#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g7n s THR 2 N 0.00 0.08 0.20 0.00 -4.23 -0.45 -4.96 115.64 106.27 3g7n s THR 2 Ca 0.00 -0.63 -0.32 0.00 -1.18 0.00 0.00 61.69 59.56 3g7n s THR 2 Cb 0.00 -0.18 -0.14 0.00 1.34 0.00 0.00 72.50 73.51 3g7n s THR 2 CO 0.00 -0.35 1.36 0.00 -0.54 0.00 0.00 174.62 175.10 3g7n n ALA 3 N 2.06 0.47 -2.98 3.99 0.00 -1.26 -0.88 120.51 121.90 3g7n n ALA 3 Ca -0.20 0.44 -0.15 0.00 0.00 0.00 0.00 53.44 53.53 3g7n n ALA 3 Cb 0.57 -2.20 0.02 0.00 0.00 0.00 0.00 19.45 17.83 3g7n n ALA 3 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3g7n n ASP 4 N 2.34 -0.84 -0.09 0.00 -0.08 -0.30 -4.73 116.55 112.85 3g7n n ASP 4 Ca 0.14 -3.24 0.17 0.00 -1.51 0.00 0.00 54.79 50.34 3g7n n ASP 4 Cb 0.28 0.57 0.57 0.00 2.34 0.00 0.00 41.12 44.88 3g7n n ASP 4 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3g7n h ALA 5 N 3.28 2.23 0.00 -1.67 0.00 -1.75 -1.77 119.26 119.58 3g7n h ALA 5 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3g7n h ALA 5 Cb 1.01 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 3g7n h ALA 5 CO 0.35 -0.41 -0.03 0.00 0.00 0.00 0.00 179.25 179.16 3g7n h ALA 6 N 1.69 1.24 0.00 0.00 0.00 -1.92 -1.55 119.26 118.71 3g7n h ALA 6 Ca 0.31 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 3g7n h ALA 6 Cb 0.85 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 3g7n h ALA 6 CO -0.07 0.04 -0.04 0.00 0.00 0.00 0.00 179.25 179.18 3g7n h ALA 7 N 1.97 0.99 -0.38 0.00 0.00 -1.72 -3.37 119.26 116.75 3g7n h ALA 7 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3g7n h ALA 7 Cb 0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3g7n h ALA 7 CO 0.00 0.05 0.09 0.35 0.00 0.00 0.00 179.25 179.74 3g7n h PHE 8 N 0.00 0.64 -0.96 0.00 3.57 -1.42 -2.97 116.94 115.80 3g7n h PHE 8 Ca -0.00 -0.08 0.03 0.00 3.53 0.00 0.00 57.97 61.45 3g7n h PHE 8 Cb 0.73 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 3g7n h PHE 8 CO 0.00 0.63 0.63 -1.35 -2.23 0.00 0.00 178.31 175.99 3g7n h PRO 9 N 0.46 1.20 -0.13 6.41 0.11 -1.77 0.24 132.00 138.53 3g7n h PRO 9 Ca 0.12 -0.07 -0.15 0.00 0.11 0.00 0.00 66.00 66.01 3g7n h PRO 9 Cb 0.31 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.14 3g7n h PRO 9 CO 0.00 0.80 -0.56 -0.44 -0.21 0.00 0.00 178.00 177.59 3g7n h ASP 10 N 1.24 0.44 0.47 -2.05 3.32 -1.82 -1.64 116.42 116.37 3g7n h ASP 10 Ca 0.37 -0.23 -0.20 0.00 0.02 0.00 0.00 57.03 56.99 3g7n h ASP 10 Cb -0.04 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3g7n h ASP 10 CO -0.10 0.90 -0.86 -0.07 -1.72 0.00 0.00 179.24 177.39 3g7n h LEU 11 N 0.30 0.36 -0.53 1.55 3.38 -1.17 -1.16 115.31 118.03 3g7n h LEU 11 Ca 0.00 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 3g7n h LEU 11 Cb 1.07 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 3g7n h LEU 11 CO 0.10 1.06 0.29 -0.74 0.09 0.00 0.00 178.44 179.24 3g7n h HIS 12 N 0.16 0.73 -0.50 1.13 2.76 -0.44 -0.36 115.15 118.63 3g7n h HIS 12 Ca -0.05 -0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.11 3g7n h HIS 12 Cb 1.48 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 30.18 3g7n h HIS 12 CO 0.04 0.54 0.33 -0.09 -1.30 0.00 0.00 177.93 177.45 3g7n h ARG 13 N 0.71 0.66 -1.00 5.26 2.43 -1.19 -1.07 114.38 120.18 3g7n h ARG 13 Ca 0.19 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.37 3g7n h ARG 13 Cb 0.05 -0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 29.39 3g7n h ARG 13 CO -0.03 0.44 0.65 0.00 -1.51 0.00 0.00 179.97 179.51 3g7n h ALA 14 N 1.19 1.36 -0.33 2.80 0.00 -0.80 -0.88 119.26 122.60 3g7n h ALA 14 Ca 0.19 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 3g7n h ALA 14 Cb -0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 3g7n h ALA 14 CO -0.04 0.48 -0.31 0.00 0.00 0.00 0.00 179.25 179.38 3g7n h ALA 15 N 1.43 0.84 -0.45 0.00 0.00 -0.58 -0.58 119.26 119.92 3g7n h ALA 15 Ca 0.42 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3g7n h ALA 15 Cb 0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3g7n h ALA 15 CO -0.16 0.64 0.21 0.87 0.00 0.00 0.00 179.25 180.81 3g7n h LYS 16 N 0.60 0.65 -0.68 0.00 1.57 -0.51 -0.40 116.57 117.81 3g7n h LYS 16 Ca 0.07 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 3g7n h LYS 16 Cb 0.82 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.98 3g7n h LYS 16 CO 0.07 0.56 0.32 -0.07 -0.57 0.00 0.00 179.45 179.76 3g7n h LEU 17 N 0.58 0.89 -0.83 2.94 3.38 -1.05 -0.74 115.31 120.47 3g7n h LEU 17 Ca 0.15 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3g7n h LEU 17 Cb 0.14 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3g7n h LEU 17 CO -0.02 0.78 0.42 0.28 0.09 0.00 0.00 178.44 179.98 3g7n h SER 18 N 0.94 1.08 -0.77 -0.43 0.02 -0.91 -2.00 113.55 111.48 3g7n h SER 18 Ca 0.23 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 3g7n h SER 18 Cb 0.12 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.35 3g7n h SER 18 CO -0.03 0.90 0.37 -1.28 -1.14 0.00 0.00 176.83 175.65 3g7n h SER 19 N 1.18 1.02 -0.79 3.07 0.87 -0.72 -2.61 113.55 115.57 3g7n h SER 19 Ca 0.29 -0.14 0.05 0.00 -1.23 0.00 0.00 61.79 60.76 3g7n h SER 19 Cb 0.10 -0.26 -0.05 0.00 -0.44 0.00 0.00 62.40 61.75 3g7n h SER 19 CO -0.04 0.87 0.52 0.00 -0.53 0.00 0.00 176.83 177.65 3g7n h ALA 20 N 1.19 1.56 -0.62 6.23 0.00 -0.70 -0.34 119.26 126.58 3g7n h ALA 20 Ca 0.27 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 3g7n h ALA 20 Cb 0.13 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3g7n h ALA 20 CO -0.03 0.34 0.20 0.00 0.00 0.00 0.00 179.25 179.76 3g7n h ALA 21 N 1.55 1.19 -0.42 0.00 0.00 -0.99 -0.10 119.26 120.49 3g7n h ALA 21 Ca 0.32 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 3g7n h ALA 21 Cb 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3g7n h ALA 21 CO -0.10 0.57 -0.27 1.88 0.00 0.00 0.00 179.25 181.33 3g7n h TYR 22 N 0.90 1.04 0.00 0.00 0.05 -1.05 -3.13 116.97 114.78 3g7n h TYR 22 Ca 0.20 -0.26 -0.08 0.00 0.05 0.00 0.00 58.73 58.64 3g7n h TYR 22 Cb 0.25 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 37.74 3g7n h TYR 22 CO 0.02 1.06 -0.40 1.15 -1.05 0.00 0.00 178.16 178.94 3g7n h THR 23 N 0.76 1.24 -2.61 -2.88 2.02 -0.76 -3.47 112.91 107.22 3g7n h THR 23 Ca 0.09 -1.38 -0.11 0.00 0.77 0.00 0.00 66.41 65.78 3g7n h THR 23 Cb 0.83 1.75 0.04 0.00 -1.74 0.00 0.00 68.15 69.04 3g7n h THR 23 CO 0.07 0.39 -0.21 0.61 0.37 0.00 0.00 175.52 176.75 3g7n n GLY 24 N -0.33 0.43 3.56 2.16 0.00 -0.08 -4.99 105.19 105.93 3g7n n GLY 24 Ca -0.02 -0.38 -0.46 0.00 0.00 0.00 0.00 46.02 45.17 3g7n n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g7n s ILE 26 N -0.91 5.16 0.00 0.00 -1.09 -1.26 -4.57 121.20 118.53 3g7n s ILE 26 Ca 0.62 1.04 0.00 0.00 -2.23 0.00 0.00 60.65 60.07 3g7n s ILE 26 Cb -0.76 -3.86 0.00 0.00 -1.58 0.00 0.00 42.46 36.26 3g7n s ILE 26 CO 0.58 0.30 0.00 0.61 -1.23 0.00 0.00 174.94 175.21 3g7n n GLY 27 N 3.28 1.65 3.33 6.18 0.00 -1.26 -4.80 105.19 113.56 3g7n n GLY 27 Ca -0.06 -0.11 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 3g7n n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g7n s LYS 28 N 0.00 0.86 -0.29 1.61 0.00 -1.26 -1.31 119.74 119.35 3g7n s LYS 28 Ca 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 55.97 55.77 3g7n s LYS 28 Cb 0.00 0.39 0.08 0.00 0.00 0.00 0.00 37.83 38.30 3g7n s LYS 28 CO 0.00 -0.28 0.02 0.00 0.00 0.00 0.00 175.35 175.10 3g7n s ALA 29 N -1.93 2.18 0.00 0.59 0.00 0.36 -4.79 121.76 118.18 3g7n s ALA 29 Ca -0.09 -1.86 0.00 0.00 0.00 0.00 0.00 51.96 50.01 3g7n s ALA 29 Cb -0.02 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.43 3g7n s ALA 29 CO 0.02 -1.50 0.00 1.19 0.00 0.00 0.00 175.76 175.47 3g7n n PHE 30 N 4.57 0.00 1.41 0.00 3.72 0.20 -0.97 117.46 126.39 3g7n n PHE 30 Ca -0.04 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.51 3g7n n PHE 30 Cb 0.43 0.00 0.74 0.00 -0.94 0.00 0.00 39.48 39.71 3g7n n PHE 30 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3g7n n ASP 31 N 5.23 0.04 -4.60 4.37 5.75 -1.26 -4.75 116.55 121.33 3g7n n ASP 31 Ca 0.00 -0.15 -0.40 0.00 -0.01 0.00 0.00 54.79 54.23 3g7n n ASP 31 Cb 0.00 -0.27 -0.07 0.00 -1.03 0.00 0.00 41.12 39.74 3g7n n ASP 31 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3g7n s VAL 32 N -2.58 5.03 -0.18 2.12 1.01 -0.14 -4.27 120.40 121.39 3g7n s VAL 32 Ca 0.28 0.76 -0.29 0.00 0.00 0.00 0.00 61.98 62.73 3g7n s VAL 32 Cb 0.20 -3.89 -0.00 0.00 0.00 0.00 0.00 36.38 32.70 3g7n s VAL 32 CO 0.47 -0.02 1.00 -0.89 0.00 0.00 0.00 175.10 175.65 3g7n s THR 33 N 2.38 4.75 -0.28 3.92 2.01 0.70 -0.49 115.64 128.63 3g7n s THR 33 Ca 0.21 1.97 -0.21 0.00 0.31 0.00 0.00 61.69 63.97 3g7n s THR 33 Cb -0.15 -4.28 -0.01 0.00 