#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1e4x s ILE 2 N 0.00 4.94 -0.06 0.53 1.01 -1.26 -5.01 121.20 121.34 1e4x s ILE 2 Ca 0.00 0.04 -0.18 0.00 0.00 0.00 0.00 60.65 60.52 1e4x s ILE 2 Cb 0.00 -3.34 -0.05 0.00 0.01 0.00 0.00 42.46 39.08 1e4x s ILE 2 CO 0.00 0.29 0.48 -1.58 0.00 0.00 0.00 174.94 174.12 1e4x s GLN 3 N 1.68 4.22 -0.24 2.79 0.74 -1.26 -4.70 119.66 122.88 1e4x s GLN 3 Ca 0.07 0.49 -0.06 0.00 0.05 0.00 0.00 55.36 55.90 1e4x s GLN 3 Cb -0.16 -3.36 -0.02 0.00 1.10 0.00 0.00 33.01 30.58 1e4x s GLN 3 CO 0.08 0.35 0.03 -1.64 -0.55 0.00 0.00 175.29 173.56 1e4x s MET 4 N -0.02 3.51 -0.34 1.67 -1.94 -1.26 -2.01 119.30 118.91 1e4x s MET 4 Ca 0.26 -0.56 -0.07 0.00 -1.71 0.00 0.00 55.69 53.61 1e4x s MET 4 Cb -0.16 -3.22 0.03 0.00 2.01 0.00 0.00 34.83 33.49 1e4x s MET 4 CO 0.12 -0.21 0.12 0.99 -0.01 0.00 0.00 175.02 176.03 1e4x s THR 5 N 1.56 3.95 -0.10 2.05 2.01 0.13 -4.24 115.64 120.99 1e4x s THR 5 Ca 0.06 -1.00 -0.10 0.00 0.31 0.00 0.00 61.69 60.96 1e4x s THR 5 Cb -0.15 -3.19 -0.05 0.00 0.01 0.00 0.00 72.50 69.12 1e4x s THR 5 CO 0.01 -0.14 0.22 -1.58 -0.69 0.00 0.00 174.62 172.45 1e4x s GLN 6 N 1.45 3.71 -0.06 4.92 0.74 -1.26 -1.20 119.66 127.96 1e4x s GLN 6 Ca -0.00 0.02 -0.08 0.00 0.05 0.00 0.00 55.36 55.35 1e4x s GLN 6 Cb -0.19 -3.24 0.02 0.00 1.10 0.00 0.00 33.01 30.69 1e4x s GLN 6 CO 0.03 0.66 0.21 0.95 -0.55 0.00 0.00 175.29 176.59 1e4x s THR 7 N -0.76 0.02 0.83 -0.34 -4.23 -0.36 -4.44 115.64 106.36 1e4x s THR 7 Ca 0.17 -0.20 -0.09 0.00 -1.18 0.00 0.00 61.69 60.39 1e4x s THR 7 Cb -0.13 -0.36 0.14 0.00 1.34 0.00 0.00 72.50 73.49 1e4x s THR 7 CO 0.06 -0.11 1.15 -2.16 -0.54 0.00 0.00 174.62 173.02 1e4x s PRO 8 N -0.35 1.33 0.33 3.99 0.04 -1.26 0.10 135.00 139.18 1e4x s PRO 8 Ca -0.04 -0.59 0.17 0.00 0.04 0.00 0.00 61.00 60.58 1e4x s PRO 8 Cb -0.03 -2.07 0.26 0.00 0.04 0.00 0.00 34.50 32.70 1e4x s PRO 8 CO 0.01 -1.84 1.54 0.66 0.04 0.00 0.00 177.00 177.41 1e4x h SER 9 N -1.05 0.00 -5.02 6.66 4.64 -1.78 -3.39 113.55 113.61 1e4x h SER 9 Ca -0.42 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.82 1e4x h SER 9 Cb 1.26 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.18 1e4x h SER 9 CO 0.44 0.40 -0.11 -0.94 -0.87 0.00 0.00 176.83 175.75 1e4x s SER 10 N -6.39 -0.30 -0.06 4.97 1.04 -1.26 -1.49 113.70 110.21 1e4x s SER 10 Ca 0.04 0.09 -0.05 0.00 0.48 0.00 0.00 55.95 56.51 1e4x s SER 10 Cb 0.08 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.63 1e4x s SER 10 CO 0.72 -0.61 0.15 -0.22 0.98 0.00 0.00 173.24 174.25 1e4x s LEU 11 N -1.77 1.34 -0.16 2.42 2.96 -0.79 -4.92 118.68 117.76 1e4x s LEU 11 Ca -0.08 0.30 0.02 0.00 -0.22 0.00 0.00 54.13 54.15 1e4x s LEU 11 Cb -0.02 0.49 0.01 0.00 0.50 0.00 0.00 46.19 47.18 1e4x s LEU 11 CO 0.00 -0.06 -0.21 -0.44 -1.32 0.00 0.00 176.35 174.32 1e4x s SER 12 N 0.23 3.08 0.17 3.68 0.01 -1.26 -1.14 113.70 118.47 1e4x s SER 12 Ca -0.01 -0.61 0.01 0.00 1.31 0.00 0.00 55.95 56.65 1e4x s SER 12 Cb -0.02 -1.44 -0.05 0.00 0.21 0.00 0.00 66.02 64.72 1e4x s SER 12 CO -0.01 0.04 0.01 0.00 0.41 0.00 0.00 173.24 173.69 1e4x s ALA 13 N 1.05 1.31 0.12 1.44 0.00 -0.75 -4.68 121.76 120.26 1e4x s ALA 13 Ca -0.01 -1.59 0.03 0.00 0.00 0.00 0.00 51.96 50.39 1e4x s ALA 13 Cb -0.14 0.59 -0.04 0.00 0.00 0.00 0.00 23.12 23.53 1e4x s ALA 13 CO -0.07 -0.34 0.17 -1.12 0.00 0.00 0.00 175.76 174.40 1e4x s SER 14 N -3.16 5.88 0.31 0.00 0.01 -1.26 0.20 113.70 115.68 1e4x s SER 14 Ca 0.24 0.05 -0.29 0.00 1.31 0.00 0.00 55.95 57.26 1e4x s SER 14 Cb 0.06 -1.66 -0.11 0.00 0.21 0.00 0.00 66.02 64.52 1e4x s SER 14 CO 0.04 0.11 1.45 -0.76 0.41 0.00 0.00 173.24 174.49 1e4x s LEU 15 N -2.87 4.37 0.00 2.44 1.02 -1.26 -1.69 118.68 120.68 1e4x s LEU 15 Ca 0.32 2.83 0.00 0.00 0.02 0.00 0.00 54.13 57.30 1e4x s LEU 15 Cb -0.11 -3.64 0.00 0.00 0.02 0.00 0.00 46.19 42.45 1e4x s LEU 15 CO 0.25 -0.75 0.00 0.61 0.02 0.00 0.00 176.35 176.48 1e4x n GLY 16 N 1.42 3.35 3.74 -3.19 0.00 0.34 -4.85 105.19 106.01 1e4x n GLY 16 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1e4x n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1e4x s ASP 17 N -1.05 3.98 -0.23 1.61 1.01 -0.68 -3.57 116.67 117.73 1e4x s ASP 17 Ca 0.00 1.64 -0.08 0.00 0.71 0.00 0.00 52.55 54.82 1e4x s ASP 17 Cb 0.00 -2.33 -0.03 0.00 1.01 0.00 0.00 42.92 41.57 1e4x s ASP 17 CO 0.00 -2.34 0.08 -0.60 0.21 0.00 0.00 175.17 172.52 1e4x s ARG 18 N -4.93 3.77 0.01 8.23 3.52 -1.26 -0.82 118.95 127.47 1e4x s ARG 18 Ca 0.62 -0.43 0.08 0.00 -0.13 0.00 0.00 55.73 55.87 1e4x s ARG 18 Cb -0.17 -3.32 -0.03 0.00 -1.56 0.00 0.00 34.95 29.87 1e4x s ARG 18 CO 0.56 -0.05 -0.24 0.08 -0.81 0.00 0.00 175.30 174.85 1e4x s VAL 19 N 1.26 2.30 -0.03 7.11 1.01 -0.22 -4.98 120.40 126.85 1e4x s VAL 19 Ca 0.05 -1.17 0.06 0.00 0.00 0.00 0.00 61.98 60.92 1e4x s VAL 19 Cb -0.14 -1.86 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 1e4x s VAL 19 CO 0.04 0.48 -0.21 -0.89 0.00 0.00 0.00 175.10 174.52 1e4x s THR 20 N -0.73 1.66 -0.06 3.92 2.01 -1.26 -0.87 115.64 120.31 1e4x s THR 20 Ca 0.11 -0.87 0.04 0.00 0.31 0.00 0.00 61.69 61.28 1e4x s THR 20 Cb -0.10 -1.39 0.00 0.00 0.01 0.00 0.00 72.50 71.02 1e4x s THR 20 CO 0.01 0.47 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.61 1e4x s ILE 21 N -0.28 1.48 0.07 1.82 1.01 0.33 -4.76 121.20 120.88 1e4x s ILE 21 Ca 0.03 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.99 1e4x s ILE 21 Cb -0.10 -1.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 1e4x s ILE 21 CO 0.01 0.43 0.03 -0.44 0.00 0.00 0.00 174.94 174.97 1e4x s SER 22 N 0.23 5.24 -0.06 3.58 0.01 0.28 -1.00 113.70 121.99 1e4x s SER 22 Ca -0.09 -0.08 0.02 0.00 1.31 0.00 0.00 55.95 57.11 1e4x s SER 22 Cb -0.14 -1.33 0.01 0.00 0.21 0.00 0.00 66.02 64.77 1e4x s SER 22 CO 0.04 0.19 -0.11 0.00 0.41 0.00 0.00 173.24 173.77 1e4x s ARG 24 N 0.71 2.60 0.42 0.00 6.06 -0.34 -0.44 118.95 127.96 1e4x s ARG 24 Ca -0.14 -0.69 0.06 0.00 -2.50 0.00 0.00 55.73 52.46 1e4x s ARG 24 Cb -0.16 -2.23 0.01 0.00 0.06 0.00 0.00 34.95 32.63 1e4x s ARG 24 CO 0.03 -0.13 0.58 0.00 -2.50 0.00 0.00 175.30 173.28 1e4x s ALA 25 N 1.15 4.28 -0.73 6.12 0.00 0.27 -0.69 121.76 132.17 1e4x s ALA 25 Ca -0.01 -1.50 0.25 0.00 0.00 0.00 0.00 51.96 50.70 1e4x s ALA 25 Cb -0.14 -1.76 0.48 0.00 0.00 0.00 0.00 23.12 21.70 1e4x s ALA 25 CO -0.07 -0.29 1.43 -1.13 0.00 0.00 0.00 175.76 175.70 1e4x n SER 26 N -1.89 0.65 -3.36 0.00 3.41 -0.85 -4.78 113.62 106.80 1e4x n SER 26 Ca 0.05 0.15 0.02 0.00 -0.26 0.00 0.00 58.87 58.83 1e4x n SER 26 Cb 0.59 0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1e4x n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1e4x s GLN 27 N -3.12 0.49 0.00 4.33 -2.07 -1.26 -5.02 119.66 113.01 1e4x s GLN 27 Ca 0.08 1.05 0.00 0.00 -1.82 0.00 0.00 55.36 54.67 1e4x s GLN 27 Cb 0.14 0.61 0.00 0.00 -1.09 0.00 0.00 33.01 32.67 1e4x s GLN 27 CO 0.69 -0.36 0.00 -3.47 -1.32 0.00 0.00 175.29 170.83 1e4x n ASP 28 N 5.38 0.00 -0.07 12.60 2.03 -1.26 -4.58 116.55 130.65 1e4x n ASP 28 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 1e4x n ASP 28 Cb 0.51 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 1e4x n ASP 28 