#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s7h s ILE 10 N 0.00 5.32 0.13 5.15 1.01 -1.26 -4.95 121.20 126.59 1s7h s ILE 10 Ca 0.00 0.49 -0.07 0.00 0.00 0.00 0.00 60.65 61.07 1s7h s ILE 10 Cb 0.00 -3.60 -0.06 0.00 0.01 0.00 0.00 42.46 38.81 1s7h s ILE 10 CO 0.00 0.42 0.41 0.00 0.00 0.00 0.00 174.94 175.77 1s7h s ALA 11 N 0.31 3.73 0.20 9.38 0.00 -0.98 -4.06 121.76 130.34 1s7h s ALA 11 Ca 0.15 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 51.66 1s7h s ALA 11 Cb -0.13 -2.23 -0.04 0.00 0.00 0.00 0.00 23.12 20.72 1s7h s ALA 11 CO 0.03 0.61 0.12 0.20 0.00 0.00 0.00 175.76 176.72 1s7h s GLY 12 N -2.15 1.42 -0.37 0.00 0.00 0.11 -2.44 107.32 103.89 1s7h s GLY 12 Ca 0.39 -1.69 0.06 0.00 0.00 0.00 0.00 44.72 43.48 1s7h s GLY 12 CO 0.21 -1.40 0.56 -0.12 0.00 0.00 0.00 173.10 172.35 1s7h s PHE 13 N -4.15 -1.42 -0.31 1.90 5.36 0.13 -2.33 117.98 117.16 1s7h s PHE 13 Ca 0.38 0.18 -0.24 0.00 -0.96 0.00 0.00 56.93 56.29 1s7h s PHE 13 Cb 0.07 0.14 0.00 0.00 -0.34 0.00 0.00 43.02 42.90 1s7h s PHE 13 CO 0.11 -1.11 0.83 0.50 -1.46 0.00 0.00 175.22 174.10 1s7h s ARG 14 N 1.97 3.96 0.36 10.12 3.52 -0.94 -1.98 118.95 135.97 1s7h s ARG 14 Ca 0.15 0.64 0.07 0.00 -0.13 0.00 0.00 55.73 56.46 1s7h s ARG 14 Cb -0.08 -3.74 -0.03 0.00 -1.56 0.00 0.00 34.95 29.55 1s7h s ARG 14 CO -0.11 -0.73 0.25 -0.59 -0.81 0.00 0.00 175.30 173.32 1s7h s PHE 15 N 3.08 1.79 -0.05 5.12 -0.12 0.50 0.05 117.98 128.34 1s7h s PHE 15 Ca 0.34 -1.61 -0.15 0.00 -0.05 0.00 0.00 56.93 55.47 1s7h s PHE 15 Cb -0.14 -0.82 0.03 0.00 -0.63 0.00 0.00 43.02 41.46 1s7h s PHE 15 CO 0.13 -0.76 0.34 -1.12 -0.05 0.00 0.00 175.22 173.75 1s7h s SER 16 N -3.44 -0.26 -0.14 1.98 0.01 0.17 -1.11 113.70 110.90 1s7h s SER 16 Ca 0.36 0.31 -0.02 0.00 1.31 0.00 0.00 55.95 57.91 1s7h s SER 16 Cb 0.02 0.45 -0.02 0.00 0.21 0.00 0.00 66.02 66.68 1s7h s SER 16 CO 0.25 -0.35 -0.08 -0.22 0.41 0.00 0.00 173.24 173.25 1s7h s LEU 17 N -0.85 2.99 -0.39 2.44 2.96 -1.26 -2.04 118.68 122.53 1s7h s LEU 17 Ca -0.09 -0.22 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 1s7h s LEU 17 Cb -0.04 -1.69 0.11 0.00 0.50 0.00 0.00 46.19 45.06 1s7h s LEU 17 CO 0.03 0.18 0.13 -0.31 -1.32 0.00 0.00 176.35 175.06 1s7h s TYR 18 N 0.28 3.30 -0.39 5.38 2.02 0.50 -4.96 117.35 123.47 1s7h s TYR 18 Ca -0.06 -2.90 -0.20 0.00 -0.37 0.00 0.00 57.07 53.54 1s7h s TYR 18 Cb -0.15 -2.72 0.01 0.00 -0.40 0.00 0.00 41.96 38.70 1s7h s TYR 18 CO 0.04 -0.87 0.59 -1.25 -1.57 0.00 0.00 175.55 172.49 1s7h s PRO 19 N 0.60 3.46 -1.09 -1.71 0.04 -1.26 -0.98 135.00 134.05 1s7h s PRO 19 Ca 0.13 -0.24 -0.16 0.00 0.04 0.00 0.00 61.00 60.77 1s7h s PRO 19 Cb -0.21 -3.88 -0.07 0.00 0.04 0.00 0.00 34.50 30.38 1s7h s PRO 19 CO -0.07 -0.83 2.14 -1.33 0.04 0.00 0.00 177.00 176.95 1s7h n MET 20 N 6.03 2.22 -3.50 4.56 2.81 -0.50 -4.61 117.12 124.12 1s7h n MET 20 Ca -0.03 -2.07 -0.12 0.00 -1.81 0.00 0.00 57.70 53.68 1s7h n MET 20 Cb 0.48 -2.96 -0.03 0.00 -0.71 0.00 0.00 33.22 30.00 1s7h n MET 20 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1s7h s THR 21 N 3.94 0.03 0.23 2.03 -1.32 -1.26 -4.76 115.64 114.52 1s7h s THR 21 Ca 0.53 -0.21 0.32 0.00 -1.21 0.00 0.00 61.69 61.12 1s7h s THR 21 Cb 0.14 -1.05 0.35 0.00 -1.51 0.00 0.00 72.50 70.43 1s7h s THR 21 CO 0.01 -0.11 2.02 0.44 -2.21 0.00 0.00 174.62 174.77 1s7h h ASP 22 N 2.19 0.00 -1.78 8.08 5.19 -2.03 -3.04 116.42 125.03 1s7h h ASP 22 Ca -0.34 0.00 -0.71 0.00 -0.62 0.00 0.00 57.03 55.37 1s7h h ASP 22 Cb 1.28 0.00 -0.32 0.00 0.18 0.00 0.00 39.33 40.47 1s7h h ASP 22 CO 0.41 0.06 0.49 -0.67 -3.12 0.00 0.00 179.24 176.42 1s7h n ASP 23 N -3.23 6.67 -0.04 6.45 2.03 -1.26 -4.74 116.55 122.43 1s7h n ASP 23 Ca -0.00 -3.80 -0.11 0.00 0.52 0.00 0.00 54.79 51.40 1s7h n ASP 23 Cb 0.29 -0.87 0.03 0.00 -0.72 0.00 0.00 41.12 39.85 1s7h n ASP 23 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 1s7h h PHE 24 N 2.81 0.85 -0.12 -0.67 -0.00 -1.79 -2.47 116.94 115.55 1s7h h PHE 24 Ca 0.49 -0.28 -0.03 0.00 -0.00 0.00 0.00 57.97 58.15 1s7h h PHE 24 Cb 0.36 -0.17 -0.01 0.00 -0.00 0.00 0.00 35.95 36.13 1s7h h PHE 24 CO 1.08 1.04 -0.06 0.82 -0.00 0.00 0.00 178.31 181.20 1s7h h ILE 25 N 0.55 1.12 0.40 0.88 2.04 -1.90 -0.37 117.51 120.23 1s7h h ILE 25 Ca 0.03 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 1s7h h ILE 25 Cb 1.04 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.22 1s7h h ILE 25 CO 0.10 0.16 -0.19 -1.28 0.00 0.00 0.00 178.15 176.94 1s7h h SER 26 N 0.18 -0.46 -0.91 1.72 0.87 -1.92 -2.52 113.55 110.51 1s7h h SER 26 Ca 0.04 0.02 0.15 0.00 -1.23 0.00 0.00 61.79 60.76 1s7h h SER 26 Cb 0.22 0.12 -0.15 0.00 -0.44 0.00 0.00 62.40 62.15 1s7h h SER 26 CO 0.01 -0.12 -0.37 0.58 -0.53 0.00 0.00 176.83 176.41 1s7h h VAL 27 N -0.96 0.04 0.18 2.23 2.07 -1.22 -0.36 116.25 118.23 1s7h h VAL 27 Ca -0.06 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1s7h h VAL 27 Cb 0.41 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1s7h h VAL 27 CO 0.09 0.00 -0.17 0.40 0.02 0.00 0.00 177.57 177.91 1s7h h ILE 28 N -0.03 0.00 -0.99 4.57 2.04 -1.16 -2.72 117.51 119.22 1s7h h ILE 28 Ca 0.33 0.00 0.35 0.00 1.00 0.00 0.00 64.86 66.55 1s7h h ILE 28 Cb 0.60 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.50 1s7h h ILE 28 CO -0.93 0.00 0.41 0.50 0.00 0.00 0.00 178.15 178.13 1s7h h LYS 29 N -0.36 0.08 0.07 2.37 3.64 -0.88 -2.15 116.57 119.35 1s7h h LYS 29 Ca -0.02 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1s7h h LYS 29 Cb 0.31 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1s7h h LYS 29 CO -0.02 0.05 -0.03 1.03 -2.27 0.00 0.00 179.45 178.21 1s7h h SER 30 N 0.08 -0.08 -1.12 4.20 0.87 -0.88 -2.70 113.55 113.92 1s7h h SER 30 Ca 0.75 0.00 0.38 0.00 -1.23 0.00 0.00 61.79 61.69 1s7h h SER 30 Cb 1.82 0.02 -0.14 0.00 -0.44 0.00 0.00 62.40 63.66 1s7h h SER 30 CO -0.76 -0.06 0.67 0.00 -0.53 0.00 0.00 176.83 176.15 1s7h h ALA 31 N -1.95 2.29 0.00 6.23 0.00 -1.09 0.97 119.26 125.71 1s7h h ALA 31 Ca -0.01 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1s7h h ALA 31 Cb 0.07 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1s7h h ALA 31 CO 0.02 -0.93 0.00 1.28 0.00 0.00 0.00 179.25 179.62 