1.51 0.13 -1.74 -0.91 132.00 130.68 3g9x h PRO 206 Ca 0.07 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.20 3g9x h PRO 206 Cb 0.42 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.55 3g9x h PRO 206 CO -0.23 0.22 -0.03 -0.91 -0.23 0.00 0.00 178.00 176.83 3g9x h ASN 207 N 0.00 0.00 0.64 1.44 2.35 -1.27 -2.78 115.58 115.97 3g9x h ASN 207 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3g9x h ASN 207 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.77 3g9x h ASN 207 CO 0.03 0.03 -0.56 -0.62 -1.65 0.00 0.00 177.43 174.65 3g9x n GLU 208 N -3.16 0.12 -1.84 0.81 -0.58 -0.36 -4.47 120.64 111.16 3g9x n GLU 208 Ca -0.00 0.03 -0.40 0.00 -0.42 0.00 0.00 57.16 56.37 3g9x n GLU 208 Cb 0.25 -1.57 0.01 0.00 -0.57 0.00 0.00 31.44 29.56 3g9x n GLU 208 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3g9x s LEU 209 N -3.49 4.12 -1.01 -4.62 1.43 -1.05 -4.55 118.68 109.52 3g9x s LEU 209 Ca 0.09 2.87 -0.21 0.00 -1.03 0.00 0.00 54.13 55.85 3g9x s LEU 209 Cb 0.16 -3.94 0.09 0.00 0.03 0.00 0.00 46.19 42.53 3g9x s LEU 209 CO 0.71 -1.13 1.34 -2.16 0.23 0.00 0.00 176.35 175.34 3g9x s PRO 210 N -2.43 3.63 -0.08 1.29 0.04 -1.26 -4.12 135.00 132.07 3g9x s PRO 210 Ca 0.61 -1.46 0.02 0.00 0.04 0.00 0.00 61.00 60.21 3g9x s PRO 210 Cb -0.43 -5.19 0.01 0.00 0.04 0.00 0.00 34.50 28.94 3g9x s PRO 210 CO 0.55 -2.03 -0.13 0.42 0.04 0.00 0.00 177.00 175.85 3g9x s ILE 211 N 3.95 1.25 -1.46 0.56 1.01 -1.04 -1.00 121.20 124.48 3g9x s ILE 211 Ca 0.41 -0.52 -0.12 0.00 0.00 0.00 0.00 60.65 60.43 3g9x s ILE 211 Cb -0.02 -1.15 0.05 0.00 0.01 0.00 0.00 42.46 41.35 3g9x s ILE 211 CO -0.09 0.39 1.07 0.00 0.00 0.00 0.00 174.94 176.31 3g9x n ALA 212 N 4.04 -1.28 -0.96 9.38 0.00 0.17 -2.13 120.51 129.72 3g9x n ALA 212 Ca -0.20 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3g9x n ALA 212 Cb 0.51 -4.95 0.00 0.00 0.00 0.00 0.00 19.45 15.02 3g9x n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g9x n GLY 213 N -1.83 0.84 3.01 0.00 0.00 -1.26 -4.97 105.19 100.98 3g9x n GLY 213 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 3g9x n GLY 213 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3g9x s GLU 214 N -0.10 0.44 0.36 1.61 -1.05 -0.91 -3.44 118.70 115.62 3g9x s GLU 214 Ca 0.00 -0.50 -0.26 0.00 -0.15 0.00 0.00 54.97 54.06 3g9x s GLU 214 Cb 0.00 -0.28 -0.09 0.00 -0.44 0.00 0.00 34.13 33.32 3g9x s GLU 214 CO 0.00 0.06 1.07 -1.25 0.95 0.00 0.00 175.26 176.09 3g9x s PRO 215 N -0.97 4.29 0.32 -4.83 0.04 -1.26 -2.48 135.00 130.11 3g9x s PRO 215 Ca -0.06 1.63 -0.00 0.00 0.04 0.00 0.00 61.00 62.60 3g9x s PRO 215 Cb -0.07 -2.75 0.51 0.00 0.04 0.00 0.00 34.50 32.24 3g9x s PRO 215 CO 0.00 -0.05 1.98 0.00 0.04 0.00 0.00 177.00 178.96 3g9x h ALA 216 N 2.90 1.45 -0.71 8.56 0.00 -1.98 -1.60 119.26 127.88 3g9x h ALA 216 Ca -0.48 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 3g9x h ALA 216 Cb 1.22 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 3g9x h ALA 216 CO 0.64 0.50 0.31 -2.95 0.00 0.00 0.00 179.25 177.75 3g9x h ASN 217 N 1.00 0.95 -0.28 0.00 -1.07 -1.98 -1.55 115.58 112.65 3g9x h ASN 217 Ca 0.27 -0.15 -0.15 0.00 0.07 0.00 0.00 56.30 56.33 3g9x h ASN 217 Cb -0.09 -0.25 -0.00 0.00 -2.07 0.00 0.00 38.32 35.91 3g9x h ASN 217 CO -0.06 0.84 -0.41 0.40 0.07 0.00 0.00 177.43 178.27 3g9x h ILE 218 N 1.00 1.29 -0.49 6.14 1.08 -1.75 -1.77 117.51 123.02 3g9x h ILE 218 Ca 0.24 -1.60 0.09 0.00 -0.39 0.00 0.00 64.86 63.19 3g9x h ILE 218 Cb 0.17 1.64 -0.07 0.00 -3.07 0.00 0.00 36.82 35.49 3g9x h ILE 218 CO -0.02 0.52 0.08 0.58 -0.69 0.00 0.00 178.15 178.61 3g9x h VAL 219 N 0.53 0.71 -0.55 1.67 2.07 -1.12 0.01 116.25 119.56 3g9x h VAL 219 Ca 0.03 -0.07 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 3g9x h VAL 219 Cb 1.01 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 3g9x h VAL 219 CO 0.10 0.04 0.13 0.00 0.02 0.00 0.00 177.57 177.86 3g9x h ALA 220 N 1.39 0.73 -0.26 1.67 0.00 -1.17 -0.03 119.26 121.59 3g9x h ALA 220 Ca 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3g9x h ALA 220 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3g9x h ALA 220 CO -0.34 0.43 0.16 1.25 0.00 0.00 0.00 179.25 180.76 3g9x h LEU 221 N 0.78 0.30 -0.29 0.00 6.46 -0.83 -1.11 115.31 120.63 3g9x h LEU 221 Ca 0.17 -0.03 -0.14 0.00 -0.12 0.00 0.00 57.88 57.76 3g9x h LEU 221 Cb 0.35 -0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 40.20 3g9x h LEU 221 CO 0.00 0.24 -0.37 0.58 -0.62 0.00 0.00 178.44 178.27 3g9x h VAL 222 N 0.33 1.30 -0.80 1.05 2.07 -0.90 -1.57 116.25 117.74 3g9x h VAL 222 Ca 0.09 -1.55 0.10 0.00 0.82 0.00 0.00 66.70 66.16 3g9x h VAL 222 Cb -0.01 1.61 -0.07 0.00 -1.52 0.00 0.00 31.29 31.30 3g9x h VAL 222 CO -0.02 0.50 0.45 -0.33 0.02 0.00 0.00 177.57 178.19 3g9x h GLU 223 N 0.51 0.72 -0.43 1.57 5.08 -0.88 -0.46 114.58 120.69 3g9x h GLU 223 Ca 0.04 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 3g9x h GLU 223 Cb 0.96 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 3g9x h GLU 223 CO 0.09 0.48 0.05 0.00 -1.00 0.00 0.00 179.01 178.63 3g9x h ALA 224 N 1.45 0.57 -0.03 3.43 0.00 -0.88 -0.32 119.26 123.48 3g9x h ALA 224 Ca 0.39 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 3g9x h ALA 224 Cb 0.38 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3g9x h ALA 224 CO -0.26 0.30 -0.53 0.10 0.00 0.00 0.00 179.25 178.87 3g9x h TYR 225 N 0.57 0.10 -0.36 0.00 -0.00 -0.96 -1.71 116.97 114.61 3g9x h TYR 225 Ca 0.13 -0.03 -0.14 0.00 0.00 0.00 0.00 58.73 58.69 3g9x h TYR 225 Cb 0.40 -0.02 -0.01 0.00 0.00 0.00 0.00 36.73 37.10 3g9x h TYR 225 CO 0.03 0.59 -0.33 0.52 -0.00 0.00 0.00 178.16 178.97 3g9x h MET 226 N 0.06 0.79 -0.56 0.10 2.86 -0.83 0.64 114.93 117.99 3g9x h MET 226 Ca -0.00 -0.38 -0.01 0.00 -2.06 0.00 0.00 59.70 57.26 3g9x h MET 226 Cb 0.95 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.58 3g9x h MET 226 CO 0.07 1.01 0.33 -0.97 1.06 0.00 0.00 176.91 178.41 3g9x h ASN 227 N 0.67 0.68 -0.24 1.22 -1.24 -0.86 -0.95 115.58 114.85 3g9x h ASN 227 Ca 0.07 -0.07 0.02 0.00 0.71 0.00 0.00 56.30 57.03 3g9x h ASN 227 Cb 0.87 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 39.73 3g9x h ASN 227 CO 0.08 0.55 0.10 -0.25 -1.29 0.00 0.00 177.43 176.62 3g9x h TRP 228 N 0.76 0.18 -0.83 0.67 7.01 -1.09 -2.89 115.95 119.75 3g9x h TRP 228 Ca 0.20 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.19 3g9x h TRP 228 