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1e4x n ILE 29 N 0.02 0.00 -3.78 5.18 -5.35 -1.09 -4.86 119.36 109.49 1e4x n ILE 29 Ca 0.00 0.00 -0.23 0.00 -0.27 0.00 0.00 62.75 62.25 1e4x n ILE 29 Cb 0.00 -0.16 0.02 0.00 -1.74 0.00 0.00 39.64 37.76 1e4x n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1e4x n SER 30 N -0.41 -1.10 0.00 7.28 7.64 -1.26 -1.80 113.62 123.96 1e4x n SER 30 Ca 0.00 -0.87 0.00 0.00 1.01 0.00 0.00 58.87 59.01 1e4x n SER 30 Cb 0.03 -3.79 0.00 0.00 -1.01 0.00 0.00 64.21 59.44 1e4x n SER 30 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1e4x n HIS 31 N -4.32 0.00 -2.44 1.43 -0.00 -1.26 -4.91 115.22 103.72 1e4x n HIS 31 Ca -0.29 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.01 1e4x n HIS 31 Cb 0.67 -0.42 0.00 0.00 -0.00 0.00 0.00 29.99 30.25 1e4x n HIS 31 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1e4x n TYR 32 N -2.00 3.15 -4.92 4.41 4.01 -0.74 -2.70 117.16 118.36 1e4x n TYR 32 Ca 0.00 -2.85 -0.32 0.00 -0.16 0.00 0.00 57.90 54.58 1e4x n TYR 32 Cb 0.00 -1.94 -0.17 0.00 -0.31 0.00 0.00 39.34 36.92 1e4x n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1e4x s LEU 33 N -0.08 2.05 0.01 7.72 1.98 -1.26 0.08 118.68 129.19 1e4x s LEU 33 Ca 0.39 -0.56 0.07 0.00 -2.89 0.00 0.00 54.13 51.15 1e4x s LEU 33 Cb 0.08 -1.38 -0.03 0.00 0.66 0.00 0.00 46.19 45.52 1e4x s LEU 33 CO 0.01 0.11 -0.20 0.20 -1.89 0.00 0.00 176.35 174.58 1e4x s ASN 34 N 0.58 3.59 -0.16 3.68 0.01 0.26 -0.77 114.94 122.14 1e4x s ASN 34 Ca -0.13 -0.41 -0.02 0.00 -0.71 0.00 0.00 52.86 51.59 1e4x s ASN 34 Cb -0.17 -0.55 -0.02 0.00 0.41 0.00 0.00 41.25 40.92 1e4x s ASN 34 CO 0.04 0.29 -0.09 0.26 -1.51 0.00 0.00 177.10 176.08 1e4x s TRP 35 N -0.80 2.89 0.24 2.20 0.52 0.13 -0.68 118.94 123.44 1e4x s TRP 35 Ca 0.13 -0.64 0.11 0.00 0.02 0.00 0.00 56.10 55.72 1e4x s TRP 35 Cb -0.10 -1.93 -0.05 0.00 -1.15 0.00 0.00 33.47 30.24 1e4x s TRP 35 CO 0.02 -0.25 -0.20 -0.06 0.02 0.00 0.00 176.95 176.48 1e4x s PHE 36 N 0.60 2.34 -0.09 -1.98 0.40 0.11 -0.14 117.98 119.23 1e4x s PHE 36 Ca -0.06 -0.33 0.02 0.00 -0.60 0.00 0.00 56.93 55.97 1e4x s PHE 36 Cb -0.15 -1.08 0.01 0.00 0.51 0.00 0.00 43.02 42.31 1e4x s PHE 36 CO 0.03 0.61 -0.14 -1.14 0.70 0.00 0.00 175.22 175.27 1e4x s GLN 37 N -3.12 2.03 -0.08 0.44 0.74 -0.72 -1.42 119.66 117.54 1e4x s GLN 37 Ca 0.26 -0.51 0.03 0.00 0.05 0.00 0.00 55.36 55.19 1e4x s GLN 37 Cb -0.07 -1.70 0.01 0.00 1.10 0.00 0.00 33.01 32.36 1e4x s GLN 37 CO 0.13 -0.01 -0.16 -1.14 -0.55 0.00 0.00 175.29 173.56 1e4x s GLN 38 N 0.83 2.09 0.24 1.67 0.74 0.11 -1.39 119.66 123.95 1e4x s GLN 38 Ca -0.11 -0.55 0.02 0.00 0.05 0.00 0.00 55.36 54.77 1e4x s GLN 38 Cb -0.15 -1.67 -0.04 0.00 1.10 0.00 0.00 33.01 32.25 1e4x s GLN 38 CO 0.01 0.07 0.40 0.15 -0.55 0.00 0.00 175.29 175.38 1e4x s LYS 39 N 0.58 3.48 0.64 1.67 -0.14 -0.62 -0.75 119.74 124.59 1e4x s LYS 39 Ca -0.16 -0.51 0.28 0.00 -1.36 0.00 0.00 55.97 54.22 1e4x s LYS 39 Cb -0.16 -2.83 1.46 0.00 -1.68 0.00 0.00 37.83 34.61 1e4x s LYS 39 CO 0.05 0.37 1.84 -1.35 -0.76 0.00 0.00 175.35 175.50 1e4x h PRO 40 N 1.46 0.00 -0.18 -1.68 0.11 -1.93 0.16 132.00 129.94 1e4x h PRO 40 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1e4x h PRO 40 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1e4x h PRO 40 CO 0.64 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.03 1e4x n ASP 41 N -3.18 1.71 0.00 -2.05 5.68 -1.26 -4.92 116.55 112.52 1e4x n ASP 41 Ca 0.02 -1.73 0.00 0.00 -0.50 0.00 0.00 54.79 52.59 1e4x n ASP 41 Cb 0.55 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.41 1e4x n ASP 41 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1e4x n GLY 42 N 1.13 1.23 3.77 6.12 0.00 0.56 -5.05 105.19 112.94 1e4x n GLY 42 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1e4x n GLY 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1e4x s THR 43 N -2.50 2.75 -0.09 2.61 -4.23 -1.25 -4.78 115.64 108.15 1e4x s THR 43 Ca 0.00 0.67 0.02 0.00 -1.18 0.00 0.00 61.69 61.20 1e4x s THR 43 Cb 0.00 -3.39 0.01 0.00 1.34 0.00 0.00 72.50 70.46 1e4x s THR 43 CO 0.00 0.10 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.35 1e4x s VAL 44 N -1.28 1.34 -0.02 2.29 1.01 -1.26 -1.58 120.40 120.89 1e4x s VAL 44 Ca 0.56 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 62.06 1e4x s VAL 44 Cb -0.36 -1.23 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 1e4x s VAL 44 CO 0.47 0.41 -0.25 -0.54 0.00 0.00 0.00 175.10 175.18 1e4x s LYS 45 N 0.93 2.09 -0.03 2.72 1.02 -0.48 -4.98 119.74 121.00 1e4x s LYS 45 Ca -0.09 -0.90 -0.30 0.00 0.02 0.00 0.00 55.97 54.71 1e4x s LYS 45 Cb -0.15 -1.99 -0.03 0.00 -0.52 0.00 0.00 37.83 35.14 1e4x s LYS 45 CO -0.00 0.53 1.02 -1.17 -0.92 0.00 0.00 175.35 174.81 1e4x s LEU 46 N -0.55 4.33 -0.26 3.17 2.96 -1.26 -1.76 118.68 125.31 1e4x s LEU 46 Ca 0.08 1.67 -0.15 0.00 -0.22 0.00 0.00 54.13 55.51 1e4x s LEU 46 Cb -0.10 -3.57 -0.12 0.00 0.50 0.00 0.00 46.19 42.90 1e4x s LEU 46 CO -0.01 -0.35 -0.30 0.18 -1.32 0.00 0.00 176.35 174.55 1e4x n LEU 47 N 4.29 1.95 -4.02 -0.68 4.77 0.80 -4.72 117.00 119.39 1e4x n LEU 47 Ca 0.07 0.35 -0.18 0.00 -0.03 0.00 0.00 56.01 56.23 1e4x n LEU 47 Cb 0.50 -0.83 -0.14 0.00 -2.33 0.00 0.00 43.42 40.62 1e4x n LEU 47 CO 0.53 0.45 -0.43 -0.63 -1.33 0.00 0.00 177.39 175.98 1e4x s ILE 48 N -2.53 0.66 0.08 -0.08 1.01 -1.18 -0.03 121.20 119.12 1e4x s ILE 48 Ca -0.37 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 59.86 1e4x s ILE 48 Cb 0.13 -0.57 -0.04 0.00 0.01 0.00 0.00 42.46 41.99 1e4x s ILE 48 CO 0.49 0.14 -0.05 -0.72 0.00 0.00 0.00 174.94 174.80 1e4x s TYR 49 N -0.30 0.74 -1.28 3.97 -0.85 0.63 0.22 117.35 120.48 1e4x s TYR 49 Ca 0.02 -0.98 -0.04 0.00 -0.52 0.00 0.00 57.07 55.56 1e4x s TYR 49 Cb -0.04 -0.46 -0.01 0.00 0.38 0.00 0.00 41.96 41.83 1e4x s TYR 49 CO -0.00 -0.24 0.68 0.98 -1.52 0.00 0.00 175.55 175.44 1e4x n TYR 50 N 0.02 -1.90 0.00 -3.49 9.36 -1.15 -0.91 117.16 119.08 1e4x n TYR 50 Ca -0.13 0.77 0.00 0.00 3.32 0.00 0.00 57.90 61.86 1e4x n TYR 50 Cb 0.61 -4.13 0.00 0.00 -0.63 0.00 0.00 39.34 35.19 1e4x n TYR 50 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1e4x n THR 51 N -4.22 0.00 -0.19 2.97 -1.04 0.05 -4.18 114.28 107.67 1e4x n THR 51 Ca -0.26 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 1e4x n THR 51 Cb 0.66 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.17 1e4x n THR 51 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1e4x n SER 52 N 1.65 0.36 -4.64 8.00 3.41 -1.20 -3.45 113.62 117.75 1e4x n SER 52 Ca 0.00 -0.70 -0.42 0.00 -0.26 0.00 0.00 58.87 57.49 1e4x n SER 52 Cb 0.00 0.29 -0.04 0.00 -0.26 0.00 0.00 64.21 64.20 1e4x n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1e4x s THR 53 N -0.29 4.84 0.19 6.66 2.01 -0.09 -4.59 115.64 124.36 1e4x s THR 53 Ca 0.00 1.57 -0.30 0.00 0.31 0.00 0.00 61.69 63.27 1e4x s THR 53 Cb 0.00 -4.12 -0.08 0.00 0.01 0.00 0.00 72.50 68.31 1e4x s THR 53 CO 0.00 -0.07 1.17 -0.76 -0.69 0.00 0.00 174.62 174.26 1e4x s LEU 54 N 2.84 4.46 0.64 4.42 1.02 -1.26 -0.27 118.68 130.54 1e4x s LEU 54 Ca 0.35 2.20 -0.11 0.00 0.02 0.00 0.00 54.13 56.59 1e4x s LEU 54 Cb -0.15 -3.61 -0.02 0.00 0.02 0.00 0.00 46.19 42.43 1e4x s LEU 54 CO 