#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 0.49 0.22 0.00 -1.32 -0.22 -4.96 115.64 109.85 3g7n s THR 2 Ca 0.00 -0.80 -0.32 0.00 -1.21 0.00 0.00 61.69 59.36 3g7n s THR 2 Cb 0.00 -0.52 -0.13 0.00 -1.51 0.00 0.00 72.50 70.34 3g7n s THR 2 CO 0.00 -0.22 1.50 0.00 -2.21 0.00 0.00 174.62 173.69 3g7n n ALA 3 N 1.95 1.45 -3.02 11.08 0.00 -1.26 -0.93 120.51 129.78 3g7n n ALA 3 Ca -0.20 0.42 -0.16 0.00 0.00 0.00 0.00 53.44 53.50 3g7n n ALA 3 Cb 0.56 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.67 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 2.66 -0.56 0.12 0.00 -0.08 -0.21 -4.70 116.55 113.78 3g7n n ASP 4 Ca 0.13 -3.16 0.10 0.00 -1.51 0.00 0.00 54.79 50.36 3g7n n ASP 4 Cb 0.31 0.32 0.60 0.00 2.34 0.00 0.00 41.12 44.69 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 3.33 2.05 0.00 -1.67 0.00 -1.75 -1.32 119.26 119.90 3g7n h ALA 5 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g7n h ALA 5 Cb 0.99 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3g7n h ALA 5 CO 0.38 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.52 3g7n h ALA 6 N 1.87 1.00 0.00 0.00 0.00 -1.92 -2.16 119.26 118.04 3g7n h ALA 6 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3g7n h ALA 6 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3g7n h ALA 6 CO -0.02 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.23 3g7n h ALA 7 N 2.11 1.00 -0.42 0.00 0.00 -1.63 -3.37 119.26 116.95 3g7n h ALA 7 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3g7n h ALA 7 Cb 0.32 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3g7n h ALA 7 CO 0.00 0.00 0.02 0.35 0.00 0.00 0.00 179.25 179.62 3g7n h PHE 8 N 0.00 0.78 -0.53 0.00 3.57 -1.53 -3.04 116.94 116.18 3g7n h PHE 8 Ca 0.00 -0.13 0.02 0.00 3.53 0.00 0.00 57.97 61.39 3g7n h PHE 8 Cb 0.74 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.25 3g7n h PHE 8 CO 0.00 0.78 0.34 -1.35 -2.23 0.00 0.00 178.31 175.84 3g7n h PRO 9 N 0.56 0.66 -0.16 6.41 0.11 -1.78 0.28 132.00 138.07 3g7n h PRO 9 Ca 0.12 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.09 3g7n h PRO 9 Cb 0.45 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 3g7n h PRO 9 CO 0.02 0.44 -0.35 -0.44 -0.21 0.00 0.00 178.00 177.45 3g7n h ASP 10 N 0.68 0.35 0.63 -2.05 3.32 -1.83 -1.50 116.42 116.02 3g7n h ASP 10 Ca 0.21 -0.14 -0.18 0.00 0.02 0.00 0.00 57.03 56.94 3g7n h ASP 10 Cb -0.03 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 3g7n h ASP 10 CO -0.07 0.69 -0.80 -0.07 -1.72 0.00 0.00 179.24 177.27 3g7n h LEU 11 N 0.29 0.16 -0.51 1.55 3.38 -1.25 -1.20 115.31 117.74 3g7n h LEU 11 Ca 0.03 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 3g7n h LEU 11 Cb 0.77 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 3g7n h LEU 11 CO 0.06 0.89 0.11 -0.74 0.09 0.00 0.00 178.44 178.86 3g7n h HIS 12 N 0.08 0.87 -0.71 1.13 2.76 -0.28 -0.13 115.15 118.87 3g7n h HIS 12 Ca -0.03 -0.11 -0.01 0.00 -2.20 0.00 0.00 60.37 58.02 3g7n h HIS 12 Cb 1.40 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 30.08 3g7n h HIS 12 CO 0.02 0.78 0.39 -0.09 -1.30 0.00 0.00 177.93 177.72 3g7n h ARG 13 N 0.72 1.00 -0.91 5.26 2.43 -1.16 -1.18 114.38 120.53 3g7n h ARG 13 Ca 0.16 -0.12 0.05 0.00 -0.81 0.00 0.00 59.98 59.26 3g7n h ARG 13 Cb 0.35 -0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 29.65 3g7n h ARG 13 CO 0.00 0.75 0.58 0.00 -1.51 0.00 0.00 179.97 179.79 3g7n h ALA 14 N 1.19 1.23 -0.57 2.80 0.00 -0.77 -0.77 119.26 122.37 3g7n h ALA 14 Ca 0.25 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 3g7n h ALA 14 Cb 0.04 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3g7n h ALA 14 CO -0.04 0.38 0.02 0.00 0.00 0.00 0.00 179.25 179.61 3g7n h ALA 15 N 1.40 0.96 -0.66 0.00 0.00 -0.54 -0.38 119.26 120.05 3g7n h ALA 15 Ca 0.38 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3g7n h ALA 15 Cb 0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3g7n h ALA 15 CO -0.15 0.63 0.20 0.87 0.00 0.00 0.00 179.25 180.80 3g7n h LYS 16 N 0.89 1.02 -0.67 0.00 1.57 -0.42 -0.46 116.57 118.51 3g7n h LYS 16 Ca 0.17 -0.22 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 3g7n h LYS 16 Cb 0.50 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 3g7n h LYS 16 CO 0.02 0.90 0.13 -0.07 -0.57 0.00 0.00 179.45 179.87 3g7n h LEU 17 N 0.95 1.03 -0.71 2.94 3.38 -0.98 -0.59 115.31 121.34 3g7n h LEU 17 Ca 0.21 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 3g7n h LEU 17 Cb 0.31 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3g7n h LEU 17 CO -0.01 1.01 0.15 0.28 0.09 0.00 0.00 178.44 179.96 3g7n h SER 18 N 1.02 1.08 -0.60 -0.43 0.02 -0.81 -1.95 113.55 111.88 3g7n h SER 18 Ca 0.21 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 3g7n h SER 18 Cb 0.40 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 3g7n h SER 18 CO 0.01 1.05 0.29 -1.28 -1.14 0.00 0.00 176.83 175.76 3g7n h SER 19 N 1.07 0.79 -0.55 3.07 0.87 -0.74 -2.58 113.55 115.48 3g7n h SER 19 Ca 0.22 -0.13 0.04 0.00 -1.23 0.00 0.00 61.79 60.69 3g7n h SER 19 Cb 0.41 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 3g7n h SER 19 CO 0.01 0.69 0.37 0.00 -0.53 0.00 0.00 176.83 177.37 3g7n h ALA 20 N 1.12 1.78 -0.50 6.23 0.00 -0.64 -0.25 119.26 127.00 3g7n h ALA 20 Ca 0.21 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 3g7n h ALA 20 Cb 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3g7n h ALA 20 CO -0.03 0.14 0.10 0.00 0.00 0.00 0.00 179.25 179.47 3g7n h ALA 21 N 1.69 0.67 -0.78 0.00 0.00 -0.97 -0.86 119.26 119.00 3g7n h ALA 21 Ca 0.23 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3g7n h ALA 21 Cb 0.18 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3g7n h ALA 21 CO -0.06 0.38 0.40 1.88 0.00 0.00 0.00 179.25 181.86 3g7n h TYR 22 N 0.70 1.09 0.00 0.00 0.05 -0.96 -2.89 116.97 114.96 3g7n h TYR 22 Ca 0.16 -0.04 -0.05 0.00 0.05 0.00 0.00 58.73 58.85 3g7n h TYR 22 Cb 0.37 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 3g7n h TYR 22 CO 0.03 0.78 -0.22 1.15 -1.05 0.00 0.00 178.16 178.84 3g7n h THR 23 N 1.08 1.16 -1.75 -2.88 2.02 -0.76 -3.47 112.91 108.31 3g7n h THR 23 Ca 0.27 -0.77 -0.10 0.00 0.77 0.00 0.00 66.41 66.58 3g7n h THR 23 Cb 0.07 1.42 0.02 0.00 -1.74 0.00 0.00 68.15 67.92 3g7n h THR 23 CO -0.04 0.22 -0.15 0.61 0.37 0.00 0.00 175.52 176.53 3g7n n GLY 24 N -0.89 0.48 3.53 2.16 0.00 -0.36 -4.98 105.19 105.13 3g7n n GLY 24 Ca -0.02 -0.52 -0.51 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.34 5.20 0.00 0.00 1.01 -1.26 -4.69 121.20 121.12 3g7n s ILE 26 Ca 0.75 0.70 0.00 0.00 0.00 0.00 0.00 60.65 62.10 3g7n s ILE 26 Cb -0.95 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 37.84 3g7n s ILE 26 CO 0.54 0.46 0.00 0.61 0.00 0.00 0.00 174.94 176.56 3g7n n GLY 27 N 2.68 1.59 3.12 6.18 0.00 -1.26 -4.82 105.19 112.67 3g7n n GLY 27 Ca -0.12 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 3g7n n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g7n s LYS 28 N 0.00 0.46 -0.37 1.61 1.02 -1.26 -1.18 119.74 120.02 3g7n s LYS 28 Ca 0.00 -0.26 0.03 0.00 0.02 0.00 0.00 55.97 55.76 3g7n s LYS 28 Cb 0.00 0.20 0.11 0.00 -0.52 0.00 0.00 37.83 37.61 3g7n s LYS 28 CO 0.00 -0.11 0.10 0.00 -0.92 0.00 0.00 175.35 174.42 3g7n s ALA 29 N -1.12 2.71 0.00 5.17 0.00 0.26 -4.82 121.76 123.96 3g7n s ALA 29 Ca -0.12 -2.53 0.00 0.00 0.00 0.00 0.00 51.96 49.31 3g7n s ALA 29 Cb -0.06 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.11 3g7n s ALA 29 CO 0.02 -1.76 0.00 1.19 0.00 0.00 0.00 175.76 175.21 3g7n n PHE 30 N 4.11 0.00 1.80 0.00 3.72 0.20 -1.05 117.46 126.24 3g7n n PHE 30 Ca 0.03 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.59 3g7n n PHE 30 Cb 0.40 0.00 0.85 0.00 -0.94 0.00 0.00 39.48 39.79 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 5.04 0.17 -4.63 4.37 5.75 -1.26 -4.72 116.55 121.26 3g7n n ASP 31 Ca 0.00 -0.85 -0.39 0.00 -0.01 0.00 0.00 54.79 53.54 3g7n n ASP 31 Cb 0.00 -0.06 -0.08 0.00 -1.03 0.00 0.00 41.12 39.95 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 -2.15 5.15 -0.19 2.12 1.01 -0.22 -4.27 120.40 121.86 3g7n s VAL 32 Ca 0.42 0.71 -0.27 0.00 0.00 0.00 0.00 61.98 62.84 3g7n s VAL 32 Cb 0.21 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.84 3g7n s VAL 32 CO 0.39 0.17 0.92 -0.89 0.00 0.00 0.00 175.10 175.69 3g7n s THR 33 N 1.89 4.80 -0.19 3.92 2.01 0.65 -0.58 115.64 128.15 3g7n s THR 33 Ca 0.18 1.80 -0.26 0.00 0.31 0.00 0.00 61.69 63.72 3g7n s