1s7h n LEU 32 N -4.93 0.27 -0.09 0.00 4.77 -0.98 -3.23 117.00 112.80 1s7h n LEU 32 Ca 0.34 0.54 -0.21 0.00 -0.03 0.00 0.00 56.01 56.65 1s7h n LEU 32 Cb 1.19 -0.47 -0.12 0.00 -2.33 0.00 0.00 43.42 41.69 1s7h n LEU 32 CO 0.13 -0.18 -0.50 0.50 -1.33 0.00 0.00 177.39 176.01 1s7h h LYS 33 N 0.00 0.03 0.00 3.23 1.63 0.13 -3.35 116.57 118.24 1s7h h LYS 33 Ca 0.00 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 1s7h h LYS 33 Cb 0.47 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1s7h h LYS 33 CO 0.00 1.02 0.00 1.63 -3.45 0.00 0.00 179.45 178.65 1s7h n LYS 34 N -4.35 0.32 -4.40 1.90 5.02 -0.76 -4.66 118.16 111.23 1s7h n LYS 34 Ca -0.31 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.64 1s7h n LYS 34 Cb 0.71 -1.48 -0.12 0.00 -0.02 0.00 0.00 35.03 34.12 1s7h n LYS 34 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1s7h s THR 35 N -2.00 3.96 -1.10 -0.18 2.01 -1.20 -5.05 115.64 112.08 1s7h s THR 35 Ca 0.15 -0.34 -0.20 0.00 0.31 0.00 0.00 61.69 61.61 1s7h s THR 35 Cb 0.07 -2.72 0.09 0.00 0.01 0.00 0.00 72.50 69.94 1s7h s THR 35 CO 0.11 0.51 1.46 -0.62 -0.69 0.00 0.00 174.62 175.39 1s7h s ASP 36 N 0.18 6.69 -0.11 3.53 2.15 -1.26 -4.78 116.67 123.07 1s7h s ASP 36 Ca -0.01 -2.05 0.04 0.00 0.43 0.00 0.00 52.55 50.96 1s7h s ASP 36 Cb -0.14 -2.51 0.31 0.00 -0.30 0.00 0.00 42.92 40.28 1s7h s ASP 36 CO 0.03 -1.22 1.08 0.35 -0.17 0.00 0.00 175.17 175.23 1s7h n THR 37 N 6.16 1.28 0.29 1.71 -2.24 -1.26 -4.06 114.28 116.15 1s7h n THR 37 Ca 0.36 -0.60 0.18 0.00 -2.27 0.00 0.00 64.05 61.72 1s7h n THR 37 Cb 0.48 -0.51 0.77 0.00 -2.10 0.00 0.00 70.33 68.97 1s7h n THR 37 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1s7h h SER 38 N 1.27 0.00 -0.26 3.42 4.64 -2.02 -2.81 113.55 117.79 1s7h h SER 38 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1s7h h SER 38 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1s7h h SER 38 CO 0.25 0.02 0.00 0.29 -0.87 0.00 0.00 176.83 176.52 1s7h n LYS 39 N -3.14 2.10 -3.90 4.77 4.76 -1.26 -4.92 118.16 116.58 1s7h n LYS 39 Ca -0.00 -1.66 -0.11 0.00 -2.87 0.00 0.00 58.31 53.67 1s7h n LYS 39 Cb 0.27 -1.45 -0.13 0.00 -1.84 0.00 0.00 35.03 31.88 1s7h n LYS 39 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1s7h s VAL 40 N -1.67 0.04 -0.06 -0.18 -7.23 -1.06 -4.72 120.40 105.52 1s7h s VAL 40 Ca 0.35 -0.29 -0.30 0.00 -1.81 0.00 0.00 61.98 59.93 1s7h s VAL 40 Cb 0.20 -0.12 -0.03 0.00 0.56 0.00 0.00 36.38 36.99 1s7h s VAL 40 CO 0.29 -0.16 1.09 0.86 -0.31 0.00 0.00 175.10 176.86 1s7h s TRP 41 N -0.48 3.41 0.27 2.82 -0.00 -0.08 -4.85 118.94 120.03 1s7h s TRP 41 Ca -0.05 1.45 0.12 0.00 -0.00 0.00 0.00 56.10 57.61 1s7h s TRP 41 Cb -0.03 -3.28 -0.05 0.00 -0.00 0.00 0.00 33.47 30.11 1s7h s TRP 41 CO -0.00 -0.68 -0.18 0.99 -0.00 0.00 0.00 176.95 177.08 1s7h s THR 42 N 1.87 2.59 -0.29 5.86 2.01 -1.26 -1.15 115.64 125.26 1s7h s THR 42 Ca 0.52 -2.32 -0.14 0.00 0.31 0.00 0.00 61.69 60.06 1s7h s THR 42 Cb -0.22 -2.35 0.13 0.00 0.01 0.00 0.00 72.50 70.07 1s7h s THR 42 CO 0.22 -0.37 0.82 -0.75 -0.69 0.00 0.00 174.62 173.84 1s7h s LYS 43 N -3.46 0.50 0.08 4.92 2.20 -1.04 -5.01 119.74 117.92 1s7h s LYS 43 Ca 0.29 1.03 0.09 0.00 -0.36 0.00 0.00 55.97 57.02 1s7h s LYS 43 Cb -0.05 0.37 -0.03 0.00 -1.51 0.00 0.00 37.83 36.61 1s7h s LYS 43 CO 0.15 -0.13 -0.22 0.99 -0.36 0.00 0.00 175.35 175.77 1s7h s THR 44 N 2.05 2.50 0.00 3.43 2.01 -1.26 -1.30 115.64 123.07 1s7h s THR 44 Ca -0.07 -1.43 0.00 0.00 0.31 0.00 0.00 61.69 60.50 1s7h s THR 44 Cb -0.07 -2.06 0.00 0.00 0.01 0.00 0.00 72.50 70.38 1s7h s THR 44 CO -0.18 0.25 0.00 -0.90 -0.69 0.00 0.00 174.62 173.10 1s7h n ASP 45 N 1.33 0.41 -0.33 3.53 3.85 -0.35 -5.01 116.55 119.98 1s7h n ASP 45 Ca -0.17 -0.98 -0.04 0.00 -0.71 0.00 0.00 54.79 52.89 1s7h n ASP 45 Cb 0.52 0.00 0.08 0.00 -1.35 0.00 0.00 41.12 40.38 1s7h n ASP 45 CO 0.00 0.00 0.00 1.12 -1.01 0.00 0.00 177.20 177.31 1s7h h HIS 46 N 0.98 1.24 0.15 2.11 2.07 -2.05 -3.28 115.15 116.37 1s7h h HIS 46 Ca 0.00 -0.04 -0.34 0.00 -2.85 0.00 0.00 60.37 57.15 1s7h h HIS 46 Cb 0.00 -0.39 -0.00 0.00 2.57 0.00 0.00 27.41 29.58 1s7h h HIS 46 CO 0.00 0.87 -1.71 0.82 -3.07 0.00 0.00 177.93 174.83 1s7h h ILE 47 N 1.25 0.96 -2.97 6.12 2.04 -1.99 -3.50 117.51 119.42 1s7h h ILE 47 Ca 0.31 -2.59 0.01 0.00 1.00 0.00 0.00 64.86 63.59 1s7h h ILE 47 Cb 0.05 2.71 -0.01 0.00 -0.74 0.00 0.00 36.82 38.83 1s7h h ILE 47 CO -0.05 0.83 0.29 -0.94 0.00 0.00 0.00 178.15 178.28 1s7h s SER 48 N -7.09 -0.04 -0.07 1.72 1.04 -1.24 -4.84 113.70 103.18 1s7h s SER 48 Ca -0.14 -1.03 0.05 0.00 0.48 0.00 0.00 55.95 55.31 1s7h s SER 48 Cb 0.06 0.81 -0.01 0.00 0.10 0.00 0.00 66.02 66.99 1s7h s SER 48 CO 0.84 -1.59 -0.23 -0.89 0.98 0.00 0.00 173.24 172.34 1s7h s THR 49 N -2.55 1.96 -0.10 2.02 2.01 -0.27 -1.21 115.64 117.49 1s7h s THR 49 Ca 0.15 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 61.17 1s7h s THR 49 Cb -0.05 -1.67 -0.02 0.00 0.01 0.00 0.00 72.50 70.77 1s7h s THR 49 CO 0.10 0.54 -0.15 0.54 -0.69 0.00 0.00 174.62 174.97 1s7h s VAL 50 N 0.03 2.91 -0.13 3.82 0.11 -0.42 -0.37 120.40 126.36 1s7h s VAL 50 Ca -0.09 -0.73 -0.01 0.00 -2.93 0.00 0.00 61.98 58.22 1s7h s VAL 50 Cb -0.15 -2.19 -0.02 0.00 -1.53 0.00 0.00 36.38 32.49 1s7h s VAL 50 CO 0.05 0.55 -0.08 -0.76 -3.33 0.00 0.00 175.10 171.52 1s7h s LEU 51 N 0.05 3.00 -0.11 2.54 1.43 -0.84 -2.50 118.68 122.25 1s7h s LEU 51 Ca -0.06 -0.19 -0.01 0.00 -1.03 0.00 0.00 54.13 52.84 1s7h s LEU 51 Cb -0.15 -1.69 0.03 0.00 0.03 0.00 0.00 46.19 44.42 1s7h s LEU 51 CO 0.05 0.21 -0.02 -0.13 0.23 0.00 0.00 176.35 176.69 1s7h s ARG 52 N 0.11 0.92 0.00 1.70 0.52 -0.30 -0.70 118.95 121.20 1s7h s ARG 52 Ca -0.03 -0.13 0.00 0.00 -0.52 0.00 0.00 55.73 55.04 1s7h s ARG 52 Cb -0.14 -1.42 0.00 0.00 0.52 0.00 0.00 34.95 33.91 1s7h s ARG 52 CO 0.04 -0.36 0.00 0.41 0.02 0.00 0.00 175.30 175.40 1s7h n GLY 53 N 5.05 3.18 3.98 -3.53 0.00 -1.02 -0.91 105.19 111.95 1s7h n GLY 53 Ca -0.09 -0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.52 1s7h n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1s7h s SER 54 N 2.00 4.84 0.27 1.61 1.04 -1.26 -2.33 113.70 119.87 1s7h s SER 54 Ca 0.00 -0.13 -0.03 0.00 