0.01 0.00 0.00 72.50 68.06 3g7n s THR 33 CO 0.11 -0.09 0.66 -0.63 -0.69 0.00 0.00 174.62 173.98 3g7n s ILE 34 N 2.64 4.93 -0.05 1.82 1.01 -0.42 -1.46 121.20 129.68 3g7n s ILE 34 Ca 0.44 1.03 0.20 0.00 0.00 0.00 0.00 60.65 62.32 3g7n s ILE 34 Cb -0.16 -4.00 -0.30 0.00 0.01 0.00 0.00 42.46 38.00 3g7n s ILE 34 CO 0.11 -0.09 0.39 1.33 0.00 0.00 0.00 174.94 176.68 3g7n n VAL 35 N 5.34 0.16 -3.72 2.92 0.24 0.12 -4.81 118.33 118.58 3g7n n VAL 35 Ca 0.00 -0.50 -0.12 0.00 -2.04 0.00 0.00 64.34 61.68 3g7n n VAL 35 Cb 0.49 -0.03 -0.12 0.00 -1.47 0.00 0.00 33.84 32.71 3g7n n VAL 35 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3g7n s LYS 36 N -3.28 0.28 -0.28 7.34 2.47 -0.86 -5.02 119.74 120.39 3g7n s LYS 36 Ca -0.08 0.62 -0.09 0.00 -1.56 0.00 0.00 55.97 54.86 3g7n s LYS 36 Cb 0.12 -0.08 -0.02 0.00 -1.46 0.00 0.00 37.83 36.39 3g7n s LYS 36 CO 0.83 -0.16 0.13 1.03 0.16 0.00 0.00 175.35 177.33 3g7n s ARG 37 N 1.28 3.52 -0.14 4.03 0.52 -1.26 -0.97 118.95 125.92 3g7n s ARG 37 Ca -0.09 -0.59 -0.21 0.00 -0.52 0.00 0.00 55.73 54.32 3g7n s ARG 37 Cb -0.09 -3.49 -0.03 0.00 0.52 0.00 0.00 34.95 31.86 3g7n s ARG 37 CO -0.10 -0.31 0.64 0.42 0.02 0.00 0.00 175.30 175.98 3g7n s ILE 38 N 1.63 5.05 -0.11 1.52 -1.09 -0.26 -4.98 121.20 122.95 3g7n s ILE 38 Ca 0.05 1.26 -0.05 0.00 -2.23 0.00 0.00 60.65 59.69 3g7n s ILE 38 Cb -0.16 -3.97 0.05 0.00 -1.58 0.00 0.00 42.46 36.80 3g7n s ILE 38 CO 0.06 0.18 0.24 -0.47 -1.23 0.00 0.00 174.94 173.72 3g7n s TYR 39 N 1.39 -0.35 -0.23 3.97 5.04 -1.26 -1.45 117.35 124.45 3g7n s TYR 39 Ca 0.32 0.83 0.01 0.00 -2.44 0.00 0.00 57.07 55.79 3g7n s TYR 39 Cb -0.16 -0.01 0.06 0.00 0.35 0.00 0.00 41.96 42.19 3g7n s TYR 39 CO 0.13 -0.28 -0.05 0.34 -1.34 0.00 0.00 175.55 174.35 3g7n s ASP 40 N 1.78 3.84 0.12 4.32 2.15 0.16 -4.97 116.67 124.08 3g7n s ASP 40 Ca -0.04 -1.18 -0.17 0.00 0.43 0.00 0.00 52.55 51.59 3g7n s ASP 40 Cb -0.11 -1.17 -0.02 0.00 -0.30 0.00 0.00 42.92 41.32 3g7n s ASP 40 CO -0.08 -0.24 1.67 0.25 -0.17 0.00 0.00 175.17 176.60 3g7n h LEU 41 N 7.96 0.49 -0.69 -1.34 5.85 -1.94 0.26 115.31 125.89 3g7n h LEU 41 Ca -0.18 -0.16 -0.11 0.00 0.84 0.00 0.00 57.88 58.27 3g7n h LEU 41 Cb 1.07 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3g7n h LEU 41 CO 0.41 0.52 -0.20 -0.37 -0.34 0.00 0.00 178.44 178.46 3g7n h VAL 42 N 0.42 1.27 -0.10 1.05 -1.51 -1.97 -1.50 116.25 113.91 3g7n h VAL 42 Ca 0.12 -1.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.28 3g7n h VAL 42 Cb 0.18 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.51 3g7n h VAL 42 CO -0.01 0.44 0.00 0.35 -1.23 0.00 0.00 177.57 177.12 3g7n n THR 43 N -4.12 0.12 -4.20 7.19 -2.24 -1.22 -4.94 114.28 104.87 3g7n n THR 43 Ca 0.00 -0.40 -0.35 0.00 -2.27 0.00 0.00 64.05 61.03 3g7n n THR 43 Cb 0.42 0.78 -0.03 0.00 -2.10 0.00 0.00 70.33 69.41 3g7n n THR 43 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3g7n n ASP 44 N 0.68 -2.94 -4.67 3.42 2.03 0.64 -4.94 116.55 110.77 3g7n n ASP 44 Ca 0.17 -1.01 -0.39 0.00 0.52 0.00 0.00 54.79 54.08 3g7n n ASP 44 Cb 0.44 -2.77 -0.07 0.00 -0.72 0.00 0.00 41.12 38.00 3g7n n ASP 44 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3g7n s THR 45 N -3.38 5.12 0.04 5.18 2.01 0.36 -4.88 115.64 120.09 3g7n s THR 45 Ca 0.65 0.95 0.03 0.00 0.31 0.00 0.00 61.69 63.63 3g7n s THR 45 Cb -0.36 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.29 3g7n s THR 45 CO 0.93 0.20 -0.09 0.20 -0.69 0.00 0.00 174.62 175.17 3g7n s ASN 46 N 1.06 1.05 0.00 3.53 0.01 -1.26 0.38 114.94 119.71 3g7n s ASN 46 Ca 0.24 -0.53 0.00 0.00 -0.71 0.00 0.00 52.86 51.87 3g7n s ASN 46 Cb -0.15 0.00 0.00 0.00 0.41 0.00 0.00 41.25 41.51 3g7n s ASN 46 CO 0.10 -0.14 0.00 0.61 -1.51 0.00 0.00 177.10 176.15 3g7n n GLY 47 N 1.56 0.78 2.97 0.66 0.00 -0.53 -0.49 105.19 110.14 3g7n n GLY 47 Ca -0.21 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 3g7n n GLY 47 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g7n s PHE 48 N -2.51 0.26 -0.02 1.61 0.08 0.70 -1.10 117.98 117.00 3g7n s PHE 48 Ca 0.00 -0.46 0.06 0.00 0.12 0.00 0.00 56.93 56.64 3g7n s PHE 48 Cb 0.00 -0.18 -0.01 0.00 -0.57 0.00 0.00 43.02 42.25 3g7n s PHE 48 CO 0.00 -0.16 -0.19 0.08 -0.10 0.00 0.00 175.22 174.85 3g7n s VAL 49 N -1.28 1.49 0.00 -0.44 1.01 -0.14 -0.65 120.40 120.39 3g7n s VAL 49 Ca -0.14 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.04 3g7n s VAL 49 Cb -0.09 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.05 3g7n s VAL 49 CO -0.01 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.12 3g7n n GLY 50 N 2.63 1.62 3.01 4.51 0.00 -0.47 -0.70 105.19 115.79 3g7n n GLY 50 Ca -0.15 -0.65 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 3g7n n GLY 50 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3g7n s TYR 51 N -2.35 0.37 -0.25 1.61 -0.85 -0.53 -0.63 117.35 114.72 3g7n s TYR 51 Ca 0.00 -0.56 -0.01 0.00 -0.52 0.00 0.00 57.07 55.98 3g7n s TYR 51 Cb 0.00 -0.25 0.03 0.00 0.38 0.00 0.00 41.96 42.12 3g7n s TYR 51 CO 0.00 -0.18 -0.07 0.45 -1.52 0.00 0.00 175.55 174.23 3g7n s SER 52 N -1.60 4.35 0.29 -0.18 0.15 0.44 -0.21 113.70 116.94 3g7n s SER 52 Ca -0.13 -1.01 0.01 0.00 0.70 0.00 0.00 55.95 55.53 3g7n s SER 52 Cb -0.09 -1.64 0.45 0.00 -1.71 0.00 0.00 66.02 63.04 3g7n s SER 52 CO -0.01 -0.15 1.79 0.74 1.20 0.00 0.00 173.24 176.81 3g7n h THR 53 N 6.28 1.23 -0.13 6.45 2.02 -1.85 0.17 112.91 127.07 3g7n h THR 53 Ca -0.30 -0.98 -0.01 0.00 0.77 0.00 0.00 66.41 65.89 3g7n h THR 53 Cb 1.09 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.51 3g7n h THR 53 CO 0.55 0.33 0.05 -0.08 0.37 0.00 0.00 175.52 176.75 3g7n h GLU 54 N 0.57 0.19 0.00 6.66 4.81 -1.94 -3.09 114.58 121.79 3g7n h GLU 54 Ca 0.11 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3g7n h GLU 54 Cb 0.46 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.81 3g7n h GLU 54 CO 0.02 0.28 -0.66 1.63 -0.73 0.00 0.00 179.01 179.56 3g7n n LYS 55 N -4.90 0.05 -3.64 1.92 4.76 -1.16 -4.96 118.16 110.23 3g7n n LYS 55 Ca -0.05 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.17 3g7n n LYS 55 Cb 0.11 -1.52 0.04 0.00 -1.84 0.00 0.00 35.03 31.82 3g7n n LYS 55 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3g7n n LYS 56 N -1.58 -4.16 -4.28 1.97 5.02 0.54 -4.87 118.16 110.80 3g7n n LYS 56 Ca 0.05 0.63 -0.19 0.00 -2.02 0.00 0.00 58.31 56.78 3g7n n LYS 56 Cb 0.35 -5.12 -0.11 0.00 -0.02 0.00 0.00 35.03 30.13 3g7n n LYS 56 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3g7n s THR 57 N -3.60 1.52 -0.20 -0.18 -4.23 -0.95 -0.95 115.64 107.05 3g7n s THR 57 Ca 0.12 -1.84 -0.04 0.00 -1.18 0.00 0.00 61.69 58.74 3g7n s THR 57 Cb -0.03 -1.70 -0.02 0.00 1.34 0.00 0.00 72.50 72.10 3g7n s THR 57 CO 0.81 -0.42 -0.03 -0.63 -0.54 0.00 0.00 174.62 173.81 3g7n s ILE 58 N -2.25 3.64 -0.04 2.99 1.01 0.87 -0.42 121.20 127.01 3g7n s ILE 58 Ca 0.13 -0.42 0.06 0.00 0.00 0.00 0.00 60.65 60.42 3g7n s ILE 58 Cb -0.04 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.77 3g7n s ILE 58 CO 0.04 0.44 -0.22 0.00 0.00 0.00 0.00 174.94 175.20 3g7n s ALA 59 N 1.06 2.31 -0.25 9.38 0.00 0.20 -0.88 121.76 133.59 3g7n s ALA 59 Ca 0.01 -1.07 -0.01 0.00 0.00 0.00 0.00 51.96 50.90 3g7n s ALA 59 Cb -0.15 -0.69 0.03 0.00 0.00 0.00 0.00 23.12 22.31 3g7n s ALA 59 CO 0.01 0.52 -0.08 0.08 0.00 0.00 0.00 175.76 176.28 3g7n s VAL 60 N -0.56 2.68 -0.23 0.00 1.01 -0.17 -1.36 120.40 121.76 3g7n s VAL 60 Ca 0.08 -1.13 0.01 0.00 0.00 0.00 0.00 61.98 60.94 3g7n s VAL 60 Cb -0.11 -2.38 0.04 0.00 0.00 0.00 0.00 36.38 33.93 3g7n s VAL 60 CO 0.00 0.18 -0.12 -0.63 0.00 0.00 0.00 175.10 174.53 3g7n s ILE 61 N 1.28 2.38 -0.12 2.22 1.01 0.18 -1.06 121.20 127.09 3g7n s ILE 61 Ca -0.01 -1.20 -0.05 0.00 0.00 0.00 0.00 60.65 59.38 3g7n s ILE 61 Cb -0.17 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 3g7n s ILE 61 CO -0.05 0.23 0.08 -0.04 0.00 0.00 0.00 174.94 175.16 3g7n s MET 62 N 1.24 3.40 0.33 2.79 -1.94 0.04 -0.22 119.30 124.94 3g7n s MET 62 Ca -0.01 -0.26 -0.20 0.00 -1.71 0.00 0.00 55.69 53.51 3g7n s MET 62 Cb -0.17 -3.07 -0.10 0.00 2.01 0.00 0.00 34.83 33.51 3g7n s MET 62 CO -0.07 0.66 0.85 0.50 -0.01 0.00 0.00 175.02 176.94 3g7n s ARG 63 N -0.72 4.27 0.63 2.03 3.52 0.36 -4.00 118.95 125.04 3g7n s ARG 63 Ca 0.12 1.01 -0.11 0.00 -0.13 0.00 0.00 55.73 56.62 3g7n s ARG 63 Cb -0.12 -2.55 0.15 0.00 -1.56 0.00 0.00 34.95 30.88 3g7n s ARG 63 CO 0.03 0.18 0.67 0.41 -0.81 0.00 0.00 175.30 175.78 3g7n n GLY 64 N 0.02 -2.12 3.75 8.12 0.00 -1.22 -3.59 105.19 110.15 3g7n n GLY 64 Ca 0.03 -1.56 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 3g7n n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3g7n