THR 33 Cb -0.15 -4.21 -0.01 0.00 0.01 0.00 0.00 72.50 68.14 3g7n s THR 33 CO 0.09 -0.05 0.85 -0.63 -0.69 0.00 0.00 174.62 174.20 3g7n s ILE 34 N 2.51 4.85 -0.17 1.82 1.01 -0.32 -1.42 121.20 129.47 3g7n s ILE 34 Ca 0.41 1.66 0.12 0.00 0.00 0.00 0.00 60.65 62.85 3g7n s ILE 34 Cb -0.16 -4.15 -0.18 0.00 0.01 0.00 0.00 42.46 37.98 3g7n s ILE 34 CO 0.11 -0.01 0.34 1.33 0.00 0.00 0.00 174.94 176.71 3g7n n VAL 35 N 4.88 0.00 -3.70 2.92 0.24 -0.02 -4.81 118.33 117.84 3g7n n VAL 35 Ca 0.05 -0.27 -0.12 0.00 -2.04 0.00 0.00 64.34 61.97 3g7n n VAL 35 Cb 0.48 0.43 -0.12 0.00 -1.47 0.00 0.00 33.84 33.16 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 -2.67 0.23 -0.28 7.34 2.47 -0.72 -5.01 119.74 121.10 3g7n s LYS 36 Ca -0.02 0.67 -0.20 0.00 -1.56 0.00 0.00 55.97 54.87 3g7n s LYS 36 Cb 0.08 -0.05 -0.02 0.00 -1.46 0.00 0.00 37.83 36.39 3g7n s LYS 36 CO 0.52 -0.21 0.59 1.03 0.16 0.00 0.00 175.35 177.44 3g7n s ARG 37 N 1.72 4.01 -0.17 4.03 0.52 -1.26 -0.88 118.95 126.92 3g7n s ARG 37 Ca -0.06 0.38 -0.20 0.00 -0.52 0.00 0.00 55.73 55.33 3g7n s ARG 37 Cb -0.11 -3.68 -0.03 0.00 0.52 0.00 0.00 34.95 31.65 3g7n s ARG 37 CO -0.10 -0.46 0.60 0.42 0.02 0.00 0.00 175.30 175.79 3g7n s ILE 38 N 2.48 5.06 -0.17 1.52 -1.09 0.13 -4.99 121.20 124.14 3g7n s ILE 38 Ca 0.24 1.15 -0.06 0.00 -2.23 0.00 0.00 60.65 59.75 3g7n s ILE 38 Cb -0.15 -3.92 0.08 0.00 -1.58 0.00 0.00 42.46 36.88 3g7n s ILE 38 CO 0.10 0.17 0.36 -0.47 -1.23 0.00 0.00 174.94 173.87 3g7n s TYR 39 N 1.54 -0.65 -0.24 3.97 5.04 -1.25 -1.62 117.35 124.14 3g7n s TYR 39 Ca 0.29 1.30 0.01 0.00 -2.44 0.00 0.00 57.07 56.23 3g7n s TYR 39 Cb -0.16 0.18 0.04 0.00 0.35 0.00 0.00 41.96 42.37 3g7n s TYR 39 CO 0.11 -0.42 -0.11 0.34 -1.34 0.00 0.00 175.55 174.12 3g7n s ASP 40 N 2.45 4.17 0.15 4.32 2.15 -0.05 -4.98 116.67 124.89 3g7n s ASP 40 Ca -0.01 -1.14 -0.13 0.00 0.43 0.00 0.00 52.55 51.70 3g7n s ASP 40 Cb -0.12 -1.57 0.03 0.00 -0.30 0.00 0.00 42.92 40.96 3g7n s ASP 40 CO -0.11 -0.14 1.64 0.25 -0.17 0.00 0.00 175.17 176.64 3g7n h LEU 41 N 7.87 0.79 -0.25 -1.34 6.46 -1.95 0.14 115.31 127.02 3g7n h LEU 41 Ca -0.27 -0.25 -0.00 0.00 -0.12 0.00 0.00 57.88 57.23 3g7n h LEU 41 Cb 1.07 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.78 3g7n h LEU 41 CO 0.52 0.84 0.14 0.58 -0.62 0.00 0.00 178.44 179.90 3g7n h VAL 42 N 0.71 1.11 -0.27 1.05 2.07 -1.97 -2.07 116.25 116.88 3g7n h VAL 42 Ca 0.15 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.40 3g7n h VAL 42 Cb 0.37 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 3g7n h VAL 42 CO 0.01 0.10 0.00 0.35 0.02 0.00 0.00 177.57 178.05 3g7n n THR 43 N -4.87 0.34 -4.41 2.57 -2.24 -1.17 -4.95 114.28 99.55 3g7n n THR 43 Ca -0.03 -0.54 -0.36 0.00 -2.27 0.00 0.00 64.05 60.84 3g7n n THR 43 Cb 0.06 0.72 -0.09 0.00 -2.10 0.00 0.00 70.33 68.93 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 0.94 -0.45 -4.72 3.42 2.03 0.40 -4.95 116.55 113.21 3g7n n ASP 44 Ca 0.18 -1.25 -0.37 0.00 0.52 0.00 0.00 54.79 53.86 3g7n n ASP 44 Cb 0.48 -1.66 -0.06 0.00 -0.72 0.00 0.00 41.12 39.15 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 -3.83 5.24 0.03 5.18 2.01 -0.76 -4.90 115.64 118.61 3g7n s THR 45 Ca 0.40 0.76 0.04 0.00 0.31 0.00 0.00 61.69 63.20 3g7n s THR 45 Cb -0.23 -3.73 -0.02 0.00 0.01 0.00 0.00 72.50 68.53 3g7n s THR 45 CO 1.01 0.35 -0.12 0.20 -0.69 0.00 0.00 174.62 175.38 3g7n s ASN 46 N 0.57 1.35 0.00 3.53 0.01 -1.26 -0.87 114.94 118.27 3g7n s ASN 46 Ca 0.21 -0.38 0.00 0.00 -0.71 0.00 0.00 52.86 51.98 3g7n s ASN 46 Cb -0.14 -0.09 0.00 0.00 0.41 0.00 0.00 41.25 41.43 3g7n s ASN 46 CO 0.07 0.02 0.00 0.61 -1.51 0.00 0.00 177.10 176.29 3g7n n GLY 47 N 2.12 0.62 3.08 0.66 0.00 -0.64 -0.75 105.19 110.28 3g7n n GLY 47 Ca -0.17 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.48 0.73 -0.00 1.61 0.08 0.62 -0.70 117.98 117.85 3g7n s PHE 48 Ca 0.00 -0.55 0.07 0.00 0.12 0.00 0.00 56.93 56.57 3g7n s PHE 48 Cb 0.00 -0.43 -0.02 0.00 -0.57 0.00 0.00 43.02 42.00 3g7n s PHE 48 CO 0.00 -0.08 -0.21 0.08 -0.10 0.00 0.00 175.22 174.91 3g7n s VAL 49 N -1.64 1.65 0.00 -0.44 1.01 -0.06 -0.88 120.40 120.03 3g7n s VAL 49 Ca -0.07 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 60.95 3g7n s VAL 49 Cb -0.08 -1.38 0.00 0.00 0.00 0.00 0.00 36.38 34.92 3g7n s VAL 49 CO -0.00 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.11 3g7n n GLY 50 N 2.40 1.23 3.07 4.51 0.00 -0.57 -0.84 105.19 114.99 3g7n n GLY 50 Ca -0.16 -0.66 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.43 0.61 -0.19 1.61 -0.85 -0.51 -0.72 117.35 114.87 3g7n s TYR 51 Ca 0.00 -0.63 0.01 0.00 -0.52 0.00 0.00 57.07 55.94 3g7n s TYR 51 Cb 0.00 -0.38 0.03 0.00 0.38 0.00 0.00 41.96 41.99 3g7n s TYR 51 CO 0.00 -0.14 -0.17 0.45 -1.52 0.00 0.00 175.55 174.17 3g7n s SER 52 N -1.92 3.32 0.28 -0.18 0.15 0.49 -0.25 113.70 115.59 3g7n s SER 52 Ca -0.06 -0.78 0.13 0.00 0.70 0.00 0.00 55.95 55.93 3g7n s SER 52 Cb -0.06 -1.42 0.35 0.00 -1.71 0.00 0.00 66.02 63.18 3g7n s SER 52 CO -0.02 -0.06 1.59 0.71 1.20 0.00 0.00 173.24 176.67 3g7n h THR 53 N 6.14 1.29 -0.21 6.45 1.35 -1.85 0.26 112.91 126.35 3g7n h THR 53 Ca -0.38 -2.13 -0.02 0.00 -0.55 0.00 0.00 66.41 63.32 3g7n h THR 53 Cb 1.12 2.19 -0.01 0.00 -1.73 0.00 0.00 68.15 69.72 3g7n h THR 53 CO 0.58 0.58 0.05 -0.08 -0.25 0.00 0.00 175.52 176.40 3g7n h GLU 54 N 0.00 0.33 0.00 4.72 4.81 -1.94 -3.16 114.58 119.35 3g7n h GLU 54 Ca -0.01 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3g7n h GLU 54 Cb 1.14 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.48 3g7n h GLU 54 CO 0.08 0.45 -0.92 1.63 -0.73 0.00 0.00 179.01 179.52 3g7n n LYS 55 N -4.76 0.28 -3.44 1.92 4.76 -1.20 -4.98 118.16 110.73 3g7n n LYS 55 Ca -0.04 0.02 -0.18 0.00 -2.87 0.00 0.00 58.31 55.24 3g7n n LYS 55 Cb 0.17 -1.61 0.07 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 -1.98 -4.61 -4.27 1.97 5.02 0.86 -4.88 118.16 110.28 3g7n n LYS 56 Ca 0.02 0.79 -0.17 0.00 -2.02 0.00 0.00 58.31 56.93 3g7n n LYS 56 Cb 0.43 -5.61 -0.11 0.00 -0.02 0.00 0.00 35.03 29.72 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 -3.43 1.40 -0.19 -0.18 -4.23 -0.89 -1.08 115.64 107.03 3g7n s THR 57 Ca 0.17 -1.90 -0.03 0.00 -1.18 0.00 0.00 61.69 58.75 3g7n s THR 57 Cb -0.03 -1.72 -0.01 0.00 1.34 0.00 0.00 72.50 72.08 3g7n s THR 57 CO 0.76 -0.52 -0.06 -0.63 -0.54 0.00 0.00 174.62 173.63 3g7n s ILE 58 N -2.56 3.45 0.02 2.99 1.01 0.68 -0.38 121.20 126.41 3g7n s ILE 58 Ca 0.14 -0.49 0.07 0.00 0.00 0.00 0.00 60.65 60.37 3g7n s ILE 58 Cb -0.02 -2.54 -0.03 0.00 0.01 0.00 0.00 42.46 39.88 3g7n s ILE 58 CO 0.03 0.46 -0.20 0.00 0.00 0.00 0.00 174.94 175.23 3g7n s ALA 59 N 1.02 2.48 -0.21 9.38 0.00 0.10 -1.06 121.76 133.46 3g7n s ALA 59 Ca 0.00 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 50.81 3g7n s ALA 59 Cb -0.15 -0.70 0.03 0.00 0.00 0.00 0.00 23.12 22.30 3g7n s ALA 59 CO 0.00 0.56 -0.15 0.08 0.00 0.00 0.00 175.76 176.25 3g7n s VAL 60 N -0.82 2.29 -0.21 0.00 1.01 -0.20 -1.51 120.40 120.95 3g7n s VAL 60 Ca 0.13 -1.11 0.02 0.00 0.00 0.00 0.00 61.98 61.02 3g7n s VAL 60 Cb -0.10 -2.10 0.04 0.00 0.00 0.00 0.00 36.38 34.22 3g7n s VAL 60 CO 0.03 0.34 -0.16 -0.63 0.00 0.00 0.00 175.10 174.67 3g7n s ILE 61 N 1.26 2.11 -0.07 2.22 1.01 -0.06 -1.02 121.20 126.64 3g7n s ILE 61 Ca 0.01 -1.23 -0.03 0.00 0.00 0.00 0.00 60.65 59.40 3g7n s ILE 61 Cb -0.15 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 3g7n s ILE 61 CO -0.09 0.30 0.08 -0.04 0.00 0.00 0.00 174.94 175.19 3g7n s MET 62 N 1.21 3.19 0.33 2.79 -1.94 -0.07 -0.27 119.30 124.54 3g7n s MET 62 Ca -0.01 -0.32 -0.18 0.00 -1.71 0.00 0.00 55.69 53.47 3g7n s MET 62 Cb -0.16 -2.97 -0.09 0.00 2.01 0.00 0.00 34.83 33.62 3g7n s MET 62 CO -0.10 0.72 0.80 0.50 -0.01 0.00 0.00 175.02 176.93 3g7n s ARG 63 N -1.20 4.14 0.00 2.03 3.52 0.07 -3.94 118.95 123.57 3g7n s ARG 63 Ca 0.17 0.86 0.00 0.00 -0.13 0.00 0.00 55.73 56.63 3g7n s ARG 63 Cb -0.12 -2.48 0.00 0.00 -1.56 0.00 0.00 34.95 30.79 3g7n s ARG 63 CO 0.07 0.16 0.00 0.41 -0.81 0.00 0.00 175.30 175.13 3g7n n GLY 64 N -0.17 -1.36 3.79 8.12 0.00 -1.18 -3.38 105.19 111.00 3g7n n GLY 64 Ca 0.03 -1.61 -0.34 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.12 5.64 0.20 1.61 0.01 -1.26 -4.80 113.70 113.98 3g7n s SER 65 Ca 0.00 1.97 -0.11 0.00 1.31 0.00 0.00 55.95 59.12 3g7n s SER 65 Cb 0.00 -2.55 0.19 0.00 0.21 0.00 0.00 66.02 63.86 3g7n s SER 65 CO 0.00 -1.26 1.81 0.71 0.41 