Cb 0.00 -0.05 -0.04 0.00 -2.10 0.00 0.00 29.16 26.98 3g9x h TRP 228 CO -0.02 0.09 0.45 1.25 -2.79 0.00 0.00 178.44 177.42 3g9x h LEU 229 N 0.22 1.05 -1.89 0.65 5.85 -0.46 -0.63 115.31 120.09 3g9x h LEU 229 Ca 0.10 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3g9x h LEU 229 Cb 0.05 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 3g9x h LEU 229 CO -0.09 0.85 -0.05 0.45 -0.34 0.00 0.00 178.44 179.26 3g9x h HIS 230 N 1.16 0.00 -0.00 1.25 3.86 -1.07 -2.79 115.15 117.57 3g9x h HIS 230 Ca 0.29 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.50 3g9x h HIS 230 Cb 0.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.52 3g9x h HIS 230 CO 0.01 0.05 -0.91 1.04 0.86 0.00 0.00 177.93 178.98 3g9x n GLN 231 N -3.25 0.44 -2.93 2.45 6.02 -0.70 -4.42 117.38 114.99 3g9x n GLN 231 Ca -0.01 -0.08 -0.40 0.00 -0.01 0.00 0.00 57.00 56.50 3g9x n GLN 231 Cb 0.25 -1.45 -0.05 0.00 1.02 0.00 0.00 30.24 30.01 3g9x n GLN 231 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3g9x s SER 232 N -2.85 7.31 0.00 1.08 0.15 -0.33 -4.94 113.70 114.11 3g9x s SER 232 Ca 0.08 1.56 0.30 0.00 0.70 0.00 0.00 55.95 58.60 3g9x s SER 232 Cb 0.15 -2.50 1.81 0.00 -1.71 0.00 0.00 66.02 63.77 3g9x s SER 232 CO 0.80 0.04 2.15 -0.81 1.20 0.00 0.00 173.24 176.62 3g9x n PRO 233 N 2.56 0.97 -1.72 5.44 -0.04 -1.26 -4.42 135.00 136.54 3g9x n PRO 233 Ca -0.02 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.02 3g9x n PRO 233 Cb 0.50 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.46 3g9x n PRO 233 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 3g9x n VAL 234 N -0.99 1.80 -1.76 0.52 3.14 -1.26 -4.76 118.33 115.02 3g9x n VAL 234 Ca 0.23 -0.45 -0.41 0.00 -2.96 0.00 0.00 64.34 60.75 3g9x n VAL 234 Cb 0.10 -1.68 -0.01 0.00 -1.06 0.00 0.00 33.84 31.20 3g9x n VAL 234 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 3g9x n PRO 235 N 0.83 2.70 -4.58 1.45 -0.02 -1.26 -4.73 135.00 129.39 3g9x n PRO 235 Ca 0.05 0.95 -0.22 0.00 -2.02 0.00 0.00 63.50 62.26 3g9x n PRO 235 Cb 0.36 -2.71 -0.15 0.00 -0.02 0.00 0.00 33.50 30.99 3g9x n PRO 235 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3g9x s LYS 236 N -1.38 1.12 -0.15 -0.52 1.02 -0.36 -1.24 119.74 118.22 3g9x s LYS 236 Ca 0.58 -0.61 -0.01 0.00 0.02 0.00 0.00 55.97 55.96 3g9x s LYS 236 Cb -0.48 -1.10 0.04 0.00 -0.52 0.00 0.00 37.83 35.77 3g9x s LYS 236 CO 0.57 0.29 -0.05 -1.17 -0.92 0.00 0.00 175.35 174.08 3g9x s LEU 237 N -0.61 1.47 -0.25 3.17 2.96 -0.12 -1.23 118.68 124.07 3g9x s LEU 237 Ca 0.05 -0.59 -0.02 0.00 -0.22 0.00 0.00 54.13 53.35 3g9x s LEU 237 Cb -0.06 -0.85 0.02 0.00 0.50 0.00 0.00 46.19 45.80 3g9x s LEU 237 CO 0.00 -0.18 -0.05 -0.22 -1.32 0.00 0.00 176.35 174.57 3g9x s LEU 238 N 1.68 3.20 0.01 -0.68 2.96 0.11 -0.48 118.68 125.48 3g9x s LEU 238 Ca 0.01 -0.82 -0.16 0.00 -0.22 0.00 0.00 54.13 52.94 3g9x s LEU 238 Cb -0.15 -1.68 -0.06 0.00 0.50 0.00 0.00 46.19 44.80 3g9x s LEU 238 CO -0.08 -0.12 0.45 -0.36 -1.32 0.00 0.00 176.35 174.92 3g9x s PHE 239 N 1.35 3.74 0.04 5.38 0.40 -0.48 -0.68 117.98 127.72 3g9x s PHE 239 Ca 0.01 1.06 -0.06 0.00 -0.60 0.00 0.00 56.93 57.34 3g9x s PHE 239 Cb -0.16 -2.36 -0.01 0.00 0.51 0.00 