s SER 65 N -3.39 4.88 0.03 1.61 0.01 -1.26 -4.79 113.70 110.79 3g7n s SER 65 Ca 0.41 2.20 0.28 0.00 1.31 0.00 0.00 55.95 60.14 3g7n s SER 65 Cb -0.03 -2.57 1.13 0.00 0.21 0.00 0.00 66.02 64.76 3g7n s SER 65 CO 0.30 -1.80 1.87 0.35 0.41 0.00 0.00 173.24 174.38 3g7n n THR 66 N -2.28 0.16 -4.18 1.44 -2.24 -1.26 -4.68 114.28 101.25 3g7n n THR 66 Ca 0.12 -0.02 -0.16 0.00 -2.27 0.00 0.00 64.05 61.72 3g7n n THR 66 Cb 0.51 -0.56 -0.13 0.00 -2.10 0.00 0.00 70.33 68.05 3g7n n THR 66 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3g7n s THR 67 N -3.02 0.65 -0.26 4.28 -1.32 -1.26 -5.05 115.64 109.66 3g7n s THR 67 Ca 0.13 -0.74 0.13 0.00 -1.21 0.00 0.00 61.69 60.00 3g7n s THR 67 Cb 0.17 -0.62 0.30 0.00 -1.51 0.00 0.00 72.50 70.84 3g7n s THR 67 CO 0.52 -0.09 1.22 2.30 -2.21 0.00 0.00 174.62 176.35 3g7n n ILE 68 N 2.13 1.66 1.35 5.08 -5.35 -1.26 -5.14 119.36 117.83 3g7n n ILE 68 Ca -0.18 -1.67 0.14 0.00 -0.27 0.00 0.00 62.75 60.77 3g7n n ILE 68 Cb 0.56 0.04 0.55 0.00 -1.74 0.00 0.00 39.64 39.05 3g7n n ILE 68 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3g7n n THR 69 N -0.63 0.00 0.00 7.28 -2.24 -1.26 -4.90 114.28 112.53 3g7n n THR 69 Ca 0.13 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 3g7n n THR 69 Cb 0.59 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 3g7n n THR 69 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3g7n n ASP 74 N -0.92 0.00 -4.76 3.42 10.43 -1.26 -5.03 116.55 118.43 3g7n n ASP 74 Ca 0.13 0.00 -0.41 0.00 2.57 0.00 0.00 54.79 57.09 3g7n n ASP 74 Cb 0.30 0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.24 3g7n n ASP 74 CO 0.00 0.00 0.00 -0.51 -1.07 0.00 0.00 177.20 175.62 3g7n s ILE 75 N -0.14 2.68 -0.45 0.53 2.07 -1.26 -4.92 121.20 119.70 3g7n s ILE 75 Ca 0.00 0.65 -0.29 0.00 -1.41 0.00 0.00 60.65 59.60 3g7n s ILE 75 Cb 0.00 -3.41 0.03 0.00 0.13 0.00 0.00 42.46 39.20 3g7n s ILE 75 CO 0.00 0.14 1.17 -0.62 -1.91 0.00 0.00 174.94 173.72 3g7n s ASP 76 N -0.23 6.63 -0.18 4.50 -1.08 -1.26 -4.88 116.67 120.17 3g7n s ASP 76 Ca 0.52 0.60 0.16 0.00 -0.52 0.00 0.00 52.55 53.30 3g7n s ASP 76 Cb -0.41 -2.55 0.75 0.00 -1.46 0.00 0.00 42.92 39.26 3g7n s ASP 76 CO 0.51 -1.23 1.67 2.30 0.52 0.00 0.00 175.17 178.94 3g7n n ILE 77 N 6.75 2.32 -1.92 4.11 -5.35 -1.26 -0.63 119.36 123.38 3g7n n ILE 77 Ca 0.13 -1.36 -0.42 0.00 -0.27 0.00 0.00 62.75 60.83 3g7n n ILE 77 Cb 0.49 -0.09 -0.03 0.00 -1.74 0.00 0.00 39.64 38.26 3g7n n ILE 77 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3g7n s ALA 78 N -2.36 3.75 0.05 -1.28 0.00 -1.26 -4.75 121.76 115.91 3g7n s ALA 78 Ca 0.52 1.33 -0.30 0.00 0.00 0.00 0.00 51.96 53.51 3g7n s ALA 78 Cb 0.37 -3.65 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 3g7n s ALA 78 CO 0.19 -0.90 0.96 -0.51 0.00 0.00 0.00 175.76 175.50 3g7n s LEU 79 N 1.68 4.43 0.17 0.00 1.43 -1.26 -0.63 118.68 124.50 3g7n s LEU 79 Ca 0.72 1.70 0.05 0.00 -1.03 0.00 0.00 54.13 55.57 3g7n s LEU 79 Cb -0.43 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.19 3g7n s LEU 79 CO 0.32 -0.16 -0.08 0.27 0.23 0.00 0.00 176.35 176.92 3g7n s ILE 80 N 0.52 1.18 -0.29 -0.59 -5.25 0.09 -4.89 121.20 111.97 3g7n s ILE 80 Ca 0.49 -2.07 -0.29 0.00 -0.99 0.00 0.00 60.65 57.79 3g7n s ILE 80 Cb -0.22 -1.96 0.00 0.00 2.95 0.00 0.00 42.46 43.23 3g7n s ILE 80 CO 0.28 -0.65 1.23 -0.89 -1.79 0.00 0.00 174.94 173.13 3g7n s THR 81 N -3.32 4.26 0.58 8.37 2.01 -1.26 -1.39 115.64 124.88 3g7n s THR 81 Ca 0.19 1.44 -0.13 0.00 0.31 0.00 0.00 61.69 63.51 3g7n s THR 81 Cb 0.03 -4.22 -0.05 0.00 0.01 0.00 0.00 72.50 68.27 3g7n s THR 81 CO 0.03 -0.45 1.00 -2.16 -0.69 0.00 0.00 174.62 172.35 3g7n s PRO 82 N 3.95 3.71 -0.13 4.92 0.04 -1.26 -4.99 135.00 141.24 3g7n s PRO 82 Ca 0.53 0.79 -0.05 0.00 0.04 0.00 0.00 61.00 62.31 3g7n s PRO 82 Cb -0.16 -2.11 0.06 0.00 0.04 0.00 0.00 34.50 32.33 3g7n s PRO 82 CO 0.20 -0.45 0.28 -2.00 0.04 0.00 0.00 177.00 175.06 3g7n s GLU 83 N -4.79 0.18 -0.02 4.56 2.12 -1.26 -4.90 118.70 114.59 3g7n s GLU 83 Ca 0.56 0.73 -0.04 0.00 0.36 0.00 0.00 54.97 56.58 3g7n s GLU 83 Cb -0.11 -0.02 0.00 0.00 0.26 0.00 0.00 34.13 34.26 3g7n s GLU 83 CO 0.46 -0.25 0.09 -0.51 -0.54 0.00 0.00 175.26 174.51 3g7n s LEU 84 N 2.17 1.68 0.29 2.70 1.43 -1.26 -4.99 118.68 120.70 3g7n s LEU 84 Ca -0.01 0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 52.82 3g7n s LEU 84 Cb -0.12 0.38 -0.11 0.00 0.03 0.00 0.00 46.19 46.38 3g7n s LEU 84 CO -0.09 -0.14 1.52 -0.94 0.23 0.00 0.00 176.35 176.93 3g7n s SER 85 N -0.42 6.47 0.00 2.29 1.04 -1.26 -1.73 113.70 120.09 3g7n s SER 85 Ca -0.05 2.86 0.00 0.00 0.48 0.00 0.00 55.95 59.24 3g7n s SER 85 Cb -0.03 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.45 3g7n s SER 85 CO 0.00 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.01 3g7n n GLY 86 N 1.90 1.24 3.46 7.32 0.00 -1.26 -4.91 105.19 112.94 3g7n n GLY 86 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3g7n n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g7n s VAL 87 N -3.82 3.50 -0.40 1.61 1.01 -0.70 -4.05 120.40 117.54 3g7n s VAL 87 Ca 0.00 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 3g7n s VAL 87 Cb 0.00 -2.49 0.10 0.00 0.00 0.00 0.00 36.38 33.98 3g7n s VAL 87 CO 0.00 0.52 0.21 -0.89 0.00 0.00 0.00 175.10 174.94 3g7n s THR 88 N 0.16 3.61 0.05 3.92 2.01 -1.26 -4.61 115.64 119.51 3g7n s THR 88 Ca -0.04 -1.76 -0.23 0.00 0.31 0.00 0.00 61.69 59.97 3g7n s THR 88 Cb -0.14 -3.34 -0.06 0.00 0.01 0.00 0.00 72.50 68.97 3g7n s THR 88 CO 0.04 -0.58 0.68 -0.36 -0.69 0.00 0.00 174.62 173.71 3g7n s PHE 89 N 1.26 3.75 0.75 4.92 0.08 -1.26 -5.05 117.98 122.43 3g7n s PHE 89 Ca 0.05 1.38 -0.15 0.00 0.12 0.00 0.00 56.93 58.33 3g7n s PHE 89 Cb -0.23 -2.70 0.05 0.00 -0.57 0.00 0.00 43.02 39.57 3g7n s PHE 89 CO -0.02 0.38 1.23 -2.30 -0.10 0.00 0.00 175.22 174.41 3g7n n PRO 90 N 2.45 0.52 0.06 0.24 -0.02 -1.26 -4.87 135.00 132.12 3g7n n PRO 90 Ca -0.05 0.25 0.08 0.00 -2.02 0.00 0.00 63.50 61.75 3g7n n PRO 90 Cb 0.50 -2.46 0.53 0.00 -0.02 0.00 0.00 33.50 32.05 3g7n n PRO 90 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3g7n h SER 91 N -0.39 0.27 0.33 2.55 4.64 -2.02 -1.99 113.55 116.95 3g7n h SER 91 Ca -0.48 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3g7n h SER 91 Cb 1.31 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3g7n h SER 91 CO 0.48 0.19 -0.14 -0.90 -0.87 0.00 0.00 176.83 175.59 3g7n n ASP 92 N -4.49 0.59 -4.71 4.97 5.75 -1.26 -4.91 116.55 112.50 3g7n n ASP 92 Ca 0.03 -0.65 -0.42 0.00 -0.01 0.00 0.00 54.79 53.74 3g7n n ASP 92 Cb 0.18 -0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.21 3g7n n ASP 92 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3g7n s VAL 93 N -2.47 3.71 0.01 2.12 1.01 -0.75 -4.73 120.40 119.31 3g7n s VAL 93 Ca 0.28 1.24 0.03 0.00 0.00 0.00 0.00 61.98 63.53 3g7n s VAL 93 Cb 0.20 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 3g7n s VAL 93 CO 0.48 0.10 -0.11 -0.54 0.00 0.00 0.00 175.10 175.03 3g7n s LYS 94 N 1.03 0.79 0.06 2.72 -0.14 -1.26 -4.41 119.74 118.53 3g7n s LYS 94 Ca 0.61 -0.51 0.04 0.00 -1.36 0.00 0.00 55.97 54.75 3g7n s LYS 94 Cb -0.33 -0.75 -0.03 0.00 -1.68 0.00 0.00 37.83 35.05 3g7n s LYS 94 CO 0.30 0.19 -0.12 0.42 -0.76 0.00 0.00 175.35 175.38 3g7n s ILE 95 N -0.54 0.92 0.36 2.17 1.01 -0.49 -2.03 121.20 122.60 3g7n s ILE 95 Ca 0.01 -1.18 -0.28 0.00 0.00 0.00 0.00 60.65 59.20 3g7n s ILE 95 Cb -0.06 -0.91 -0.10 0.00 0.01 0.00 0.00 42.46 41.41 3g7n s ILE 95 CO 0.00 -0.24 1.30 0.00 0.00 0.00 0.00 174.94 176.00 3g7n s MET 96 N -1.60 4.20 0.33 2.79 0.23 0.42 -0.73 119.30 124.95 3g7n s MET 96 Ca -0.04 2.18 0.02 0.00 -1.03 0.00 0.00 55.69 56.82 3g7n s MET 96 Cb -0.10 -2.94 0.57 0.00 -1.53 0.00 0.00 34.83 30.83 3g7n s MET 96 CO 0.02 -0.30 1.93 -0.09 -2.03 0.00 0.00 175.02 174.54 3g7n h ARG 97 N 3.09 0.75 0.00 3.16 2.43 -0.90 -1.22 114.38 121.69 3g7n h ARG 97 Ca -0.49 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 58.58 3g7n h ARG 97 Cb 1.23 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 3g7n h ARG 97 CO 0.64 0.60 0.00 0.41 -1.51 0.00 0.00 179.97 180.12 3g7n n GLY 98 N -1.14 -0.83 0.16 2.80 0.00 0.20 -0.58 105.19 105.80 3g7n n GLY 98 Ca 0.04 0.10 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 3g7n n GLY 98 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3g7n n VAL 99 N -1.97 0.70 -0.31 1.61 0.31 -0.84 -4.55 118.33 113.29 3g7n n VAL 99 Ca -0.00 -0.25 -0.01 0.00 -0.01 0.00 0.00 64.34 64.07 3g7n n VAL 99 Cb 0.06 -1.07 0.12 0.00 -0.91 0.00 0.00 33.84 32.04 3g7n n VAL 99 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 3g7n h HIS 100 N -0.09 1.00 0.52 3.52 -0.00 -1.12 -2.06 115.15 116.92 3g7n h HIS 100 Ca -0.28 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.09 3g7n h HIS 100 Cb 1.39 -0.33 0.01 0.00 -0.00 0.00 0.00 27.41 28.48 3g7n h HIS 100 CO 0.00 0.56 -0.25 -0.09 -0.00 0.00 0.00 177.93 178.15 3g7n h ARG 101 N 1.02 -0.67 -0.78 5.26 2.43 -1.09 0.85 114.38 121.40 3g7n h ARG 101 Ca 0.35 0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.54 3g7n h ARG 101 Cb 0.06 0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.72 3g7n h ARG 101 CO -0.13 -0.43 0.40 -1.00 -1.51 0.00 0.00 179.97 177.30 3g7n h PRO 102 N -0.73 1.12 -0.39 0.20 0.13 -1.77 -2.25 132.00 128.30 3g7n h PRO 102 Ca -0.07 -0.15 -0.00 0.00 -0.87 0.00 0.00 66.00 64.91 3g7n h PRO 102 Cb 0.55 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.46 3g7n h PRO 102 CO 0.12 0.85 0.24 2.35 -0.23 0.00 0.00 178.00 181.32 3g7n h TRP 103 N 1.10 0.51 0.00 1.56 2.91 -1.26 -2.62 115.95 118.14 3g7n h TRP 103 Ca 0.27 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.27 3g7n h TRP 103 Cb 0.08 -0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 28.56 3g7n h TRP 103 CO 0.01 0.36 -0.11 0.66 -1.03 0.00 0.00 178.44 178.33 3g7n h SER 104 N 0.51 0.00 -0.12 2.65 4.64 -0.62 0.13 113.55 120.75 3g7n h SER 104 Ca 0.14 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.40 3g7n h SER 104 Cb -0.01 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 3g7n h SER 104 CO -0.03 0.11 -0.10 0.00 -0.87 0.00 0.00 176.83 175.94 3g7n h ALA 105 N 1.89 1.33 -0.00 5.18 0.00 -1.02 -3.23 119.26 123.41 3g7n h ALA 105 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3g7n h ALA 105 Cb 0.26 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3g7n h ALA 105 CO 0.01 0.45 -0.35 1.33 0.00 0.00 0.00 179.25 180.69 3g7n n VAL 106 N -4.23 0.00 0.08 0.00 0.24 -0.47 -4.76 118.33 109.19 3g7n n VAL 106 Ca 0.01 -0.32 -0.13 0.00 -2.04 0.00 0.00 64.34 61.86 3g7n n VAL 106 Cb 0.29 1.07 -0.06 0.00 -1.47 0.00 0.00 33.84 33.67 3g7n n VAL 106 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 3g7n h HIS 107 N 0.63 -0.97 -0.45 6.34 2.76 -0.81 -1.23 115.15 121.41 3g7n h HIS 107 Ca 0.00 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.12 3g7n h HIS 107 Cb 0.31 0.42 -0.02 0.00 1.55 0.00 0.00 27.41 29.67 3g7n h HIS 107 CO 0.00 -0.44 -0.05 -0.44 -1.30 0.00 0.00 177.93 175.69 3g7n h ASP 108 N -0.53 0.76 -0.47 3.26 3.32 -1.86 -0.25 116.42 120.65 3g7n h ASP 108 Ca 0.05 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 3g7n h ASP 108 Cb 0.60 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 3g7n h ASP 108 CO -0.26 0.86 0.29 0.74 -1.72 0.00 0.00 179.24 179.15 3g7n h THR 109 N 0.72 1.14 -0.07 0.35 2.02 -1.80 -0.83 112.91 114.43 3g7n h THR 109 Ca 0.13 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 3g7n h THR 109 Cb 0.52 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 3g7n h THR 109 CO 0.03 0.14 -0.02 0.40 0.37 0.00 0.00 175.52 176.44 3g7n h ILE 110 N 0.63 1.29 -0.82 3.11 2.04 -0.88 -2.17 117.51 120.71 3g7n h ILE 110 Ca 0.17 -0.92 0.06 0.00 1.00 0.00 0.00 64.86 65.17 3g7n h ILE 110 Cb -0.02 1.76 -0.06 0.00 -0.74 0.00 0.00 36.82 37.76 3g7n h ILE 110 CO -0.03 0.25 0.51 0.40 0.00 0.00 0.00 178.15 179.28 3g7n h ILE 111 N -0.20 1.05 -0.64 -0.67 1.08 -0.97 0.06 117.51 117.22 3g7n h ILE 111 Ca 0.02 -0.32 -0.01 0.00 -0.39 0.00 0.00 64.86 64.16 3g7n h ILE 111 Cb 0.41 0.03 -0.03 0.00 -3.07 0.00 0.00 36.82 34.16 3g7n h ILE 111 CO 0.01 0.17 0.38 0.74 -0.69 0.00 0.00 178.15 178.75 3g7n h THR 112 N 0.94 1.19 -0.29 -0.27 2.02 -1.06 -0.75 112.91 114.69 3g7n h THR 112 Ca 0.35 -0.43 -0.19 0.00 0.77 0.00 0.00 66.41 66.91 3g7n h THR 112 Cb 0.14 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 3g7n h THR 112 CO -0.16 0.20 -0.56 -0.08 0.37 0.00 0.00 175.52 175.29 3g7n h GLU 113 N 0.86 0.89 -0.90 6.66 4.57 -0.87 -1.84 114.58 123.95 3g7n h GLU 113 Ca 0.23 -0.57 0.00 0.00 -1.18 0.00 0.00 59.36 57.84 3g7n h GLU 113 Cb -0.01 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.61 3g7n h GLU 113 CO -0.04 1.20 0.57 0.28 -1.18 0.00 0.00 179.01 179.84 3g7n h VAL 114 N 0.68 1.24 -0.52 0.32 2.07 -0.81 -0.46 116.25 118.77 3g7n h VAL 114 Ca 0.01 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 66.98 3g7n h VAL 114 Cb 1.17 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3g7n h VAL 114 CO 0.12 0.24 0.06 0.50 0.02 0.00 0.00 177.57 178.51 3g7n h LYS 115 N 1.23 0.85 -0.65 1.57 3.64 -0.92 0.91 116.57 123.19 3g7n h LYS 115 Ca 0.33 -0.21 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 3g7n h LYS 115 Cb -0.10 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.59 3g7n h LYS 115 CO -0.07 0.81 0.09 0.00 -2.27 0.00 0.00 179.45 178.02 3g7n h ALA 116 N 1.26 0.87 -0.21 5.00 0.00 -0.75 -2.33 119.26 123.10 3g7n h ALA 116 Ca 0.16 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 3g7n h ALA 116 Cb 0.40 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3g7n h ALA 116 CO 0.01 0.65 -0.46 -0.07 0.00 0.00 0.00 179.25 179.38 3g7n h LEU 117 N 1.01 0.57 -1.19 0.00 3.38 -0.50 -2.80 115.31 115.79 3g7n h LEU 117 Ca 0.20 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.90 3g7n h LEU 117 Cb 0.46 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 3g7n h LEU 117 CO 0.02 0.95 0.54 0.40 0.09 0.00 0.00 178.44 180.44 3g7n h ILE 118 N 0.43 1.21 -0.47 1.22 2.04 -0.60 0.24 117.51 121.59 3g7n h ILE 118 Ca 0.03 -0.39 -0.05 0.00 1.00 0.00 0.00 64.86 65.45 3g7n h ILE 118 Cb 0.97 -0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3g7n h ILE 118 CO 0.09 0.21 0.09 0.00 0.00 0.00 0.00 178.15 178.53 3g7n h ALA 119 N 1.48 1.28 0.06 1.87 0.00 -1.17 -2.42 119.26 120.36 3g7n h ALA 119 Ca 0.30 -0.20 -0.27 0.00 0.00 0.00 0.00 54.91 54.75 3g7n h ALA 119 Cb -0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 3g7n h ALA 119 CO -0.06 0.50 -1.32 -0.22 0.00 0.00 0.00 179.25 178.15 3g7n h LYS 120 N 0.69 0.14 -2.24 0.00 3.64 -1.19 -3.40 116.57 114.21 3g7n h LYS 120 Ca 0.15 -0.23 -0.59 0.00 -1.27 0.00 0.00 60.65 58.71 3g7n h LYS 120 Cb 0.30 0.09 -0.41 0.00 -0.41 0.00 0.00 32.23 31.80 3g7n h LYS 120 CO 0.00 1.01 -0.80 0.66 -2.27 0.00 0.00 179.45 178.06 3g7n n TYR 121 N -3.38 1.86 1.23 1.91 4.01 0.80 -4.96 117.16 118.62 3g7n n TYR 121 Ca -0.09 -3.90 0.14 0.00 -0.16 0.00 0.00 57.90 53.89 3g7n n TYR 121 Cb 1.01 -0.43 0.69 0.00 -0.31 0.00 0.00 39.34 40.30 3g7n n TYR 121 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3g7n n PRO 122 N 1.33 0.26 0.00 -0.72 -0.04 -0.93 -1.88 135.00 133.01 3g7n n PRO 122 Ca 0.26 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.85 3g7n n PRO 122 Cb 0.45 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.57 3g7n n PRO 122 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3g7n n ASP 123 N -1.37 1.70 -4.81 3.54 5.75 -1.26 -4.97 116.55 115.12 3g7n n ASP 123 Ca 0.11 -1.32 -0.34 0.00 -0.01 0.00 0.00 54.79 53.24 3g7n n ASP 123 Cb 0.27 0.32 -0.06 0.00 -1.03 0.00 0.00 41.12 40.62 3g7n n ASP 123 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 3g7n s TYR 124 N -2.45 3.26 0.63 2.11 1.51 -0.79 -5.00 117.35 116.63 3g7n s TYR 124 Ca 0.22 1.62 0.04 0.00 -1.01 0.00 0.00 57.07 57.94 3g7n s TYR 124 Cb 0.19 -2.91 0.10 0.00 -0.11 0.00 0.00 41.96 39.22 3g7n s TYR 124 CO 0.53 -0.27 0.87 0.95 -1.11 0.00 0.00 175.55 176.53 3g7n s THR 125 N -2.08 2.21 0.07 -0.71 -4.23 -0.13 -4.84 115.64 105.93 3g7n s THR 125 Ca 0.62 -0.80 0.04 0.00 -1.18 0.00 0.00 61.69 60.37 3g7n s THR 125 Cb -0.12 -2.41 -0.04 0.00 1.34 0.00 0.00 72.50 71.28 3g7n s THR 125 CO 0.16 0.00 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.47 3g7n s LEU 126 N -4.88 3.44 0.00 4.79 1.43 0.33 -0.09 118.68 123.71 3g7n s LEU 126 Ca 0.63 -0.15 -0.08 0.00 -1.03 0.00 0.00 54.13 53.50 3g7n s LEU 126 Cb -0.06 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 44.04 3g7n s LEU 126 CO 0.41 0.20 0.16 -1.83 0.23 0.00 0.00 176.35 175.53 3g7n s GLU 127 N -2.09 0.53 0.02 1.70 -1.05 -0.06 -1.84 118.70 115.89 3g7n s GLU 127 Ca 0.24 -0.40 0.02 0.00 -0.15 0.00 0.00 54.97 54.68 3g7n s GLU 127 Cb -0.12 0.22 -0.01 0.00 -0.44 0.00 0.00 34.13 33.78 3g7n s GLU 127 CO 0.16 -0.13 -0.08 0.00 0.95 0.00 0.00 175.26 176.16 3g7n s ALA 128 N -1.49 0.61 -0.00 -0.84 0.00 -0.93 -1.00 121.76 118.11 3g7n s ALA 128 Ca -0.14 -0.50 -0.23 0.00 0.00 0.00 0.00 51.96 51.09 3g7n s ALA 128 Cb -0.07 -0.08 0.05 0.00 0.00 0.00 0.00 23.12 23.02 3g7n s ALA 128 CO 0.01 0.09 0.52 0.54 0.00 0.00 0.00 175.76 176.93 3g7n s VAL 129 N -0.63 0.03 0.00 0.00 0.11 -0.22 -0.35 120.40 119.34 3g7n s VAL 129 Ca -0.02 -0.23 0.00 0.00 -2.93 0.00 0.00 61.98 58.81 3g7n s VAL 129 Cb -0.05 -0.90 0.00 0.00 -1.53 0.00 0.00 36.38 33.90 3g7n