0.00 0.00 173.24 174.91 3g7n h THR 66 N 0.66 1.00 -3.43 1.44 1.35 -1.95 -3.37 112.91 108.60 3g7n h THR 66 Ca -0.48 -0.23 -0.64 0.00 -0.55 0.00 0.00 66.41 64.52 3g7n h THR 66 Cb 1.24 0.28 -0.40 0.00 -1.73 0.00 0.00 68.15 67.54 3g7n h THR 66 CO 0.56 0.12 -0.69 -0.89 -0.25 0.00 0.00 175.52 174.38 3g7n s THR 67 N -6.11 2.18 0.47 6.82 2.01 -1.26 -4.99 115.64 114.76 3g7n s THR 67 Ca -0.13 -2.70 0.19 0.00 0.31 0.00 0.00 61.69 59.36 3g7n s THR 67 Cb 0.15 -2.56 0.24 0.00 0.01 0.00 0.00 72.50 70.33 3g7n s THR 67 CO 0.75 -0.72 2.06 -0.29 -0.69 0.00 0.00 174.62 175.73 3g7n h ILE 68 N 5.97 0.93 0.00 1.82 6.09 -1.99 -2.53 117.51 127.80 3g7n h ILE 68 Ca -0.06 -0.44 -0.16 0.00 -1.37 0.00 0.00 64.86 62.83 3g7n h ILE 68 Cb 0.95 1.25 -0.02 0.00 0.47 0.00 0.00 36.82 39.47 3g7n h ILE 68 CO 0.58 0.12 -0.91 0.71 -3.07 0.00 0.00 178.15 175.58 3g7n h THR 69 N 0.00 1.07 0.00 2.19 1.35 -1.96 -3.37 112.91 112.19 3g7n h THR 69 Ca -0.00 -2.60 -0.10 0.00 -0.55 0.00 0.00 66.41 63.16 3g7n h THR 69 Cb 0.24 2.49 -0.02 0.00 -1.73 0.00 0.00 68.15 69.13 3g7n h THR 69 CO 0.02 0.61 -1.66 0.47 -0.25 0.00 0.00 175.52 174.70 3g7n n ASP 70 N -3.19 0.43 0.22 5.36 8.00 -0.98 -4.52 116.55 121.88 3g7n n ASP 70 Ca -0.02 0.18 0.07 0.00 0.71 0.00 0.00 54.79 55.73 3g7n n ASP 70 Cb 0.84 0.99 0.58 0.00 -0.02 0.00 0.00 41.12 43.51 3g7n n ASP 70 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 3g7n h PHE 71 N 0.00 0.05 0.00 1.24 -5.15 -1.66 -1.68 116.94 109.74 3g7n h PHE 71 Ca -0.13 -0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.62 3g7n h PHE 71 Cb 1.34 -0.02 -0.00 0.00 0.22 0.00 0.00 35.95 37.49 3g7n h PHE 71 CO 0.00 0.08 -0.11 -0.39 -2.00 0.00 0.00 178.31 175.89 3g7n h VAL 72 N 0.06 0.81 0.00 0.88 -1.51 -1.84 -2.28 116.25 112.37 3g7n h VAL 72 Ca 0.01 -0.41 0.00 0.00 -1.23 0.00 0.00 66.70 65.07 3g7n h VAL 72 Cb 0.07 1.24 0.00 0.00 -2.13 0.00 0.00 31.29 30.48 3g7n h VAL 72 CO 0.00 0.11 0.00 0.78 -1.23 0.00 0.00 177.57 177.23 3g7n h ASN 73 N 0.00 0.00 0.00 4.19 2.35 -1.61 -3.32 115.58 117.19 3g7n h ASN 73 Ca -0.00 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.59 3g7n h ASN 73 Cb 0.23 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.57 3g7n h ASN 73 CO 0.01 0.00 -1.81 0.47 -1.65 0.00 0.00 177.43 174.45 3g7n n ASP 74 N -3.01 1.78 -4.77 5.81 8.00 -1.01 -5.04 116.55 118.32 3g7n n ASP 74 Ca 0.03 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.12 3g7n n ASP 74 Cb 0.46 1.09 -0.01 0.00 -0.02 0.00 0.00 41.12 42.64 3g7n n ASP 74 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3g7n s ILE 75 N -2.53 2.46 -0.39 0.53 2.07 -0.89 -4.91 121.20 117.53 3g7n s ILE 75 Ca -0.06 0.46 -0.27 0.00 -1.41 0.00 0.00 60.65 59.37 3g7n s ILE 75 Cb 0.06 -3.29 0.02 0.00 0.13 0.00 0.00 42.46 39.37 3g7n s ILE 75 CO 0.55 0.11 1.00 -0.62 -1.91 0.00 0.00 174.94 174.06 3g7n s ASP 76 N -0.27 6.69 0.00 4.50 -1.08 -1.26 -4.91 116.67 120.34 3g7n s ASP 76 Ca 0.51 0.58 0.23 0.00 -0.52 0.00 0.00 52.55 53.35 3g7n s ASP 76 Cb -0.42 -2.49 0.63 0.00 -1.46 0.00 0.00 42.92 39.17 3g7n s ASP 76 CO 0.56 -0.97 1.50 2.30 0.52 0.00 0.00 175.17 179.07 3g7n n ILE 77 N 6.20 0.24 -1.71 4.11 -5.35 -1.26 -0.45 119.36 121.13 3g7n n ILE 77 Ca 0.09 -0.46 -0.43 0.00 -0.27 0.00 0.00 62.75 61.67 3g7n n ILE 77 Cb 0.48 0.70 -0.03 0.00 -1.74 0.00 0.00 39.64 39.05 3g7n n ILE 77 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3g7n n ALA 78 N 0.76 2.24 -2.69 -1.28 0.00 -1.26 -4.68 120.51 113.59 3g7n n ALA 78 Ca 0.17 0.41 -0.41 0.00 0.00 0.00 0.00 53.44 53.60 3g7n n ALA 78 Cb 0.44 -2.44 -0.04 0.00 0.00 0.00 0.00 19.45 17.42 3g7n n ALA 78 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3g7n s LEU 79 N 0.61 4.27 0.26 0.00 1.43 -1.26 -0.57 118.68 123.42 3g7n s LEU 79 Ca 0.73 1.38 0.08 0.00 -1.03 0.00 0.00 54.13 55.28 3g7n s LEU 79 Cb -0.56 -3.36 -0.05 0.00 0.03 0.00 0.00 46.19 42.25 3g7n s LEU 79 CO 0.39 -0.32 -0.12 0.27 0.23 0.00 0.00 176.35 176.81 3g7n s ILE 80 N 1.55 1.89 -0.29 -0.59 -5.25 -0.18 -4.89 121.20 113.44 3g7n s ILE 80 Ca 0.44 -2.21 -0.27 0.00 -0.99 0.00 0.00 60.65 57.61 3g7n s ILE 80 Cb -0.18 -2.31 0.01 0.00 2.95 0.00 0.00 42.46 42.93 3g7n s ILE 80 CO 0.19 -0.41 0.96 -0.89 -1.79 0.00 0.00 174.94 173.00 3g7n s THR 81 N -2.87 4.66 0.70 8.37 2.01 -1.26 -1.54 115.64 125.72 3g7n s THR 81 Ca 0.28 1.64 -0.11 0.00 0.31 0.00 0.00 61.69 63.80 3g7n s THR 81 Cb 0.01 -4.28 0.01 0.00 0.01 0.00 0.00 72.50 68.24 3g7n s THR 81 CO 0.11 -0.30 1.08 -2.16 -0.69 0.00 0.00 174.62 172.66 3g7n s PRO 82 N 3.27 2.91 -0.18 4.92 0.04 -1.26 -5.00 135.00 139.70 3g7n s PRO 82 Ca 0.40 0.63 -0.07 0.00 0.04 0.00 0.00 61.00 62.01 3g7n s PRO 82 Cb -0.14 -2.01 0.08 0.00 0.04 0.00 0.00 34.50 32.47 3g7n s PRO 82 CO 0.11 -1.03 0.39 -2.00 0.04 0.00 0.00 177.00 174.51 3g7n s GLU 83 N -5.23 0.31 -0.08 4.56 2.12 -1.26 -4.94 118.70 114.17 3g7n s GLU 83 Ca 0.58 0.94 -0.06 0.00 0.36 0.00 0.00 54.97 56.80 3g7n s GLU 83 Cb -0.12 0.21 0.03 0.00 0.26 0.00 0.00 34.13 34.51 3g7n s GLU 83 CO 0.53 -0.24 0.19 -0.51 -0.54 0.00 0.00 175.26 174.70 3g7n s LEU 84 N 2.35 1.01 0.24 2.70 1.43 -1.26 -5.00 118.68 120.15 3g7n s LEU 84 Ca -0.03 0.40 -0.31 0.00 -1.03 0.00 0.00 54.13 53.16 3g7n s LEU 84 Cb -0.11 0.63 -0.12 0.00 0.03 0.00 0.00 46.19 46.61 3g7n s LEU 84 CO -0.12 -0.10 1.60 -1.54 0.23 0.00 0.00 176.35 176.42 3g7n n SER 85 N 3.42 3.62 0.00 2.29 3.41 -1.26 -1.62 113.62 123.48 3g7n n SER 85 Ca -0.17 1.11 0.00 0.00 -0.26 0.00 0.00 58.87 59.55 3g7n n SER 85 Cb 0.56 -1.54 0.00 0.00 -0.26 0.00 0.00 64.21 62.98 3g7n n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g7n n GLY 86 N 2.90 1.06 3.39 5.00 0.00 -1.26 -4.92 105.19 111.36 3g7n n GLY 86 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.45 3.06 -0.44 1.61 1.01 -0.64 -4.10 120.40 117.45 3g7n s VAL 87 Ca 0.00 -0.67 -0.07 0.00 0.00 0.00 0.00 61.98 61.24 3g7n s VAL 87 Cb 0.00 -2.27 0.11 0.00 0.00 0.00 0.00 36.38 34.22 3g7n s VAL 87 CO 0.00 0.53 0.28 -0.89 0.00 0.00 0.00 175.10 175.02 3g7n s THR 88 N 0.21 3.88 0.23 3.92 2.01 -1.26 -4.62 115.64 120.01 3g7n s THR 88 Ca -0.08 -1.82 -0.21 0.00 0.31 0.00 0.00 61.69 59.88 3g7n s THR 88 Cb -0.15 -3.56 -0.08 0.00 0.01 0.00 0.00 72.50 68.71 3g7n s THR 88 CO 0.05 -0.70 0.76 -0.36 -0.69 0.00 0.00 174.62 173.68 3g7n s PHE 89 N 1.29 3.69 0.61 4.92 0.08 -1.26 -5.06 117.98 122.25 3g7n s PHE 89 Ca 0.06 1.48 -0.18 0.00 0.12 0.00 0.00 56.93 58.41 3g7n s PHE 89 Cb -0.25 -2.69 -0.03 0.00 -0.57 0.00 0.00 43.02 39.49 3g7n s PHE 89 CO -0.02 0.34 1.24 -2.14 -0.10 0.00 0.00 175.22 174.55 3g7n s PRO 90 N -1.87 2.81 0.30 0.24 0.02 -1.26 -4.91 135.00 130.34 3g7n s PRO 90 Ca 0.43 1.92 0.01 0.00 0.02 0.00 0.00 61.00 63.38 3g7n s PRO 90 Cb -0.18 -1.90 0.56 0.00 0.02 0.00 0.00 34.50 33.00 3g7n s PRO 90 CO 0.22 -1.36 1.90 0.77 -0.33 0.00 0.00 177.00 178.20 3g7n h SER 91 N 0.76 0.89 0.88 2.53 0.02 -2.01 -2.15 113.55 114.46 3g7n h SER 91 Ca -0.51 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 3g7n h SER 91 Cb 1.31 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.68 3g7n h SER 91 CO 0.54 0.55 0.00 -0.90 -1.14 0.00 0.00 176.83 175.88 3g7n n ASP 92 N -4.51 0.16 -4.72 3.07 3.85 -1.26 -4.85 116.55 108.29 3g7n n ASP 92 Ca 0.14 0.52 -0.42 0.00 -0.71 0.00 0.00 54.79 54.33 3g7n n ASP 92 Cb 0.23 -0.56 -0.03 0.00 -1.35 0.00 0.00 41.12 39.41 3g7n n ASP 92 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 3g7n s VAL 93 N -3.04 2.72 0.03 2.12 1.01 -0.81 -4.73 120.40 117.70 3g7n s VAL 93 Ca 0.11 0.53 0.04 0.00 0.00 0.00 0.00 61.98 62.65 3g7n s VAL 93 Cb 0.14 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 3g7n s VAL 93 CO 0.44 0.05 -0.11 -0.54 0.00 0.00 0.00 175.10 174.94 3g7n s LYS 94 N 0.97 0.76 0.06 2.72 1.02 -1.26 -4.42 119.74 119.59 3g7n s LYS 94 Ca 0.68 -0.65 0.05 0.00 0.02 0.00 0.00 55.97 56.07 3g7n s LYS 94 Cb -0.43 -0.70 -0.03 0.00 -0.52 0.00 0.00 37.83 36.15 3g7n s LYS 94 CO 0.32 0.17 -0.13 0.42 -0.92 0.00 0.00 175.35 175.21 3g7n s ILE 95 N -0.83 1.05 0.33 2.17 1.01 -0.59 -2.14 121.20 122.20 3g7n s ILE 95 Ca -0.01 -1.22 -0.29 0.00 0.00 0.00 0.00 60.65 59.14 3g7n s ILE 95 Cb -0.07 -1.01 -0.10 0.00 0.01 0.00 0.00 42.46 41.28 3g7n s ILE 95 CO 0.01 -0.19 1.40 0.00 0.00 0.00 0.00 174.94 176.15 3g7n s MET 96 N -1.60 4.26 0.43 2.79 0.23 0.63 -1.01 119.30 125.02 3g7n s MET 96 Ca -0.02 2.35 0.09 0.00 -1.03 0.00 0.00 55.69 57.08 3g7n s MET 96 Cb -0.10 -3.05 0.92 0.00 -1.53 0.00 0.00 34.83 31.08 3g7n s MET 96 CO 0.02 -0.35 