0.07 -0.32 1.04 -2.28 0.02 0.00 0.00 176.35 174.88 1e4x s HIS 55 N -0.17 3.46 0.11 0.29 2.46 0.95 -4.93 115.29 117.46 1e4x s HIS 55 Ca 0.51 1.34 -0.36 0.00 0.47 0.00 0.00 55.06 57.02 1e4x s HIS 55 Cb -0.32 -2.77 -0.16 0.00 -0.13 0.00 0.00 32.58 29.20 1e4x s HIS 55 CO 0.37 -0.87 1.37 0.43 -2.47 0.00 0.00 174.74 173.57 1e4x n SER 56 N -2.86 1.92 0.00 9.88 7.64 -1.26 -1.75 113.62 127.19 1e4x n SER 56 Ca 0.07 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.06 1e4x n SER 56 Cb 0.54 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 1e4x n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1e4x n GLY 57 N 2.64 1.41 3.71 0.23 0.00 -1.26 -5.01 105.19 106.91 1e4x n GLY 57 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1e4x n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1e4x s VAL 58 N -3.26 4.20 0.71 1.61 1.01 -0.72 -4.99 120.40 118.96 1e4x s VAL 58 Ca 0.00 1.57 -0.13 0.00 0.00 0.00 0.00 61.98 63.41 1e4x s VAL 58 Cb 0.00 -4.00 0.03 0.00 0.00 0.00 0.00 36.38 32.40 1e4x s VAL 58 CO 0.00 0.09 1.11 -2.16 0.00 0.00 0.00 175.10 174.15 1e4x s PRO 59 N 1.31 2.48 0.00 2.72 0.04 -1.26 -4.88 135.00 135.41 1e4x s PRO 59 Ca 0.57 1.36 0.19 0.00 0.04 0.00 0.00 61.00 63.16 1e4x s PRO 59 Cb -0.27 -1.91 0.99 0.00 0.04 0.00 0.00 34.50 33.34 1e4x s PRO 59 CO 0.27 -1.49 1.56 -1.13 0.04 0.00 0.00 177.00 176.25 1e4x n SER 60 N -2.88 0.00 0.04 6.66 3.41 -1.26 -2.02 113.62 117.58 1e4x n SER 60 Ca 0.10 -0.13 0.10 0.00 -0.26 0.00 0.00 58.87 58.69 1e4x n SER 60 Cb 0.52 -0.22 0.41 0.00 -0.26 0.00 0.00 64.21 64.66 1e4x n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1e4x n ARG 61 N -1.22 0.07 -3.19 4.33 1.85 -1.26 -4.54 116.66 112.70 1e4x n ARG 61 Ca 0.10 0.26 -0.39 0.00 -1.00 0.00 0.00 57.85 56.82 1e4x n ARG 61 Cb 0.13 -1.62 -0.05 0.00 -1.05 0.00 0.00 32.46 29.86 1e4x n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1e4x s PHE 62 N -3.09 3.57 0.04 2.89 0.40 -0.86 -0.67 117.98 120.25 1e4x s PHE 62 Ca 0.07 1.09 -0.02 0.00 -0.60 0.00 0.00 56.93 57.47 1e4x s PHE 62 Cb 0.11 -2.66 -0.02 0.00 0.51 0.00 0.00 43.02 40.96 1e4x s PHE 62 CO 0.36 0.18 0.01 0.45 0.70 0.00 0.00 175.22 176.92 1e4x s SER 63 N 0.52 0.30 0.05 1.36 0.15 -0.00 -4.99 113.70 111.07 1e4x s SER 63 Ca 0.31 -0.67 0.04 0.00 0.70 0.00 0.00 55.95 56.33 1e4x s SER 63 Cb -0.17 0.18 -0.02 0.00 -1.71 0.00 0.00 66.02 64.30 1e4x s SER 63 CO 0.15 -0.47 -0.11 -0.83 1.20 0.00 0.00 173.24 173.18 1e4x s GLY 64 N -2.15 0.66 0.19 9.45 0.00 -1.26 -0.52 107.32 113.70 1e4x s GLY 64 Ca -0.05 -0.80 -0.12 0.00 0.00 0.00 0.00 44.72 43.75 1e4x s GLY 64 CO -0.05 -0.82 0.40 -1.35 0.00 0.00 0.00 173.10 171.28 1e4x s SER 65 N -1.39 -0.08 0.00 1.64 1.04 -0.56 -4.20 113.70 110.16 1e4x s SER 65 Ca -0.04 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1e4x s SER 65 Cb -0.09 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1e4x s SER 65 CO 0.01 -1.00 0.00 0.61 0.98 0.00 0.00 173.24 173.84 1e4x n GLY 66 N -0.29 3.15 3.52 7.32 0.00 -1.26 -0.44 105.19 117.19 1e4x n GLY 66 Ca -0.07 -1.54 -0.14 0.00 0.00 0.00 0.00 46.02 44.27 1e4x n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1e4x s SER 67 N 0.00 -0.54 1.76 1.61 0.01 -1.06 -4.93 113.70 110.55 1e4x s SER 67 Ca 0.00 0.48 0.00 0.00 1.31 0.00 0.00 55.95 57.74 1e4x s SER 67 Cb 0.00 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.70 1e4x s SER 67 CO 0.00 -0.58 0.00 0.61 0.41 0.00 0.00 173.24 173.68 1e4x n GLY 68 N 0.60 3.12 0.08 3.44 0.00 -1.26 -3.02 105.19 108.16 1e4x n GLY 68 Ca -0.15 0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 1e4x n GLY 68 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1e4x h THR 69 N 0.00 0.85 -3.72 2.61 2.02 -1.92 -2.89 112.91 109.86 1e4x h THR 69 Ca 0.00 -2.66 -0.68 0.00 0.77 0.00 0.00 66.41 63.84 1e4x h THR 69 Cb 0.00 2.40 -0.27 0.00 -1.74 0.00 0.00 68.15 68.54 1e4x h THR 69 CO 0.00 0.48 -0.80 -1.81 0.37 0.00 0.00 175.52 173.76 1e4x s ASP 70 N -6.09 3.74 0.15 4.18 1.01 -1.17 0.98 116.67 119.47 1e4x s ASP 70 Ca -0.04 -0.34 0.05 0.00 0.71 0.00 0.00 52.55 52.92 1e4x s ASP 70 Cb 0.08 -1.17 -0.04 0.00 1.01 0.00 0.00 42.92 42.80 1e4x s ASP 70 CO 0.82 0.24 -0.11 -0.31 0.21 0.00 0.00 175.17 176.03 1e4x s TYR 71 N -0.12 1.30 0.00 4.23 1.51 0.41 -2.58 117.35 122.10 1e4x s TYR 71 Ca -0.02 -0.73 -0.07 0.00 -1.01 0.00 0.00 57.07 55.24 1e4x s TYR 71 Cb -0.14 -0.66 0.00 0.00 -0.11 0.00 0.00 41.96 41.06 1e4x s TYR 71 CO 0.04 0.10 0.13 -1.12 -1.11 0.00 0.00 175.55 173.59 1e4x s SER 72 N -3.09 0.03 -0.09 2.29 0.01 0.42 -0.69 113.70 112.59 1e4x s SER 72 Ca 0.16 -0.21 0.04 0.00 1.31 0.00 0.00 55.95 57.25 1e4x s SER 72 Cb 0.01 0.20 -0.00 0.00 0.21 0.00 0.00 66.02 66.45 1e4x s SER 72 CO 0.01 -0.36 -0.23 -0.22 0.41 0.00 0.00 173.24 172.85 1e4x s LEU 73 N -1.35 2.05 -0.14 2.44 2.96 -0.17 -1.50 118.68 122.98 1e4x s LEU 73 Ca -0.14 -0.52 0.02 0.00 -0.22 0.00 0.00 54.13 53.26 1e4x s LEU 73 Cb -0.08 -1.34 0.01 0.00 0.50 0.00 0.00 46.19 45.29 1e4x s LEU 73 CO 0.01 0.17 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.13 1e4x s THR 74 N 0.24 1.86 -0.28 3.68 2.01 0.33 -0.51 115.64 122.97 1e4x s THR 74 Ca -0.15 -0.85 -0.04 0.00 0.31 0.00 0.00 61.69 60.96 1e4x s THR 74 Cb -0.17 -1.67 0.02 0.00 0.01 0.00 0.00 72.50 70.69 1e4x s THR 74 CO 0.07 0.51 0.02 -0.63 -0.69 0.00 0.00 174.62 173.90 1e4x s ILE 75 N 0.99 3.43 0.32 1.82 1.01 -0.04 -0.82 121.20 127.89 1e4x s ILE 75 Ca -0.04 -0.94 0.06 0.00 0.00 0.00 0.00 60.65 59.73 1e4x s ILE 75 Cb -0.15 -2.80 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 1e4x s ILE 75 CO -0.04 0.08 0.45 -0.44 0.00 0.00 0.00 174.94 174.99 1e4x s SER 76 N 1.40 6.06 -1.37 3.58 0.01 0.15 -1.05 113.70 122.47 1e4x s SER 76 Ca 0.00 -0.08 -0.00 0.00 1.31 0.00 0.00 55.95 57.18 1e4x s SER 76 Cb -0.17 -1.43 0.00 0.00 0.21 0.00 0.00 66.02 64.63 1e4x s SER 76 CO -0.01 -0.35 0.53 0.59 0.41 0.00 0.00 173.24 174.41 1e4x n ASN 77 N -1.61 -0.65 -4.59 2.44 3.02 -1.04 -4.78 115.26 108.05 1e4x n ASN 77 Ca -0.02 -0.93 -0.50 0.00 -0.03 0.00 0.00 54.58 53.10 1e4x n ASN 77 Cb 0.58 -3.44 -0.05 0.00 -0.61 0.00 0.00 39.78 36.26 1e4x n ASN 77 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1e4x n LEU 78 N -4.35 1.71 -4.54 3.41 7.94 -0.00 -4.44 117.00 116.73 1e4x n LEU 78 Ca -0.31 1.13 -0.25 0.00 -1.11 0.00 0.00 56.01 55.48 1e4x n LEU 78 Cb 0.68 -1.23 -0.10 0.00 0.53 0.00 0.00 43.42 43.31 1e4x n LEU 78 CO 0.73 -1.13 -0.40 -1.61 -1.11 0.00 0.00 177.39 173.86 1e4x s GLU 79 N -0.04 1.85 0.37 1.96 0.41 -1.26 -0.50 118.70 121.48 1e4x s GLU 79 Ca 0.77 -1.80 0.06 0.00 -0.41 0.00 0.00 54.97 53.59 1e4x s GLU 79 Cb -0.87 -1.81 0.75 0.00 -1.78 0.00 0.00 34.13 30.43 1e4x s GLU 79 CO 0.50 0.23 1.97 1.49 -0.49 0.00 0.00 175.26 178.95 1e4x h GLU 80 N 2.07 0.71 0.00 1.61 4.81 -1.99 -0.94 114.58 120.85 1e4x h GLU 80 Ca -0.42 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1e4x h GLU 80 Cb 1.25 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.47 1e4x h GLU 80 CO 0.65 0.47 0.00 1.05 -0.73 0.00 0.00 179.01 180.45 1e4x h GLU 81 N 0.74 0.00 -0.00 1.92 4.11 -2.01 -2.79 114.58 116.54 1e4x h GLU 81 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.73 1e4x h GLU 81 