s VAL 129 CO 0.00 -0.13 0.00 0.61 -3.33 0.00 0.00 175.10 172.26 3g7n n GLY 130 N 0.78 0.79 3.38 6.54 0.00 -1.06 -0.78 105.19 114.84 3g7n n GLY 130 Ca -0.19 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 44.70 3g7n n GLY 130 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3g7n s HIS 131 N -2.00 2.43 0.00 1.61 2.46 -1.26 -0.69 115.29 117.85 3g7n s HIS 131 Ca 0.00 -0.35 0.00 0.00 0.47 0.00 0.00 55.06 55.18 3g7n s HIS 131 Cb 0.00 -1.49 0.00 0.00 -0.13 0.00 0.00 32.58 30.96 3g7n s HIS 131 CO 0.00 0.10 0.00 0.45 -2.47 0.00 0.00 174.74 172.82 3g7n n SER 132 N 2.07 0.00 -0.17 9.88 2.88 0.22 -0.51 113.62 127.99 3g7n n SER 132 Ca -0.16 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.47 3g7n n SER 132 Cb 0.52 0.00 0.40 0.00 -0.75 0.00 0.00 64.21 64.38 3g7n n SER 132 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3g7n h LEU 133 N 0.00 0.57 -1.71 2.46 5.85 -1.89 0.81 115.31 121.40 3g7n h LEU 133 Ca 0.00 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.75 3g7n h LEU 133 Cb 0.00 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 3g7n h LEU 133 CO 0.00 0.35 0.23 1.23 -0.34 0.00 0.00 178.44 179.90 3g7n h GLY 134 N 0.64 0.43 1.24 3.75 0.00 -0.86 0.13 103.07 108.40 3g7n h GLY 134 Ca 0.33 -0.15 -0.20 0.00 0.00 0.00 0.00 47.33 47.31 3g7n h GLY 134 CO -0.12 0.14 -0.64 -1.33 0.00 0.00 0.00 176.54 174.59 3g7n h GLY 135 N 0.39 0.85 0.99 4.60 0.00 -0.78 -1.35 103.07 107.77 3g7n h GLY 135 Ca 0.13 -1.07 -0.03 0.00 0.00 0.00 0.00 47.33 46.36 3g7n h GLY 135 CO -0.03 0.96 0.26 0.00 0.00 0.00 0.00 176.54 177.73 3g7n h ALA 136 N 0.70 0.76 -0.94 3.60 0.00 -0.69 -1.15 119.26 121.54 3g7n h ALA 136 Ca -0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3g7n h ALA 136 Cb 1.25 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 3g7n h ALA 136 CO 0.13 0.35 0.57 -0.07 0.00 0.00 0.00 179.25 180.23 3g7n h LEU 137 N 0.81 1.12 -1.64 0.00 3.38 -0.75 -2.22 115.31 116.01 3g7n h LEU 137 Ca 0.20 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 3g7n h LEU 137 Cb 0.16 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3g7n h LEU 137 CO -0.02 0.86 -0.18 0.74 0.09 0.00 0.00 178.44 179.93 3g7n h THR 138 N 1.29 1.13 0.00 0.22 2.02 -0.46 0.13 112.91 117.24 3g7n h THR 138 Ca 0.34 -0.62 -0.06 0.00 0.77 0.00 0.00 66.41 66.84 3g7n h THR 138 Cb -0.06 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 3g7n h THR 138 CO -0.06 0.18 -0.29 0.77 0.37 0.00 0.00 175.52 176.48 3g7n h SER 139 N 0.00 0.00 0.29 4.18 4.64 -0.60 -0.03 113.55 122.04 3g7n h SER 139 Ca -0.00 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.98 3g7n h SER 139 Cb 0.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 3g7n h SER 139 CO 0.02 0.29 -1.73 -0.29 -0.87 0.00 0.00 176.83 174.25 3g7n h ILE 140 N 0.00 0.93 -0.97 0.95 6.09 -1.31 -3.36 117.51 119.83 3g7n h ILE 140 Ca -0.00 -2.58 0.17 0.00 -1.37 0.00 0.00 64.86 61.07 3g7n h ILE 140 Cb 0.66 2.68 -0.09 0.00 0.47 0.00 0.00 36.82 40.54 3g7n h ILE 140 CO 0.04 0.82 0.61 0.00 -3.07 0.00 0.00 178.15 176.55 3g7n h ALA 141 N 0.31 1.73 -0.35 0.18 0.00 -0.39 -0.52 119.26 120.21 3g7n h ALA 141 Ca -0.32 0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.68 3g7n h ALA 141 Cb 2.05 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 19.68 3g7n h ALA 141 CO 0.15 -0.03 0.07 1.25 0.00 0.00 0.00 179.25 180.68 3g7n h HIS 142 N 0.77 0.11 -0.28 0.00 -0.00 -1.15 0.10 115.15 114.70 3g7n h HIS 142 Ca 0.52 0.02 -0.17 0.00 -0.00 0.00 0.00 60.37 60.74 3g7n h HIS 142 Cb 0.79 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.20 3g7n h HIS 142 CO -0.00 0.01 -0.50 0.28 -0.00 0.00 0.00 177.93 177.72 3g7n h VAL 143 N 0.19 1.29 -0.27 5.26 2.07 -1.46 -0.98 116.25 122.34 3g7n h VAL 143 Ca 0.17 -1.70 0.01 0.00 0.82 0.00 0.00 66.70 66.00 3g7n h VAL 143 Cb 0.19 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 3g7n h VAL 143 CO -0.22 0.55 0.16 0.00 0.02 0.00 0.00 177.57 178.08 3g7n h ALA 144 N 0.82 0.33 -0.27 1.67 0.00 -0.68 -1.08 119.26 120.05 3g7n h ALA 144 Ca 0.03 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3g7n h ALA 144 Cb 1.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3g7n h ALA 144 CO 0.11 -0.22 -0.13 -0.07 0.00 0.00 0.00 179.25 178.94 3g7n h LEU 145 N 0.33 0.58 -0.95 0.00 3.38 -0.76 -1.88 115.31 116.01 3g7n h LEU 145 Ca 0.10 -0.41 0.03 0.00 0.09 0.00 0.00 57.88 57.70 3g7n h LEU 145 Cb -0.01 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.52 3g7n h LEU 145 CO -0.04 0.86 0.62 0.00 0.09 0.00 0.00 178.44 179.97 3g7n h ALA 146 N 0.74 1.25 0.05 1.53 0.00 -0.98 0.43 119.26 122.27 3g7n h ALA 146 Ca 0.06 -0.05 -0.26 0.00 0.00 0.00 0.00 54.91 54.66 3g7n h ALA 146 Cb 0.64 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 18.10 3g7n h ALA 146 CO 0.04 0.52 -1.08 1.96 0.00 0.00 0.00 179.25 180.69 3g7n h GLN 147 N 1.22 0.51 0.00 0.00 1.08 -1.21 -3.13 115.11 113.58 3g7n h GLN 147 Ca 0.37 -0.61 -0.14 0.00 -1.45 0.00 0.00 58.65 56.83 3g7n h GLN 147 Cb -0.03 0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.57 3g7n h GLN 147 CO -0.11 1.23 -0.65 -0.91 -0.95 0.00 0.00 178.83 177.44 3g7n h ASN 148 N 0.26 0.00 -2.09 1.46 2.35 -1.21 -3.40 115.58 112.96 3g7n h ASN 148 Ca -0.12 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.07 3g7n h ASN 148 Cb 1.74 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 39.70 3g7n h ASN 148 CO 0.20 0.64 -0.93 0.49 -1.65 0.00 0.00 177.43 176.18 3g7n n PHE 149 N -3.26 1.40 0.57 1.19 3.72 0.13 -4.95 117.46 116.26 3g7n n PHE 149 Ca 0.01 -3.83 0.09 0.00 -0.05 0.00 0.00 57.45 53.67 3g7n n PHE 149 Cb 0.79 -0.44 0.39 0.00 -0.94 0.00 0.00 39.48 39.28 3g7n n PHE 149 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3g7n n PRO 150 N 0.76 0.04 -0.39 -1.08 -0.04 -1.18 -2.05 135.00 131.06 3g7n n PRO 150 Ca 0.26 0.24 0.08 0.00 -0.04 0.00 0.00 63.50 64.04 3g7n n PRO 150 Cb 0.51 -1.57 0.27 0.00 -0.04 0.00 0.00 33.50 32.67 3g7n n PRO 150 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3g7n n ASP 151 N -1.64 3.46 -4.43 3.54 5.75 -1.26 -4.89 116.55 117.09 3g7n n ASP 151 Ca 0.04 -2.17 -0.32 0.00 -0.01 0.00 0.00 54.79 52.33 3g7n n ASP 151 Cb 0.21 -0.45 -0.14 0.00 -1.03 0.00 0.00 41.12 39.72 3g7n n ASP 151 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3g7n s LYS 152 N -1.49 2.58 0.33 0.11 -0.14 -0.87 -5.11 119.74 115.15 3g7n s LYS 152 Ca 0.39 -0.74 -0.28 0.00 -1.36 0.00 0.00 55.97 53.98 3g7n s LYS 152 Cb 0.23 -2.35 -0.10 0.00 -1.68 0.00 0.00 37.83 33.93 3g7n s LYS 152 CO 0.23 0.54 1.21 -1.12 -0.76 0.00 0.00 175.35 175.46 3g7n s SER 153 N -0.53 6.87 -0.04 2.83 0.01 -1.26 -4.88 113.70 116.71 3g7n s SER 153 Ca 0.07 2.49 -0.01 0.00 1.31 0.00 0.00 55.95 59.81 3g7n s SER 153 Cb -0.11 -2.64 0.03 0.00 0.21 0.00 0.00 66.02 63.51 3g7n s SER 153 CO 0.01 -0.44 0.07 -0.22 0.41 0.00 0.00 173.24 173.07 3g7n s LEU 154 N -1.83 1.04 -0.05 2.44 2.96 -1.26 -0.51 118.68 121.47 3g7n s LEU 154 Ca 0.49 0.14 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 3g7n s LEU 154 Cb -0.36 0.11 0.02 0.00 0.50 0.00 0.00 46.19 46.46 3g7n s LEU 154 CO 0.46 -0.12 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.61 3g7n s VAL 155 N 0.98 0.73 -0.03 1.68 1.01 -0.77 -1.12 120.40 122.88 3g7n s VAL 155 Ca -0.08 -0.23 0.07 0.00 0.00 0.00 0.00 61.98 61.73 3g7n s VAL 155 Cb -0.11 -0.71 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 3g7n s VAL 155 CO -0.04 0.27 -0.23 -0.44 0.00 0.00 0.00 175.10 174.66 3g7n s SER 156 N 0.84 2.76 -0.32 3.32 0.01 0.29 -2.18 113.70 118.42 3g7n s SER 156 Ca -0.12 -0.44 0.02 0.00 1.31 0.00 0.00 55.95 56.72 3g7n s SER 156 Cb -0.15 -0.48 0.10 0.00 0.21 0.00 0.00 66.02 65.70 3g7n s SER 156 CO 0.01 0.26 0.06 0.20 0.41 0.00 0.00 173.24 174.18 3g7n s ASN 157 N -0.38 4.48 -0.25 2.44 0.01 0.53 -0.26 114.94 121.50 3g7n s ASN 157 Ca 0.04 -1.93 -0.18 0.00 -0.71 0.00 0.00 52.86 50.08 3g7n s ASN 157 Cb -0.11 -1.35 -0.03 0.00 0.41 0.00 0.00 41.25 40.18 3g7n s ASN 157 CO 0.01 -0.38 0.53 0.00 -1.51 0.00 0.00 177.10 175.74 3g7n s ALA 158 N 1.17 3.58 -0.17 0.60 0.00 -0.03 -2.56 121.76 124.35 3g7n s ALA 158 Ca 0.10 -0.55 -0.07 0.00 0.00 0.00 0.00 51.96 51.44 3g7n s ALA 158 Cb -0.18 -2.89 -0.04 0.00 0.00 0.00 0.00 23.12 20.01 3g7n s ALA 158 CO -0.14 -0.69 0.07 -0.51 0.00 0.00 0.00 175.76 174.50 3g7n s LEU 159 N 2.19 3.89 -1.39 0.00 1.43 0.13 -0.66 118.68 124.27 3g7n s LEU 159 Ca 0.22 0.14 -0.08 0.00 -1.03 0.00 0.00 54.13 53.38 3g7n s LEU 159 Cb -0.16 -1.98 0.03 0.00 0.03 0.00 0.00 46.19 44.12 3g7n s LEU 159 CO 0.09 0.21 1.00 0.59 0.23 0.00 0.00 176.35 178.47 3g7n n ASN 160 N 3.29 -4.27 -4.89 2.29 4.13 -0.45 -0.61 115.26 114.75 3g7n n ASN 160 Ca -0.17 -0.69 -0.35 