2.04 -0.09 -2.03 0.00 0.00 175.02 174.60 3g7n h ARG 97 N 3.69 0.35 0.00 3.16 2.43 -0.89 -1.38 114.38 121.74 3g7n h ARG 97 Ca -0.49 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 3g7n h ARG 97 Cb 1.23 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 3g7n h ARG 97 CO 0.68 0.29 0.00 0.41 -1.51 0.00 0.00 179.97 179.85 3g7n n GLY 98 N -1.33 -0.95 0.12 2.80 0.00 0.40 -0.67 105.19 105.56 3g7n n GLY 98 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.70 0.74 -0.33 1.61 0.31 -0.84 -4.55 118.33 113.58 3g7n n VAL 99 Ca 0.02 -0.27 -0.04 0.00 -0.01 0.00 0.00 64.34 64.04 3g7n n VAL 99 Cb 0.14 -1.04 0.09 0.00 -0.91 0.00 0.00 33.84 32.12 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 -0.06 1.16 0.36 3.52 -0.00 -1.14 -2.32 115.15 116.68 3g7n h HIS 100 Ca -0.29 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.06 3g7n h HIS 100 Cb 1.43 -0.38 0.00 0.00 -0.00 0.00 0.00 27.41 28.46 3g7n h HIS 100 CO 0.01 0.77 -0.18 -0.09 -0.00 0.00 0.00 177.93 178.44 3g7n h ARG 101 N 1.22 -0.47 -0.54 5.26 1.12 -1.14 0.12 114.38 119.94 3g7n h ARG 101 Ca 0.32 0.03 -0.05 0.00 -1.11 0.00 0.00 59.98 59.17 3g7n h ARG 101 Cb -0.06 0.11 -0.03 0.00 -0.01 0.00 0.00 29.97 29.98 3g7n h ARG 101 CO -0.06 -0.27 0.15 -1.00 -3.11 0.00 0.00 179.97 175.67 3g7n h PRO 102 N -0.56 0.82 -0.41 0.20 0.13 -1.77 -2.19 132.00 128.22 3g7n h PRO 102 Ca -0.05 -0.16 -0.02 0.00 -0.87 0.00 0.00 66.00 64.90 3g7n h PRO 102 Cb 0.42 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.40 3g7n h PRO 102 CO 0.08 0.73 0.16 2.35 -0.23 0.00 0.00 178.00 181.09 3g7n h TRP 103 N 0.80 0.62 0.00 1.56 2.91 -1.26 -2.58 115.95 118.00 3g7n h TRP 103 Ca 0.18 -0.05 -0.03 0.00 1.13 0.00 0.00 58.89 60.13 3g7n h TRP 103 Cb 0.27 -0.19 -0.00 0.00 -0.51 0.00 0.00 29.16 28.73 3g7n h TRP 103 CO 0.02 0.55 -0.12 0.66 -1.03 0.00 0.00 178.44 178.52 3g7n h SER 104 N 0.52 0.00 0.46 2.65 4.64 -0.28 0.13 113.55 121.66 3g7n h SER 104 Ca 0.14 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.36 3g7n h SER 104 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 3g7n h SER 104 CO -0.01 0.12 -0.45 0.00 -0.87 0.00 0.00 176.83 175.62 3g7n h ALA 105 N 1.88 1.24 -0.01 5.18 0.00 -0.99 -3.27 119.26 123.30 3g7n h ALA 105 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3g7n h ALA 105 Cb 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3g7n h ALA 105 CO 0.02 0.56 -0.21 1.33 0.00 0.00 0.00 179.25 180.95 3g7n n VAL 106 N -3.99 0.00 0.14 0.00 0.24 -0.50 -4.76 118.33 109.47 3g7n n VAL 106 Ca -0.02 -0.39 -0.14 0.00 -2.04 0.00 0.00 64.34 61.76 3g7n n VAL 106 Cb 0.48 1.09 -0.06 0.00 -1.47 0.00 0.00 33.84 33.87 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 0.83 -0.77 -0.79 6.34 2.76 -0.85 -1.07 115.15 121.59 3g7n h HIS 107 Ca 0.00 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.14 3g7n h HIS 107 Cb 0.28 0.31 -0.04 0.00 1.55 0.00 0.00 27.41 29.52 3g7n h HIS 107 CO 0.00 -0.40 0.32 -0.44 -1.30 0.00 0.00 177.93 176.11 3g7n h ASP 108 N -0.54 1.09 -0.32 3.26 3.32 -1.86 0.56 116.42 121.93 3g7n h ASP 108 Ca 0.01 -0.17 0.05 0.00 0.02 0.00 0.00 57.03 56.95 3g7n h ASP 108 Cb 0.54 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.76 3g7n h ASP 108 CO -0.12 0.96 0.06 0.74 -1.72 0.00 0.00 179.24 179.15 3g7n h THR 109 N 1.15 0.83 -0.17 0.35 2.02 -1.75 -0.83 112.91 114.52 3g7n h THR 109 Ca 0.27 -0.06 -0.05 0.00 0.77 0.00 0.00 66.41 67.34 3g7n h THR 109 Cb 0.21 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.26 3g7n h THR 109 CO -0.02 0.03 -0.08 0.40 0.37 0.00 0.00 175.52 176.22 3g7n h ILE 110 N 0.17 1.31 -0.68 3.11 2.04 -0.85 -1.81 117.51 120.80 3g7n h ILE 110 Ca 0.15 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.89 3g7n h ILE 110 Cb 0.17 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 3g7n h ILE 110 CO -0.21 0.33 0.39 0.40 0.00 0.00 0.00 178.15 179.06 3g7n h ILE 111 N 0.03 1.20 -0.38 -0.67 1.08 -0.81 0.27 117.51 118.22 3g7n h ILE 111 Ca 0.04 -0.47 -0.07 0.00 -0.39 0.00 0.00 64.86 63.97 3g7n h ILE 111 Cb 0.55 0.26 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 3g7n h ILE 111 CO 0.02 0.22 -0.04 0.74 -0.69 0.00 0.00 178.15 178.40 3g7n h THR 112 N 0.94 1.27 -0.35 -0.27 2.02 -1.07 -0.05 112.91 115.41 3g7n h THR 112 Ca 0.24 -1.08 -0.05 0.00 0.77 0.00 0.00 66.41 66.29 3g7n h THR 112 Cb -0.00 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 3g7n h THR 112 CO -0.04 0.36 0.04 -0.08 0.37 0.00 0.00 175.52 176.17 3g7n h GLU 113 N 0.51 0.59 -0.94 6.66 4.57 -0.89 -1.82 114.58 123.25 3g7n h GLU 113 Ca 0.10 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 3g7n h GLU 113 Cb 0.54 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 29.02 3g7n h GLU 113 CO 0.03 0.68 0.59 0.28 -1.18 0.00 0.00 179.01 179.41 3g7n h VAL 114 N 0.42 1.25 -0.79 0.32 2.07 -0.79 -0.45 116.25 118.28 3g7n h VAL 114 Ca 0.10 -0.51 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 3g7n h VAL 114 Cb 0.39 -0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.01 3g7n h VAL 114 CO 0.01 0.25 0.39 0.50 0.02 0.00 0.00 177.57 178.74 3g7n h LYS 115 N 1.29 1.13 -0.58 1.57 3.64 -0.76 0.00 116.57 122.85 3g7n h LYS 115 Ca 0.34 -0.16 -0.08 0.00 -1.27 0.00 0.00 60.65 59.48 3g7n h LYS 115 Cb -0.10 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.49 3g7n h LYS 115 CO -0.07 0.87 0.03 0.00 -2.27 0.00 0.00 179.45 178.01 3g7n h ALA 116 N 1.20 0.95 -0.37 5.00 0.00 -0.82 -2.62 119.26 122.60 3g7n h ALA 116 Ca 0.27 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 3g7n h ALA 116 Cb 0.10 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3g7n h ALA 116 CO -0.04 0.64 -0.25 -0.07 0.00 0.00 0.00 179.25 179.54 3g7n h LEU 117 N 0.92 0.76 -1.52 0.00 3.38 -0.68 -2.59 115.31 115.57 3g7n h LEU 117 Ca 0.17 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.88 3g7n h LEU 117 Cb 0.50 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3g7n h LEU 117 CO 0.02 0.97 0.34 0.40 0.09 0.00 0.00 178.44 180.27 3g7n h ILE 118 N 0.64 1.10 -0.42 1.22 2.04 -0.75 0.28 117.51 121.63 3g7n h ILE 118 Ca 0.09 -0.22 -0.12 0.00 1.00 0.00 0.00 64.86 65.60 3g7n h ILE 118 Cb 0.75 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3g7n h ILE 118 CO 0.06 0.12 -0.22 0.00 0.00 0.00 0.00 178.15 178.11 3g7n h ALA 119 N 1.69 0.83 0.00 1.87 0.00 -1.11 -2.96 119.26 119.58 3g7n h ALA 119 Ca 0.20 -0.38 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 3g7n h ALA 119 Cb -0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3g7n h ALA 119 CO -0.05 0.64 -0.92 0.87 0.00 0.00 0.00 179.25 179.80 3g7n h LYS 120 N 0.73 0.00 -2.10 0.00 1.57 -0.99 -3.40 116.57 112.38 3g7n h LYS 120 Ca 0.10 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.31 3g7n h LYS 120 Cb 0.75 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.65 3g7n h LYS 120 CO 0.06 0.92 -0.90 0.66 -0.57 0.00 0.00 179.45 179.62 3g7n n TYR 121 N -3.44 1.57 0.30 -1.35 4.01 0.91 -4.99 117.16 114.16 3g7n n TYR 121 Ca -0.00 -3.85 0.18 0.00 -0.16 0.00 0.00 57.90 54.07 3g7n n TYR 121 Cb 0.87 -0.45 0.77 0.00 -0.31 0.00 0.00 39.34 40.23 3g7n n TYR 121 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3g7n h PRO 122 N 3.80 0.00 -0.02 -0.72 0.13 -1.75 -2.23 132.00 131.21 3g7n h PRO 122 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3g7n h PRO 122 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3g7n h PRO 122 CO 0.63 0.00 -0.15 -0.25 -0.23 0.00 0.00 178.00 178.00 3g7n n ASP 123 N -2.99 1.90 -4.79 1.44 8.00 -1.26 -4.97 116.55 113.88 3g7n n ASP 123 Ca -0.00 -1.50 -0.35 0.00 0.71 0.00 0.00 54.79 53.64 3g7n n ASP 123 Cb 0.25 0.12 -0.04 0.00 -0.02 0.00 0.00 41.12 41.43 3g7n n ASP 123 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3g7n s TYR 124 N -2.20 3.20 0.63 1.24 1.51 -0.84 -5.00 117.35 115.88 3g7n s TYR 124 Ca 0.28 1.62 0.05 0.00 -1.01 0.00 0.00 57.07 58.01 3g7n s TYR 124 Cb 0.20 -3.06 0.10 0.00 -0.11 0.00 0.00 41.96 39.09 3g7n s TYR 124 CO 0.41 -0.58 0.87 0.95 -1.11 0.00 0.00 175.55 176.08 3g7n s THR 125 N -1.84 2.22 0.04 -0.71 -4.23 -0.24 -4.84 115.64 106.04 3g7n s THR 125 Ca 0.61 -0.81 0.04 0.00 -1.18 0.00 0.00 61.69 60.36 3g7n s THR 125 Cb -0.18 -2.42 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 3g7n s THR 125 CO 0.23 0.00 -0.06 -0.76 -0.54 0.00 0.00 174.62 173.49 3g7n s LEU 126 N -4.86 3.20 0.01 4.79 1.43 0.37 -0.23 118.68 123.38 3g7n s LEU 126 Ca 0.63 -0.20 -0.07 0.00 -1.03 0.00 0.00 54.13 53.46 3g7n s LEU 126 Cb -0.06 -1.89 -0.00 0.00 0.03 0.00 0.00 46.19 44.27 3g7n s LEU 126 CO 0.41 0.24 0.13 -1.83 0.23 0.00 0.00 176.35 175.53 3g7n s GLU 127 N -1.74 0.50 0.01 1.70 -1.05 -0.22 -1.83 118.70 116.07 3g7n s GLU 127 Ca 0.19 -0.45 0.02 0.00 -0.15 0.00 0.00 54.97 54.59 3g7n s GLU 127 Cb -0.11 0.21 -0.01 0.00 -0.44 0.00 0.00 34.13 33.78 3g7n s GLU 127 CO 0.11 -0.12 -0.06 0.00 0.95 0.00 0.00 175.26 176.14 3g7n s ALA 128 N -1.54 0.49 -0.01 -0.84 0.00 -0.95 -1.03 121.76 117.88 3g7n s ALA 128 Ca -0.14 -0.35 -0.21 0.00 0.00 0.00 0.00 51.96 51.27 3g7n s ALA 128 Cb -0.07 -0.09 0.04 0.00 0.00 0.00 0.00 23.12 23.00 3g7n s ALA 128 CO 0.01 0.09 0.45 0.54 0.00 0.00 0.00 175.76 176.85 3g7n s VAL 129 N -0.37 0.04 0.00 0.00 0.11 -0.19 -0.53 120.40 119.45 3g7n s VAL 129 Ca -0.00 -0.32 0.00 0.00 -2.93 0.00 0.00 61.98 58.73 3g7n s VAL 129 Cb -0.04 -0.82 0.00 0.00 -1.53 0.00 0.00 36.38 34.00 3g7n s VAL 129 CO -0.00 -0.18 0.00 0.61 -3.33 0.00 0.00 175.10 172.20 3g7n n GLY 130 N 0.96 0.79 3.40 6.54 0.00 -1.09 -0.89 105.19 114.89 3g7n n GLY 130 Ca -0.20 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 44.69 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 2.45 0.00 1.61 2.46 -1.25 -0.65 115.29 117.91 3g7n s HIS 131 Ca 0.00 -0.33 0.00 0.00 0.47 0.00 0.00 55.06 55.20 3g7n s HIS 131 Cb 0.00 -1.45 0.00 0.00 -0.13 0.00 0.00 32.58 31.00 3g7n s HIS 131 CO 0.00 0.17 0.00 0.45 -2.47 0.00 0.00 174.74 172.89 3g7n n SER 132 N 1.78 0.00 0.19 9.88 2.88 -0.02 -0.30 113.62 128.03 3g7n n SER 132 Ca -0.17 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.51 3g7n n SER 132 Cb 0.52 0.00 0.73 0.00 -0.75 0.00 0.00 64.21 64.71 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 0.00 -1.29 2.46 5.85 -1.87 0.14 115.31 120.59 3g7n h LEU 133 Ca 0.00 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 3g7n h LEU 133 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3g7n h LEU 133 CO 0.00 0.00 -0.33 1.23 -0.34 0.00 0.00 178.44 179.00 3g7n h GLY 134 N 0.00 0.05 0.98 3.75 0.00 -0.66 0.84 103.07 108.03 3g7n h GLY 134 Ca 0.08 -0.04 -0.19 0.00 0.00 0.00 0.00 47.33 47.19 3g7n h GLY 134 CO -0.00 0.03 -0.69 -1.33 0.00 0.00 0.00 176.54 174.55 3g7n h GLY 135 N 1.01 0.66 0.87 4.60 0.00 -0.64 -1.17 103.07 108.41 3g7n h GLY 135 Ca 0.00 -1.01 0.03 0.00 0.00 0.00 0.00 47.33 46.35 3g7n h GLY 135 CO 0.04 0.90 0.50 0.00 0.00 0.00 0.00 176.54 177.98 3g7n h ALA 136 N 0.44 1.03 -0.57 3.60 0.00 -0.88 -0.96 119.26 121.92 3g7n h ALA 136 Ca -0.07 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 3g7n h ALA 136 Cb 1.35 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 3g7n h ALA 136 CO 0.14 0.31 0.11 -0.07 0.00 0.00 0.00 179.25 179.74 3g7n h LEU 137 N 0.97 0.84 -1.47 0.00 3.38 -0.83 -2.05 115.31 116.14 3g7n h LEU 137 Ca 0.31 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3g7n h LEU 137 Cb 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3g7n h LEU 137 CO -0.11 0.83 0.13 0.74 0.09 0.00 0.00 178.44 180.12 3g7n h THR 138 N 0.85 1.14 0.00 0.22 2.02 -0.48 0.89 112.91 117.54 3g7n h THR 138 Ca 0.18 -0.44 -0.04 0.00 0.77 0.00 0.00 66.41 66.88 3g7n h THR 138 Cb 0.34 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 3g7n h THR 138 CO 0.00 0.17 -0.19 0.77 0.37 0.00 0.00 175.52 176.64 3g7n h SER 139 N 0.48 0.00 0.21 4.18 4.64 -0.46 0.04 113.55 122.64 3g7n h SER 139 Ca 0.12 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.10 3g7n h SER 139 Cb 0.11 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.22 3g7n h SER 139 CO -0.01 0.19 -1.62 0.40 -0.87 0.00 0.00 176.83 174.92 3g7n h ILE 140 N 0.00 1.08 -0.93 0.95 2.04 -1.25 -3.36 117.51 116.05 3g7n h ILE 140 Ca -0.00 -2.57 0.15 0.00 1.00 0.00 0.00 64.86 63.43 3g7n h ILE 140 Cb 0.43 2.88 -0.09 0.00 -0.74 0.00 0.00 36.82 39.29 3g7n h ILE 140 CO 0.02 0.83 0.54 0.00 0.00 0.00 0.00 178.15 179.54 3g7n h ALA 141 N 0.12 1.43 -0.32 1.87 0.00 -0.39 -0.17 119.26 121.80 3g7n h ALA 141 Ca -0.31 0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.73 3g7n h ALA 141 Cb 2.10 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.74 3g7n h ALA 141 CO 0.21 0.02 -0.07 1.25 0.00 0.00 0.00 179.25 180.66 3g7n h HIS 142 N 0.77 -0.15 -0.37 0.00 -0.00 -1.14 0.84 115.15 115.10 3g7n h HIS 142 Ca 0.50 0.03 -0.15 0.00 -0.00 0.00 0.00 60.37 60.74 3g7n h HIS 142 Cb 0.65 0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 28.17 3g7n h HIS 142 CO -0.04 -0.13 -0.36 0.28 -0.00 0.00 0.00 177.93 177.68 3g7n h VAL 143 N 0.01 1.28 -0.96 5.26 2.07 -1.47 -0.82 116.25 121.61 3g7n h VAL 143 Ca 0.15 -1.54 0.01 0.00 0.82 0.00 0.00 66.70 66.15 3g7n h VAL 143 Cb 0.23 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 3g7n h VAL 143 CO -0.32 0.51 0.63 0.00 0.02 0.00 0.00 177.57 178.42 3g7n h ALA 144 N 0.86 1.22 0.07 1.67 0.00 -0.52 -1.00 119.26 121.56 3g7n h ALA 144 Ca 0.06 -0.07 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 3g7n h ALA 144 Cb 0.94 -0.39 0.02 0.00 0.00 0.00 0.00 17.79 18.36 3g7n h ALA 144 CO 0.09 0.62 -1.05 -0.07 0.00 0.00 0.00 179.25 178.84 3g7n h LEU 145 N 1.31 0.80 -0.70 0.00 3.38 -0.75 -1.48 115.31 117.87 3g7n h LEU 145 Ca 0.35 -0.80 0.03 0.00 0.09 0.00 0.00 57.88 57.55 3g7n h LEU 145 Cb -0.14 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.31 3g7n h LEU 145 CO -0.08 1.51 0.43 0.00 0.09 0.00 0.00 178.44 180.40 3g7n h ALA 146 N 0.30 0.92 0.06 1.53 0.00 -0.97 -0.50 119.26 120.59 3g7n h ALA 146 Ca -0.15 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.47 3g7n h ALA 146 Cb 1.74 -0.21 0.02 0.00 0.00 0.00 0.00 17.79 19.33 3g7n h ALA 146 CO 0.20 0.20 -1.11 1.96 0.00 0.00 0.00 179.25 180.50 3g7n h GLN 147 N 0.84 0.55 0.00 0.00 1.08 -1.18 -3.19 115.11 113.21 3g7n h GLN 147 Ca 0.29 -0.66 -0.14 0.00 -1.45 0.00 0.00 58.65 56.69 3g7n h GLN 147 Cb 0.04 0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.66 3g7n h GLN 147 CO -0.12 1.27 -0.65 -0.91 -0.95 0.00 0.00 178.83 177.47 3g7n h ASN 148 N 0.27 0.00 -2.05 1.46 2.35 -1.20 -3.40 115.58 113.02 3g7n h ASN 148 Ca -0.14 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.06 3g7n h ASN 148 Cb 1.77 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 39.74 3g7n h ASN 148 CO 0.20 0.65 -0.99 0.49 -1.65 0.00 0.00 177.43 176.14 3g7n n PHE 149 N -3.44 0.79 0.75 1.19 3.72 -0.20 -4.94 117.46 115.33 3g7n n PHE 149 Ca 0.00 -3.75 0.10 0.00 -0.05 0.00 0.00 57.45 53.76 3g7n n PHE 149 Cb 0.73 -0.41 0.46 0.00 -0.94 0.00 0.00 39.48 39.32 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 1.02 0.02 -0.03 -1.08 -0.04 -1.21 -2.12 135.00 131.56 3g7n n PRO 150 Ca 0.24 0.13 0.11 0.00 -0.04 0.00 0.00 63.50 63.94 3g7n n PRO 150 Cb 0.52 -1.50 0.50 0.00 -0.04 0.00 0.00 33.50 32.98 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 -1.48 0.85 -4.37 3.54 5.75 -1.26 -4.87 116.55 114.71 3g7n n ASP 151 Ca 0.06 -1.52 -0.32 0.00 -0.01 0.00 0.00 54.79 52.99 3g7n n ASP 151 Cb 0.24 -0.05 -0.15 0.00 -1.03 0.00 0.00 41.12 40.14 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 -1.91 2.39 0.44 0.11 -0.14 -0.90 -5.11 119.74 114.62 3g7n s LYS 152 Ca 0.32 -0.82 -0.25 0.00 -1.36 0.00 0.00 55.97 53.86 3g7n s LYS 152 Cb 0.16 -2.22 -0.08 0.00 -1.68 0.00 0.00 37.83 34.01 3g7n s LYS 152 CO 0.26 0.54 1.27 -1.12 -0.76 0.00 0.00 175.35 175.53 3g7n s SER 153 N -0.54 6.16 -0.06 2.83 0.01 -1.26 -4.88 113.70 115.95 3g7n s SER 153 Ca 0.07 2.56 -0.03 0.00 1.31 0.00 0.00 55.95 59.87 3g7n s SER 153 Cb -0.11 -2.63 0.04 0.00 0.21 0.00 0.00 66.02 63.53 3g7n s SER 153 CO 0.01 -0.95 0.14 -0.22 0.41 0.00 0.00 173.24 172.63 3g7n s LEU 154 N -2.72 0.76 -0.06 2.44 2.96 -1.26 -0.48 118.68 120.33 3g7n s LEU 154 Ca 0.60 0.29 0.01 0.00 -0.22 0.00 0.00 54.13 54.81 3g7n s LEU 154 Cb -0.36 0.34 0.02 0.00 0.50 0.00 0.00 46.19 46.70 3g7n s LEU 154 CO 0.45 -0.15 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.57 3g7n s VAL 155 N 1.14 0.74 -0.04 1.68 1.01 -0.76 -1.20 120.40 122.97 3g7n s VAL 155 Ca -0.09 -0.23 0.06 0.00 0.00 0.00 0.00 61.98 61.73 3g7n s VAL 155 Cb -0.11 -0.73 -0.01 0.00 0.00 0.00 0.00 36.38 35.52 3g7n s VAL 155 CO -0.06 0.27 -0.23 -0.44 0.00 0.00 0.00 175.10 174.64 3g7n s SER 156 N 0.94 2.84 -0.33 3.32 0.01 0.12 -2.23 113.70 118.38 3g7n s SER 156 Ca -0.10 -0.46 0.03 0.00 1.31 0.00 0.00 55.95 56.72 3g7n s SER 156 Cb -0.15 -0.63 0.10 0.00 0.21 0.00 0.00 66.02 65.55 3g7n s SER 156 CO 0.00 0.25 0.06 0.20 0.41 0.00 0.00 173.24 174.16 3g7n s ASN 157 N -0.26 4.54 -0.28 2.44 0.02 0.31 -0.51 114.94 121.20 