0.00 43.02 41.00 3g9x s PHE 239 CO -0.04 0.60 0.10 1.67 0.70 0.00 0.00 175.22 178.25 3g9x s TRP 240 N -0.98 0.19 0.37 0.36 1.48 -0.61 -4.20 118.94 115.54 3g9x s TRP 240 Ca 0.25 -0.48 0.04 0.00 -1.06 0.00 0.00 56.10 54.84 3g9x s TRP 240 Cb -0.17 -0.14 -0.04 0.00 -1.16 0.00 0.00 33.47 31.96 3g9x s TRP 240 CO 0.15 -0.36 0.09 0.20 -4.06 0.00 0.00 176.95 172.96 3g9x s GLY 241 N -2.08 2.35 -0.15 3.67 0.00 -1.26 -0.91 107.32 108.94 3g9x s GLY 241 Ca -0.06 -1.59 0.02 0.00 0.00 0.00 0.00 44.72 43.09 3g9x s GLY 241 CO -0.04 -1.84 -0.20 -1.59 0.00 0.00 0.00 173.10 169.43 3g9x s THR 242 N -3.25 1.99 -1.67 0.90 2.01 -0.78 -2.59 115.64 112.24 3g9x s THR 242 Ca 0.29 -0.92 0.28 0.00 0.31 0.00 0.00 61.69 61.66 3g9x s THR 242 Cb 0.06 -1.78 0.43 0.00 0.01 0.00 0.00 72.50 71.21 3g9x s THR 242 CO 0.14 0.53 1.81 -0.81 -0.69 0.00 0.00 174.62 175.61 3g9x n PRO 243 N 4.33 0.72 -0.73 4.92 -0.04 -0.95 -1.56 135.00 141.69 3g9x n PRO 243 Ca -0.20 -0.28 0.10 0.00 -0.04 0.00 0.00 63.50 63.08 3g9x n PRO 243 Cb 0.51 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.45 3g9x n PRO 243 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g9x n GLY 244 N 1.29 -2.03 1.11 0.55 0.00 -0.13 -4.19 105.19 101.79 3g9x n GLY 244 Ca 0.14 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.84 3g9x n GLY 244 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3g9x n VAL 245 N -2.64 0.00 0.15 1.61 0.31 -1.11 -4.73 118.33 111.92 3g9x n VAL 245 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 3g9x n VAL 245 Cb 0.33 -0.17 0.17 0.00 -0.91 0.00 0.00 33.84 33.26 3g9x n VAL 245 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3g9x h LEU 246 N 0.00 0.00 -6.85 7.52 3.38 -1.90 -3.40 115.31 114.05 3g9x h LEU 246 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 3g9x h LEU 246 Cb 0.00 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.35 3g9x h LEU 246 CO 0.00 0.55 -0.76 -0.63 0.09 0.00 0.00 178.44 177.68 3g9x s ILE 247 N -3.35 1.36 0.82 1.22 -1.09 -1.26 -4.91 121.20 113.99 3g9x s ILE 247 Ca 0.01 -2.81 -0.11 0.00 -2.23 0.00 0.00 60.65 55.51 3g9x s ILE 247 Cb 0.11 -1.93 0.08 0.00 -1.58 0.00 0.00 42.46 39.13 3g9x s ILE 247 CO 0.73 -0.99 1.09 -2.16 -1.23 0.00 0.00 174.94 172.39 3g9x s PRO 248 N 0.04 1.88 0.28 2.79 0.04 -1.26 -4.64 135.00 134.13 3g9x s PRO 248 Ca 0.22 1.00 0.02 0.00 0.04 0.00 0.00 61.00 62.28 3g9x s PRO 248 Cb -0.15 -1.87 0.66 0.00 0.04 0.00 0.00 34.50 33.18 3g9x s PRO 248 CO -0.07 -1.86 1.71 -1.35 0.04 0.00 0.00 177.00 175.48 3g9x h PRO 249 N -1.28 0.43 0.00 0.56 0.11 -1.75 -0.25 132.00 129.82 3g9x h PRO 249 Ca -0.46 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 3g9x h PRO 249 Cb 1.25 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 3g9x h PRO 249 CO 0.53 0.28 -0.44 0.00 -0.21 0.00 0.00 178.00 178.16 3g9x h ALA 250 N 1.66 1.24 -0.18 -0.75 0.00 -1.95 -1.29 119.26 117.99 3g9x h ALA 250 Ca 0.52 -0.40 -0.21 0.00 0.00 0.00 0.00 54.91 54.82 3g9x h ALA 250 Cb 0.93 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.66 3g9x h ALA 250 CO -0.49 0.56 -0.71 0.93 0.00 0.00 0.00 179.25 179.54 3g9x h GLU 251 N 0.00 0.79 -0.96 0.00 4.39 -1.43 -1.12 114.58 116.25 3g9x h GLU 251 