0.48 0.00 0.00 55.95 56.27 1s7h s SER 54 Cb 0.00 -0.52 0.37 0.00 0.10 0.00 0.00 66.02 65.98 1s7h s SER 54 CO 0.00 -1.49 1.93 0.40 0.98 0.00 0.00 173.24 175.06 1s7h h ILE 55 N -0.24 1.20 0.68 -1.02 2.04 -1.92 -1.37 117.51 116.88 1s7h h ILE 55 Ca -0.40 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.01 1s7h h ILE 55 Cb 1.29 -0.13 0.01 0.00 -0.74 0.00 0.00 36.82 37.24 1s7h h ILE 55 CO 0.48 0.22 -0.33 0.44 0.00 0.00 0.00 178.15 178.96 1s7h h ASP 56 N 1.22 -0.77 -0.49 1.72 3.32 -1.98 -0.98 116.42 118.46 1s7h h ASP 56 Ca 0.36 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.40 1s7h h ASP 56 Cb -0.06 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1s7h h ASP 56 CO -0.10 -0.55 0.19 0.45 -1.72 0.00 0.00 179.24 177.52 1s7h h HIS 57 N -0.93 0.74 -0.11 4.55 3.86 -1.86 -0.83 115.15 120.57 1s7h h HIS 57 Ca -0.09 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.06 1s7h h HIS 57 Cb 0.70 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 1s7h h HIS 57 CO -0.02 0.63 0.06 0.28 0.86 0.00 0.00 177.93 179.73 1s7h h VAL 58 N 0.64 1.10 0.00 2.45 2.07 -1.25 0.24 116.25 121.50 1s7h h VAL 58 Ca 0.16 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1s7h h VAL 58 Cb 0.20 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1s7h h VAL 58 CO -0.01 0.09 0.00 -0.26 0.02 0.00 0.00 177.57 177.41 1s7h h PHE 59 N 0.08 0.00 0.09 1.57 0.04 -1.16 -0.82 116.94 116.75 1s7h h PHE 59 Ca 0.04 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.81 1s7h h PHE 59 Cb 0.09 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.24 1s7h h PHE 59 CO -0.04 0.00 -0.04 0.22 -0.60 0.00 0.00 178.31 177.85 1s7h h ASP 60 N 0.00 -0.10 -0.09 2.17 3.58 -0.31 -2.65 116.42 119.01 1s7h h ASP 60 Ca 0.00 -0.47 -0.00 0.00 0.42 0.00 0.00 57.03 56.98 1s7h h ASP 60 Cb 0.51 0.03 -0.00 0.00 1.72 0.00 0.00 39.33 41.58 1s7h h ASP 60 CO 0.00 0.54 0.06 0.00 -2.88 0.00 0.00 179.24 176.96 1s7h h ALA 61 N -0.26 0.12 -0.29 -0.78 0.00 -0.42 -2.07 119.26 115.55 1s7h h ALA 61 Ca -0.01 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1s7h h ALA 61 Cb 0.57 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1s7h h ALA 61 CO 0.02 -0.37 -0.11 0.00 0.00 0.00 0.00 179.25 178.79 1s7h h ALA 62 N 1.00 0.14 -0.36 0.00 0.00 -1.26 0.37 119.26 119.15 1s7h h ALA 62 Ca 0.03 0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1s7h h ALA 62 Cb 0.02 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1s7h h ALA 62 CO -0.01 -0.51 -0.09 -0.22 0.00 0.00 0.00 179.25 178.43 1s7h h LYS 63 N -0.06 0.61 -0.29 0.00 3.64 -1.39 -2.26 116.57 116.82 1s7h h LYS 63 Ca 0.15 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1s7h h LYS 63 Cb 0.28 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1s7h h LYS 63 CO -0.33 0.70 0.11 0.00 -2.27 0.00 0.00 179.45 177.65 1s7h h ALA 64 N 1.34 0.37 -0.46 5.00 0.00 -0.58 -0.61 119.26 124.32 1s7h h ALA 64 Ca 0.11 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1s7h h ALA 64 Cb 0.49 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1s7h h ALA 64 CO 0.03 -0.02 0.20 0.82 0.00 0.00 0.00 179.25 180.27 1s7h h ILE 65 N 0.31 1.20 0.34 0.00 2.04 -0.84 -1.86 117.51 118.71 1s7h h ILE 65 Ca 0.10 -0.60 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 1s7h h ILE 65 Cb 0.19 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1s7h h ILE 65 CO -0.01 0.23 -0.16 0.22 0.00 0.00 0.00 178.15 178.43 1s7h h TYR 66 N 0.60 -0.42 -0.40 1.37 3.20 -1.25 -2.17 116.97 117.90 1s7h h TYR 66 Ca 0.16 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.10 1s7h h TYR 66 Cb 0.17 0.14 -0.08 0.00 1.54 0.00 0.00 36.73 38.50 1s7h h TYR 66 CO -0.00 -0.24 -0.15 -0.07 -1.64 0.00 0.00 178.16 176.06 1s7h h LEU 67 N -0.49 -0.54 0.40 2.82 -0.00 -1.00 0.17 115.31 116.68 1s7h h LEU 67 Ca -0.05 0.14 -0.02 0.00 -0.00 0.00 0.00 57.88 57.96 1s7h h LEU 67 Cb 0.37 0.31 -0.01 0.00 -0.00 0.00 0.00 40.66 41.33 1s7h h LEU 67 CO 0.08 -0.19 -0.28 0.45 -0.00 0.00 0.00 178.44 178.50 1s7h h HIS 68 N -0.07 -0.76 -0.89 1.13 3.86 -1.28 -1.17 115.15 115.96 1s7h h HIS 68 Ca 0.20 -0.00 0.22 0.00 -1.16 0.00 0.00 60.37 59.62 1s7h h HIS 68 Cb 0.37 0.28 -0.12 0.00 1.06 0.00 0.00 27.41 29.00 1s7h h HIS 68 CO -0.40 -0.40 0.39 0.00 0.86 0.00 0.00 177.93 178.37 1s7h h ALA 69 N -1.43 1.42 -0.55 2.45 0.00 -1.24 -0.07 119.26 119.85 1s7h h ALA 69 Ca -0.05 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1s7h h ALA 69 Cb 0.53 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1s7h h ALA 69 CO 0.03 -0.34 0.04 0.00 0.00 0.00 0.00 179.25 178.98 1s7h h ALA 70 N 1.71 1.04 0.00 0.00 0.00 -0.46 -2.22 119.26 119.33 1s7h h ALA 70 Ca 0.56 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1s7h h ALA 70 Cb 1.05 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1s7h h ALA 70 CO -0.53 0.61 0.00 0.09 0.00 0.00 0.00 179.25 179.42 1s7h n ASN 71 N -4.21 0.00 0.00 0.00 4.13 -0.05 -2.19 115.26 112.93 1s7h n ASN 71 Ca 0.03 -0.37 0.14 0.00 1.68 0.00 0.00 54.58 56.06 1s7h n ASN 71 Cb 0.30 -0.05 0.83 0.00 -1.54 0.00 0.00 39.78 39.31 1s7h n ASN 71 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1s7h n SER 72 N -1.05 0.00 0.00 6.41 3.41 -0.84 -4.83 113.62 116.72 1s7h n SER 72 Ca 0.11 -0.72 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 1s7h n SER 72 Cb 0.06 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1s7h n SER 72 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1s7h n GLU 73 N -1.07 0.00 -3.19 4.33 1.02 -0.93 -4.95 120.64 115.85 1s7h n GLU 73 Ca 0.20 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.95 1s7h n GLU 73 Cb 0.13 -3.58 -0.06 0.00 -0.02 0.00 0.00 31.44 27.91 1s7h n GLU 73 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1s7h s GLN 74 N -0.51 4.31 -0.20 3.49 -1.52 -1.26 -4.99 119.66 118.97 1s7h s GLN 74 Ca 0.00 0.84 -0.29 0.00 -1.95 0.00 0.00 55.36 53.96 1s7h s GLN 74 Cb 0.00 -3.26 -0.03 0.00 -0.22 0.00 0.00 33.01 29.50 1s7h s GLN 74 CO 0.00 0.58 1.63 -1.58 -0.25 0.00 0.00 175.29 175.68 1s7h s HIS 75 N -0.99 2.07 0.01 0.91 5.65 -1.26 -4.59 115.29 117.09 1s7h s HIS 75 Ca 0.31 0.50 -0.01 0.00 0.25 0.00 0.00 55.06 56.11 1s7h s HIS 75 Cb -0.20 -3.97 -0.01 0.00 -1.18 0.00 0.00 32.58 27.22 