3g7n s ASN 157 Ca 0.01 -1.99 -0.17 0.00 -1.02 0.00 0.00 52.86 49.69 3g7n s ASN 157 Cb -0.12 -1.40 -0.03 0.00 0.02 0.00 0.00 41.25 39.72 3g7n s ASN 157 CO 0.02 -0.39 0.46 0.00 0.02 0.00 0.00 177.10 177.21 3g7n s ALA 158 N 1.12 3.56 -0.18 0.60 0.00 -0.05 -2.66 121.76 124.15 3g7n s ALA 158 Ca 0.10 -0.75 -0.09 0.00 0.00 0.00 0.00 51.96 51.22 3g7n s ALA 158 Cb -0.18 -2.84 -0.05 0.00 0.00 0.00 0.00 23.12 20.05 3g7n s ALA 158 CO -0.13 -0.79 0.12 -0.51 0.00 0.00 0.00 175.76 174.45 3g7n s LEU 159 N 2.23 4.17 -1.45 0.00 1.43 0.18 -0.92 118.68 124.32 3g7n s LEU 159 Ca 0.18 0.26 -0.09 0.00 -1.03 0.00 0.00 54.13 53.45 3g7n s LEU 159 Cb -0.16 -2.06 0.05 0.00 0.03 0.00 0.00 46.19 44.06 3g7n s LEU 159 CO 0.10 0.24 0.91 0.59 0.23 0.00 0.00 176.35 178.41 3g7n n ASN 160 N 3.14 -3.73 -4.88 2.29 4.13 -0.22 -0.84 115.26 115.16 3g7n n ASN 160 Ca -0.17 -0.78 -0.35 0.00 1.68 0.00 0.00 54.58 54.96 3g7n n ASN 160 Cb 0.53 -4.01 -0.05 0.00 -1.54 0.00 0.00 39.78 34.70 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 -3.42 3.83 0.47 5.41 0.00 -1.26 -3.79 121.76 123.00 3g7n s ALA 161 Ca 0.45 -0.53 -0.14 0.00 0.00 0.00 0.00 51.96 51.73 3g7n s ALA 161 Cb -0.22 -2.10 -0.07 0.00 0.00 0.00 0.00 23.12 20.73 3g7n s ALA 161 CO 0.82 0.62 0.91 -0.59 0.00 0.00 0.00 175.76 177.52 3g7n s PHE 162 N -1.24 3.46 0.57 0.00 -0.12 -1.26 -3.80 117.98 115.59 3g7n s PHE 162 Ca 0.26 1.32 -0.15 0.00 -0.05 0.00 0.00 56.93 58.30 3g7n s PHE 162 Cb -0.13 -2.67 -0.05 0.00 -0.63 0.00 0.00 43.02 39.54 3g7n s PHE 162 CO 0.14 -0.27 1.03 -1.25 -0.05 0.00 0.00 175.22 174.82 3g7n s PRO 163 N -3.98 3.53 0.00 1.99 0.04 -1.26 -4.67 135.00 130.65 3g7n s PRO 163 Ca 0.56 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.67 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 0.31 -0.62 0.38 0.44 0.04 0.00 0.00 177.00 177.54 3g7n n ILE 164 N -1.98 0.10 -3.41 0.56 -5.35 -1.26 -4.87 119.36 103.15 3g7n n ILE 164 Ca 0.08 -0.34 -0.04 0.00 -0.27 0.00 0.00 62.75 62.18 3g7n n ILE 164 Cb 0.53 1.30 0.01 0.00 -1.74 0.00 0.00 39.64 39.75 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 -0.05 1.44 2.70 3.28 0.00 -1.26 -0.27 105.19 111.02 3g7n n GLY 165 Ca 0.00 -1.11 -0.20 0.00 0.00 0.00 0.00 46.02 44.72 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 -1.18 0.20 -0.06 1.61 0.23 -0.91 -0.41 115.26 114.74 3g7n n ASN 166 Ca -0.04 -1.40 -0.01 0.00 -0.53 0.00 0.00 54.58 52.61 3g7n n ASN 166 Cb 0.27 -0.67 0.27 0.00 -2.08 0.00 0.00 39.78 37.57 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 -0.56 -3.83 5.75 -1.91 -1.62 115.11 113.59 3g7n h GLN 167 Ca -0.29 -0.12 -0.00 0.00 -0.15 0.00 0.00 58.65 58.09 3g7n h GLN 167 Cb 0.83 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.25 3g7n h GLN 167 CO 0.22 0.60 0.35 0.00 -2.65 0.00 0.00 178.83 177.35 3g7n h ALA 168 N 1.47 0.71 -0.13 3.38 0.00 -1.93 0.35 119.26 123.12 3g7n h ALA 168 Ca 0.14 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.03 3g7n h ALA 168 Cb 0.25 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 3g7n h ALA 168 CO -0.00 0.19 -0.16 2.35 0.00 0.00 0.00 179.25 181.62 3g7n h TRP 169 N 0.76 -0.41 -0.91 0.00 2.91 -1.58 -1.01 115.95 115.71 3g7n h TRP 169 Ca 0.20 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.26 3g7n h TRP 169 Cb -0.03 0.20 -0.05 0.00 -0.51 0.00 0.00 29.16 28.77 3g7n h TRP 169 CO -0.03 -0.23 0.60 0.00 -1.03 0.00 0.00 178.44 177.75 3g7n h ALA 170 N 0.85 1.17 -0.57 2.65 0.00 -0.87 -0.11 119.26 122.39 3g7n h ALA 170 Ca 0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3g7n h ALA 170 Cb 0.34 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3g7n h ALA 170 CO -0.25 0.52 0.12 -0.44 0.00 0.00 0.00 179.25 179.19 3g7n h ASP 171 N 1.20 0.84 -0.37 0.00 3.32 -0.76 -0.37 116.42 120.28 3g7n h ASP 171 Ca 0.34 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 57.19 3g7n h ASP 171 Cb -0.10 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.22 3g7n h ASP 171 CO -0.09 0.84 0.09 0.15 -1.72 0.00 0.00 179.24 178.51 3g7n h PHE 172 N 0.86 0.63 -0.16 4.55 3.57 -0.43 -0.94 116.94 125.00 3g7n h PHE 172 Ca 0.18 -0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.65 3g7n h PHE 172 Cb 0.34 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 3g7n h PHE 172 CO 0.02 0.61 -0.11 0.78 -2.23 0.00 0.00 178.31 177.39 3g7n h GLY 173 N 0.46 0.02 1.36 2.40 0.00 -0.68 -2.59 103.07 104.04 3g7n h GLY 173 Ca 0.12 0.13 0.04 0.00 0.00 0.00 0.00 47.33 47.62 3g7n h GLY 173 CO 0.00 -0.12 0.34 -0.84 0.00 0.00 0.00 176.54 175.91 3g7n h THR 174 N -0.11 1.03 0.00 4.70 2.02 -0.85 -2.23 112.91 117.47 3g7n h THR 174 Ca 0.10 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.10 3g7n h THR 174 Cb 0.25 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 3g7n h THR 174 CO -0.23 0.10 0.00 0.00 0.37 0.00 0.00 175.52 175.76 3g7n n ALA 175 N -2.49 2.21 -1.76 6.16 0.00 -0.38 -4.79 120.51 119.46 3g7n n ALA 175 Ca 0.06 -0.11 -0.39 0.00 0.00 0.00 0.00 53.44 53.00 3g7n n ALA 175 Cb 0.18 -1.39 -0.06 0.00 0.00 0.00 0.00 19.45 18.18 3g7n n ALA 175 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3g7n s GLN 176 N -2.64 4.69 0.52 0.00 -1.52 -0.84 -5.02 119.66 114.85 3g7n s GLN 176 Ca 0.21 1.49 -0.22 0.00 -1.95 0.00 0.00 55.36 54.89 3g7n s GLN 176 Cb 0.16 -3.07 -0.06 0.00 -0.22 0.00 0.00 33.01 29.83 3g7n s GLN 176 CO 0.38 0.35 1.30 0.00 -0.25 0.00 0.00 175.29 177.07 3g7n s ALA 177 N -1.34 2.86 0.00 6.09 0.00 -1.26 -4.84 121.76 123.26 3g7n s ALA 177 Ca 0.46 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.63 3g7n s ALA 177 Cb -0.24 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.36 3g7n s ALA 177 CO 0.31 -1.17 0.00 0.41 0.00 0.00 0.00 175.76 175.31 3g7n n GLY 178 N 0.64 2.50 3.29 0.00 0.00 -1.26 -4.82 105.19 105.54 3g7n n GLY 178 Ca 0.10 -1.99 -0.34 0.00 0.00 0.00 0.00 46.02 43.79 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 -2.68 3.13 -0.25 2.61 2.01 -0.34 -5.01 115.64 115.12 3g7n s THR 179 Ca 0.00 -0.58 -0.07 0.00 0.31 0.00 0.00 61.69 61.35 3g7n s THR 179 Cb 0.00 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 70.08 3g7n s THR 179 CO 0.00 0.45 0.07 0.12 -0.69 0.00 0.00 174.62 174.58 3g7n s PHE 180 N 1.32 3.10 -0.06 4.92 5.36 -1.26 -0.70 117.98 130.66 3g7n s PHE 180 Ca 0.04 -0.37 0.02 0.00 -0.96 0.00 0.00 56.93 55.66 3g7n s PHE 180 Cb -0.14 -2.23 -0.03 0.00 -0.34 0.00 0.00 43.02 40.28 3g7n s PHE 180 CO -0.04 -0.32 -0.10 -0.80 -1.46 0.00 0.00 175.22 172.50 3g7n s ASN 181 N 1.53 4.37 -0.39 6.13 0.02 0.33 -1.31 114.94 125.63 3g7n s ASN 181 Ca 0.06 -0.10 -0.04 0.00 -1.02 0.00 0.00 52.86 51.77 3g7n s ASN 181 Cb -0.15 -1.02 0.09 0.00 0.02 0.00 0.00 41.25 40.19 3g7n s ASN 181 CO 0.04 0.36 0.17 -0.13 0.02 0.00 0.00 177.10 177.56 3g7n s ARG 182 N -0.78 2.17 -0.35 -0.60 0.52 0.47 -0.87 118.95 119.52 3g7n s ARG 182 Ca 0.12 -1.66 -0.16 0.00 -0.52 0.00 0.00 55.73 53.51 3g7n s ARG 182 Cb -0.11 -3.53 -0.01 0.00 0.52 0.00 0.00 34.95 31.82 3g7n s ARG 182 CO 0.01 -0.96 0.41 0.20 0.02 0.00 0.00 175.30 174.97 3g7n s GLY 183 N 1.75 1.88 0.32 -3.53 0.00 -0.10 -0.81 107.32 106.84 3g7n s GLY 183 Ca 0.05 -1.17 0.10 0.00 0.00 0.00 0.00 44.72 43.69 3g7n s GLY 183 CO -0.03 1.08 -0.05 -1.31 0.00 0.00 0.00 173.10 172.80 3g7n s ASN 184 N 1.74 4.03 0.13 1.64 0.01 0.08 -1.05 114.94 121.51 3g7n s ASN 184 Ca 0.14 -1.01 0.10 0.00 -0.71 0.00 0.00 52.86 51.38 3g7n s ASN 184 Cb -0.16 -0.49 -0.04 0.00 0.41 0.00 0.00 41.25 40.97 3g7n s ASN 184 CO 0.12 -0.16 -0.25 0.21 -1.51 0.00 0.00 177.10 175.52 3g7n s ASN 185 N -3.66 3.05 0.54 -1.22 2.47 -1.26 -2.57 114.94 112.29 3g7n s ASN 185 Ca 0.33 -0.74 -0.20 0.00 0.42 0.00 0.00 52.86 52.67 3g7n s ASN 185 Cb -0.01 -0.19 -0.08 0.00 -1.45 0.00 0.00 41.25 39.52 3g7n s ASN 185 CO 0.18 0.13 0.84 1.33 -3.72 0.00 0.00 177.10 175.86 3g7n n VAL 186 N 0.92 2.89 -1.27 -5.21 0.24 -0.91 -3.20 118.33 111.78 3g7n n VAL 186 Ca -0.18 -0.50 -0.09 0.00 -2.04 0.00 0.00 64.34 61.52 3g7n n VAL 186 Cb 0.53 -0.99 -0.04 0.00 -1.47 0.00 0.00 33.84 31.87 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 0.01 -0.58 -4.16 1.34 4.77 -1.26 -4.14 117.00 112.98 3g7n n LEU 187 Ca 0.12 0.23 -0.33 0.00 -0.03 0.00 0.00 56.01 56.00 3g7n n LEU 187 Cb 0.45 -1.79 -0.16 0.00 -2.33 0.00 0.00 43.42 39.59 3g7n n LEU 187 CO 0.52 -0.60 -0.50 -0.62 -1.33 0.00 0.00 177.39 174.85 3g7n s ASP 188 N -2.70 3.35 0.00 -1.43 2.15 -1.19 -1.02 116.67 115.82 3g7n s ASP 188 Ca 0.00 -0.60 0.26 0.00 0.43 0.00 0.00 52.55 52.64 