Ca -0.00 -0.62 0.06 0.00 0.34 0.00 0.00 59.36 59.14 3g9x h GLU 251 Cb 0.80 0.12 -0.07 0.00 -0.10 0.00 0.00 28.75 29.50 3g9x h GLU 251 CO 0.06 1.23 0.61 0.00 -1.16 0.00 0.00 179.01 179.75 3g9x h ALA 252 N 0.57 1.33 -0.49 3.43 0.00 -0.95 -0.04 119.26 123.10 3g9x h ALA 252 Ca -0.04 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 3g9x h ALA 252 Cb 1.34 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3g9x h ALA 252 CO 0.15 0.39 -0.18 0.00 0.00 0.00 0.00 179.25 179.61 3g9x h ALA 253 N 1.44 0.75 -0.58 0.00 0.00 -1.14 0.11 119.26 119.84 3g9x h ALA 253 Ca 0.42 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3g9x h ALA 253 Cb 0.17 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3g9x h ALA 253 CO -0.17 0.67 0.32 0.00 0.00 0.00 0.00 179.25 180.06 3g9x h ARG 254 N 0.85 0.81 -0.24 0.00 3.08 -0.66 -2.92 114.38 115.30 3g9x h ARG 254 Ca 0.12 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 3g9x h ARG 254 Cb 0.74 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 3g9x h ARG 254 CO 0.06 0.62 -0.15 -0.07 -1.07 0.00 0.00 179.97 179.36 3g9x h LEU 255 N 0.79 0.40 -1.06 3.04 3.38 -0.73 -0.21 115.31 120.92 3g9x h LEU 255 Ca 0.20 -0.10 0.11 0.00 0.09 0.00 0.00 57.88 58.18 3g9x h LEU 255 Cb 0.05 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 40.61 3g9x h LEU 255 CO -0.03 0.58 0.63 0.00 0.09 0.00 0.00 178.44 179.70 3g9x h ALA 256 N 1.46 1.53 0.09 1.53 0.00 -0.79 -0.34 119.26 122.74 3g9x h ALA 256 Ca 0.07 0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.69 3g9x h ALA 256 Cb 0.50 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3g9x h ALA 256 CO 0.03 0.25 -1.48 0.93 0.00 0.00 0.00 179.25 178.99 3g9x h GLU 257 N 1.00 0.19 0.05 0.00 4.39 -1.29 -3.40 114.58 115.53 3g9x h GLU 257 Ca 0.47 -0.33 -0.34 0.00 0.34 0.00 0.00 59.36 59.50 3g9x h GLU 257 Cb 0.42 0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.15 3g9x h GLU 257 CO -0.23 1.04 -1.97 0.45 -1.16 0.00 0.00 179.01 177.15 3g9x n SER 258 N -3.40 1.39 -4.72 1.42 2.88 -0.14 -4.86 113.62 106.18 3g9x n SER 258 Ca -0.14 0.24 -0.42 0.00 -1.33 0.00 0.00 58.87 57.22 3g9x n SER 258 Cb 1.03 -0.30 -0.03 0.00 -0.75 0.00 0.00 64.21 64.16 3g9x n SER 258 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3g9x s LEU 259 N -6.45 4.39 0.53 2.46 1.43 -0.17 -4.97 118.68 115.90 3g9x s LEU 259 Ca -0.15 2.29 -0.21 0.00 -1.03 0.00 0.00 54.13 55.03 3g9x s LEU 259 Cb 0.07 -3.60 -0.06 0.00 0.03 0.00 0.00 46.19 42.64 3g9x s LEU 259 CO 0.78 -0.55 1.20 -2.84 0.23 0.00 0.00 176.35 175.17 3g9x s PRO 260 N 0.55 3.34 -1.39 1.29 0.02 -1.26 -3.81 135.00 133.75 3g9x s PRO 260 Ca 0.60 1.82 -0.09 0.00 0.02 0.00 0.00 61.00 63.34 3g9x s PRO 260 Cb -0.35 -2.15 0.01 0.00 0.02 0.00 0.00 34.50 32.04 3g9x s PRO 260 CO 0.33 -0.91 1.13 -1.71 -0.33 0.00 0.00 177.00 175.52 3g9x n ASN 261 N -1.08 -6.30 -4.30 2.53 5.15 -1.26 -4.57 115.26 105.42 3g9x n ASN 261 Ca 0.11 -0.53 -0.33 0.00 -0.60 0.00 0.00 54.58 53.22 3g9x n ASN 261 Cb 0.49 -4.97 -0.15 0.00 -0.53 0.00 0.00 39.78 34.62 3g9x n ASN 261 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3g9x s LYS 263 N 0.64 3.71 -0.02 0.00 2.20 -0.36 -4.96 119.74 120.95 3g9x s LYS 263 Ca -0.08 -0.46 0.00 0.00 -0.36 0.00 0.00 55.97 55.08 3g9x s LYS 263 Cb -0.16 -2.99 -0.04 0.00 -1.51 0.00 0.00 37.83 33.13 3g9x s LYS 263 CO 0.03 0.29 0.03 0.95 -0.36 0.00 0.00 175.35 176.29 3g9x s THR 264 N 0.26 4.43 -0.12 3.43 -4.23 -1.26 -0.71 115.64 117.43 3g9x s THR 264 Ca -0.01 -0.46 -0.01 0.00 -1.18 0.00 0.00 61.69 60.04 3g9x s THR 264 Cb -0.13 -2.98 0.03 0.00 1.34 0.00 0.00 72.50 70.76 3g9x s THR 264 CO 0.02 0.41 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.75 3g9x s VAL 265 N -1.10 0.98 -0.28 2.29 1.01 0.15 -4.93 120.40 118.52 3g9x s VAL 265 Ca 0.20 -0.34 -0.29 0.00 0.00 0.00 0.00 61.98 61.55 3g9x s VAL 265 Cb -0.12 -1.06 0.01 0.00 0.00 0.00 0.00 36.38 35.22 3g9x s VAL 265 CO 0.10 0.29 1.05 -0.62 0.00 0.00 0.00 175.10 175.92 3g9x s ASP 266 N 1.72 7.01 0.00 3.32 -1.08 -1.26 -1.58 116.67 124.79 3g9x s ASP 266 Ca 0.04 1.20 0.27 0.00 -0.52 0.00 0.00 52.55 53.53 3g9x s ASP 266 Cb -0.13 -2.54 0.75 0.00 -1.46 0.00 0.00 42.92 39.54 3g9x s ASP 266 CO -0.08 -0.77 1.57 2.30 0.52 0.00 0.00 175.17 178.71 3g9x n ILE 267 N 5.60 0.00 -2.76 4.11 -5.35 -0.08 -4.96 119.36 115.91 3g9x n ILE 267 Ca 0.12 -0.31 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 3g9x n ILE 267 Cb 0.47 0.79 0.00 0.00 -1.74 0.00 0.00 39.64 39.15 3g9x n ILE 267 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3g9x n GLY 268 N 1.25 0.10 3.73 3.28 0.00 -1.26 -4.85 105.19 107.43 3g9x n GLY 268 Ca 0.17 -1.25 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 3g9x n GLY 268 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3g9x n PRO 269 N 3.77 2.50 -3.62 1.61 -0.02 -1.26 -1.87 135.00 136.10 3g9x n PRO 269 Ca 0.00 0.88 -0.05 0.00 -2.02 0.00 0.00 63.50 62.32 3g9x n PRO 269 Cb 0.00 -2.61 -0.05 0.00 -0.02 0.00 0.00 33.50 30.82 3g9x n PRO 269 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3g9x s GLY 270 N 0.27 0.00 0.00 -1.23 0.00 -0.60 -4.72 107.32 101.03 3g9x s GLY 270 Ca 0.62 2.65 0.00 0.00 0.00 0.00 0.00 44.72 47.99 3g9x s GLY 270 CO 0.53 1.17 0.00 1.04 0.00 0.00 0.00 173.10 175.83 3g9x n LEU 271 N 0.70 0.00 -0.09 0.66 4.77 -1.26 -0.96 117.00 120.83 3g9x n LEU 271 Ca -0.04 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.76 3g9x n LEU 271 Cb 0.58 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.61 3g9x n LEU 271 CO 0.09 0.00 -1.09 1.57 -1.33 0.00 0.00 177.39 176.63 3g9x n HIS 272 N 0.00 0.00 -2.25 -1.77 -0.00 -0.74 -2.75 115.22 107.71 3g9x n HIS 272 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.30 3g9x n HIS 272 Cb 0.00 -0.62 0.00 0.00 -0.00 0.00 0.00 29.99 29.38 3g9x n HIS 272 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 3g9x n TYR 273 N -3.70 3.13 0.18 1.57 4.01 -0.86 -4.76 117.16 116.73 3g9x n TYR 273 Ca -0.33 -2.84 0.10 0.00 -0.16 0.00 0.00 57.90 54.67 3g9x n TYR 273 Cb 0.75 -2.07 0.63 0.00 -0.31 0.00 0.00 39.34 38.33 3g9x n TYR 273 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3g9x h LEU 274 N 8.36 0.04 -2.46 7.72 3.38 -1.86 -0.37 115.31 130.13 3g9x h LEU 274 Ca 0.42 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.40 3g9x h LEU 274 Cb 0.64 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 3g9x h LEU 274 CO 1.66 0.03 0.01 1.56 0.09 