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1e4x h GLU 81 CO -0.10 0.00 -0.08 -0.25 0.07 0.00 0.00 179.01 178.65 1e4x n ASP 82 N -2.54 0.52 -4.64 3.06 8.00 -0.36 -4.75 116.55 115.85 1e4x n ASP 82 Ca 0.00 -0.72 -0.43 0.00 0.71 0.00 0.00 54.79 54.35 1e4x n ASP 82 Cb 0.17 -0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.19 1e4x n ASP 82 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1e4x s ILE 83 N -2.37 4.25 -0.03 0.53 -1.09 -1.06 -4.86 121.20 116.58 1e4x s ILE 83 Ca 0.32 1.45 -0.19 0.00 -2.23 0.00 0.00 60.65 60.00 1e4x s ILE 83 Cb 0.20 -4.15 0.06 0.00 -1.58 0.00 0.00 42.46 37.00 1e4x s ILE 83 CO 0.45 -0.37 0.86 0.00 -1.23 0.00 0.00 174.94 174.65 1e4x n ALA 84 N 7.19 -2.44 -2.81 9.38 0.00 -1.08 -4.97 120.51 125.79 1e4x n ALA 84 Ca 0.14 -0.50 -0.35 0.00 0.00 0.00 0.00 53.44 52.73 1e4x n ALA 84 Cb 0.46 0.06 -0.09 0.00 0.00 0.00 0.00 19.45 19.88 1e4x n ALA 84 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1e4x s PHE 85 N -2.25 3.29 -0.02 0.00 5.36 0.07 -0.40 117.98 124.03 1e4x s PHE 85 Ca 0.20 0.14 0.08 0.00 -0.96 0.00 0.00 56.93 56.39 1e4x s PHE 85 Cb -0.00 -2.06 -0.02 0.00 -0.34 0.00 0.00 43.02 40.60 1e4x s PHE 85 CO -0.01 0.23 -0.25 0.71 -1.46 0.00 0.00 175.22 174.44 1e4x s TYR 86 N 0.19 2.23 0.00 10.12 1.51 -0.48 0.05 117.35 130.97 1e4x s TYR 86 Ca 0.05 -0.43 -0.10 0.00 -1.01 0.00 0.00 57.07 55.58 1e4x s TYR 86 Cb -0.12 -1.44 0.01 0.00 -0.11 0.00 0.00 41.96 40.30 1e4x s TYR 86 CO 0.00 -0.05 0.20 -0.59 -1.11 0.00 0.00 175.55 174.01 1e4x s PHE 87 N -0.56 -0.03 0.26 2.71 -0.12 -0.50 -0.62 117.98 119.12 1e4x s PHE 87 Ca 0.09 -0.03 0.06 0.00 -0.05 0.00 0.00 56.93 57.00 1e4x s PHE 87 Cb -0.10 -0.00 -0.03 0.00 -0.63 0.00 0.00 43.02 42.26 1e4x s PHE 87 CO -0.01 -0.34 0.33 0.00 -0.05 0.00 0.00 175.22 175.16 1e4x s GLN 89 N -3.97 0.87 0.02 0.00 0.74 0.14 -0.61 119.66 116.84 1e4x s GLN 89 Ca 0.36 -0.26 -0.17 0.00 0.05 0.00 0.00 55.36 55.33 1e4x s GLN 89 Cb -0.09 -0.82 -0.06 0.00 1.10 0.00 0.00 33.01 33.14 1e4x s GLN 89 CO 0.28 0.09 0.49 1.14 -0.55 0.00 0.00 175.29 176.74 1e4x s GLN 90 N 0.24 4.10 -0.15 1.67 1.03 0.74 -0.58 119.66 126.72 1e4x s GLN 90 Ca -0.04 0.57 0.18 0.00 0.04 0.00 0.00 55.36 56.11 1e4x s GLN 90 Cb -0.08 -3.25 0.32 0.00 0.03 0.00 0.00 33.01 30.03 1e4x s GLN 90 CO 0.00 0.61 1.18 0.41 -2.54 0.00 0.00 175.29 174.95 1e4x n GLY 91 N 1.93 4.89 0.10 2.60 0.00 0.11 -3.54 105.19 111.28 1e4x n GLY 91 Ca -0.11 -1.16 -0.02 0.00 0.00 0.00 0.00 46.02 44.73 1e4x n GLY 91 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1e4x h GLY 92 N 0.25 0.00 -3.96 -0.02 0.00 -1.75 -3.47 103.07 94.12 1e4x h GLY 92 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.26 1e4x h GLY 92 CO 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 176.54 176.54 1e4x s ALA 93 N -2.85 -1.26 0.20 3.60 0.00 -1.26 -4.98 121.76 115.20 1e4x s ALA 93 Ca -0.01 0.67 -0.16 0.00 0.00 0.00 0.00 51.96 52.47 1e4x s ALA 93 Cb 0.08 0.20 -0.08 0.00 0.00 0.00 0.00 23.12 23.33 1e4x s ALA 93 CO 0.80 -0.40 0.62 -0.51 0.00 0.00 0.00 175.76 176.27 1e4x s LEU 94 N -1.62 4.29 0.34 0.00 1.43 -1.26 -3.51 118.68 118.35 1e4x s LEU 94 Ca -0.09 1.19 -0.23 0.00 -1.03 0.00 0.00 54.13 53.97 1e4x s LEU 94 Cb -0.02 -3.50 -0.10 0.00 0.03 0.00 0.00 46.19 42.61 1e4x s LEU 94 CO 0.03 0.03 0.92 -2.16 0.23 0.00 0.00 176.35 175.39 1e4x s PRO 95 N -2.16 4.42 0.35 1.29 0.04 -1.26 -4.96 135.00 132.72 1e4x s PRO 95 Ca 0.42 1.19 -0.28 0.00 0.04 0.00 0.00 61.00 62.37 1e4x s PRO 95 Cb -0.15 -2.61 -0.11 0.00 0.04 0.00 0.00 34.50 31.68 1e4x s PRO 95 CO 0.20 0.20 1.37 -0.06 0.04 0.00 0.00 177.00 178.74 1e4x s PHE 96 N -1.79 2.88 0.10 0.56 0.08 -1.23 -4.70 117.98 113.87 1e4x s PHE 96 Ca 0.53 1.32 0.06 0.00 0.12 0.00 0.00 56.93 58.97 1e4x s PHE 96 Cb -0.15 -3.81 -0.03 0.00 -0.57 0.00 0.00 43.02 38.46 1e4x s PHE 96 CO 0.20 -2.28 -0.16 0.95 -0.10 0.00 0.00 175.22 173.83 1e4x s THR 97 N -1.13 1.38 0.09 0.64 -4.23 -1.23 -4.98 115.64 106.18 1e4x s THR 97 Ca 0.50 -1.50 0.07 0.00 -1.18 0.00 0.00 61.69 59.59 1e4x s THR 97 Cb -0.42 -1.36 -0.04 0.00 1.34 0.00 0.00 72.50 72.02 1e4x s THR 97 CO 0.57 -0.22 -0.12 -0.36 -0.54 0.00 0.00 174.62 173.95 1e4x s PHE 98 N -1.45 2.71 0.81 3.99 0.08 -1.26 -0.18 117.98 122.66 1e4x s PHE 98 Ca 0.04 -0.17 -0.12 0.00 0.12 0.00 0.00 56.93 56.80 1e4x s PHE 98 Cb -0.09 -1.44 0.08 0.00 -0.57 0.00 0.00 43.02 41.00 1e4x s PHE 98 CO 0.03 0.40 1.16 0.20 -0.10 0.00 0.00 175.22 176.91 1e4x s GLY 99 N -2.05 1.60 0.54 4.36 0.00 0.22 -4.54 107.32 107.44 1e4x s GLY 99 Ca 0.20 -0.57 0.31 0.00 0.00 0.00 0.00 44.72 44.66 1e4x s GLY 99 CO 0.12 -0.09 2.06 1.76 0.00 0.00 0.00 173.10 176.95 1e4x h SER 100 N -1.05 0.00 -4.99 1.64 0.02 -1.86 -3.42 113.55 103.89 1e4x h SER 100 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 1e4x h SER 100 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 1e4x h SER 100 CO 0.65 0.09 0.00 0.61 -1.14 0.00 0.00 176.83 177.04 1e4x n GLY 101 N -0.46 2.16 2.88 -3.77 0.00 -1.26 -5.02 105.19 99.71 1e4x n GLY 101 Ca -0.01 -1.76 -0.27 0.00 0.00 0.00 0.00 46.02 43.97 1e4x n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1e4x s THR 102 N -2.18 1.01 -0.40 2.61 2.01 0.21 -4.42 115.64 114.47 1e4x s THR 102 Ca 0.00 -0.44 -0.25 0.00 0.31 0.00 0.00 61.69 61.31 1e4x s THR 102 Cb 0.00 -1.13 0.02 0.00 0.01 0.00 0.00 72.50 71.40 1e4x s THR 102 CO 0.00 0.22 0.91 -0.75 -0.69 0.00 0.00 174.62 174.31 1e4x s LYS 103 N 1.69 3.72 -0.37 4.92 2.47 -0.56 -1.38 119.74 130.24 1e4x s LYS 103 Ca 0.03 0.40 -0.16 0.00 -1.56 0.00 0.00 55.97 54.68 1e4x s LYS 103 Cb -0.14 -3.85 -0.00 0.00 -1.46 0.00 0.00 37.83 32.38 1e4x s LYS 103 CO -0.08 -1.04 0.37 -1.17 0.16 0.00 0.00 175.35 173.59 1e4x s LEU 104 N 3.55 4.59 0.53 5.43 0.20 0.46 -1.88 118.68 131.56 1e4x s LEU 104 Ca 0.37 -0.39 0.01 0.00 0.69 0.00 0.00 54.13 54.81 1e4x s LEU 104 Cb -0.11 -2.33 0.00 0.00 -0.43 0.00 0.00 46.19 43.32 1e4x s LEU 104 CO 0.21 -0.40 0.07 0.00 -0.29 0.00 0.00 176.35 175.94 1e4x s ALA 105 N 2.02 4.28 -0.01 5.97 0.00 -0.29 -2.64 121.76 131.08 1e4x s ALA 105 Ca 0.11 -0.30 -0.18 0.00 0.00 0.00 0.00 51.96 51.60 1e4x s ALA 105 Cb -0.17 -0.11 -0.06 0.00 0.00 0.00 0.00 23.12 22.79 1e4x s ALA 105 CO 0.12 -0.08 0.49 0.42 0.00 0.00 0.00 175.76 176.71 1e4x s ILE 106 N -2.88 4.97 0.36 0.00 1.01 -1.26 -1.80 121.20 121.59 1e4x s ILE 106 Ca 0.07 1.03 -0.20 0.00 0.00 0.00 0.00 60.65 61.55 1e4x s ILE 106 Cb 0.00 -3.82 -0.10 0.00 0.01 0.00 0.00 42.46 38.55 1e4x s ILE 106 CO 0.04 0.49 0.86 -0.75 0.00 0.00 0.00 174.94 175.57 1e4x s LYS 107 N -0.54 4.21 0.19 2.79 2.20 0.13 -4.70 119.74 124.03 1e4x s LYS 107 Ca 0.27 0.98 -0.01 0.00 -0.36 0.00 0.00 55.97 56.84 1e4x s LYS 107 Cb -0.17 -2.43 0.01 0.00 -1.51 0.00 0.00 37.83 33.72 1e4x s LYS 107 CO 0.15 0.12 0.27 2.89 -0.36 0.00 0.00 175.35 178.42 1e4x n ARG 108 N -0.22 0.39 -2.26 4.03 1.85 -1.26 -4.82 116.66 114.37 1e4x n ARG 108 Ca 0.04 -1.47 -0.34 0.00 -1.00 0.00 0.00 57.85 55.08 1e4x n ARG 108 Cb 0.53 1.44 -0.00 0.00 -1.05 0.00 0.00 32.46 33.37 1e4x n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1e4x s ALA 109 N -2.18 2.73 0.36 2.89 0.00 -1.26 -4.97 121.76 119.33 1e4x s ALA 109 Ca 0.15 0.67 -0.28 0.00 0.00 0.00 0.00 51.96 