3g7n s ASP 188 Cb 0.00 -1.53 0.83 0.00 -0.30 0.00 0.00 42.92 41.93 3g7n s ASP 188 CO 0.00 -0.00 1.62 0.61 -0.17 0.00 0.00 175.17 177.23 3g7n n GLY 189 N 4.64 0.28 0.32 2.66 0.00 -1.03 -4.44 105.19 107.63 3g7n n GLY 189 Ca -0.20 -0.50 -0.01 0.00 0.00 0.00 0.00 46.02 45.31 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 2.83 1.20 0.00 1.61 2.07 -1.73 -0.38 116.25 121.85 3g7n h VAL 190 Ca 0.00 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.96 3g7n h VAL 190 Cb 0.61 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 3g7n h VAL 190 CO 0.00 0.24 0.00 -2.65 0.02 0.00 0.00 177.57 175.18 3g7n n PRO 191 N -4.35 0.11 0.00 1.57 -0.02 -1.25 -1.59 135.00 129.47 3g7n n PRO 191 Ca 0.06 0.40 0.13 0.00 -2.02 0.00 0.00 63.50 62.06 3g7n n PRO 191 Cb 0.13 -1.74 0.37 0.00 -0.02 0.00 0.00 33.50 32.24 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 -1.95 1.25 -4.76 2.55 3.02 -0.26 -4.59 115.26 110.53 3g7n n ASN 192 Ca 0.02 -1.09 -0.39 0.00 -0.03 0.00 0.00 54.58 53.09 3g7n n ASN 192 Cb 0.17 0.14 0.03 0.00 -0.61 0.00 0.00 39.78 39.51 3g7n n ASN 192 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 3g7n n MET 193 N -0.38 2.00 -1.28 3.52 2.81 -0.62 -3.11 117.12 120.06 3g7n n MET 193 Ca 0.13 0.72 -0.09 0.00 -1.81 0.00 0.00 57.70 56.66 3g7n n MET 193 Cb 0.37 -2.62 -0.04 0.00 -0.71 0.00 0.00 33.22 30.22 3g7n n MET 193 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3g7n n TYR 194 N -0.61 -0.01 1.13 2.03 4.01 -1.26 -4.47 117.16 117.97 3g7n n TYR 194 Ca 0.08 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.94 3g7n n TYR 194 Cb 0.43 -1.75 0.30 0.00 -0.31 0.00 0.00 39.34 38.01 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 0.60 0.81 -4.74 7.72 3.41 -1.18 -1.19 113.62 119.04 3g7n n SER 195 Ca -0.09 -0.62 -0.37 0.00 -0.26 0.00 0.00 58.87 57.53 3g7n n SER 195 Cb 0.29 0.21 0.05 0.00 -0.26 0.00 0.00 64.21 64.50 3g7n n SER 195 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3g7n s SER 196 N -2.73 5.02 0.60 4.04 0.15 -1.26 -4.66 113.70 114.86 3g7n s SER 196 Ca 0.18 2.61 0.35 0.00 0.70 0.00 0.00 55.95 59.79 3g7n s SER 196 Cb 0.18 -2.62 1.91 0.00 -1.71 0.00 0.00 66.02 63.78 3g7n s SER 196 CO 0.61 -1.72 2.23 -0.65 1.20 0.00 0.00 173.24 174.90 3g7n h PRO 197 N 1.00 0.00 0.00 5.44 0.11 -1.98 0.34 132.00 136.91 3g7n h PRO 197 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3g7n h PRO 197 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3g7n h PRO 197 CO 0.55 0.03 0.00 -0.07 -0.21 0.00 0.00 178.00 178.30 3g7n h LEU 198 N 0.00 0.00 0.00 2.35 -0.00 -1.95 -3.36 115.31 112.35 3g7n h LEU 198 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.87 3g7n h LEU 198 Cb 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.80 3g7n h LEU 198 CO 0.00 0.00 -0.38 0.52 -0.00 0.00 0.00 178.44 178.59 3g7n n VAL 199 N -2.64 1.29 -2.48 1.22 0.31 -0.31 -5.06 118.33 110.66 3g7n n VAL 199 Ca 0.02 0.30 -0.07 0.00 -0.01 0.00 0.00 64.34 64.58 3g7n n VAL 199 Cb 0.29 -1.83 0.01 0.00 -0.91 0.00 0.00 33.84 31.40 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 -3.80 -2.92 -4.81 4.52 5.15 0.11 -5.00 115.26 108.50 3g7n n ASN 200 Ca -0.05 -0.09 -0.33 0.00 -0.60 0.00 0.00 54.58 53.51 3g7n n ASN 200 Cb 0.19 -1.86 -0.03 0.00 -0.53 0.00 0.00 39.78 37.56 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 -2.71 3.13 -0.02 1.20 0.08 -0.33 -4.66 117.98 114.66 3g7n s PHE 201 Ca 0.09 1.54 0.06 0.00 0.12 0.00 0.00 56.93 58.74 3g7n s PHE 201 Cb -0.04 -2.96 -0.01 0.00 -0.57 0.00 0.00 43.02 39.43 3g7n s PHE 201 CO 0.11 -0.73 -0.19 0.15 -0.10 0.00 0.00 175.22 174.46 3g7n s LYS 202 N -3.65 1.68 0.52 0.44 -0.14 0.46 -4.68 119.74 114.36 3g7n s LYS 202 Ca 0.64 -0.69 -0.09 0.00 -1.36 0.00 0.00 55.97 54.47 3g7n s LYS 202 Cb -0.14 -1.57 -0.04 0.00 -1.68 0.00 0.00 37.83 34.39 3g7n s LYS 202 CO 0.26 0.39 0.87 -1.01 -0.76 0.00 0.00 175.35 175.10 3g7n s HIS 203 N -0.35 3.56 0.32 3.18 3.76 -1.26 -4.28 115.29 120.23 3g7n s HIS 203 Ca 0.05 1.04 0.03 0.00 -0.15 0.00 0.00 55.06 56.03 3g7n s HIS 203 Cb -0.09 -2.49 -0.04 0.00 1.11 0.00 0.00 32.58 31.07 3g7n s HIS 203 CO 0.00 -0.39 0.12 1.52 -0.85 0.00 0.00 174.74 175.14 3g7n s TYR 204 N -2.82 1.71 0.00 1.40 1.13 -1.26 -4.83 117.35 112.68 3g7n s TYR 204 Ca 0.51 -1.22 0.00 0.00 -1.41 0.00 0.00 57.07 54.95 3g7n s TYR 204 Cb -0.10 -1.03 0.00 0.00 -1.10 0.00 0.00 41.96 39.72 3g7n s TYR 204 CO 0.45 -0.31 0.00 0.41 -2.51 0.00 0.00 175.55 173.59 3g7n n GLY 205 N -0.66 -1.52 3.34 5.49 0.00 -1.26 -4.81 105.19 105.77 3g7n n GLY 205 Ca -0.02 -2.07 -0.35 0.00 0.00 0.00 0.00 46.02 43.58 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 3.41 0.12 2.61 2.01 -0.42 -4.85 115.64 118.51 3g7n s THR 206 Ca 0.00 -0.49 -0.24 0.00 0.31 0.00 0.00 61.69 61.27 3g7n s THR 206 Cb 0.00 -2.54 -0.07 0.00 0.01 0.00 0.00 72.50 69.90 3g7n s THR 206 CO 0.00 0.44 0.74 -0.70 -0.69 0.00 0.00 174.62 174.41 3g7n s GLU 207 N 1.27 4.50 0.21 4.92 2.12 -1.26 -0.40 118.70 130.07 3g7n s GLU 207 Ca 0.03 1.07 0.10 0.00 0.36 0.00 0.00 54.97 56.54 3g7n s GLU 207 Cb -0.14 -3.29 -0.05 0.00 0.26 0.00 0.00 34.13 30.91 3g7n s GLU 207 CO -0.02 0.50 -0.20 0.71 -0.54 0.00 0.00 175.26 175.71 3g7n s TYR 208 N -0.84 2.10 -0.09 5.30 2.02 0.01 -0.47 117.35 125.38 3g7n s TYR 208 Ca 0.35 -0.40 -0.09 0.00 -0.37 0.00 0.00 57.07 56.56 3g7n s TYR 208 Cb -0.22 -1.00 0.02 0.00 -0.40 0.00 0.00 41.96 40.37 3g7n s TYR 208 CO 0.24 0.50 0.26 -0.47 -1.57 0.00 0.00 175.55 174.52 3g7n s TYR 209 N -2.16 -0.28 0.16 2.71 5.04 -0.64 -0.74 117.35 121.43 3g7n s TYR 209 Ca 0.22 0.67 -0.12 0.00 -2.44 0.00 0.00 57.07 55.40 3g7n s TYR 209 Cb -0.06 0.09 0.01 0.00 0.35 0.00 0.00 41.96 42.35 3g7n s TYR 209 CO 0.10 -0.15 0.34 -1.54 -1.34 0.00 0.00 175.55 172.96 3g7n s SER 210 N 0.06 -0.05 -0.22 4.32 1.04 -1.06 -1.06 113.70 116.72 3g7n s SER 210 Ca -0.01 -0.68 0.15 0.00 0.48 0.00 0.00 55.95 55.90 3g7n s SER 210 Cb -0.02 0.46 0.73 0.00 0.10 0.00 0.00 66.02 67.29 3g7n s SER 210 CO 0.01 -0.90 1.64 -1.54 0.98 0.00 0.00 173.24 173.43 3g7n n SER 211 N -0.22 5.13 0.00 7.02 3.41 -1.26 -2.14 113.62 125.56 3g7n n SER 211 Ca -0.10 -2.96 0.00 0.00 -0.26 0.00 0.00 58.87 55.55 3g7n n SER 211 Cb 0.63 -0.64 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 0.26 0.99 3.26 5.00 0.00 -1.26 -4.86 105.19 108.57 3g7n n GLY 212 Ca 0.26 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.13 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 0.87 0.21 2.61 -4.23 -1.26 -3.67 115.64 108.18 3g7n s THR 213 Ca 0.00 -2.01 -0.07 0.00 -1.18 0.00 0.00 61.69 58.43 3g7n s THR 213 Cb 0.00 -2.08 0.13 0.00 1.34 0.00 0.00 72.50 71.89 3g7n s THR 213 CO 0.00 -0.53 1.74 -0.08 -0.54 0.00 0.00 174.62 175.21 3g7n h GLU 214 N 2.68 1.11 0.00 3.99 4.81 -1.97 -2.35 114.58 122.86 3g7n h GLU 214 Ca -0.37 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.61 3g7n h GLU 214 Cb 1.20 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3g7n h GLU 214 CO 0.63 0.97 0.00 0.00 -0.73 0.00 0.00 179.01 179.88 3g7n h ALA 215 N 1.14 1.00 -0.24 2.92 0.00 -1.96 -2.32 119.26 119.79 3g7n h ALA 215 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3g7n h ALA 215 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3g7n h ALA 215 CO -0.00 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 3g7n n SER 216 N -2.97 2.91 -4.70 0.00 3.41 -0.89 -4.95 113.62 106.43 3g7n n SER 216 Ca 0.00 -1.91 -0.40 0.00 -0.26 0.00 0.00 58.87 56.30 3g7n n SER 216 Cb 0.27 -0.15 -0.05 0.00 -0.26 0.00 0.00 64.21 64.01 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 -1.70 5.06 0.14 6.66 2.01 -0.87 -4.17 115.64 122.76 3g7n s THR 217 Ca 0.35 1.29 0.10 0.00 0.31 0.00 0.00 61.69 63.74 3g7n s THR 217 Cb 0.21 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 3g7n s THR 217 CO 0.30 0.21 -0.23 0.68 -0.69 0.00 0.00 174.62 174.90 3g7n s VAL 218 N 1.17 2.05 -0.18 3.82 -7.23 -0.23 -1.05 120.40 118.75 3g7n s VAL 218 Ca 0.33 -1.79 -0.16 0.00 -1.81 0.00 0.00 61.98 58.55 3g7n s VAL 218 Cb -0.17 -1.87 -0.04 0.00 0.56 0.00 0.00 36.38 34.86 3g7n s VAL 218 CO 0.14 -0.07 0.40 -0.75 -0.31 0.00 0.00 175.10 174.51 3g7n s LYS 219 N -2.28 4.22 0.36 4.82 2.20 -0.10 -1.62 119.74 127.34 3g7n s LYS 219 Ca 0.14 0.24 -0.07 0.00 -0.36 0.00 0.00 55.97 55.91 3g7n s LYS 219 Cb -0.09 -3.50 -0.05 0.00 -1.51 0.00 0.00 37.83 32.68 3g7n s LYS 219 CO 0.06 0.04 0.68 0.00 -0.36 0.00 0.00 175.35 175.77 3g7n s GLU 221 N -3.85 4.08 2.61 0.00 2.12 -1.26 -4.59 118.70 