0.00 0.00 178.44 181.79 3g9x h GLN 275 N 0.05 0.00 0.00 1.13 7.50 -1.88 -1.24 115.11 120.66 3g9x h GLN 275 Ca 0.07 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.22 3g9x h GLN 275 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.74 3g9x h GLN 275 CO -0.01 0.00 -0.60 0.93 -1.50 0.00 0.00 178.83 177.65 3g9x h GLU 276 N 0.00 0.00 0.09 1.46 4.39 -1.37 -3.16 114.58 115.99 3g9x h GLU 276 Ca 0.00 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.33 3g9x h GLU 276 Cb 0.02 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 3g9x h GLU 276 CO -0.00 0.00 -2.13 -0.25 -1.16 0.00 0.00 179.01 175.47 3g9x n ASP 277 N -2.66 2.06 -3.10 1.42 8.00 -0.63 -4.78 116.55 116.87 3g9x n ASP 277 Ca 0.02 0.11 -0.19 0.00 0.71 0.00 0.00 54.79 55.45 3g9x n ASP 277 Cb 0.52 -0.72 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 3g9x n ASP 277 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3g9x n ASN 278 N -3.41 -0.10 -0.01 -2.24 2.85 -0.57 -4.96 115.26 106.83 3g9x n ASN 278 Ca -0.36 -2.98 -0.00 0.00 -0.11 0.00 0.00 54.58 51.13 3g9x n ASN 278 Cb 1.03 -0.15 0.29 0.00 1.24 0.00 0.00 39.78 42.19 3g9x n ASN 278 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3g9x h PRO 279 N 3.49 0.54 -0.28 1.20 0.13 -1.74 -2.73 132.00 132.61 3g9x h PRO 279 Ca 0.04 -0.12 -0.14 0.00 -0.87 0.00 0.00 66.00 64.92 3g9x h PRO 279 Cb 0.95 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 3g9x h PRO 279 CO 0.43 0.57 -0.41 -0.44 -0.23 0.00 0.00 178.00 177.92 3g9x h ASP 280 N 0.52 0.71 -0.41 1.44 3.32 -1.90 0.52 116.42 120.62 3g9x h ASP 280 Ca 0.11 -0.32 -0.11 0.00 0.02 0.00 0.00 57.03 56.73 3g9x h ASP 280 Cb 0.34 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3g9x h ASP 280 CO 0.01 1.03 -0.16 0.25 -1.72 0.00 0.00 179.24 178.65 3g9x h LEU 281 N 0.54 0.86 -0.06 1.55 5.85 -1.95 -0.51 115.31 121.58 3g9x h LEU 281 Ca 0.04 -0.39 -0.00 0.00 0.84 0.00 0.00 57.88 58.37 3g9x h LEU 281 Cb 0.94 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.73 3g9x h LEU 281 CO 0.09 1.05 0.04 0.40 -0.34 0.00 0.00 178.44 179.68 3g9x h ILE 282 N 0.65 1.05 -0.38 4.05 2.04 -1.29 -0.92 117.51 122.72 3g9x h ILE 282 Ca 0.10 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 3g9x h ILE 282 Cb 0.71 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 3g9x h ILE 282 CO 0.05 0.05 0.09 1.23 0.00 0.00 0.00 178.15 179.57 3g9x h GLY 283 N 0.04 0.65 1.17 5.37 0.00 -0.88 -1.27 103.07 108.15 3g9x h GLY 283 Ca 0.02 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 46.86 3g9x h GLY 283 CO -0.00 0.38 0.04 1.48 0.00 0.00 0.00 176.54 178.43 3g9x h SER 284 N 0.46 0.98 -0.40 0.19 4.64 -1.03 -0.80 113.55 117.59 3g9x h SER 284 Ca 0.12 -0.25 -0.14 0.00 -0.47 0.00 0.00 61.79 61.05 3g9x h SER 284 Cb 0.31 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 3g9x h SER 284 CO 0.00 1.01 -0.29 -0.33 -0.87 0.00 0.00 176.83 176.35 3g9x h GLU 285 N 0.93 0.93 -0.11 4.77 4.39 -1.09 -1.85 114.58 122.55 3g9x h GLU 285 Ca 0.18 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.45 3g9x h GLU 285 Cb 0.49 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 3g9x h GLU 285 CO 0.02 1.09 0.06 0.82 -1.16 0.00 0.00 179.01 179.84 