0.00 1.68 0.00 0.00 54.58 55.06 3g7n n ASN 160 Cb 0.53 -4.46 -0.05 0.00 -1.54 0.00 0.00 39.78 34.25 3g7n n ASN 160 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3g7n s ALA 161 N -3.38 3.93 0.48 5.41 0.00 -1.26 -3.83 121.76 123.10 3g7n s ALA 161 Ca 0.43 -0.72 -0.13 0.00 0.00 0.00 0.00 51.96 51.53 3g7n s ALA 161 Cb -0.20 -1.91 -0.07 0.00 0.00 0.00 0.00 23.12 20.94 3g7n s ALA 161 CO 0.78 0.70 0.90 -0.59 0.00 0.00 0.00 175.76 177.55 3g7n s PHE 162 N -1.22 3.48 0.57 0.00 -0.12 -1.26 -3.89 117.98 115.54 3g7n s PHE 162 Ca 0.23 1.26 -0.16 0.00 -0.05 0.00 0.00 56.93 58.21 3g7n s PHE 162 Cb -0.12 -2.63 -0.05 0.00 -0.63 0.00 0.00 43.02 39.58 3g7n s PHE 162 CO 0.14 -0.29 1.03 -1.25 -0.05 0.00 0.00 175.22 174.80 3g7n s PRO 163 N -4.10 3.54 0.00 1.99 0.04 -1.26 -4.69 135.00 130.51 3g7n s PRO 163 Ca 0.55 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.70 3g7n s PRO 163 Cb -0.10 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.37 3g7n s PRO 163 CO 0.34 -0.62 0.45 0.44 0.04 0.00 0.00 177.00 177.64 3g7n n ILE 164 N -1.89 0.11 -3.04 0.56 -5.35 -1.26 -4.88 119.36 103.61 3g7n n ILE 164 Ca 0.08 -0.43 -0.00 0.00 -0.27 0.00 0.00 62.75 62.12 3g7n n ILE 164 Cb 0.53 1.15 0.00 0.00 -1.74 0.00 0.00 39.64 39.58 3g7n n ILE 164 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3g7n n GLY 165 N -0.06 1.94 3.47 3.28 0.00 -1.26 -0.43 105.19 112.13 3g7n n GLY 165 Ca 0.00 -1.01 -0.23 0.00 0.00 0.00 0.00 46.02 44.78 3g7n n GLY 165 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3g7n n ASN 166 N -0.98 0.82 -0.05 1.61 0.23 -0.86 -0.62 115.26 115.40 3g7n n ASN 166 Ca -0.00 -1.82 0.02 0.00 -0.53 0.00 0.00 54.58 52.25 3g7n n ASN 166 Cb 0.01 -0.70 0.34 0.00 -2.08 0.00 0.00 39.78 37.35 3g7n n ASN 166 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 3g7n h GLN 167 N 0.00 0.65 -0.45 -3.83 5.75 -1.91 -1.69 115.11 113.63 3g7n h GLN 167 Ca -0.33 -0.07 -0.07 0.00 -0.15 0.00 0.00 58.65 58.04 3g7n h GLN 167 Cb 1.08 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.48 3g7n h GLN 167 CO 0.30 0.49 -0.00 0.00 -2.65 0.00 0.00 178.83 176.97 3g7n h ALA 168 N 1.61 1.15 -0.08 3.38 0.00 -1.93 -0.25 119.26 123.15 3g7n h ALA 168 Ca 0.17 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3g7n h ALA 168 Cb 0.05 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3g7n h ALA 168 CO -0.03 0.55 0.04 2.35 0.00 0.00 0.00 179.25 182.17 3g7n h TRP 169 N 0.69 0.11 -0.78 0.00 2.91 -1.62 -0.51 115.95 116.74 3g7n h TRP 169 Ca 0.14 -0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.13 3g7n h TRP 169 Cb 0.43 -0.03 -0.04 0.00 -0.51 0.00 0.00 29.16 29.01 3g7n h TRP 169 CO 0.02 0.14 0.41 0.00 -1.03 0.00 0.00 178.44 177.98 3g7n h ALA 170 N 0.96 1.24 -0.60 2.65 0.00 -0.84 0.26 119.26 122.92 3g7n h ALA 170 Ca 0.03 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 3g7n h ALA 170 Cb 0.07 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3g7n h ALA 170 CO -0.00 0.60 0.02 -0.44 0.00 0.00 0.00 179.25 179.43 3g7n h ASP 171 N 1.10 0.99 -0.66 0.00 3.32 -0.82 -0.11 116.42 120.24 3g7n h ASP 171 Ca 0.27 -0.27 -0.07 0.00 0.02 0.00 0.00 57.03 56.99 3g7n h ASP 171 Cb 0.06 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 3g7n h ASP 171 CO -0.04 1.03 0.13 0.15 -1.72 0.00 0.00 179.24 178.80 3g7n h PHE 172 N 0.94 1.14 -0.48 4.55 3.57 -0.22 -0.89 116.94 125.55 3g7n h PHE 172 Ca 0.17 -0.15 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 3g7n h PHE 172 Cb 0.51 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 3g7n h PHE 172 CO 0.03 0.95 0.22 0.78 -2.23 0.00 0.00 178.31 178.07 3g7n h GLY 173 N 1.00 0.74 1.61 2.40 0.00 -0.61 -2.44 103.07 105.77 3g7n h GLY 173 Ca 0.20 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3g7n h GLY 173 CO 0.01 0.35 0.21 -0.84 0.00 0.00 0.00 176.54 176.27 3g7n h THR 174 N 0.62 1.12 0.00 4.70 2.02 -0.79 -2.50 112.91 118.09 3g7n h THR 174 Ca 0.16 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 67.00 3g7n h THR 174 Cb 0.13 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 3g7n h THR 174 CO -0.02 0.13 -0.21 0.00 0.37 0.00 0.00 175.52 175.79 3g7n h ALA 175 N 1.71 1.15 -2.81 6.16 0.00 -0.67 -3.44 119.26 121.35 3g7n h ALA 175 Ca 0.14 -0.19 -0.52 0.00 0.00 0.00 0.00 54.91 54.33 3g7n h ALA 175 Cb 0.01 -0.03 0.06 0.00 0.00 0.00 0.00 17.79 17.83 3g7n h ALA 175 CO -0.02 0.26 0.69 -0.65 0.00 0.00 0.00 179.25 179.53 3g7n s GLN 176 N -3.91 4.32 0.69 0.00 -1.52 -0.94 -4.99 119.66 113.31 3g7n s GLN 176 Ca -0.01 2.24 -0.16 0.00 -1.95 0.00 0.00 55.36 55.48 3g7n s GLN 176 Cb 0.12 -3.10 0.02 0.00 -0.22 0.00 0.00 33.01 29.83 3g7n s GLN 176 CO 0.63 -0.30 1.24 0.00 -0.25 0.00 0.00 175.29 176.61 3g7n s ALA 177 N -0.55 2.24 0.00 6.09 0.00 -1.26 -4.83 121.76 123.45 3g7n s ALA 177 Ca 0.54 1.01 0.00 0.00 0.00 0.00 0.00 51.96 53.51 3g7n s ALA 177 Cb -0.40 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.22 3g7n s ALA 177 CO 0.48 -1.72 0.00 0.41 0.00 0.00 0.00 175.76 174.92 3g7n n GLY 178 N 0.58 2.36 3.44 0.00 0.00 -1.26 -4.83 105.19 105.47 3g7n n GLY 178 Ca 0.14 -1.85 -0.37 0.00 0.00 0.00 0.00 46.02 43.95 3g7n n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g7n s THR 179 N -2.61 4.30 -0.27 2.61 2.01 -0.28 -5.01 115.64 116.39 3g7n s THR 179 Ca 0.00 -0.23 -0.09 0.00 0.31 0.00 0.00 61.69 61.68 3g7n s THR 179 Cb 0.00 -3.04 -0.03 0.00 0.01 0.00 0.00 72.50 69.44 3g7n s THR 179 CO 0.00 0.30 0.13 0.12 -0.69 0.00 0.00 174.62 174.48 3g7n s PHE 180 N 1.61 3.15 -0.07 4.92 5.36 -1.26 -0.55 117.98 131.13 3g7n s PHE 180 Ca 0.06 -0.28 0.01 0.00 -0.96 0.00 0.00 56.93 55.76 3g7n s PHE 180 Cb -0.15 -2.31 -0.03 0.00 -0.34 0.00 0.00 43.02 40.19 3g7n s PHE 180 CO 0.04 -0.32 -0.07 -0.80 -1.46 0.00 0.00 175.22 172.61 3g7n s ASN 181 N 1.66 4.61 -0.39 6.13 0.01 0.64 -1.18 114.94 126.43 3g7n s ASN 181 Ca 0.06 -0.04 -0.05 0.00 -0.71 0.00 0.00 52.86 52.12 3g7n s ASN 181 Cb -0.16 -1.20 0.08 0.00 0.41 0.00 0.00 41.25 40.39 3g7n s ASN 181 CO 0.07 0.35 0.18 -0.13 -1.51 0.00 0.00 177.10 176.06 3g7n s ARG 182 N -0.71 2.34 -0.34 -0.60 0.52 0.35 -0.85 118.95 119.67 3g7n s ARG 182 Ca 0.11 -1.55 -0.14 0.00 -0.52 0.00 0.00 55.73 53.62 3g7n s ARG 182 Cb -0.11 -3.58 -0.02 0.00 0.52 0.00 0.00 34.95 31.76 3g7n s ARG 182 CO 0.02 -0.93 0.32 0.20 0.02 0.00 0.00 175.30 174.93 3g7n s GLY 183 N 1.83 1.92 0.33 -3.53 0.00 0.16 -0.70 107.32 107.33 3g7n s GLY 183 Ca 0.03 -1.24 0.10 0.00 0.00 0.00 0.00 44.72 43.61 3g7n s GLY 183 CO -0.01 0.91 -0.12 -1.31 0.00 0.00 0.00 173.10 172.58 3g7n s ASN 184 N 1.73 3.72 0.14 1.64 0.01 0.04 -1.34 114.94 120.89 3g7n s ASN 184 Ca 0.10 -1.14 0.10 0.00 -0.71 0.00 0.00 52.86 51.21 3g7n s ASN 184 Cb -0.17 -0.35 -0.04 0.00 0.41 0.00 0.00 41.25 41.10 3g7n s ASN 184 CO 0.11 -0.14 -0.23 0.21 -1.51 0.00 0.00 177.10 175.54 3g7n s ASN 185 N -3.59 3.04 0.61 -1.22 2.47 -1.26 -2.56 114.94 112.42 3g7n s ASN 185 Ca 0.32 -0.77 -0.19 0.00 0.42 0.00 0.00 52.86 52.64 3g7n s ASN 185 Cb 0.00 -0.20 -0.04 0.00 -1.45 0.00 0.00 41.25 39.57 3g7n s ASN 185 CO 0.16 0.10 1.11 1.33 -3.72 0.00 0.00 177.10 176.08 3g7n n VAL 186 N 0.73 4.09 -1.66 -5.21 0.24 -0.90 -3.10 118.33 112.52 3g7n n VAL 186 Ca -0.17 -0.50 -0.14 0.00 -2.04 0.00 0.00 64.34 61.49 3g7n n VAL 186 Cb 0.54 -1.31 -0.05 0.00 -1.47 0.00 0.00 33.84 31.56 3g7n n VAL 186 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3g7n n LEU 187 N -1.12 -1.22 -4.07 1.34 4.77 -1.26 -4.19 117.00 111.25 3g7n n LEU 187 Ca 0.14 0.25 -0.32 0.00 -0.03 0.00 0.00 56.01 56.06 3g7n n LEU 187 Cb 0.47 -2.14 -0.16 0.00 -2.33 0.00 0.00 43.42 39.26 3g7n n LEU 187 CO 0.49 -0.58 -0.51 -0.62 -1.33 0.00 0.00 177.39 174.84 3g7n s ASP 188 N -2.71 2.93 0.00 -1.43 2.15 -1.18 -0.62 116.67 115.81 3g7n s ASP 188 Ca 0.00 -0.58 0.27 0.00 0.43 0.00 0.00 52.55 52.66 3g7n s ASP 188 Cb 0.00 -1.33 0.75 0.00 -0.30 0.00 0.00 42.92 42.04 3g7n s ASP 188 CO 0.00 -0.03 1.57 0.61 -0.17 0.00 0.00 175.17 177.15 3g7n n GLY 189 N 4.69 -0.07 0.31 2.66 0.00 -0.97 -4.47 105.19 107.35 3g7n n GLY 189 Ca -0.19 -0.48 -0.00 0.00 0.00 0.00 0.00 46.02 45.35 3g7n n GLY 189 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3g7n h VAL 190 N 2.29 1.19 0.00 1.61 2.07 -1.77 -0.90 116.25 120.74 3g7n h VAL 190 Ca 0.00 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 66.97 3g7n h VAL 190 Cb 0.59 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3g7n h VAL 190 CO 0.00 0.22 0.00 -2.65 0.02 0.00 0.00 177.57 175.16 3g7n n PRO 191 N -4.36 0.00 0.00 1.57 -0.02 -1.25 -1.74 135.00 129.21 3g7n n PRO 191 Ca 0.05 0.28 0.12 0.00 -2.02 0.00 0.00 63.50 61.93 3g7n n PRO 191 Cb 0.14 -1.50 0.20 0.00 -0.02 0.00 0.00 33.50 32.32 3g7n n PRO 191 