1s7h s HIS 75 CO 0.21 -3.08 0.01 -1.50 -0.65 0.00 0.00 174.74 169.73 1s7h s ILE 76 N 5.11 0.06 -0.03 0.89 -1.16 0.53 -1.41 121.20 125.19 1s7h s ILE 76 Ca 0.72 -0.49 0.07 0.00 -0.51 0.00 0.00 60.65 60.43 1s7h s ILE 76 Cb -0.26 -0.19 -0.01 0.00 0.61 0.00 0.00 42.46 42.61 1s7h s ILE 76 CO 0.29 -0.27 -0.23 -0.69 -2.81 0.00 0.00 174.94 171.23 1s7h s VAL 77 N -0.81 1.80 -0.22 4.00 1.01 -0.15 -0.25 120.40 125.78 1s7h s VAL 77 Ca -0.09 -0.96 -0.06 0.00 0.00 0.00 0.00 61.98 60.87 1s7h s VAL 77 Cb -0.06 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1s7h s VAL 77 CO -0.00 0.51 0.03 -0.32 0.00 0.00 0.00 175.10 175.31 1s7h s MET 78 N -0.40 3.63 -0.09 2.72 1.75 -0.05 -0.37 119.30 126.49 1s7h s MET 78 Ca 0.05 -0.50 -0.00 0.00 -1.25 0.00 0.00 55.69 53.98 1s7h s MET 78 Cb -0.10 -3.18 0.02 0.00 2.84 0.00 0.00 34.83 34.41 1s7h s MET 78 CO 0.00 -0.07 -0.05 1.21 -0.65 0.00 0.00 175.02 175.46 1s7h s ASN 79 N 1.26 1.78 0.27 1.11 3.84 -0.86 -0.43 114.94 121.90 1s7h s ASN 79 Ca 0.04 -0.20 -0.20 0.00 0.21 0.00 0.00 52.86 52.71 1s7h s ASN 79 Cb -0.15 -0.65 0.05 0.00 -0.55 0.00 0.00 41.25 39.96 1s7h s ASN 79 CO 0.02 -0.13 0.86 -0.83 -2.79 0.00 0.00 177.10 174.23 1s7h s GLY 80 N 1.63 0.08 -0.12 1.21 0.00 -0.95 -0.66 107.32 108.51 1s7h s GLY 80 Ca 0.02 -0.38 0.01 0.00 0.00 0.00 0.00 44.72 44.37 1s7h s GLY 80 CO -0.05 0.37 -0.15 -1.59 0.00 0.00 0.00 173.10 171.67 1s7h s THR 81 N -2.88 1.53 -0.06 0.90 2.01 0.11 -1.05 115.64 116.19 1s7h s THR 81 Ca 0.15 -0.64 -0.20 0.00 0.31 0.00 0.00 61.69 61.31 1s7h s THR 81 Cb -0.04 -1.41 -0.05 0.00 0.01 0.00 0.00 72.50 71.01 1s7h s THR 81 CO 0.07 0.45 0.58 -0.36 -0.69 0.00 0.00 174.62 174.67 1s7h s PHE 82 N 1.17 3.60 0.06 4.92 0.08 0.12 -2.21 117.98 125.72 1s7h s PHE 82 Ca -0.02 1.11 0.03 0.00 0.12 0.00 0.00 56.93 58.17 1s7h s PHE 82 Cb -0.14 -2.64 -0.03 0.00 -0.57 0.00 0.00 43.02 39.64 1s7h s PHE 82 CO -0.05 0.23 -0.10 0.45 -0.10 0.00 0.00 175.22 175.65 1s7h s SER 83 N 0.32 1.18 -0.18 1.36 0.15 -0.98 -0.53 113.70 115.01 1s7h s SER 83 Ca 0.31 -0.65 -0.28 0.00 0.70 0.00 0.00 55.95 56.02 1s7h s SER 83 Cb -0.17 0.02 0.10 0.00 -1.71 0.00 0.00 66.02 64.25 1s7h s SER 83 CO 0.15 -0.21 0.85 -0.51 1.20 0.00 0.00 173.24 174.72 1s7h s ILE 84 N -1.76 0.00 0.00 6.45 2.07 -0.78 -0.71 121.20 126.47 1s7h s ILE 84 Ca -0.03 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.21 1s7h s ILE 84 Cb -0.07 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.52 1s7h s ILE 84 CO 0.00 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.64 1s7h n GLY 85 N 1.54 0.48 3.64 1.50 0.00 -1.24 -1.60 105.19 109.52 1s7h n GLY 85 Ca -0.14 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.37 1s7h n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7h n PRO 87 N 3.76 2.22 -0.80 0.00 -0.02 -1.26 -0.39 135.00 138.51 1s7h n PRO 87 Ca 0.20 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 1s7h n PRO 87 Cb 0.22 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 30.99 1s7h n PRO 87 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s7h n GLY 88 N 4.57 0.53 3.53 -1.23 0.00 -1.26 -4.96 105.19 106.36 1s7h n GLY 88 Ca 0.23 -0.69 -0.45 0.00 0.00 0.00 0.00 46.02 45.11 1s7h n GLY 88 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1s7h n ASP 89 N 1.25 2.65 -4.40 1.61 4.64 0.48 -4.82 116.55 117.95 1s7h n ASP 89 Ca 0.00 0.22 -0.47 0.00 -1.38 0.00 0.00 54.79 53.16 1s7h n ASP 89 Cb 0.00 -1.43 -0.02 0.00 -1.04 0.00 0.00 41.12 38.63 1s7h n ASP 89 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1s7h n THR 90 N 7.56 1.82 -1.69 5.18 -2.24 -1.26 -4.79 114.28 118.87 1s7h n THR 90 Ca 0.36 -0.50 -0.33 0.00 -2.27 0.00 0.00 64.05 61.31 1s7h n THR 90 Cb 0.36 -0.08 -0.04 0.00 -2.10 0.00 0.00 70.33 68.47 1s7h n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s7h n GLN 91 N 1.01 3.55 0.00 -0.78 1.13 -1.26 -4.85 117.38 116.19 1s7h n GLN 91 Ca 0.16 -2.78 0.00 0.00 -1.94 0.00 0.00 57.00 52.44 1s7h n GLN 91 Cb 0.28 -2.42 0.00 0.00 0.11 0.00 0.00 30.24 28.20 1s7h n GLN 91 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1s7h n GLY 92 N 1.62 4.21 3.68 1.08 0.00 -1.26 -4.99 105.19 109.53 1s7h n GLY 92 Ca 0.57 -0.81 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 1s7h n GLY 92 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1s7h n ASP 93 N 0.00 -0.72 -3.77 1.61 8.00 -1.26 -4.89 116.55 115.52 1s7h n ASP 93 Ca 0.00 -0.69 -0.11 0.00 0.71 0.00 0.00 54.79 54.69 1s7h n ASP 93 Cb 0.00 -0.85 -0.07 0.00 -0.02 0.00 0.00 41.12 40.18 1s7h n ASP 93 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1s7h s THR 94 N -3.96 0.09 0.00 -3.53 -1.32 -1.26 -4.65 115.64 101.01 1s7h s THR 94 Ca 0.12 -0.73 0.00 0.00 -1.21 0.00 0.00 61.69 59.87 1s7h s THR 94 Cb -0.07 -0.95 0.00 0.00 -1.51 0.00 0.00 72.50 69.97 1s7h s THR 94 CO 0.53 -0.40 0.00 0.00 -2.21 0.00 0.00 174.62 172.54 1s7h n TYR 95 N 0.55 0.00 0.00 9.09 9.36 -1.17 -4.81 117.16 130.18 1s7h n TYR 95 Ca -0.18 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.04 1s7h n TYR 95 Cb 0.60 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.31 1s7h n TYR 95 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 1s7h n LYS 101 N 0.00 0.00 -2.96 2.98 4.81 -1.26 -4.60 118.16 117.13 1s7h n LYS 101 Ca 0.00 0.00 -0.44 0.00 -0.87 0.00 0.00 58.31 57.00 1s7h n LYS 101 Cb 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.04 1s7h n LYS 101 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1s7h s ARG 102 N 0.00 3.87 0.25 1.64 0.52 -1.26 -4.88 118.95 119.09 1s7h s ARG 102 Ca 0.00 -2.25 -0.12 0.00 -0.52 0.00 0.00 55.73 52.84 1s7h s ARG 102 Cb 0.00 -4.97 0.35 0.00 0.52 0.00 0.00 34.95 30.85 1s7h s ARG 102 CO 0.00 -1.74 1.56 -0.39 0.02 0.00 0.00 175.30 174.75 1s7h h VAL 103 N 5.13 0.04 0.00 3.52 -1.51 -1.97 0.47 116.25 121.93 1s7h h VAL 103 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.71 1s7h h VAL 103 Cb 0.94 0.04 0.00 0.00 -2.13 0.00 0.00 31.29 30.14 1s7h h VAL 103 CO 1.17 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 178.10 1s7h n ASN 104 N -5.55 0.00 0.05 4.19 3.02 -1.26 -3.85 115.26 111.86 1s7h n ASN 104 Ca 0.13 -0.21 -0.11 0.00 -0.03 0.00 0.00 54.58 54.36 1s7h n ASN 104 Cb 0.45 -0.23 -0.04 0.00 -0.61 0.00 0.00 39.78 39.35 1s7h n ASN 104 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1s7h h GLU 105 N 0.00 -0.38 0.92 3.52 4.81 -0.42 -1.31 114.58 121.73 1s7h h GLU 105 Ca 0.00 0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 1s7h h GLU 105 Cb 0.18 0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.65 1s7h h GLU 105 CO 0.00 -0.25 -0.45 -0.44 -0.73 0.00 0.00 179.01 177.14 1s7h h ASP 106 N -0.39 -1.07 -0.99 1.04 3.32 -1.72 -1.58 116.42 115.02 1s7h h ASP 106 Ca 0.07 0.04 0.17 0.00 0.02 0.00 0.00 57.03 57.33 1s7h h ASP 106 Cb 0.49 0.28 -0.10 0.00 0.22 0.00 0.00 39.33 40.22 1s7h h ASP 106 CO -0.26 -0.75 0.62 0.00 -1.72 0.00 0.00 179.24 177.13 1s7h h ALA 107 N -1.15 1.69 -0.00 3.45 0.00 -1.76 -2.67 119.26 118.82 1s7h h ALA 107 Ca -0.13 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1s7h h ALA 107 Cb 0.96 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1s7h h ALA 107 CO 0.20 -0.02 -0.62 1.55 0.00 0.00 0.00 179.25 180.37 1s7h n VAL 108 N -4.70 0.00 -0.30 0.00 3.14 -0.50 -4.44 118.33 111.54 1s7h n VAL 108 Ca 0.22 -0.04 0.12 0.00 -2.96 0.00 0.00 64.34 61.68 1s7h n VAL 108 Cb 0.53 0.57 0.28 0.00 -1.06 0.00 0.00 33.84 34.16 1s7h n VAL 108 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 1s7h h ARG 109 N 0.35 0.19 0.00 1.45 2.43 -0.91 -0.88 114.38 117.00 1s7h h ARG 109 Ca 0.00 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.06 1s7h h ARG 109 Cb 0.52 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1s7h h ARG 109 CO 0.00 0.12 -0.48 0.78 -1.51 0.00 0.00 179.97 178.88 1s7h h GLY 110 N 0.19 0.00 -4.29 2.80 0.00 -1.78 -3.46 103.07 96.53 1s7h h GLY 110 Ca 0.54 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 47.35 1s7h h GLY 110 CO -0.66 0.00 0.80 1.08 0.00 0.00 0.00 176.54 177.76 1s7h s LEU 111 N -6.78 4.37 0.08 3.11 1.02 -0.34 -5.04 118.68 115.11 1s7h s LEU 111 Ca 0.02 2.73 0.08 0.00 0.02 0.00 0.00 54.13 56.98 1s7h s LEU 111 Cb 0.09 -3.62 -0.03 0.00 0.02 0.00 0.00 46.19 42.65 1s7h s LEU 111 CO 0.72 -0.77 -0.21 -0.75 0.02 0.00 0.00 176.35 175.36 1s7h s LYS 112 N -0.24 1.23 -0.29 1.70 2.36 -1.26 -4.94 119.74 118.29 1s7h s LYS 112 Ca 0.61 -1.09 -0.17 0.00 -2.55 0.00 0.00 55.97 52.78 1s7h s LYS 112 Cb -0.44 -1.45 0.18 0.00 -1.05 0.00 0.00 37.83 35.07 1s7h s LYS 112 CO 0.43 0.35 1.12 0.00 1.55 0.00 0.00 175.35 178.80 1s7h s ALA 113 N -1.03 -2.44 0.22 3.13 0.00 -1.26 -4.80 121.76 115.58 1s7h s ALA 113 Ca 0.07 2.07 -0.30 0.00 0.00 0.00 0.00 51.96 53.80 1s7h s ALA 113 Cb -0.10 -1.83 -0.09 0.00 0.00 0.00 0.00 23.12 21.10 1s7h s ALA 113 CO 0.03 -0.32 1.41 -1.21 0.00 0.00 0.00 175.76 175.68 1s7h s GLU 114 N 1.10 4.30 -0.56 0.00 0.41 -1.26 0.30 118.70 122.99 1s7h s GLU 114 Ca -0.07 2.22 0.06 0.00 -0.41 0.00 0.00 54.97 56.76 1s7h s GLU 114 Cb -0.03 -3.15 0.31 0.00 -1.78 0.00 0.00 34.13 29.48 1s7h s GLU 114 CO -0.12 -0.39 0.85 0.00 -0.49 0.00 0.00 175.26 175.11 1s7h n ALA 115 N 2.68 4.12 -1.69 5.21 0.00 0.42 -4.62 120.51 126.63 1s7h n ALA 115 Ca 0.08 -4.52 -0.44 0.00 0.00 0.00 0.00 53.44 48.56 1s7h n ALA 115 Cb 0.41 -0.80 -0.03 0.00 0.00 0.00 0.00 19.45 19.02 1s7h n ALA 115 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1s7h n PRO 116 N 0.19 2.56 -4.07 0.00 -0.04 -1.26 -4.39 135.00 128.00 1s7h n PRO 116 Ca 0.30 0.93 -0.09 0.00 -0.04 0.00 0.00 63.50 64.59 1s7h n PRO 116 Cb 0.43 -2.77 -0.11 0.00 -0.04 0.00 0.00 33.50 31.02 1s7h n PRO 116 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1s7h s GLN 118 N -2.71 1.22 0.24 0.00 -0.21 -0.96 -0.36 119.66 116.88 1s7h s GLN 118 Ca -0.02 -0.14 0.05 0.00 0.02 0.00 0.00 55.36 55.26 1s7h s GLN 118 Cb -0.01 -1.36 -0.05 0.00 1.00 0.00 0.00 33.01 32.59 1s7h s GLN 118 CO -0.04 -0.26 -0.03 -0.59 -2.12 0.00 0.00 175.29 172.25 1s7h s PHE 119 N 1.72 1.67 -0.12 0.91 -0.12 -0.56 -1.38 117.98 120.10 1s7h s PHE 119 Ca 0.04 -0.84 -0.06 0.00 -0.05 0.00 0.00 56.93 56.02 1s7h s PHE 119 Cb -0.13 -0.96 0.05 0.00 -0.63 0.00 0.00 43.02 41.36 1s7h s PHE 119 CO -0.06 0.07 0.28 0.00 -0.05 0.00 0.00 175.22 175.46 1s7h s ALA 120 N -3.28 -0.65 -0.12 1.99 0.00 -0.53 -1.08 121.76 118.09 1s7h s ALA 120 Ca 0.28 1.08 -0.11 0.00 0.00 0.00 0.00 51.96 53.20 1s7h s ALA 120 Cb 0.05 -0.79 -0.05 0.00 0.00 0.00 0.00 23.12 22.33 1s7h s ALA 120 CO 0.09 -0.33 0.25 -1.17 0.00 0.00 0.00 175.76 174.60 1s7h s LEU 121 N 1.60 4.33 -0.49 0.00 2.96 -1.26 -0.90 118.68 124.92 1s7h s LEU 121 Ca -0.07 0.54 0.03 0.00 -0.22 0.00 0.00 54.13 54.42 1s7h s LEU 121 Cb -0.11 -2.28 0.14 0.00 0.50 0.00 0.00 46.19 44.44 1s7h s LEU 121 CO -0.09 0.24 0.30 -0.31 -1.32 0.00 0.00 176.35 175.17 1s7h s TYR 122 N -0.28 2.23 -0.19 5.38 2.02 0.78 -4.98 117.35 122.31 1s7h s TYR 122 Ca 0.16 -2.62 -0.29 0.00 -0.37 0.00 0.00 57.07 53.95 1s7h s TYR 122 Cb -0.13 -1.97 -0.01 0.00 -0.40 0.00 0.00 41.96 39.45 1s7h s TYR 122 CO 0.05 -0.75 1.17 -2.14 -1.57 0.00 0.00 175.55 172.31 1s7h s PRO 123 N -0.04 4.25 0.23 -1.71 0.02 -1.26 -2.13 135.00 134.37 1s7h s PRO 123 Ca 0.21 1.54 -0.19 0.00 0.02 0.00 0.00 61.00 62.57 1s7h s PRO 123 Cb -0.18 -3.70 -0.08 0.00 0.02 0.00 0.00 34.50 30.56 1s7h s PRO 123 CO -0.05 -0.66 0.72 -1.64 -0.33 0.00 0.00 177.00 175.04 1s7h s MET 124 N 3.30 4.22 -1.60 5.54 -1.94 -0.02 -3.98 119.30 124.83 1s7h s MET 124 Ca 0.50 0.84 -0.10 0.00 -1.71 0.00 0.00 55.69 55.22 1s7h s MET 124 Cb -0.19 -2.83 0.09 0.00 2.01 0.00 0.00 34.83 33.91 1s7h s MET 124 CO 0.12 0.37 0.56 -1.71 -0.01 0.00 0.00 175.02 174.34 1s7h n ASN 125 N 0.60 -1.70 -3.95 3.03 5.15 -1.26 -4.66 115.26 112.46 1s7h n ASN 125 Ca -0.02 -1.06 -0.31 0.00 -0.60 0.00 0.00 54.58 52.60 1s7h n ASN 125 Cb 0.51 -2.65 -0.15 0.00 -0.53 0.00 0.00 39.78 36.96 1s7h n ASN 125 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1s7h s GLU 126 N -6.88 1.33 0.44 1.20 2.56 -1.26 -4.99 118.70 111.10 1s7h s GLU 126 Ca 0.41 -1.74 0.22 0.00 0.00 0.00 0.00 54.97 53.86 1s7h s GLU 126 Cb -0.23 -2.94 1.19 0.00 2.00 0.00 0.00 34.13 34.16 1s7h s GLU 126 CO 0.93 -0.96 1.82 -1.35 -0.56 0.00 0.00 175.26 175.14 1s7h h PRO 127 N 7.65 0.30 -0.88 4.30 0.11 -1.92 -0.58 132.00 140.98 1s7h h PRO 127 Ca -0.06 -0.02 -0.33 0.00 0.11 0.00 0.00 66.00 65.70 1s7h h PRO 127 Cb 1.01 -0.07 -0.20 0.00 0.11 0.00 0.00 31.00 31.86 1s7h h PRO 127 CO 0.52 0.20 0.42 -3.47 -0.21 0.00 0.00 178.00 175.46 1s7h n ASP 128 N -4.50 4.25 -0.17 -2.05 2.03 -1.26 -4.67 116.55 110.18 1s7h n ASP 128 Ca 0.22 -3.30 0.07 0.00 0.52 0.00 0.00 54.79 52.30 1s7h n ASP 128 Cb 0.87 -0.77 0.37 0.00 -0.72 0.00 0.00 41.12 40.86 1s7h n ASP 128 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 1s7h h TYR 129 N 1.82 0.73 0.00 -0.67 -0.00 -1.43 0.14 116.97 117.56 1s7h h TYR 129 Ca 0.41 0.02 -0.03 0.00 0.00 0.00 0.00 58.73 59.12 1s7h h TYR 129 Cb 2.48 -0.24 -0.00 0.00 0.00 0.00 0.00 36.73 38.97 1s7h h TYR 129 CO 1.35 0.38 -0.16 0.52 -0.00 0.00 0.00 178.16 180.25 1s7h h MET 130 N 0.72 0.00 -0.13 0.10 2.86 -1.85 -1.97 114.93 114.65 1s7h h MET 130 Ca 0.31 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.76 1s7h h MET 130 Cb 0.30 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.97 1s7h h MET 130 CO -0.10 0.16 -0.67 0.78 1.06 0.00 0.00 176.91 178.14 1s7h h GLY 131 N 1.08 0.76 1.70 8.32 0.00 -1.34 -2.47 103.07 111.12 1s7h h GLY 131 Ca -0.00 -1.07 -0.07 0.00 0.00 0.00 0.00 47.33 46.18 1s7h h GLY 131 CO 0.02 0.95 -0.19 1.41 0.00 0.00 0.00 176.54 178.73 1s7h h LEU 132 N 0.37 0.35 -0.43 3.11 4.07 -1.13 -0.44 115.31 121.21 1s7h h LEU 132 Ca -0.05 -0.10 -0.16 0.00 0.08 0.00 0.00 57.88 57.66 1s7h h LEU 132 Cb 1.31 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.95 1s7h h LEU 132 CO 0.14 0.56 -0.44 0.40 -1.08 0.00 0.00 178.44 178.01 1s7h h ILE 133 N 0.32 1.28 -0.65 1.22 2.04 -1.36 0.43 117.51 120.79 1s7h h ILE 133 Ca 0.06 -1.63 -0.08 0.00 1.00 0.00 0.00 64.86 64.21 1s7h h ILE 133 Cb 0.53 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 1s7h h ILE 133 CO 0.04 0.53 0.09 -0.03 0.00 0.00 0.00 178.15 178.78 1s7h h MET 134 N 0.66 1.09 -0.69 2.37 4.05 -1.09 -1.94 114.93 119.38 1s7h h MET 134 Ca 0.04 -0.30 -0.08 0.00 -0.28 0.00 0.00 59.70 59.08 1s7h h MET 134 Cb 1.02 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 31.67 1s7h h MET 134 CO 0.10 1.01 0.14 1.49 0.23 0.00 0.00 176.91 179.88 1s7h h GLU 135 N 1.01 1.13 -0.98 0.39 4.81 -0.82 -2.44 114.58 117.67 1s7h h GLU 135 Ca 0.20 -0.29 0.10 0.00 -0.13 0.00 0.00 59.36 59.23 1s7h h GLU 135 Cb 0.46 -0.14 -0.08 0.00 0.63 0.00 0.00 28.75 29.63 1s7h h GLU 135 CO 0.02 1.01 0.62 0.00 -0.73 0.00 0.00 179.01 179.92 1s7h h ALA 136 N 1.08 1.42 0.07 2.92 0.00 -0.23 -0.67 119.26 123.86 1s7h h ALA 136 Ca 0.21 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1s7h h ALA 136 Cb 0.41 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1s7h h ALA 136 CO 0.01 0.29 -0.03 0.28 0.00 0.00 0.00 179.25 179.80 1s7h h VAL 137 N 1.04 1.11 -0.78 0.00 2.07 -0.98 -1.98 116.25 116.73 1s7h h VAL 137 Ca 0.46 -0.65 0.13 0.00 0.82 0.00 0.00 66.70 67.45 1s7h h VAL 137 Cb 0.35 1.54 -0.05 0.00 -1.52 0.00 0.00 31.29 31.60 1s7h h VAL 137 CO -0.23 0.16 0.51 0.44 0.02 0.00 0.00 177.57 178.48 1s7h h ASP 138 N -0.39 0.52 -0.56 0.57 3.32 -0.95 0.48 116.42 119.41 1s7h h ASP 138 Ca -0.01 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 1s7h h ASP 138 Cb 0.34 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1s7h h ASP 138 CO 0.02 0.29 0.13 0.40 -1.72 0.00 0.00 179.24 178.36 1s7h h ILE 139 N 0.57 1.25 -0.08 0.35 2.04 -0.87 0.16 117.51 120.92 1s7h h ILE 139 Ca 0.38 -0.89 -0.12 0.00 1.00 0.00 0.00 64.86 65.23 1s7h h ILE 139 Cb 0.68 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1s7h h ILE 139 CO -0.14 0.33 -0.49 0.00 0.00 0.00 0.00 178.15 177.85 1s7h h ALA 140 N 1.02 1.03 -0.30 1.87 0.00 0.09 -1.38 119.26 121.59 1s7h h ALA 140 Ca 0.18 -0.46 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 1s7h h ALA 140 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1s7h h ALA 140 CO 0.00 0.64 -0.46 0.87 0.00 0.00 0.00 179.25 180.30 1s7h h LYS 141 N 0.16 0.78 0.31 0.00 1.57 0.30 -1.06 116.57 118.64 1s7h h LYS 141 Ca 0.01 -0.45 -0.02 0.00 -1.87 0.00 0.00 60.65 58.32 1s7h h LYS 141 Cb 0.92 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.27 1s7h h LYS 141 CO 0.07 1.08 -0.15 0.00 -0.57 0.00 0.00 179.45 179.88 1s7h h ALA 142 N 0.85 -0.42 0.00 3.86 0.00 -0.42 -2.33 119.26 120.80 1s7h h ALA 142 Ca 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1s7h h ALA 142 Cb 1.04 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1s7h h ALA 142 CO 0.10 -0.68 0.00 1.04 0.00 0.00 0.00 179.25 179.71 1s7h n GLN 143 N -5.22 0.22 -0.92 0.00 6.02 -0.55 -4.85 117.38 112.09 1s7h n GLN 143 Ca -0.10 0.13 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1s7h n GLN 143 Cb 0.22 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.98 1s7h n GLN 143 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s7h n GLY 144 N -0.27 0.57 0.10 1.08 0.00 -0.80 -4.89 105.19 100.98 1s7h n GLY 144 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.07 1s7h n GLY 144 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1s7h h THR 145 N 0.00 0.91 -3.51 2.61 1.35 -1.51 -3.48 112.91 109.29 1s7h h THR 145 Ca 0.00 -2.45 -0.56 0.00 -0.55 0.00 0.00 66.41 62.85 1s7h h THR 145 Cb 0.12 2.37 0.18 0.00 -1.73 0.00 0.00 68.15 69.09 1s7h h THR 145 CO 0.00 0.52 -0.11 0.33 -0.25 0.00 0.00 175.52 176.01 1s7h n PHE 146 N -3.11 0.05 0.00 4.73 7.35 -0.54 -1.89 117.46 124.05 1s7h n PHE 146 Ca -0.05 0.38 0.00 0.00 -0.76 0.00 0.00 57.45 57.02 1s7h n PHE 146 Cb 0.86 -2.02 0.00 0.00 0.35 0.00 0.00 39.48 38.67 1s7h n PHE 146 CO 0.00 0.00 0.00 1.55 -0.76 0.00 0.00 176.76 177.55 1s7h n VAL 147 N -2.37 0.00 0.00 -2.13 3.14 -0.24 -4.77 118.33 111.95 1s7h n VAL 147 Ca 0.12 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.50 1s7h n VAL 147 Cb 0.49 -0.28 0.00 0.00 -1.06 0.00 0.00 33.84 32.99 1s7h n VAL 147 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1s7h n GLN 148 N -1.97 -0.31 -4.49 1.45 10.64 -1.23 -5.02 117.38 116.45 1s7h n GLN 148 Ca 0.00 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 54.83 1s7h n GLN 148 Cb 0.12 0.00 -0.10 0.00 -0.86 0.00 0.00 30.24 29.40 1s7h n GLN 148 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 1s7h s GLY 149 N 0.00 1.77 0.41 2.61 0.00 -1.26 -0.21 107.32 110.64 1s7h s GLY 149 Ca 0.00 -0.85 0.04 0.00 0.00 0.00 0.00 44.72 