3g9x h ILE 286 N 0.78 1.01 -0.84 3.13 2.04 -1.04 -2.56 117.51 120.05 3g9x h ILE 286 Ca 0.09 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.94 3g9x h ILE 286 Cb 0.87 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 37.77 3g9x h ILE 286 CO 0.08 0.02 0.53 0.00 0.00 0.00 0.00 178.15 178.79 3g9x h ALA 287 N 1.05 1.11 -0.86 1.87 0.00 -0.99 -1.77 119.26 119.67 3g9x h ALA 287 Ca 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3g9x h ALA 287 Cb -0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 3g9x h ALA 287 CO -0.02 0.35 0.50 0.00 0.00 0.00 0.00 179.25 180.08 3g9x h ARG 288 N 1.03 1.18 0.00 0.00 2.47 -1.23 -3.08 114.38 114.75 3g9x h ARG 288 Ca 0.34 -0.12 -0.02 0.00 -1.26 0.00 0.00 59.98 58.92 3g9x h ARG 288 Cb 0.03 -0.24 -0.00 0.00 -1.65 0.00 0.00 29.97 28.11 3g9x h ARG 288 CO -0.12 0.84 -0.14 2.35 0.56 0.00 0.00 179.97 183.46 3g9x h TRP 289 N 1.20 0.00 -0.51 3.04 7.01 -0.91 -3.37 115.95 122.41 3g9x h TRP 289 Ca 0.31 0.00 -0.07 0.00 2.11 0.00 0.00 58.89 61.24 3g9x h TRP 289 Cb -0.02 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.02 3g9x h TRP 289 CO 0.01 0.11 0.04 -0.07 -2.79 0.00 0.00 178.44 175.74 3g9x h LEU 290 N 0.00 0.85 -0.93 0.65 3.38 -1.33 -3.29 115.31 114.63 3g9x h LEU 290 Ca -0.00 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.73 3g9x h LEU 290 Cb 1.09 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.55 3g9x h LEU 290 CO 0.01 0.92 0.60 -0.65 0.09 0.00 0.00 178.44 179.42 3g9x h PRO 291 N 0.75 1.09 0.00 1.13 0.11 -1.77 -1.57 132.00 131.74 3g9x h PRO 291 Ca 0.15 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3g9x h PRO 291 Cb 0.46 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 31.33 3g9x h PRO 291 CO 0.02 0.72 0.00 0.00 -0.21 0.00 0.00 178.00 178.53 3g9x n ALA 292 N -2.36 1.67 0.42 -0.75 0.00 -1.24 -1.91 120.51 116.34 3g9x n ALA 292 Ca 0.13 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.65 3g9x n ALA 292 Cb 0.14 -1.24 0.27 0.00 0.00 0.00 0.00 19.45 18.62 3g9x n ALA 292 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3g9x h LEU 293 N 0.00 0.00 -0.06 0.00 3.38 -1.42 -3.38 115.31 113.83 3g9x h LEU 293 Ca 0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3g9x h LEU 293 Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 3g9x h LEU 293 CO 0.00 0.00 0.03 -0.74 0.09 0.00 0.00 178.44 177.83 3g9x h HIS 294 N 0.00 0.08 -3.77 1.13 2.76 -1.47 -3.45 115.15 110.44 3g9x h HIS 294 Ca 0.00 -0.00 -0.53 0.00 -2.20 0.00 0.00 60.37 57.64 3g9x h HIS 294 Cb 0.87 -0.03 0.08 0.00 1.55 0.00 0.00 27.41 29.88 3g9x h HIS 294 CO 0.00 0.13 0.71 -1.58 -1.30 0.00 0.00 177.93 175.90 3g9x s HIS 295 N -5.86 2.90 -0.33 5.26 5.65 -1.26 -4.96 115.29 116.69 3g9x s HIS 295 Ca -0.13 1.24 -0.11 0.00 0.25 0.00 0.00 55.06 56.31 3g9x s HIS 295 Cb 0.06 -3.82 -0.01 0.00 -1.18 0.00 0.00 32.58 27.63 3g9x s HIS 295 CO 0.67 -2.42 0.19 -1.58 -0.65 0.00 0.00 174.74 170.95 3g9x s HIS 296 N -0.86 3.20 -2.00 3.88 2.46 -1.26 -5.14 115.29 115.57 3g9x s HIS 296 Ca 0.53 -0.48 0.31 0.00 0.47 0.00 0.00 55.06 55.89 3g9x s HIS 296 Cb -0.42 -2.41 1.84 0.00 -0.13 0.00 0.00 32.58 31.46 3g9x s HIS 296 CO 0.54 -0.44 2.17 0.72 -2.47 0.00 0.00 174.74 175.26