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3g7n n ASN 192 N -1.50 1.89 -4.77 2.55 3.02 -0.43 -4.61 115.26 111.41 3g7n n ASN 192 Ca 0.03 -1.45 -0.40 0.00 -0.03 0.00 0.00 54.58 52.73 3g7n n ASN 192 Cb 0.14 0.21 -0.00 0.00 -0.61 0.00 0.00 39.78 39.52 3g7n n ASN 192 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3g7n s MET 193 N -2.31 4.04 -0.37 3.52 -1.94 -0.71 -3.16 119.30 118.38 3g7n s MET 193 Ca 0.25 2.28 0.00 0.00 -1.71 0.00 0.00 55.69 56.51 3g7n s MET 193 Cb 0.19 -2.85 0.00 0.00 2.01 0.00 0.00 34.83 34.18 3g7n s MET 193 CO 0.46 -0.48 0.00 0.66 -0.01 0.00 0.00 175.02 175.66 3g7n n TYR 194 N 0.29 0.00 0.90 -0.03 4.01 -1.26 -4.44 117.16 116.63 3g7n n TYR 194 Ca 0.03 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.89 3g7n n TYR 194 Cb 0.42 -1.02 0.33 0.00 -0.31 0.00 0.00 39.34 38.77 3g7n n TYR 194 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3g7n n SER 195 N 0.50 0.43 -4.74 7.72 3.41 -1.19 -1.13 113.62 118.62 3g7n n SER 195 Ca -0.03 0.04 -0.37 0.00 -0.26 0.00 0.00 58.87 58.25 3g7n n SER 195 Cb 0.17 -0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.18 3g7n n SER 195 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3g7n s SER 196 N -3.30 4.74 0.49 4.04 1.04 -1.26 -4.62 113.70 114.82 3g7n s SER 196 Ca 0.11 2.64 0.14 0.00 0.48 0.00 0.00 55.95 59.31 3g7n s SER 196 Cb 0.17 -2.62 1.15 0.00 0.10 0.00 0.00 66.02 64.81 3g7n s SER 196 CO 0.66 -1.92 2.11 -0.65 0.98 0.00 0.00 173.24 174.42 3g7n h PRO 197 N 0.71 0.13 0.00 4.02 0.11 -1.98 0.35 132.00 135.34 3g7n h PRO 197 Ca -0.51 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 3g7n h PRO 197 Cb 1.33 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 3g7n h PRO 197 CO 0.54 0.10 -0.08 -0.07 -0.21 0.00 0.00 178.00 178.28 3g7n h LEU 198 N 0.14 0.00 0.00 2.35 3.38 -1.97 -3.35 115.31 115.86 3g7n h LEU 198 Ca 0.04 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 3g7n h LEU 198 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3g7n h LEU 198 CO -0.01 0.08 -1.17 0.52 0.09 0.00 0.00 178.44 177.96 3g7n n VAL 199 N -3.17 1.44 -3.06 1.22 0.31 -0.63 -5.05 118.33 109.38 3g7n n VAL 199 Ca 0.01 0.07 -0.13 0.00 -0.01 0.00 0.00 64.34 64.29 3g7n n VAL 199 Cb 0.41 -2.16 0.04 0.00 -0.91 0.00 0.00 33.84 31.22 3g7n n VAL 199 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3g7n n ASN 200 N -4.28 -4.14 -4.82 4.52 5.15 0.12 -5.01 115.26 106.80 3g7n n ASN 200 Ca -0.19 -0.30 -0.32 0.00 -0.60 0.00 0.00 54.58 53.17 3g7n n ASN 200 Cb 0.53 -2.95 0.01 0.00 -0.53 0.00 0.00 39.78 36.83 3g7n n ASN 200 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 3g7n s PHE 201 N -3.17 3.15 -0.04 1.20 0.40 -0.29 -4.68 117.98 114.55 3g7n s PHE 201 Ca 0.29 1.48 0.03 0.00 -0.60 0.00 0.00 56.93 58.13 3g7n s PHE 201 Cb -0.13 -2.92 0.00 0.00 0.51 0.00 0.00 43.02 40.48 3g7n s PHE 201 CO 0.39 -0.94 -0.14 0.15 0.70 0.00 0.00 175.22 175.39 3g7n s LYS 202 N -4.27 1.50 0.61 0.44 -0.14 0.21 -4.64 119.74 113.45 3g7n s LYS 202 Ca 0.61 -0.48 -0.10 0.00 -1.36 0.00 0.00 55.97 54.65 3g7n s LYS 202 Cb -0.14 -1.32 -0.03 0.00 -1.68 0.00 0.00 37.83 34.67 3g7n s LYS 202 CO 0.39 0.16 1.00 -1.01 -0.76 0.00 0.00 175.35 175.13 3g7n s HIS 203 N 0.20 3.55 0.30 3.18 3.76 -1.26 -4.29 115.29 120.73 3g7n s HIS 203 Ca -0.06 1.14 0.03 0.00 -0.15 0.00 0.00 55.06 56.02 3g7n s HIS 203 Cb -0.11 -2.71 -0.04 0.00 1.11 0.00 0.00 32.58 30.83 3g7n s HIS 203 CO 0.02 -0.71 0.16 1.52 -0.85 0.00 0.00 174.74 174.87 3g7n s TYR 204 N -3.13 1.60 0.00 1.40 -0.85 -1.26 -4.84 117.35 110.27 3g7n s TYR 204 Ca 0.54 -1.37 0.00 0.00 -0.52 0.00 0.00 57.07 55.72 3g7n s TYR 204 Cb -0.11 -0.86 0.00 0.00 0.38 0.00 0.00 41.96 41.37 3g7n s TYR 204 CO 0.52 -0.52 0.00 0.41 -1.52 0.00 0.00 175.55 174.44 3g7n n GLY 205 N -0.58 -1.37 3.31 5.49 0.00 -1.26 -4.79 105.19 105.99 3g7n n GLY 205 Ca 0.01 -2.09 -0.34 0.00 0.00 0.00 0.00 46.02 43.60 3g7n n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g7n s THR 206 N 0.00 3.19 0.06 2.61 2.01 -0.32 -4.86 115.64 118.33 3g7n s THR 206 Ca 0.00 -0.57 -0.23 0.00 0.31 0.00 0.00 61.69 61.21 3g7n s THR 206 Cb 0.00 -2.42 -0.06 0.00 0.01 0.00 0.00 72.50 70.03 3g7n s THR 206 CO 0.00 0.46 0.68 -0.70 -0.69 0.00 0.00 174.62 174.37 3g7n s GLU 207 N 1.16 4.40 0.22 4.92 2.12 -1.26 -0.49 118.70 129.76 3g7n s GLU 207 Ca 0.02 0.91 0.11 0.00 0.36 0.00 0.00 54.97 56.37 3g7n s GLU 207 Cb -0.14 -3.31 -0.05 0.00 0.26 0.00 0.00 34.13 30.89 3g7n s GLU 207 CO -0.02 0.43 -0.20 0.71 -0.54 0.00 0.00 175.26 175.64 3g7n s TYR 208 N -0.51 2.13 -0.12 5.30 2.02 0.12 -0.57 117.35 125.73 3g7n s TYR 208 Ca 0.34 -0.40 -0.13 0.00 -0.37 0.00 0.00 57.07 56.51 3g7n s TYR 208 Cb -0.20 -1.00 0.03 0.00 -0.40 0.00 0.00 41.96 40.39 3g7n s TYR 208 CO 0.21 0.52 0.35 -0.47 -1.57 0.00 0.00 175.55 174.59 3g7n s TYR 209 N -2.17 -0.36 0.26 2.71 5.04 -0.69 -0.78 117.35 121.37 3g7n s TYR 209 Ca 0.23 0.85 -0.12 0.00 -2.44 0.00 0.00 57.07 55.59 3g7n s TYR 209 Cb -0.06 0.13 -0.00 0.00 0.35 0.00 0.00 41.96 42.38 3g7n s TYR 209 CO 0.10 -0.22 0.48 -1.54 -1.34 0.00 0.00 175.55 173.03 3g7n s SER 210 N -0.06 0.01 -0.27 4.32 1.04 -1.06 -0.86 113.70 116.82 3g7n s SER 210 Ca -0.02 -0.99 0.11 0.00 0.48 0.00 0.00 55.95 55.53 3g7n s SER 210 Cb -0.03 0.60 0.54 0.00 0.10 0.00 0.00 66.02 67.23 3g7n s SER 210 CO 0.01 -1.17 1.51 -1.54 0.98 0.00 0.00 173.24 173.03 3g7n n SER 211 N -0.51 3.20 0.00 7.02 3.41 -1.26 -2.12 113.62 123.36 3g7n n SER 211 Ca -0.02 -3.47 0.00 0.00 -0.26 0.00 0.00 58.87 55.12 3g7n n SER 211 Cb 0.62 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 3g7n n SER 211 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g7n n GLY 212 N -0.86 0.80 3.26 5.00 0.00 -1.26 -4.88 105.19 107.24 3g7n n GLY 212 Ca 0.32 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.19 3g7n n GLY 212 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g7n s THR 213 N -2.00 1.25 0.17 2.61 -4.23 -1.26 -3.54 115.64 108.64 3g7n s THR 213 Ca 0.00 -2.03 -0.13 0.00 -1.18 0.00 0.00 61.69 58.35 3g7n s THR 213 Cb 0.00 -1.82 0.07 0.00 1.34 0.00 0.00 72.50 72.09 3g7n s THR 213 CO 0.00 -0.68 1.79 -0.08 -0.54 0.00 0.00 174.62 175.11 3g7n h GLU 214 N 2.86 0.78 -0.11 3.99 4.81 -1.96 -2.80 114.58 122.15 3g7n h GLU 214 Ca -0.37 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 58.75 3g7n h GLU 214 Cb 1.20 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 3g7n h GLU 214 CO 0.61 0.58 -0.06 0.00 -0.73 0.00 0.00 179.01 179.41 3g7n h ALA 215 N 1.15 1.69 -0.01 2.92 0.00 -1.96 -1.98 119.26 121.07 3g7n h ALA 215 Ca 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3g7n h ALA 215 Cb 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3g7n h ALA 215 CO -0.03 0.23 -0.11 -1.13 0.00 0.00 0.00 179.25 178.21 3g7n n SER 216 N -4.37 0.80 -4.70 0.00 3.41 -1.07 -4.87 113.62 102.82 3g7n n SER 216 Ca -0.01 -0.90 -0.42 0.00 -0.26 0.00 0.00 58.87 57.28 3g7n n SER 216 Cb 0.20 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.12 3g7n n SER 216 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3g7n s THR 217 N -2.33 4.43 0.16 6.66 2.01 -0.75 -4.32 115.64 121.50 3g7n s THR 217 Ca 0.31 1.74 0.09 0.00 0.31 0.00 0.00 61.69 64.14 3g7n s THR 217 Cb 0.20 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 3g7n s THR 217 CO 0.45 0.05 -0.20 0.68 -0.69 0.00 0.00 174.62 174.91 3g7n s VAL 218 N 1.71 1.91 -0.23 3.82 -7.23 -0.04 -1.15 120.40 119.19 3g7n s VAL 218 Ca 0.54 -1.86 -0.12 0.00 -1.81 0.00 0.00 61.98 58.73 3g7n s VAL 218 Cb -0.24 -1.85 -0.05 0.00 0.56 0.00 0.00 36.38 34.81 3g7n s VAL 218 CO 0.24 -0.22 0.23 -0.75 -0.31 0.00 0.00 175.10 174.29 3g7n s LYS 219 N -2.58 4.09 0.36 4.82 2.20 -0.06 -1.70 119.74 126.87 3g7n s LYS 219 Ca 0.15 -0.13 -0.09 0.00 -0.36 0.00 0.00 55.97 55.54 3g7n s LYS 219 Cb -0.07 -3.55 -0.06 0.00 -1.51 0.00 0.00 37.83 32.64 3g7n s LYS 219 CO 0.07 0.01 0.69 0.00 -0.36 0.00 0.00 175.35 175.75 3g7n s GLU 221 N -3.68 3.94 2.10 0.00 2.02 -1.26 -4.57 118.70 117.24 3g7n s GLU 221 Ca 0.49 -0.08 0.00 0.00 0.02 0.00 0.00 54.97 55.40 3g7n s GLU 221 Cb -0.10 -3.68 0.00 0.00 0.10 0.00 0.00 34.13 30.45 3g7n s GLU 221 CO 0.30 -0.31 0.00 0.41 0.02 0.00 0.00 175.26 175.68 3g7n n GLY 222 N 4.78 -0.84 0.09 -1.39 0.00 -1.26 -3.54 105.19 103.03 3g7n n GLY 222 Ca -0.09 -1.15 -0.03 0.00 0.00 0.00 0.00 46.02 44.74 3g7n n GLY 222 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3g7n h GLN 223 N 0.00 0.00 -1.02 1.61 1.08 -1.93 -3.41 115.11 111.45 3g7n h GLN 223 Ca 0.00 0.00 -0.41 0.00 -1.45 0.00 0.00 58.65 56.79 3g7n h GLN 223 Cb 0.00 0.00 -0.41 0.00 -0.05 0.00 0.00 27.48 27.02 3g7n h GLN 223 CO 0.00 0.44 -1.04 0.54 -0.95 0.00 0.00 178.83 177.82 3g7n n ARG 