52.50 1e4x s ALA 109 Cb -0.01 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.70 1e4x s ALA 109 CO 0.11 -0.70 1.38 -0.51 0.00 0.00 0.00 175.76 176.04 1e4x s ASP 110 N -2.06 6.51 -0.04 0.00 1.01 -1.26 -4.78 116.67 116.05 1e4x s ASP 110 Ca 0.69 2.83 -0.01 0.00 0.71 0.00 0.00 52.55 56.77 1e4x s ASP 110 Cb -0.20 -2.66 0.03 0.00 1.01 0.00 0.00 42.92 41.11 1e4x s ASP 110 CO 0.28 -0.73 0.08 0.00 0.21 0.00 0.00 175.17 175.01 1e4x s ALA 111 N -1.15 -0.04 0.28 5.23 0.00 -0.40 -4.92 121.76 120.76 1e4x s ALA 111 Ca 0.52 0.45 -0.29 0.00 0.00 0.00 0.00 51.96 52.63 1e4x s ALA 111 Cb -0.42 -0.40 -0.10 0.00 0.00 0.00 0.00 23.12 22.20 1e4x s ALA 111 CO 0.57 -0.20 1.15 0.00 0.00 0.00 0.00 175.76 177.27 1e4x s ALA 112 N 1.32 3.43 0.60 0.00 0.00 -1.26 -1.01 121.76 124.84 1e4x s ALA 112 Ca -0.07 0.97 -0.18 0.00 0.00 0.00 0.00 51.96 52.68 1e4x s ALA 112 Cb -0.12 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 1e4x s ALA 112 CO -0.04 -0.27 1.20 -1.25 0.00 0.00 0.00 175.76 175.39 1e4x s PRO 113 N -1.38 2.93 -0.33 0.00 0.04 -1.26 -4.54 135.00 130.47 1e4x s PRO 113 Ca 0.46 1.78 -0.15 0.00 0.04 0.00 0.00 61.00 63.13 1e4x s PRO 113 Cb -0.33 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 1e4x s PRO 113 CO 0.43 -1.23 0.36 0.99 0.04 0.00 0.00 177.00 177.60 1e4x s THR 114 N -1.68 5.17 -0.11 1.26 2.01 0.56 -4.80 115.64 118.04 1e4x s THR 114 Ca 0.76 0.15 -0.04 0.00 0.31 0.00 0.00 61.69 62.87 1e4x s THR 114 Cb -0.29 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 1e4x s THR 114 CO 0.34 -0.05 0.05 -0.69 -0.69 0.00 0.00 174.62 173.58 1e4x s VAL 115 N 2.04 4.70 -0.08 3.82 1.01 -1.26 -0.67 120.40 129.96 1e4x s VAL 115 Ca 0.12 -0.09 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 1e4x s VAL 115 Cb -0.16 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.21 1e4x s VAL 115 CO 0.11 0.58 0.22 -0.44 0.00 0.00 0.00 175.10 175.58 1e4x s SER 116 N -0.66 -0.23 0.01 3.32 0.01 -0.46 -4.98 113.70 110.71 1e4x s SER 116 Ca 0.11 0.45 0.08 0.00 1.31 0.00 0.00 55.95 57.90 1e4x s SER 116 Cb -0.12 0.44 -0.03 0.00 0.21 0.00 0.00 66.02 66.52 1e4x s SER 116 CO 0.02 -0.09 -0.23 -0.51 0.41 0.00 0.00 173.24 172.84 1e4x s ILE 117 N 0.28 2.36 -0.09 1.44 2.07 -1.26 -0.64 121.20 125.36 1e4x s ILE 117 Ca -0.01 -1.17 0.02 0.00 -1.41 0.00 0.00 60.65 58.07 1e4x s ILE 117 Cb -0.03 -1.90 0.02 0.00 0.13 0.00 0.00 42.46 40.67 1e4x s ILE 117 CO -0.01 0.46 -0.13 -0.36 -1.91 0.00 0.00 174.94 172.99 1e4x s PHE 118 N -0.76 1.69 0.93 3.50 0.40 0.28 -4.97 117.98 119.06 1e4x s PHE 118 Ca 0.12 -0.75 -0.11 0.00 -0.60 0.00 0.00 56.93 55.58 1e4x s PHE 118 Cb -0.10 -1.26 0.15 0.00 0.51 0.00 0.00 43.02 42.32 1e4x s PHE 118 CO 0.01 -0.41 1.09 -2.14 0.70 0.00 0.00 175.22 174.47 1e4x s PRO 119 N 1.00 0.98 0.44 0.24 0.02 -1.26 -1.64 135.00 134.78 1e4x s PRO 119 Ca -0.07 0.92 -0.25 0.00 0.02 0.00 0.00 61.00 61.61 1e4x s PRO 119 Cb -0.15 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.51 1e4x s PRO 119 CO -0.01 -2.46 1.39 -2.30 -0.33 0.00 0.00 177.00 173.30 1e4x n PRO 120 N -4.05 2.19 -1.60 5.54 -0.02 -1.18 -4.79 135.00 131.09 1e4x n PRO 120 Ca 0.07 0.78 -0.34 0.00 -2.02 0.00 0.00 63.50 61.99 1e4x n PRO 120 Cb 0.55 -2.57 0.07 0.00 -0.02 0.00 0.00 33.50 31.53 1e4x n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1e4x s SER 121 N -0.47 4.63 0.37 2.55 1.04 -1.26 -4.92 113.70 115.64 1e4x s SER 121 Ca 0.61 2.20 0.17 0.00 0.48 0.00 0.00 55.95 59.40 1e4x s SER 121 Cb -0.47 -2.57 0.70 0.00 0.10 0.00 0.00 66.02 63.78 1e4x s SER 121 CO 0.58 -1.96 1.76 0.77 0.98 0.00 0.00 173.24 175.37 1e4x h SER 122 N -0.11 0.00 -0.26 7.02 4.64 -1.99 -0.60 113.55 122.26 1e4x h SER 122 Ca -0.47 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.83 1e4x h SER 122 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 1e4x h SER 122 CO 0.52 0.40 0.09 -0.08 -0.87 0.00 0.00 176.83 176.88 1e4x h GLU 123 N 0.00 0.39 -0.69 4.77 4.81 -1.99 -1.54 114.58 120.33 1e4x h GLU 123 Ca -0.00 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1e4x h GLU 123 Cb 0.83 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 1e4x h GLU 123 CO 0.05 0.46 0.41 0.37 -0.73 0.00 0.00 179.01 179.57 1e4x h GLN 124 N 0.25 0.95 -0.90 1.92 4.15 -1.72 -2.83 115.11 116.93 1e4x h GLN 124 Ca 0.08 -0.09 0.02 0.00 0.77 0.00 0.00 58.65 59.43 1e4x h GLN 124 Cb 0.22 -0.20 -0.05 0.00 0.21 0.00 0.00 27.48 27.67 1e4x h GLN 124 CO -0.00 0.68 0.60 -0.07 -1.93 0.00 0.00 178.83 178.10 1e4x h LEU 125 N 0.95 1.02 -1.47 -2.39 3.38 -0.80 -1.26 115.31 114.74 1e4x h LEU 125 Ca 0.25 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1e4x h LEU 125 Cb -0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1e4x h LEU 125 CO -0.05 0.73 0.21 0.74 0.09 0.00 0.00 178.44 180.17 1e4x h THR 126 N 1.20 1.14 0.00 0.22 2.02 -1.09 -1.15 112.91 115.24 1e4x h THR 126 Ca 0.34 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1e4x h THR 126 Cb -0.10 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 1e4x h THR 126 CO -0.08 0.15 0.00 -1.54 0.37 0.00 0.00 175.52 174.42 1e4x n SER 127 N -4.42 0.00 0.00 4.18 3.41 -0.51 -4.90 113.62 111.38 1e4x n SER 127 Ca 0.03 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1e4x n SER 127 Cb 0.11 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 1e4x n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1e4x n GLY 128 N 1.04 0.51 3.74 5.00 0.00 -0.44 -5.08 105.19 109.97 1e4x n GLY 128 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1e4x n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1e4x s GLY 129 N -1.15 2.03 -0.18 -0.02 0.00 -0.99 -2.64 107.32 104.36 1e4x s GLY 129 Ca 0.00 -1.89 -0.05 0.00 0.00 0.00 0.00 44.72 42.79 1e4x s GLY 129 CO 0.00 -1.78 0.33 0.00 0.00 0.00 0.00 173.10 171.64 1e4x s ALA 130 N -2.46 -0.80 -0.10 3.20 0.00 -1.00 -3.32 121.76 117.27 1e4x s ALA 130 Ca 0.39 0.99 0.03 0.00 0.00 0.00 0.00 51.96 53.37 1e4x s ALA 130 Cb -0.01 -1.30 0.01 0.00 0.00 0.00 0.00 23.12 21.82 1e4x s ALA 130 CO 0.23 -0.89 -0.18 -1.12 0.00 0.00 0.00 175.76 173.79 1e4x s SER 131 N 2.49 2.58 -0.20 0.00 0.01 -1.26 -1.10 113.70 116.21 1e4x s SER 131 Ca 0.04 -0.46 -0.07 0.00 1.31 0.00 0.00 55.95 56.77 1e4x s SER 131 Cb -0.13 -1.18 -0.04 0.00 0.21 0.00 0.00 66.02 64.88 1e4x s SER 131 CO -0.12 0.08 0.06 -0.69 0.41 0.00 0.00 173.24 172.98 1e4x s VAL 132 N 0.65 4.56 0.09 3.43 1.01 0.16 -3.13 120.40 127.16 1e4x s VAL 132 Ca -0.13 -0.10 0.09 0.00 0.00 0.00 0.00 61.98 61.83 1e4x s VAL 132 Cb -0.16 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 1e4x s VAL 132 CO 0.04 0.42 -0.23 0.68 0.00 0.00 0.00 175.10 176.00 1e4x s VAL 133 N 0.82 1.92 -0.08 2.92 -7.23 -0.65 -0.03 120.40 118.07 1e4x s VAL 133 Ca 0.03 -1.49 0.01 0.00 -1.81 0.00 0.00 61.98 58.72 1e4x s VAL 133 Cb -0.14 -1.70 0.02 0.00 0.56 0.00 0.00 36.38 35.13 1e4x s VAL 133 CO 0.02 0.12 -0.08 0.00 -0.31 0.00 0.00 175.10 174.85 1e4x s PHE 135 N 1.21 3.47 -0.35 0.00 0.08 0.18 -0.94 117.98 121.63 1e4x s PHE 135 Ca -0.05 0.41 0.01 0.00 0.12 0.00 0.00 56.93 57.42 1e4x s PHE 135 Cb -0.14 -1.94 0.11 0.00 -0.57 0.00 0.00 43.02 40.48 1e4x s PHE 135 CO -0.02 0.60 0.13 -0.51 -0.10 0.00 0.00 175.22 175.32 1e4x s LEU 136 N -0.77 2.86 0.12 -0.37 1.02 0.76 -1.36 118.68 120.95 1e4x s LEU 136 Ca 0.13 -2.01 0.07 0.00 0.02 0.00 0.00 54.13 52.34 1e4x s LEU 136 Cb -0.12 -1.06 -0.04 0.00 0.02 0.00 0.00 46.19 44.99 1e4x s LEU 136 CO 0.03 -0.37 -0.06 0.20 0.02 0.00 0.00 176.35 176.17 1e4x s ASN 137 N 1.13 4.60 -1.23 2.29 0.01 0.16 -0.88 114.94 121.02 1e4x s ASN 137 Ca 0.12 -0.36 -0.04 0.00 -0.71 0.00 0.00 52.86 51.86 1e4x s ASN 137 Cb -0.20 -0.94 -0.01 0.00 0.41 0.00 0.00 41.25 40.51 1e4x s ASN 137 CO -0.15 0.15 0.78 0.59 -1.51 0.00 0.00 177.10 176.96 1e4x n ASN 138 N 0.43 -2.78 -4.77 -1.22 4.13 -0.76 -0.32 115.26 109.96 1e4x n ASN 138 Ca -0.12 -0.81 -0.23 0.00 1.68 0.00 0.00 54.58 55.10 1e4x n ASN 138 Cb 0.53 -4.25 -0.06 0.00 -1.54 0.00 0.00 39.78 34.46 1e4x n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1e4x s PHE 139 N -3.56 2.72 -0.28 3.10 -0.12 0.51 -4.56 117.98 115.79 1e4x s PHE 139 Ca 0.15 -0.42 -0.18 0.00 -0.05 0.00 0.00 56.93 56.43 1e4x s PHE 139 Cb -0.04 -1.79 0.08 0.00 -0.63 0.00 0.00 43.02 40.64 1e4x s PHE 139 CO 0.80 0.22 0.72 -0.47 -0.05 0.00 0.00 175.22 176.44 1e4x s TYR 140 N -2.44 -0.99 0.40 3.49 6.14 -0.18 -1.07 117.35 122.71 1e4x s TYR 140 Ca 0.40 2.03 -0.07 0.00 0.64 0.00 0.00 57.07 60.08 1e4x s TYR 140 Cb -0.02 0.56 0.09 0.00 0.42 0.00 0.00 41.96 43.01 1e4x s TYR 140 CO 0.24 -0.49 0.55 -0.35 0.64 0.00 0.00 175.55 176.14 1e4x n PRO 141 N 4.00 -0.52 0.23 4.97 -0.04 -1.26 -1.27 135.00 141.11 1e4x n PRO 141 Ca -0.19 -0.86 0.11 0.00 -0.04 0.00 0.00 63.50 62.52 1e4x n PRO 141 Cb 0.58 -0.56 0.44 0.00 -0.04 0.00 0.00 33.50 33.92 1e4x n PRO 141 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1e4x h LYS 142 N 0.00 0.00 -6.39 0.54 2.10 -1.98 -3.44 116.57 107.40 1e4x h LYS 142 Ca -0.18 0.00 -0.54 0.00 -2.00 0.00 0.00 60.65 57.93 1e4x h LYS 142 Cb 0.49 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.82 1e4x h LYS 142 CO 0.13 0.17 0.73 -0.51 -2.00 0.00 0.00 179.45 177.96 1e4x s ASP 143 N -6.10 6.96 -0.03 7.07 1.01 -1.26 -4.99 116.67 119.33 1e4x s ASP 143 Ca 0.02 2.01 -0.22 0.00 0.71 0.00 0.00 52.55 55.07 1e4x s ASP 143 Cb 0.09 -2.57 0.04 0.00 1.01 0.00 0.00 42.92 41.50 1e4x s ASP 143 CO 0.63 -0.62 0.48 -0.51 0.21 0.00 0.00 175.17 175.36 1e4x s ILE 144 N 1.98 0.03 -0.03 0.77 2.07 -1.26 -4.61 121.20 120.14 1e4x s ILE 144 Ca 0.60 -0.26 0.04 0.00 -1.41 0.00 0.00 60.65 59.62 1e4x s ILE 144 Cb -0.29 -0.79 -0.00 0.00 0.13 0.00 0.00 42.46 41.50 1e4x s ILE 144 CO 0.26 -0.14 -0.14 0.20 -1.91 0.00 0.00 174.94 173.21 1e4x s ASN 145 N -1.27 1.75 -0.07 4.50 0.01 -0.69 -4.99 114.94 114.18 1e4x s ASN 145 Ca -0.12 -0.28 0.05 0.00 -0.71 0.00 0.00 52.86 51.80 1e4x s ASN 145 Cb -0.03 -0.41 -0.01 0.00 0.41 0.00 0.00 41.25 41.22 1e4x s ASN 145 CO 0.07 0.13 -0.24 -0.69 -1.51 0.00 0.00 177.10 174.86 1e4x s VAL 146 N -0.01 2.01 0.04 1.60 1.01 -1.26 -0.03 120.40 123.77 1e4x s VAL 146 Ca -0.01 -1.02 0.06 0.00 0.00 0.00 0.00 61.98 61.01 1e4x s VAL 146 Cb -0.09 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 1e4x s VAL 146 CO 0.01 0.55 -0.16 -0.75 0.00 0.00 0.00 175.10 174.75 1e4x s LYS 147 N 0.06 1.09 0.05 2.72 2.20 0.46 -4.96 119.74 121.36 1e4x s LYS 147 Ca -0.10 -0.83 0.04 0.00 -0.36 0.00 0.00 55.97 54.72 1e4x s LYS 147 Cb -0.15 -1.14 -0.04 0.00 -1.51 0.00 0.00 37.83 34.99 1e4x s LYS 147 CO 0.06 0.28 -0.04 -1.58 -0.36 0.00 0.00 175.35 173.71 1e4x s TRP 148 N -0.85 2.92 -0.01 4.03 0.52 -1.26 -0.43 118.94 123.86 1e4x s TRP 148 Ca 0.04 -0.04 0.02 0.00 0.02 0.00 0.00 56.10 56.13 1e4x s TRP 148 Cb -0.08 -1.55 0.00 0.00 -1.15 0.00 0.00 33.47 30.69 1e4x s TRP 148 CO 0.02 0.43 -0.05 0.15 0.02 0.00 0.00 176.95 177.52 1e4x s LYS 149 N -1.91 0.51 -0.20 4.98 1.02 -0.08 -1.07 119.74 122.99 1e4x s LYS 149 Ca 0.21 -0.17 -0.01 0.00 0.02 0.00 0.00 55.97 56.02 1e4x s LYS 149 Cb -0.11 -0.51 0.00 0.00 -0.52 0.00 0.00 37.83 36.69 1e4x s LYS 149 CO 0.13 0.07 -0.12 0.42 -0.92 0.00 0.00 175.35 174.93 1e4x s ILE 150 N 0.11 2.76 -1.20 2.17 1.01 -0.17 -0.85 121.20 125.04 1e4x s ILE 150 Ca -0.01 -0.71 -0.03 0.00 0.00 0.00 0.00 60.65 59.90 1e4x s ILE 150 Cb -0.05 -2.21 0.02 0.00 0.01 0.00 0.00 42.46 40.23 1e4x s ILE 150 CO -0.00 0.48 0.20 0.47 0.00 0.00 0.00 174.94 176.09 1e4x n ASP 151 N 4.63 -4.17 0.00 3.58 8.00 0.79 -0.77 116.55 128.60 1e4x n ASP 151 Ca -0.19 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.28 1e4x n ASP 151 Cb 0.51 -3.49 0.00 0.00 -0.02 0.00 0.00 41.12 38.12 1e4x n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1e4x n GLY 152 N -0.99 1.00 3.66 0.44 0.00 -1.26 -5.01 105.19 103.02 1e4x n GLY 152 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 1e4x n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1e4x s SER 153 N -3.03 5.52 0.32 1.61 0.01 0.05 -5.01 113.70 113.16 1e4x s SER 153 Ca 0.00 0.12 -0.29 0.00 1.31 0.00 0.00 55.95 57.08 1e4x s SER 153 Cb 0.00 -1.83 -0.11 0.00 0.21 0.00 0.00 66.02 64.28 1e4x s SER 153 CO 0.00 0.25 1.58 -0.70 0.41 0.00 0.00 173.24 174.78 1e4x s GLU 154 N -0.11 4.11 -0.17 12.44 2.12 -1.26 -1.00 118.70 134.84 1e4x s GLU 154 Ca 0.06 2.59 0.01 0.00 0.36 0.00 0.00 54.97 57.99 1e4x s GLU 154 Cb -0.12 -3.01 0.02 0.00 0.26 0.00 0.00 34.13 31.29 1e4x s GLU 154 CO 0.01 -0.62 -0.15 0.50 -0.54 0.00 0.00 175.26 174.46 1e4x s ARG 155 N -0.90 2.46 -0.09 4.30 6.06 -0.24 -4.83 118.95 125.70 1e4x s ARG 155 Ca 0.61 -0.69 0.06 0.00 -2.50 0.00 0.00 55.73 53.21 1e4x s ARG 155 Cb -0.48 -2.29 -0.10 0.00 0.06 0.00 0.00 34.95 32.14 1e4x s ARG 155 CO 0.52 -0.26 -0.00 0.00 -2.50 0.00 0.00 175.30 173.06 1e4x n GLN 156 N 4.71 1.99 -2.54 5.12 10.64 -1.26 -4.14 117.38 131.90 1e4x n GLN 156 Ca -0.18 0.01 -0.37 0.00 -1.83 0.00 0.00 57.00 54.63 1e4x n GLN 156 Cb 0.49 -1.23 -0.04 0.00 -0.86 0.00 0.00 30.24 28.61 1e4x n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 1e4x s ASN 157 N -4.34 6.90 0.00 2.61 0.01 -1.26 -3.82 114.94 115.04 1e4x s ASN 157 Ca -0.07 2.08 0.00 0.00 -0.71 0.00 0.00 52.86 54.16 1e4x s ASN 157 Cb 0.03 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.09 1e4x s ASN 157 CO 0.34 -0.39 0.00 0.61 -1.51 0.00 0.00 177.10 176.15 1e4x n GLY 158 N 0.57 0.69 3.66 0.66 0.00 -1.26 -4.88 105.19 104.63 1e4x n GLY 158 Ca 0.03 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 1e4x n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1e4x s VAL 159 N -2.00 5.29 -0.13 1.61 1.01 -1.25 -1.22 120.40 123.71 1e4x s VAL 159 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.39 1e4x s VAL 159 Cb 0.00 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 1e4x s VAL 159 CO 0.00 0.30 -0.15 -0.76 0.00 0.00 0.00 175.10 174.50 1e4x s LEU 160 N 1.19 2.60 0.16 3.92 1.02 0.67 -4.94 118.68 123.30 1e4x s LEU 160 Ca 0.12 -0.38 0.08 0.00 0.02 0.00 0.00 54.13 53.97 1e4x s LEU 160 Cb -0.14 -1.58 -0.04 0.00 0.02 0.00 0.00 46.19 44.45 1e4x s LEU 160 CO 0.06 0.15 -0.09 -1.81 0.02 0.00 0.00 176.35 174.67 1e4x s ASP 161 N 0.46 4.31 -0.11 2.29 1.01 -1.26 -0.18 116.67 123.19 1e4x s ASP 161 Ca -0.11 -0.52 -0.12 0.00 0.71 0.00 0.00 52.55 52.52 1e4x s ASP 161 Cb -0.16 -0.76 0.03 0.00 1.01 0.00 0.00 42.92 43.04 1e4x s ASP 161 CO 0.05 0.12 0.32 -0.55 0.21 0.00 0.00 175.17 175.32 1e4x s SER 162 N -2.69 -0.33 0.00 0.27 0.15 0.09 -4.99 113.70 106.20 1e4x s SER 162 Ca 0.24 0.61 0.07 0.00 0.70 0.00 0.00 55.95 57.57 1e4x s SER 162 Cb -0.09 0.64 -0.02 0.00 -1.71 0.00 0.00 66.02 64.83 1e4x s SER 162 CO 0.15 -0.14 -0.22 0.26 1.20 0.00 0.00 173.24 174.49 1e4x s TRP 163 N 0.04 1.92 0.56 3.44 0.51 -1.26 -0.34 118.94 123.83 1e4x s TRP 163 Ca -0.01 -0.37 -0.07 0.00 -2.12 0.00 0.00 56.10 53.53 1e4x s TRP 163 Cb -0.03 -1.21 -0.01 0.00 -0.81 0.00 0.00 33.47 31.41 1e4x s TRP 163 CO 0.01 0.01 0.89 0.95 -0.51 0.00 0.00 176.95 178.29 1e4x s THR 164 N -0.59 4.17 0.69 2.01 -4.23 -0.90 -5.01 115.64 111.78 1e4x s THR 164 Ca 0.08 0.19 -0.11 0.00 -1.18 0.00 0.00 61.69 60.67 1e4x s THR 164 Cb -0.08 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.12 1e4x s THR 164 CO -0.00 -0.67 1.06 -1.81 -0.54 0.00 0.00 174.62 172.66 1e4x s ASP 165 N -4.23 5.52 0.22 3.99 1.01 -1.26 -4.59 116.67 117.34 1e4x s ASP 165 Ca 0.52 1.48 -0.31 0.00 0.71 0.00 0.00 52.55 54.95 1e4x s ASP 165 Cb -0.11 -2.38 -0.15 0.00 1.01 0.00 0.00 42.92 41.30 1e4x s ASP 165 CO 0.46 -1.34 1.14 1.67 0.21 0.00 0.00 175.17 177.31 1e4x n GLN 166 N -3.05 1.35 -2.11 8.23 7.27 -1.26 -4.78 117.38 123.03 1e4x n GLN 166 Ca 0.07 0.48 -0.42 0.00 0.07 0.00 0.00 57.00 57.20 1e4x n GLN 166 Cb 0.54 -1.95 -0.03 0.00 2.41 0.00 0.00 30.24 31.22 1e4x n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1e4x s ASP 167 N -0.18 6.76 0.37 1.69 -1.08 0.12 -4.91 116.67 119.45 1e4x s ASP 167 Ca 0.67 2.46 0.04 0.00 -0.52 0.00 0.00 52.55 55.20 1e4x s ASP 167 Cb -0.77 -2.60 0.70 0.00 -1.46 0.00 0.00 42.92 38.80 1e4x s ASP 167 CO 0.55 -0.66 2.01 0.28 0.52 0.00 0.00 175.17 177.86 1e4x h SER 168 N 6.11 0.66 0.00 -0.34 0.02 -1.90 -1.12 113.55 116.98 1e4x h SER 168 Ca -0.44 -0.01 -0.36 0.00 -0.84 0.00 0.00 61.79 60.15 1e4x h SER 168 Cb 1.21 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 63.53 1e4x h SER 168 CO 0.83 0.47 -2.34 2.29 -1.14 0.00 0.00 176.83 176.94 1e4x n LYS 169 N -4.45 0.69 -0.02 3.45 2.85 -1.26 -4.72 118.16 114.70 1e4x n LYS 169 Ca 0.07 0.10 0.07 0.00 -1.05 0.00 0.00 58.31 57.50 1e4x n LYS 169 Cb 0.08 -1.48 0.07 0.00 -0.65 0.00 0.00 35.03 33.06 1e4x n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1e4x n ASP 170 N -3.07 2.30 -1.68 -5.58 5.68 -1.24 -5.00 116.55 107.97 1e4x n ASP 170 Ca -0.39 -1.64 -0.18 0.00 -0.50 0.00 0.00 54.79 52.07 1e4x n ASP 170 Cb 0.99 -0.03 -0.05 0.00 -1.14 0.00 0.00 41.12 40.89 1e4x n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1e4x n SER 171 N 0.81 -5.28 -4.84 -1.12 7.64 -0.43 -4.95 113.62 105.46 1e4x n SER 171 Ca 0.09 0.28 -0.22 0.00 1.01 0.00 0.00 58.87 60.03 1e4x n SER 171 Cb 0.37 -4.38 0.09 0.00 -1.01 0.00 0.00 64.21 59.28 1e4x n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1e4x s THR 172 N -2.77 2.14 0.16 0.44 -4.23 -1.26 -4.61 115.64 105.50 1e4x s THR 172 Ca 0.00 -0.79 0.09 0.00 -1.18 0.00 0.00 61.69 59.81 1e4x s THR 172 Cb 0.00 -2.35 -0.04 0.00 1.34 0.00 0.00 72.50 71.45 1e4x s THR 172 CO 0.00 0.00 -0.19 -0.31 -0.54 0.00 0.00 174.62 173.58 1e4x s TYR 173 N -2.92 1.83 0.05 3.99 1.51 -0.23 0.16 117.35 121.73 1e4x s TYR 173 Ca 0.64 -0.46 -0.02 0.00 -1.01 0.00 0.00 57.07 56.22 1e4x s TYR 173 Cb -0.05 -0.92 -0.03 0.00 -0.11 0.00 0.00 41.96 40.85 1e4x s TYR 173 CO 0.42 0.32 0.01 -1.12 -1.11 0.00 0.00 175.55 174.07 1e4x s SER 174 N -2.57 0.38 -0.05 2.29 0.01 -1.26 -0.37 113.70 112.13 1e4x s SER 174 Ca 0.15 -0.85 -0.12 0.00 1.31 0.00 0.00 55.95 56.44 1e4x s SER 174 Cb -0.06 0.21 0.02 0.00 0.21 0.00 0.00 66.02 66.40 1e4x s SER 174 CO 0.06 -0.57 0.28 -0.32 0.41 0.00 0.00 173.24 173.11 1e4x s MET 175 N -3.47 0.54 -0.02 12.44 0.00 -0.05 -2.11 119.30 126.62 1e4x s MET 175 Ca 0.03 -0.01 0.07 0.00 0.00 0.00 0.00 55.69 55.77 1e4x s MET 175 Cb 0.04 0.24 -0.02 0.00 0.00 0.00 0.00 34.83 35.10 1e4x s MET 175 CO -0.08 -0.13 -0.22 0.45 0.00 0.00 0.00 175.02 175.04 1e4x s SER 176 N -0.83 2.62 -0.04 1.11 0.15 0.54 -0.17 113.70 117.08 1e4x s SER 176 Ca -0.09 -0.41 0.01 0.00 0.70 0.00 0.00 55.95 56.16 1e4x s SER 176 Cb -0.05 -0.34 0.02 0.00 -1.71 0.00 0.00 66.02 63.95 1e4x s SER 176 CO 0.03 0.27 -0.03 -0.55 1.20 0.00 0.00 173.24 174.15 1e4x s SER 177 N -0.48 0.83 -0.10 5.45 0.15 -0.11 -0.74 113.70 118.71 1e4x s SER 177 Ca 0.07 -0.09 0.02 0.00 0.70 0.00 0.00 55.95 56.65 1e4x s SER 177 Cb -0.09 -0.38 0.01 0.00 -1.71 0.00 0.00 66.02 63.85 1e4x s SER 177 CO -0.00 -0.08 -0.15 -0.89 1.20 0.00 0.00 173.24 173.32 1e4x s THR 178 N 1.02 1.48 -0.26 6.45 2.01 0.75 -0.28 115.64 126.81 1e4x s THR 178 Ca -0.10 -0.64 -0.09 0.00 0.31 0.00 0.00 61.69 61.18 1e4x s THR 178 Cb -0.14 -1.35 -0.04 0.00 0.01 0.00 0.00 72.50 70.98 1e4x s THR 178 CO -0.01 0.44 0.13 -0.22 -0.69 0.00 0.00 174.62 174.27 1e4x s LEU 179 N 0.95 3.76 -0.17 4.42 2.96 0.96 -0.24 118.68 131.32 1e4x s LEU 179 Ca -0.08 -0.08 -0.03 0.00 -0.22 0.00 0.00 54.13 53.73 1e4x s LEU 179 Cb -0.15 -2.02 -0.02 0.00 0.50 0.00 0.00 46.19 44.50 1e4x s LEU 179 CO -0.01 -0.02 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.05 1e4x s THR 180 N 1.56 3.48 0.19 3.68 2.01 -0.35 0.37 115.64 126.57 1e4x s THR 180 Ca 0.06 -0.49 0.05 0.00 0.31 0.00 0.00 61.69 61.62 1e4x s THR 180 Cb -0.15 -2.53 -0.05 0.00 0.01 0.00 0.00 72.50 69.78 1e4x s THR 180 CO 0.07 0.48 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.64 1e4x s LEU 181 N 0.74 2.42 0.72 4.42 1.02 -0.26 -4.71 118.68 123.05 1e4x s LEU 181 Ca -0.03 -1.09 -0.11 0.00 0.02 0.00 0.00 54.13 52.92 1e4x s LEU 181 Cb -0.15 -0.38 0.03 0.00 0.02 0.00 0.00 46.19 45.71 1e4x s LEU 181 CO 0.02 -0.37 1.07 0.42 0.02 0.00 0.00 176.35 177.51 1e4x s THR 182 N -3.30 3.78 0.23 5.49 -4.23 -1.26 -2.38 115.64 113.96 1e4x s THR 182 Ca 0.22 0.58 -0.08 0.00 -1.18 0.00 0.00 61.69 61.23 1e4x s THR 182 Cb 0.03 -3.28 0.19 0.00 1.34 0.00 0.00 72.50 70.78 1e4x s THR 182 CO 0.05 -0.75 1.86 0.50 -0.54 0.00 0.00 174.62 175.74 1e4x h LYS 183 N -0.84 0.96 -0.68 3.99 3.64 -1.73 -1.25 116.57 120.66 1e4x h LYS 183 Ca -0.44 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 58.82 1e4x h LYS 183 Cb 1.22 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 32.80 1e4x h LYS 183 CO 0.56 0.64 0.20 -0.44 -2.27 0.00 0.00 179.45 178.14 1e4x h ASP 184 N 0.99 1.01 -0.23 4.20 3.32 -1.92 -0.93 116.42 122.87 1e4x h ASP 184 Ca 0.33 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 1e4x h ASP 184 Cb 0.04 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1e4x h ASP 184 CO -0.12 0.96 0.03 -0.08 -1.72 0.00 0.00 179.24 178.30 1e4x h GLU 185 N 1.01 0.38 -0.91 3.56 4.81 -1.80 -2.37 114.58 119.27 1e4x h GLU 185 Ca 0.22 -0.11 0.21 0.00 -0.13 0.00 0.00 59.36 59.55 1e4x h GLU 185 Cb 0.32 -0.04 -0.12 0.00 0.63 0.00 0.00 28.75 29.54 1e4x h GLU 185 CO -0.00 0.53 0.44 -0.92 -0.73 0.00 0.00 179.01 178.33 1e4x h TYR 186 N 0.18 0.75 -0.00 0.92 3.20 -1.14 0.13 116.97 121.00 1e4x h TYR 186 Ca 0.07 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1e4x h TYR 186 Cb 0.34 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.42 1e4x h TYR 186 CO 0.02 0.02 -0.00 0.39 -1.64 0.00 0.00 178.16 176.95 1e4x n GLU 187 N -4.98 0.82 0.00 1.82 1.02 -0.36 -2.73 120.64 116.23 1e4x n GLU 187 Ca 0.22 -0.02 0.13 0.00 -0.02 0.00 0.00 57.16 