43.91 1s7h s GLY 149 CO 0.00 -0.59 0.07 -1.34 0.00 0.00 0.00 173.10 171.24 1s7h s VAL 150 N -0.80 1.04 0.12 1.40 -7.23 -0.82 -4.96 120.40 109.15 1s7h s VAL 150 Ca 0.12 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 57.97 1s7h s VAL 150 Cb -0.11 -2.50 -0.11 0.00 0.56 0.00 0.00 36.38 34.21 1s7h s VAL 150 CO 0.02 0.00 1.80 1.41 -0.31 0.00 0.00 175.10 178.02 1s7h n HIS 151 N -0.93 2.58 -1.01 2.82 8.25 -1.26 -2.65 115.22 123.02 1s7h n HIS 151 Ca -0.08 -0.08 -0.00 0.00 -0.26 0.00 0.00 57.72 57.30 1s7h n HIS 151 Cb 0.66 -2.70 -0.00 0.00 1.12 0.00 0.00 29.99 29.07 1s7h n HIS 151 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1s7h n TYR 152 N 5.32 0.00 -3.68 4.41 4.01 -1.26 -4.95 117.16 121.01 1s7h n TYR 152 Ca 0.18 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.83 1s7h n TYR 152 Cb 0.36 -1.54 -0.03 0.00 -0.31 0.00 0.00 39.34 37.82 1s7h n TYR 152 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1s7h s ALA 153 N -1.26 -1.24 -0.03 -0.72 0.00 -1.08 -4.77 121.76 112.66 1s7h s ALA 153 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 51.96 1s7h s ALA 153 Cb 0.00 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.96 1s7h s ALA 153 CO 0.00 -0.88 -0.10 -1.12 0.00 0.00 0.00 175.76 173.67 1s7h s SER 154 N -2.85 4.40 -0.12 0.00 0.01 -0.25 -1.94 113.70 112.95 1s7h s SER 154 Ca 0.07 -0.15 -0.05 0.00 1.31 0.00 0.00 55.95 57.13 1s7h s SER 154 Cb -0.03 -1.00 -0.04 0.00 0.21 0.00 0.00 66.02 65.16 1s7h s SER 154 CO -0.02 0.32 0.09 -0.70 0.41 0.00 0.00 173.24 173.33 1s7h s GLU 155 N -1.07 3.37 0.34 12.44 2.12 0.71 -1.49 118.70 135.12 1s7h s GLU 155 Ca 0.14 -0.25 0.03 0.00 0.36 0.00 0.00 54.97 55.26 1s7h s GLU 155 Cb -0.11 -3.07 -0.05 0.00 0.26 0.00 0.00 34.13 31.16 1s7h s GLU 155 CO 0.04 0.69 0.09 -0.51 -0.54 0.00 0.00 175.26 175.03 1s7h s LEU 156 N -0.79 1.98 0.00 2.70 1.43 0.51 -1.08 118.68 123.43 1s7h s LEU 156 Ca 0.13 -1.48 -0.06 0.00 -1.03 0.00 0.00 54.13 51.68 1s7h s LEU 156 Cb -0.12 -0.18 0.02 0.00 0.03 0.00 0.00 46.19 45.94 1s7h s LEU 156 CO 0.03 -0.75 0.30 -0.67 0.23 0.00 0.00 176.35 175.48 1s7h n ASP 157 N -0.86 -0.61 0.00 2.29 2.03 -0.79 -2.13 116.55 116.48 1s7h n ASP 157 Ca -0.03 -1.36 0.00 0.00 0.52 0.00 0.00 54.79 53.92 1s7h n ASP 157 Cb 0.66 1.00 0.00 0.00 -0.72 0.00 0.00 41.12 42.06 1s7h n ASP 157 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1s7h n GLY 158 N -0.21 -1.85 3.78 0.27 0.00 -1.26 -4.51 105.19 101.41 1s7h n GLY 158 Ca -0.01 -2.02 -0.37 0.00 0.00 0.00 0.00 46.02 43.62 1s7h n GLY 158 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1s7h s ASP 159 N -4.00 7.26 0.54 1.61 2.15 -1.26 -0.44 116.67 122.53 1s7h s ASP 159 Ca 0.00 1.91 0.35 0.00 0.43 0.00 0.00 52.55 55.24 1s7h s ASP 159 Cb 0.00 -2.59 1.53 0.00 -0.30 0.00 0.00 42.92 41.56 1s7h s ASP 159 CO 0.00 -0.13 1.83 0.00 -0.17 0.00 0.00 175.17 176.70 1s7h h ALA 160 N 3.17 3.04 -0.20 3.66 0.00 -0.45 0.54 119.26 129.03 1s7h h ALA 160 Ca -0.47 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.28 1s7h h ALA 160 Cb 1.20 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1s7h h ALA 160 CO 0.65 -1.36 -0.42 0.45 0.00 0.00 0.00 179.25 178.57 1s7h h HIS 161 N 0.01 0.55 0.08 0.00 3.86 -1.92 -2.00 115.15 115.74 1s7h h HIS 161 Ca 0.53 -0.16 -0.00 0.00 -1.16 0.00 0.00 60.37 59.58 1s7h h HIS 161 Cb 2.12 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 30.47 1s7h h HIS 161 CO -0.00 0.81 -0.04 -0.44 0.86 0.00 0.00 177.93 179.12 1s7h h ASP 162 N 0.38 -0.10 -0.73 2.45 3.32 -0.36 -2.95 116.42 118.43 1s7h h ASP 162 Ca 0.03 -0.15 0.14 0.00 0.02 0.00 0.00 57.03 57.07 1s7h h ASP 162 Cb 0.89 0.02 -0.14 0.00 0.22 0.00 0.00 39.33 40.33 1s7h h ASP 162 CO 0.08 0.46 -0.27 0.58 -1.72 0.00 0.00 179.24 178.36 1s7h h VAL 163 N -1.01 0.18 0.00 -1.35 2.07 -1.19 0.76 116.25 115.70 1s7h h VAL 163 Ca -0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 1s7h h VAL 163 Cb 0.24 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1s7h h VAL 163 CO 0.02 0.00 -0.09 -0.26 0.02 0.00 0.00 177.57 177.26 1s7h h PHE 164 N -0.06 0.00 -0.08 1.57 0.04 -1.49 -0.91 116.94 116.01 1s7h h PHE 164 Ca 0.32 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.07 1s7h h PHE 164 Cb 0.57 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.71 1s7h h PHE 164 CO -0.65 0.09 -0.04 0.77 -0.60 0.00 0.00 178.31 177.87 1s7h h SER 165 N 0.00 0.17 -0.01 2.17 0.02 0.66 -2.58 113.55 113.97 1s7h h SER 165 Ca -0.00 -0.42 -0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1s7h h SER 165 Cb 0.26 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 1s7h h SER 165 CO 0.01 0.55 0.00 0.74 -1.14 0.00 0.00 176.83 176.99 1s7h h THR 166 N -0.22 1.04 -0.74 -2.27 2.02 -0.47 -0.73 112.91 111.55 1s7h h THR 166 Ca 0.02 -0.13 0.11 0.00 0.77 0.00 0.00 66.41 67.18 1s7h h THR 166 Cb 0.49 1.12 -0.08 0.00 -1.74 0.00 0.00 68.15 67.94 1s7h h THR 166 CO 0.01 0.03 0.37 -0.07 0.37 0.00 0.00 175.52 176.23 1s7h h LEU 167 N -0.04 0.46 -0.43 2.58 3.38 -1.22 0.16 115.31 120.20 1s7h h LEU 167 Ca 0.00 0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 1s7h h LEU 167 Cb 0.05 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1s7h h LEU 167 CO -0.00 0.25 -0.60 -0.08 0.09 0.00 0.00 178.44 178.10 1s7h h GLU 168 N 0.60 0.62 0.61 1.13 4.81 -1.32 -1.26 114.58 119.77 1s7h h GLU 168 Ca 0.37 -0.42 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1s7h h GLU 168 Cb 0.43 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 1s7h h GLU 168 CO -0.29 1.03 -0.35 0.00 -0.73 0.00 0.00 179.01 178.67 1s7h h ALA 169 N 0.87 -0.90 -0.93 2.92 0.00 0.19 -0.77 119.26 120.64 1s7h h ALA 169 Ca -0.00 -0.18 0.14 0.00 0.00 0.00 0.00 54.91 54.86 1s7h h ALA 169 Cb 1.16 0.41 -0.09 0.00 0.00 0.00 0.00 17.79 19.28 1s7h h ALA 169 CO 0.12 -1.02 0.54 0.28 0.00 0.00 0.00 179.25 179.17 1s7h h VAL 170 N -0.89 0.83 -0.47 0.00 2.07 -0.76 0.37 116.25 117.39 1s7h h VAL 170 Ca -0.08 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 1s7h h VAL 170 Cb 0.71 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1s7h h VAL 170 CO 0.10 0.15 0.15 0.15 0.02 0.00 0.00 177.57 178.14 1s7h h PHE 171 N 0.81 0.75 -0.39 1.57 3.57 -0.83 -2.13 116.94 120.29 1s7h