224 N -3.01 1.99 -1.69 1.46 5.12 -1.26 -4.91 116.66 114.36 3g7n n ARG 224 Ca -0.10 -3.68 -0.44 0.00 -1.93 0.00 0.00 57.85 51.70 3g7n n ARG 224 Cb 0.91 -1.63 -0.04 0.00 -1.16 0.00 0.00 32.46 30.54 3g7n n ARG 224 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 3g7n n ASP 225 N -0.30 3.69 0.00 0.55 -0.08 -1.23 -4.75 116.55 114.43 3g7n n ASP 225 Ca 0.19 1.03 0.11 0.00 -1.51 0.00 0.00 54.79 54.60 3g7n n ASP 225 Cb 0.79 -1.50 0.54 0.00 2.34 0.00 0.00 41.12 43.29 3g7n n ASP 225 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3g7n n LYS 226 N 4.81 0.27 0.00 -0.67 4.76 -1.26 -1.17 118.16 124.91 3g7n n LYS 226 Ca 0.18 0.09 0.14 0.00 -2.87 0.00 0.00 58.31 55.84 3g7n n LYS 226 Cb 0.33 -1.50 0.53 0.00 -1.84 0.00 0.00 35.03 32.55 3g7n n LYS 226 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 3g7n n SER 227 N -1.31 0.55 0.00 4.39 7.64 -1.26 -3.46 113.62 120.16 3g7n n SER 227 Ca 0.10 -0.52 0.00 0.00 1.01 0.00 0.00 58.87 59.45 3g7n n SER 227 Cb 0.18 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 3g7n n SER 227 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3g7n h SER 229 N 0.00 0.15 -0.22 0.00 4.64 -1.90 -2.68 113.55 113.53 3g7n h SER 229 Ca 0.00 0.08 0.06 0.00 -0.47 0.00 0.00 61.79 61.46 3g7n h SER 229 Cb 0.00 0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 3g7n h SER 229 CO 0.00 0.10 0.19 0.00 -0.87 0.00 0.00 176.83 176.25 3g7n h ALA 230 N 1.40 2.05 -0.43 5.18 0.00 -1.85 -1.66 119.26 123.94 3g7n h ALA 230 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3g7n h ALA 230 Cb 0.35 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3g7n h ALA 230 CO -0.31 -0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.05 3g7n n GLY 231 N -1.51 1.68 0.24 0.00 0.00 -1.01 -4.60 105.19 100.00 3g7n n GLY 231 Ca 0.02 -0.71 0.14 0.00 0.00 0.00 0.00 46.02 45.48 3g7n n GLY 231 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3g7n n ASN 232 N 1.38 0.81 0.00 1.61 0.23 -0.63 -4.91 115.26 113.75 3g7n n ASN 232 Ca 0.20 -1.08 0.00 0.00 -0.53 0.00 0.00 54.58 53.17 3g7n n ASN 232 Cb 0.57 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 3g7n n ASN 232 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3g7n n GLY 233 N 1.17 0.43 3.77 4.83 0.00 -1.26 -4.88 105.19 109.25 3g7n n GLY 233 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 3g7n n GLY 233 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g7n s MET 234 N -0.47 2.81 -0.02 1.61 -1.94 -1.26 -5.08 119.30 114.95 3g7n s MET 234 Ca 0.00 -0.85 0.00 0.00 -1.71 0.00 0.00 55.69 53.13 3g7n s MET 234 Cb 0.00 -2.62 0.02 0.00 2.01 0.00 0.00 34.83 34.24 3g7n s MET 234 CO 0.00 0.50 0.02 -0.47 -0.01 0.00 0.00 175.02 175.06 3g7n s TYR 235 N -1.63 0.09 0.00 -0.03 5.04 -1.26 -4.41 117.35 115.14 3g7n s TYR 235 Ca 0.30 0.08 0.00 0.00 -2.44 0.00 0.00 57.07 55.01 3g7n s TYR 235 Cb -0.11 -0.24 0.00 0.00 0.35 0.00 0.00 41.96 41.97 3g7n s TYR 235 CO 0.22 -0.08 0.00 0.00 -1.34 0.00 0.00 175.55 174.35 3g7n n ALA 236 N 3.99 0.00 -2.64 3.97 0.00 -0.67 -4.60 120.51 120.57 3g7n n ALA 236 Ca -0.25 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.77 3g7n n ALA 236 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 3g7n n ALA 236 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3g7n s VAL 237 N 0.00 4.01 0.48 0.00 1.01 -1.26 -2.30 120.40 122.35 3g7n s VAL 237 Ca 0.00 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.51 3g7n s VAL 237 Cb 0.00 -4.95 -0.01 0.00 0.00 0.00 0.00 36.38 31.42 3g7n s VAL 237 CO 0.00 -1.81 0.22 0.42 0.00 0.00 0.00 175.10 173.93 3g7n s THR 238 N 4.78 1.82 0.42 3.92 -4.23 -1.26 -5.00 115.64 116.09 3g7n s THR 238 Ca 0.39 -1.68 0.10 0.00 -1.18 0.00 0.00 61.69 59.32 3g7n s THR 238 Cb -0.04 -2.50 0.30 0.00 1.34 0.00 0.00 72.50 71.59 3g7n s THR 238 CO -0.01 0.00 2.02 -0.65 -0.54 0.00 0.00 174.62 175.43 3g7n h PRO 239 N 1.16 0.48 0.00 3.99 0.11 -1.93 -1.07 132.00 134.75 3g7n h PRO 239 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3g7n h PRO 239 Cb 1.28 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3g7n h PRO 239 CO 0.66 0.32 0.00 0.41 -0.21 0.00 0.00 178.00 179.18 3g7n n GLY 240 N -1.49 -0.98 0.25 -0.55 0.00 0.20 -3.53 105.19 99.09 3g7n n GLY 240 Ca 0.07 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.09 3g7n n GLY 240 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3g7n h HIS 241 N 0.00 0.16 0.00 1.61 6.17 -1.35 -2.64 115.15 119.11 3g7n h HIS 241 Ca 0.00 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.07 3g7n h HIS 241 Cb 0.24 -0.05 0.00 0.00 2.52 0.00 0.00 27.41 30.12 3g7n h HIS 241 CO 0.00 0.25 0.00 1.51 0.71 0.00 0.00 177.93 180.40 3g7n n ILE 242 N -4.35 0.64 -4.35 6.26 3.06 -1.23 -4.82 119.36 114.55 3g7n n ILE 242 Ca -0.01 0.13 -0.24 0.00 -2.50 0.00 0.00 62.75 60.12 3g7n n ILE 242 Cb 0.21 -0.83 -0.12 0.00 0.54 0.00 0.00 39.64 39.44 3g7n n ILE 242 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3g7n s ALA 243 N -3.05 2.15 -0.16 1.51 0.00 -1.00 -0.64 121.76 120.58 3g7n s ALA 243 Ca 0.09 -1.48 -0.08 0.00 0.00 0.00 0.00 51.96 50.49 3g7n s ALA 243 Cb 0.13 -0.26 0.06 0.00 0.00 0.00 0.00 23.12 23.05 3g7n s ALA 243 CO 0.39 0.35 0.37 0.45 0.00 0.00 0.00 175.76 177.32 3g7n s SER 244 N -2.44 -0.43 -1.55 0.00 0.15 -0.19 -4.68 113.70 104.55 3g7n s SER 244 Ca 0.15 0.81 -0.08 0.00 0.70 0.00 0.00 55.95 57.53 3g7n s SER 244 Cb -0.08 0.72 0.07 0.00 -1.71 0.00 0.00 66.02 65.02 3g7n s SER 244 CO 0.07 -0.19 0.48 0.49 1.20 0.00 0.00 173.24 175.29 3g7n n PHE 245 N 4.34 -1.60 -0.58 3.44 3.72 -1.26 -1.07 117.46 124.44 3g7n n PHE 245 Ca -0.23 0.74 0.00 0.00 -0.05 0.00 0.00 57.45 57.91 3g7n n PHE 245 Cb 0.54 -3.23 0.00 0.00 -0.94 0.00 0.00 39.48 35.85 3g7n n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g7n n GLY 246 N -1.84 0.78 3.26 1.37 0.00 -1.23 -4.57 105.19 102.94 3g7n n GLY 246 Ca -0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 3g7n n GLY 246 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g7n s VAL 247 N -2.94 2.86 -0.22 1.61 1.01 -0.23 -5.07 120.40 117.42 3g7n s VAL 247 Ca 0.00 -0.68 -0.23 0.00 0.00 0.00 0.00 61.98 61.07 3g7n s VAL 247 Cb 0.00 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 3g7n s VAL 247 CO 0.00 0.48 0.75 -0.69 0.00 0.00 0.00 175.10 175.64 3g7n s VAL 248 N 1.20 4.91 0.30 2.92 1.01 -1.26 -1.03 120.40 128.46 3g7n s VAL 248 Ca 0.02 1.42 -0.28 0.00 0.00 0.00 0.00 61.98 63.14 3g7n s VAL 248 Cb -0.14 -4.05 -0.13 0.00 0.00 0.00 0.00 36.38 32.05 3g7n s VAL 248 CO -0.05 0.00 1.12 0.23 0.00 0.00 0.00 175.10 176.40 3g7n n MET 249 N 5.63 1.63 -0.45 2.72 2.81 0.19 -1.59 117.12 128.06 3g7n n MET 249 Ca 0.03 0.57 0.00 0.00 -1.81 0.00 0.00 57.70 56.49 3g7n n MET 249 Cb 0.48 -2.02 0.00 0.00 -0.71 0.00 0.00 33.22 30.97 3g7n n MET 249 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3g7n n LEU 250 N 1.10 0.00 -0.16 4.03 4.77 -1.26 -4.88 117.00 120.60 3g7n n LEU 250 Ca 0.08 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.12 3g7n n LEU 250 Cb 0.33 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.39 3g7n n LEU 250 CO 0.61 0.00 0.11 0.35 -1.33 0.00 0.00 177.39 177.13 3g7n n THR 251 N -2.00 0.00 0.23 -5.08 -2.24 -0.62 -4.41 114.28 100.16 3g7n n THR 251 Ca 0.00 -0.28 0.11 0.00 -2.27 0.00 0.00 64.05 61.61 3g7n n THR 251 Cb 0.00 1.08 0.49 0.00 -2.10 0.00 0.00 70.33 69.81 3g7n n THR 251 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g7n h ALA 252 N 2.09 1.02 -0.64 6.98 0.00 -1.90 -3.49 119.26 123.32 3g7n h ALA 252 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3g7n h ALA 252 Cb 0.38 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3g7n h ALA 252 CO 0.00 0.23 0.00 0.41 0.00 0.00 0.00 179.25 179.89 3g7n n GLY 253 N 0.12 1.05 0.00 0.00 0.00 -1.26 -4.45 105.19 100.65 3g7n n GLY 253 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3g7n n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g7n n GLY 255 N 0.32 0.62 0.36 0.00 0.00 -1.26 -0.63 105.19 104.59 3g7n n GLY 255 Ca 0.00 -0.76 0.06 0.00 0.00 0.00 0.00 46.02 45.32 3g7n n GLY 255 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3g7n h TYR 256 N 0.00 0.85 -0.37 1.61 0.05 -1.94 -2.75 116.97 114.41 3g7n h TYR 256 Ca -0.12 0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.62 3g7n h TYR 256 Cb 0.57 -0.28 -0.04 0.00 1.01 0.00 0.00 36.73 38.00 3g7n h TYR 256 CO 0.15 0.44 0.03 1.28 -1.05 0.00 0.00 178.16 179.02 3g7n n LEU 257 N -4.49 4.42 -0.62 3.88 4.77 -1.26 -5.17 117.00 118.52 3g7n n LEU 257 Ca 0.12 -3.17 0.08 0.00 -0.03 0.00 0.00 56.01 53.00 3g7n n LEU 257 Cb 0.23 -0.60 0.07 0.00 -2.33 0.00 0.00 43.42 40.78 3g7n n LEU 257 CO 0.33 0.79 0.50 -1.20 -1.33 0.00 0.00 177.39 176.48