57.46 1e4x n GLU 187 Cb 0.63 -1.50 0.31 0.00 -0.02 0.00 0.00 31.44 30.86 1e4x n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1e4x n ARG 188 N -1.07 1.70 -4.22 3.49 1.74 0.44 -4.91 116.66 113.83 1e4x n ARG 188 Ca 0.21 -1.20 -0.17 0.00 -0.77 0.00 0.00 57.85 55.91 1e4x n ARG 188 Cb 0.16 -1.48 -0.11 0.00 -1.02 0.00 0.00 32.46 30.01 1e4x n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1e4x s HIS 189 N -2.13 1.31 -0.25 -1.55 3.76 -1.11 -5.09 115.29 110.23 1e4x s HIS 189 Ca 0.31 -0.57 -0.13 0.00 -0.15 0.00 0.00 55.06 54.52 1e4x s HIS 189 Cb 0.20 -0.70 -0.11 0.00 1.11 0.00 0.00 32.58 33.09 1e4x s HIS 189 CO 0.38 0.11 -0.32 0.09 -0.85 0.00 0.00 174.74 174.14 1e4x n ASN 190 N 0.61 1.77 -4.70 1.40 3.02 -1.26 -4.74 115.26 111.36 1e4x n ASN 190 Ca -0.16 0.31 -0.35 0.00 -0.03 0.00 0.00 54.58 54.35 1e4x n ASN 190 Cb 0.57 -0.74 -0.08 0.00 -0.61 0.00 0.00 39.78 38.92 1e4x n ASN 190 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1e4x s SER 191 N -7.21 6.07 -0.09 6.41 0.15 -1.26 0.15 113.70 117.92 1e4x s SER 191 Ca -0.35 0.19 0.04 0.00 0.70 0.00 0.00 55.95 56.53 1e4x s SER 191 Cb 0.13 -2.06 0.00 0.00 -1.71 0.00 0.00 66.02 62.38 1e4x s SER 191 CO 0.44 0.17 -0.22 -0.31 1.20 0.00 0.00 173.24 174.52 1e4x s TYR 192 N 0.41 2.35 -0.04 3.44 2.02 -0.49 -0.15 117.35 124.89 1e4x s TYR 192 Ca 0.07 -0.92 0.01 0.00 -0.37 0.00 0.00 57.07 55.86 1e4x s TYR 192 Cb -0.11 -1.58 0.02 0.00 -0.40 0.00 0.00 41.96 39.88 1e4x s TYR 192 CO -0.01 -0.37 -0.05 0.99 -1.57 0.00 0.00 175.55 174.53 1e4x s THR 193 N 0.33 0.57 -0.15 -0.71 2.01 -0.03 -1.78 115.64 115.88 1e4x s THR 193 Ca -0.16 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 61.65 1e4x s THR 193 Cb -0.17 -0.56 -0.01 0.00 0.01 0.00 0.00 72.50 71.76 1e4x s THR 193 CO 0.07 0.22 -0.11 0.00 -0.69 0.00 0.00 174.62 174.11 1e4x s GLU 195 N 0.57 1.89 -0.05 0.00 2.02 0.43 -1.70 118.70 121.85 1e4x s GLU 195 Ca -0.07 -0.47 0.06 0.00 0.02 0.00 0.00 54.97 54.50 1e4x s GLU 195 Cb -0.15 -1.54 -0.02 0.00 0.10 0.00 0.00 34.13 32.52 1e4x s GLU 195 CO 0.03 0.04 -0.22 0.00 0.02 0.00 0.00 175.26 175.13 1e4x s ALA 196 N 0.66 2.29 -0.20 5.21 0.00 -0.07 -0.40 121.76 129.24 1e4x s ALA 196 Ca -0.14 -1.04 -0.06 0.00 0.00 0.00 0.00 51.96 50.72 1e4x s ALA 196 Cb -0.16 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 1e4x s ALA 196 CO 0.04 0.46 0.02 0.99 0.00 0.00 0.00 175.76 177.27 1e4x s THR 197 N -0.34 4.14 0.03 0.00 2.01 0.96 -1.06 115.64 121.38 1e4x s THR 197 Ca 0.02 -0.25 -0.11 0.00 0.31 0.00 0.00 61.69 61.66 1e4x s THR 197 Cb -0.12 -2.87 0.01 0.00 0.01 0.00 0.00 72.50 69.52 1e4x s THR 197 CO 0.02 0.43 0.23 -2.28 -0.69 0.00 0.00 174.62 172.33 1e4x s HIS 198 N 0.92 -0.01 0.33 4.92 5.04 -1.26 -1.70 115.29 123.53 1e4x s HIS 198 Ca 0.02 -0.15 0.38 0.00 -1.54 0.00 0.00 55.06 53.76 1e4x s HIS 198 Cb -0.14 0.01 1.90 0.00 0.04 0.00 0.00 32.58 34.39 1e4x s HIS 198 CO 0.02 -0.44 2.14 1.57 -2.34 0.00 0.00 174.74 175.70 1e4x h LYS 199 N 3.48 0.00 0.00 2.88 2.10 -1.93 -1.82 116.57 121.28 1e4x h LYS 199 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 1e4x h LYS 199 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1e4x h LYS 199 CO 0.46 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.16 1e4x n THR 200 N -2.95 0.46 -3.87 0.07 -2.24 -1.26 -4.74 114.28 99.75 1e4x n THR 200 Ca -0.01 0.11 -0.12 0.00 -2.27 0.00 0.00 64.05 61.76 1e4x n THR 200 Cb 0.15 -0.82 -0.14 0.00 -2.10 0.00 0.00 70.33 67.42 1e4x n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1e4x s SER 201 N -2.56 -0.01 0.07 3.42 0.15 -0.68 -4.95 113.70 109.13 1e4x s SER 201 Ca 0.17 0.02 0.26 0.00 0.70 0.00 0.00 55.95 57.10 1e4x s SER 201 Cb 0.12 0.04 0.72 0.00 -1.71 0.00 0.00 66.02 65.19 1e4x s SER 201 CO 0.27 -0.02 1.59 1.07 1.20 0.00 0.00 173.24 177.35 1e4x n THR 202 N 3.00 0.20 -4.35 6.45 5.66 -1.26 -4.56 114.28 119.42 1e4x n THR 202 Ca -0.13 -0.12 -0.18 0.00 -3.05 0.00 0.00 64.05 60.57 1e4x n THR 202 Cb 0.60 -0.20 -0.10 0.00 -1.55 0.00 0.00 70.33 69.07 1e4x n THR 202 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1e4x s SER 203 N -3.59 2.50 0.44 1.09 1.04 -1.26 -5.13 113.70 108.79 1e4x s SER 203 Ca 0.10 -1.06 -0.24 0.00 0.48 0.00 0.00 55.95 55.23 1e4x s SER 203 Cb 0.16 -0.12 -0.08 0.00 0.10 0.00 0.00 66.02 66.08 1e4x s SER 203 CO 0.64 -0.23 1.26 -2.84 0.98 0.00 0.00 173.24 173.05 1e4x s PRO 204 N -3.68 3.79 -0.38 4.02 0.02 -1.26 -4.88 135.00 132.64 1e4x s PRO 204 Ca 0.23 2.03 -0.24 0.00 0.02 0.00 0.00 61.00 63.04 1e4x s PRO 204 Cb 0.01 -2.58 0.01 0.00 0.02 0.00 0.00 34.50 31.96 1e4x s PRO 204 CO 0.07 -0.60 0.84 0.42 -0.33 0.00 0.00 177.00 177.40 1e4x s ILE 205 N -1.36 4.67 -0.06 2.83 1.09 -0.22 -4.89 121.20 123.25 1e4x s ILE 205 Ca 0.61 0.94 0.06 0.00 -1.10 0.00 0.00 60.65 61.16 1e4x s ILE 205 Cb -0.35 -4.27 -0.01 0.00 -1.06 0.00 0.00 42.46 36.77 1e4x s ILE 205 CO 0.44 -0.51 -0.24 0.54 -0.10 0.00 0.00 174.94 175.07 1e4x s VAL 206 N 3.27 2.01 -0.06 2.92 0.11 -1.26 -0.90 120.40 126.49 1e4x s VAL 206 Ca 0.34 -1.04 0.03 0.00 -2.93 0.00 0.00 61.98 58.38 1e4x s VAL 206 Cb -0.13 -1.70 0.01 0.00 -1.53 0.00 0.00 36.38 33.03 1e4x s VAL 206 CO 0.18 0.56 -0.15 -0.54 -3.33 0.00 0.00 175.10 171.82 1e4x s LYS 207 N -0.10 1.78 0.23 1.54 -0.14 -0.69 -5.01 119.74 117.36 1e4x s LYS 207 Ca -0.05 -0.52 -0.10 0.00 -1.36 0.00 0.00 55.97 53.94 1e4x s LYS 207 Cb -0.14 -1.49 -0.01 0.00 -1.68 0.00 0.00 37.83 34.51 1e4x s LYS 207 CO 0.04 0.13 0.39 -1.54 -0.76 0.00 0.00 175.35 173.61 1e4x s SER 208 N 0.37 -0.04 0.15 2.83 1.04 -1.26 -0.40 113.70 116.39 1e4x s SER 208 Ca -0.10 -1.02 -0.10 0.00 0.48 0.00 0.00 55.95 55.21 1e4x s SER 208 Cb -0.14 0.53 -0.00 0.00 0.10 0.00 0.00 66.02 66.52 1e4x s SER 208 CO 0.03 -1.06 0.30 0.72 0.98 0.00 0.00 173.24 174.21 1e4x s PHE 209 N -4.04 0.25 -0.16 5.02 -0.71 -0.73 -5.00 117.98 112.60 1e4x s PHE 209 Ca 0.25 -0.62 -0.02 0.00 -1.04 0.00 0.00 56.93 55.50 1e4x s PHE 209 Cb 0.01 0.01 -0.01 0.00 -1.21 0.00 0.00 43.02 41.82 1e4x s PHE 209 CO 0.09 -0.70 -0.09 -0.80 -1.34 0.00 0.00 175.22 172.37 1e4x s ASN 210 N -2.92 4.17 0.27 1.98 0.02 -1.26 -1.40 114.94 115.80 1e4x s ASN 210 Ca 0.13 -0.34 0.01 0.00 -1.02 0.00 0.00 52.86 51.64 1e4x s ASN 210 Cb 0.03 -1.67 0.62 0.00 0.02 0.00 0.00 41.25 40.25 1e4x s ASN 210 CO -0.03 0.10 1.71 -0.09 0.02 0.00 0.00 177.10 178.81 1e4x h ARG 211 N 7.21 0.42 0.00 -0.60 2.43 0.11 -3.39 114.38 120.56 1e4x h ARG 211 Ca -0.32 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.69 1e4x h ARG 211 Cb 1.19 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.63 1e4x h ARG 211 CO 0.59 0.28 -1.26 -1.71 -1.51 0.00 0.00 179.97 176.35 1e4x n ASN 212 N -5.02 0.89 -4.56 -3.80 2.85 -1.26 -4.83 115.26 99.53 1e4x n ASN 212 Ca 0.19 0.14 -0.16 0.00 -0.11 0.00 0.00 54.58 54.65 1e4x n ASN 212 Cb 0.55 -0.34 -0.07 0.00 1.24 0.00 0.00 39.78 41.16 1e4x n ASN 212 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 1e4x s GLU 213 N -2.22 1.72 0.00 1.20 8.01 -1.26 -5.29 118.70 120.86 1e4x s GLU 213 Ca -0.13 0.29 0.12 0.00 0.01 0.00 0.00 54.97 55.26 1e4x s GLU 213 Cb 0.04 -4.85 0.09 0.00 -4.31 0.00 0.00 34.13 25.11 1e4x s GLU 213 CO 0.17 -4.36 0.88 0.00 0.01 0.00 0.00 175.26 171.96