h PHE 171 Ca 0.48 -0.07 -0.13 0.00 3.53 0.00 0.00 57.97 61.78 1s7h h PHE 171 Cb 0.58 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 1s7h h PHE 171 CO -0.04 0.66 -0.27 0.00 -2.23 0.00 0.00 178.31 176.44 1s7h h ARG 172 N 0.62 0.87 -0.27 1.11 3.08 -0.37 0.36 114.38 119.79 1s7h h ARG 172 Ca 0.15 -0.42 0.06 0.00 0.07 0.00 0.00 59.98 59.84 1s7h h ARG 172 Cb 0.26 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.25 1s7h h ARG 172 CO -0.01 1.06 -0.10 1.98 -1.07 0.00 0.00 179.97 181.84 1s7h h MET 173 N 0.69 -0.04 -0.16 0.04 4.05 -0.80 0.19 114.93 118.89 1s7h h MET 173 Ca 0.08 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 59.41 1s7h h MET 173 Cb 0.84 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.65 1s7h h MET 173 CO 0.07 -0.03 -0.24 0.00 0.23 0.00 0.00 176.91 176.95 1s7h h ALA 174 N 1.21 0.24 -0.94 0.39 0.00 -1.32 -3.13 119.26 115.71 1s7h h ALA 174 Ca 0.14 -0.38 0.21 0.00 0.00 0.00 0.00 54.91 54.88 1s7h h ALA 174 Cb 0.25 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1s7h h ALA 174 CO -0.31 0.21 0.62 1.49 0.00 0.00 0.00 179.25 181.26 1s7h h GLU 175 N 0.07 0.44 0.00 0.00 4.22 0.22 0.58 114.58 120.11 1s7h h GLU 175 Ca 0.02 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.43 1s7h h GLU 175 Cb 0.81 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1s7h h GLU 175 CO 0.05 0.29 0.00 1.04 -2.18 0.00 0.00 179.01 178.21 1s7h n GLN 176 N -4.55 0.14 -0.05 1.92 1.13 0.62 -3.88 117.38 112.72 1s7h n GLN 176 Ca 0.21 0.18 -0.03 0.00 -1.94 0.00 0.00 57.00 55.41 1s7h n GLN 176 Cb 0.72 -1.69 -0.09 0.00 0.11 0.00 0.00 30.24 29.29 1s7h n GLN 176 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1s7h n GLN 177 N -1.94 1.77 -4.83 -1.09 6.02 0.06 -5.01 117.38 112.36 1s7h n GLN 177 Ca 0.05 -0.03 -0.26 0.00 -0.01 0.00 0.00 57.00 56.76 1s7h n GLN 177 Cb 0.35 -1.29 -0.15 0.00 1.02 0.00 0.00 30.24 30.17 1s7h n GLN 177 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1s7h s THR 178 N -2.39 1.56 0.06 5.09 2.01 -0.39 -5.05 115.64 116.52 1s7h s THR 178 Ca -0.05 -0.95 -0.22 0.00 0.31 0.00 0.00 61.69 60.78 1s7h s THR 178 Cb 0.04 -1.32 -0.13 0.00 0.01 0.00 0.00 72.50 71.10 1s7h s THR 178 CO 0.48 0.35 1.51 0.78 -0.69 0.00 0.00 174.62 177.05 1s7h h ASN 179 N 5.39 0.19 -3.62 3.53 2.35 -1.87 -3.42 115.58 118.13 1s7h h ASN 179 Ca -0.39 -0.27 -0.68 0.00 -0.55 0.00 0.00 56.30 54.41 1s7h h ASN 179 Cb 1.15 -0.05 -0.32 0.00 0.05 0.00 0.00 38.32 39.15 1s7h h ASN 179 CO 0.47 0.41 -0.73 -2.28 -1.65 0.00 0.00 177.43 173.64 1s7h s HIS 180 N -5.13 3.15 0.16 1.19 2.46 -1.26 -3.62 115.29 112.24 1s7h s HIS 180 Ca -0.14 -1.70 0.05 0.00 0.47 0.00 0.00 55.06 53.74 1s7h s HIS 180 Cb 0.05 -2.07 -0.04 0.00 -0.13 0.00 0.00 32.58 30.39 1s7h s HIS 180 CO 0.70 -0.76 -0.10 0.96 -2.47 0.00 0.00 174.74 173.07 1s7h s ILE 181 N 1.29 1.22 0.05 0.89 -4.36 -0.63 -0.84 121.20 118.83 1s7h s ILE 181 Ca -0.02 -2.08 -0.04 0.00 -0.26 0.00 0.00 60.65 58.25 1s7h s ILE 181 Cb -0.18 -1.88 -0.02 0.00 1.25 0.00 0.00 42.46 41.63 1s7h s ILE 181 CO -0.03 -0.72 0.06 0.42 0.24 0.00 0.00 174.94 174.91 1s7h s THR 182 N -3.30 0.17 -0.17 8.37 -4.23 -0.90 -1.86 115.64 113.71 1s7h s THR 182 Ca 0.18 -1.40 -0.07 0.00 -1.18 0.00 0.00 61.69 59.21 1s7h s THR 182 Cb 0.02 -1.22 0.07 0.00 1.34 0.00 0.00 72.50 72.71 1s7h s THR 182 CO 0.01 -0.77 0.39 -0.32 -0.54 0.00 0.00 174.62 173.38 1s7h s MET 183 N -3.38 0.31 -0.01 3.99 0.00 0.31 -0.15 119.30 120.36 1s7h s MET 183 Ca 0.02 0.89 -0.09 0.00 0.00 0.00 0.00 55.69 56.51 1s7h s MET 183 Cb 0.04 0.14 -0.05 0.00 0.00 0.00 0.00 34.83 34.96 1s7h s MET 183 CO -0.08 -0.22 0.29 0.95 0.00 0.00 0.00 175.02 175.96 1s7h s THR 184 N 2.14 5.25 0.07 10.11 -4.23 -0.08 0.12 115.64 129.02 1s7h s THR 184 Ca -0.04 0.38 0.06 0.00 -1.18 0.00 0.00 61.69 60.91 1s7h s THR 184 Cb -0.11 -3.58 -0.03 0.00 1.34 0.00 0.00 72.50 70.13 1s7h s THR 184 CO -0.12 0.46 -0.16 0.68 -0.54 0.00 0.00 174.62 174.94 1s7h s VAL 185 N -1.20 1.30 -0.32 2.29 -7.23 -0.22 -1.45 120.40 113.57 1s7h s VAL 185 Ca 0.25 -1.27 -0.02 0.00 -1.81 0.00 0.00 61.98 59.13 1s7h s VAL 185 Cb -0.14 -1.20 0.11 0.00 0.56 0.00 0.00 36.38 35.72 1s7h s VAL 185 CO 0.13 -0.09 0.15 0.21 -0.31 0.00 0.00 175.10 175.19 1s7h s ASN 186 N -1.57 3.47 -0.23 4.85 3.84 -0.48 -2.24 114.94 122.58 1s7h s ASN 186 Ca 0.02 -1.64 -0.07 0.00 0.21 0.00 0.00 52.86 51.38 1s7h s ASN 186 Cb -0.09 -0.47 -0.03 0.00 -0.55 0.00 0.00 41.25 40.11 1s7h s ASN 186 CO 0.02 -0.39 0.06 -0.76 -2.79 0.00 0.00 177.10 173.24 1s7h s LEU 187 N 1.68 3.49 -0.47 3.21 1.43 0.42 -2.26 118.68 126.19 1s7h s LEU 187 Ca 0.12 -0.15 -0.12 0.00 -1.03 0.00 0.00 54.13 52.95 1s7h s LEU 187 Cb -0.18 -1.92 0.09 0.00 0.03 0.00 0.00 46.19 44.21 1s7h s LEU 187 CO -0.24 0.02 0.36 -0.55 0.23 0.00 0.00 176.35 176.17 1s7h s SER 188 N 1.28 5.89 -0.27 2.29 0.15 -0.77 -0.87 113.70 121.40 1s7h s SER 188 Ca 0.05 -1.59 -0.18 0.00 0.70 0.00 0.00 55.95 54.92 1s7h s SER 188 Cb -0.15 -2.09 -0.03 0.00 -1.71 0.00 0.00 66.02 62.05 1s7h s SER 188 CO 0.03 -0.66 0.52 0.00 1.20 0.00 0.00 173.24 174.33 1s7h s ALA 189 N 1.50 3.58 -0.58 5.45 0.00 0.66 -4.26 121.76 128.11 1s7h s ALA 189 Ca 0.04 -0.63 -0.03 0.00 0.00 0.00 0.00 51.96 51.34 1s7h s ALA 189 Cb -0.25 -2.90 0.00 0.00 0.00 0.00 0.00 23.12 19.97 1s7h s ALA 189 CO 0.03 -0.78 0.41 0.09 0.00 0.00 0.00 175.76 175.51 1s7h n ASN 190 N 5.57 -3.68 -4.68 0.00 5.03 -1.26 -0.35 115.26 115.89 1s7h n ASN 190 Ca -0.04 -0.19 -0.43 0.00 0.87 0.00 0.00 54.58 54.79 1s7h n ASN 190 Cb 0.50 -2.35 -0.01 0.00 -1.02 0.00 0.00 39.78 36.90 1s7h n ASN 190 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 1s7h n SER 191 N -0.24 2.54 -0.16 6.41 2.88 -1.26 -4.22 113.62 119.56 1s7h n SER 191 Ca -0.01 1.20 -0.05 0.00 -1.33 0.00 0.00 58.87 58.67 1s7h n SER 191 Cb 0.53 -1.45 0.04 0.00 -0.75 0.00 0.00 64.21 62.59 1s7h n SER 191 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1s7h h PRO 192 N 2.69 0.53 0.00 -1.46 0.11 -1.99 -3.51 132.00 128.38 1s7h h PRO 192 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1s7h h PRO 192 Cb 1.29 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1s7h h PRO 192 CO 0.64 0.35 0.00 -1.13 -0.21 0.00 0.00 178.00 177.65