117.81 3g7n s GLU 221 Ca 0.47 0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.81 3g7n s GLU 221 Cb -0.10 -3.59 0.00 0.00 0.26 0.00 0.00 34.13 30.69 3g7n s GLU 221 CO 0.32 -0.12 0.00 0.41 -0.54 0.00 0.00 175.26 175.34 3g7n n GLY 222 N 4.37 0.00 0.09 -1.50 0.00 -1.26 -3.49 105.19 103.40 3g7n n GLY 222 Ca -0.10 -1.02 -0.04 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.90 1.61 1.08 -1.92 -3.41 115.11 111.57 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 0.41 -1.00 0.54 -0.95 0.00 0.00 178.83 177.83 3g7n n ARG 224 N -2.98 2.27 -1.70 1.46 5.12 -1.26 -4.91 116.66 114.67 3g7n n ARG 224 Ca -0.13 -3.77 -0.44 0.00 -1.93 0.00 0.00 57.85 51.59 3g7n n ARG 224 Cb 0.95 -1.76 -0.03 0.00 -1.16 0.00 0.00 32.46 30.45 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 -0.43 3.74 0.22 0.55 -0.08 -1.23 -4.75 116.55 114.57 3g7n n ASP 225 Ca 0.22 1.04 0.15 0.00 -1.51 0.00 0.00 54.79 54.69 3g7n n ASP 225 Cb 0.81 -1.52 0.67 0.00 2.34 0.00 0.00 41.12 43.43 3g7n n ASP 225 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3g7n h LYS 226 N 7.20 0.00 0.00 -0.67 1.57 -1.91 -0.76 116.57 122.00 3g7n h LYS 226 Ca -0.45 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.30 3g7n h LYS 226 Cb 1.23 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.53 3g7n h LYS 226 CO 0.94 0.00 -0.14 0.77 -0.57 0.00 0.00 179.45 180.45 3g7n h SER 227 N 0.00 0.00 0.00 0.86 0.02 -1.93 -3.19 113.55 109.31 3g7n h SER 227 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3g7n h SER 227 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 3g7n h SER 227 CO 0.00 0.14 0.00 0.00 -1.14 0.00 0.00 176.83 175.83 3g7n h SER 229 N 0.00 0.72 -0.39 0.00 4.64 -1.89 -2.47 113.55 114.16 3g7n h SER 229 Ca 0.00 0.01 0.09 0.00 -0.47 0.00 0.00 61.79 61.42 3g7n h SER 229 Cb 0.00 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 61.93 3g7n h SER 229 CO 0.00 0.48 0.27 0.00 -0.87 0.00 0.00 176.83 176.71 3g7n h ALA 230 N 1.35 2.20 -0.21 5.18 0.00 -1.86 -0.84 119.26 125.08 3g7n h ALA 230 Ca 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3g7n h ALA 230 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3g7n h ALA 230 CO -0.15 -0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.22 3g7n n GLY 231 N -1.57 0.85 0.08 0.00 0.00 -0.93 -4.58 105.19 99.04 3g7n n GLY 231 Ca 0.06 -0.57 0.15 0.00 0.00 0.00 0.00 46.02 45.65 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 0.85 0.31 -0.04 1.61 0.23 -0.32 -4.90 115.26 113.01 3g7n n ASN 232 Ca 0.17 -0.57 -0.01 0.00 -0.53 0.00 0.00 54.58 53.64 3g7n n ASN 232 Cb 0.47 -0.11 -0.00 0.00 -2.08 0.00 0.00 39.78 38.05 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 1.23 0.40 3.77 4.83 0.00 -1.26 -4.92 105.19 109.23 3g7n n GLY 233 Ca 0.16 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.77 2.79 -0.03 1.61 -1.94 -1.26 -5.08 119.30 114.62 3g7n s MET 234 Ca 0.00 -0.89 0.00 0.00 -1.71 0.00 0.00 55.69 53.10 3g7n s MET 234 Cb 0.00 -2.60 0.03 0.00 2.01 0.00 0.00 34.83 34.27 3g7n s MET 234 CO 0.00 0.49 -0.00 -0.47 -0.01 0.00 0.00 175.02 175.03 3g7n s TYR 235 N -1.68 0.33 0.00 -0.03 5.04 -1.26 -4.41 117.35 115.35 3g7n s TYR 235 Ca 0.30 -0.01 0.00 0.00 -2.44 0.00 0.00 57.07 54.92 3g7n s TYR 235 Cb -0.10 -0.41 0.00 0.00 0.35 0.00 0.00 41.96 41.79 3g7n s TYR 235 CO 0.22 -0.13 0.00 0.00 -1.34 0.00 0.00 175.55 174.30 3g7n n ALA 236 N 4.10 0.00 -2.46 3.97 0.00 -0.56 -4.64 120.51 120.91 3g7n n ALA 236 Ca -0.27 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.76 3g7n n ALA 236 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 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 3.81 0.44 0.00 1.01 -1.26 -2.07 120.40 122.32 3g7n s VAL 237 Ca 0.00 0.65 0.03 0.00 0.00 0.00 0.00 61.98 62.66 3g7n s VAL 237 Cb 0.00 -4.61 -0.03 0.00 0.00 0.00 0.00 36.38 31.75 3g7n s VAL 237 CO 0.00 -1.37 0.08 0.42 0.00 0.00 0.00 175.10 174.23 3g7n s THR 238 N 5.84 0.87 0.44 3.92 -4.23 -1.26 -4.98 115.64 116.23 3g7n s THR 238 Ca 0.46 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 59.08 3g7n s THR 238 Cb -0.09 -2.34 0.24 0.00 1.34 0.00 0.00 72.50 71.64 3g7n s THR 238 CO 0.22 0.00 2.05 -0.65 -0.54 0.00 0.00 174.62 175.70 3g7n h PRO 239 N 1.67 0.29 0.00 3.99 0.11 -1.92 -0.51 132.00 135.62 3g7n h PRO 239 Ca -0.39 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3g7n h PRO 239 Cb 1.28 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3g7n h PRO 239 CO 0.64 0.26 0.00 0.41 -0.21 0.00 0.00 178.00 179.10 3g7n n GLY 240 N -1.33 -0.96 0.25 -0.55 0.00 -0.19 -3.58 105.19 98.84 3g7n n GLY 240 Ca 0.00 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 -0.26 1.61 6.17 -1.26 -3.12 115.15 118.29 3g7n h HIS 241 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 3g7n h HIS 241 Cb 0.21 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.14 3g7n h HIS 241 CO 0.00 0.16 0.00 0.44 0.71 0.00 0.00 177.93 179.24 3g7n n ILE 242 N -3.49 0.34 -3.99 6.26 -6.64 -1.23 -4.83 119.36 105.78 3g7n n ILE 242 Ca -0.01 -0.37 -0.08 0.00 -1.77 0.00 0.00 62.75 60.52 3g7n n ILE 242 Cb 0.32 0.22 -0.09 0.00 -1.44 0.00 0.00 39.64 38.65 3g7n n ILE 242 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3g7n s ALA 243 N -1.66 0.21 -0.21 -1.28 0.00 -1.18 -1.29 121.76 116.35 3g7n s ALA 243 Ca 0.23 -0.97 -0.15 0.00 0.00 0.00 0.00 51.96 51.07 3g7n s ALA 243 Cb 0.12 0.42 0.06 0.00 0.00 0.00 0.00 23.12 23.72 3g7n s ALA 243 CO 0.17 -0.45 0.53 0.45 0.00 0.00 0.00 175.76 176.47 3g7n s SER 244 N -2.91 -0.62 -1.51 0.00 0.15 -0.22 -4.75 113.70 103.84 3g7n s SER 244 Ca 0.08 1.11 -0.01 0.00 0.70 0.00 0.00 55.95 57.83 3g7n s SER 244 Cb 0.06 1.06 0.00 0.00 -1.71 0.00 0.00 66.02 65.44 3g7n s SER 244 CO -0.09 -0.20 0.11 0.49 1.20 0.00 0.00 173.24 174.75 3g7n n PHE 245 N 3.51 -1.36 -0.79 3.44 3.72 -1.26 -0.87 117.46 123.84 3g7n n PHE 245 Ca -0.18 0.63 0.00 0.00 -0.05 0.00 0.00 57.45 57.86 3g7n n PHE 245 Cb 0.56 -3.03 0.00 0.00 -0.94 0.00 0.00 39.48 36.08 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 -2.44 0.90 3.28 1.37 0.00 -1.24 -4.53 105.19 102.52 3g7n n GLY 246 Ca -0.32 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.58 3.31 -0.15 1.61 1.01 -0.05 -5.07 120.40 117.48 3g7n s VAL 247 Ca 0.00 -0.70 -0.29 0.00 0.00 0.00 0.00 61.98 60.99 3g7n s VAL 247 Cb 0.00 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 3g7n s VAL 247 CO 0.00 0.29 1.05 -0.69 0.00 0.00 0.00 175.10 175.75 3g7n s VAL 248 N 1.43 4.67 0.34 2.92 1.01 -1.26 -1.06 120.40 128.45 3g7n s VAL 248 Ca 0.03 1.97 -0.29 0.00 0.00 0.00 0.00 61.98 63.69 3g7n s VAL 248 Cb -0.15 -4.27 -0.11 0.00 0.00 0.00 0.00 36.38 31.85 3g7n s VAL 248 CO -0.03 -0.07 1.54 0.23 0.00 0.00 0.00 175.10 176.78 3g7n n MET 249 N 5.55 2.71 -0.14 2.72 2.81 -0.41 -1.40 117.12 128.95 3g7n n MET 249 Ca 0.10 0.96 0.00 0.00 -1.81 0.00 0.00 57.70 56.95 3g7n n MET 249 Cb 0.47 -2.71 0.00 0.00 -0.71 0.00 0.00 33.22 30.27 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 1.20 0.00 0.01 4.03 4.77 -1.26 -4.90 117.00 120.85 3g7n n LEU 250 Ca 0.04 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.13 3g7n n LEU 250 Cb 0.38 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.45 3g7n n LEU 250 CO 0.64 0.00 -0.03 0.35 -1.33 0.00 0.00 177.39 177.02 3g7n n THR 251 N -2.00 0.07 0.22 -5.08 -2.24 -0.50 -4.35 114.28 100.40 3g7n n THR 251 Ca 0.00 -0.15 0.10 0.00 -2.27 0.00 0.00 64.05 61.73 3g7n n THR 251 Cb 0.00 0.47 0.45 0.00 -2.10 0.00 0.00 70.33 69.16 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 2.71 1.02 -0.27 6.98 0.00 -1.91 -3.49 119.26 124.30 3g7n h ALA 252 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3g7n h ALA 252 Cb 0.64 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3g7n h ALA 252 CO 0.00 0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.94 3g7n n GLY 253 N 0.16 0.26 0.00 0.00 0.00 -1.26 -4.52 105.19 99.83 3g7n n GLY 253 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.09 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 0.24 0.28 0.31 0.00 0.00 -1.26 -0.63 105.19 104.13 3g7n n GLY 255 Ca 0.00 -0.48 0.01 0.00 0.00 0.00 0.00 46.02 45.55 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 0.66 -0.01 1.61 0.05 -1.93 -3.44 116.97 113.91 3g7n h TYR 256 Ca -0.24 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.53 3g7n h TYR 256 Cb 1.04 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 38.57 3g7n h TYR 256 CO 0.28 0.48 0.00 1.28 -1.05 0.00 0.00 178.16 179.15