#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mex s ILE 2 N 0.00 4.81 -0.23 0.53 1.01 -1.26 -5.02 121.20 121.04 1mex s ILE 2 Ca 0.00 2.02 -0.13 0.00 0.00 0.00 0.00 60.65 62.54 1mex s ILE 2 Cb 0.00 -4.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1mex s ILE 2 CO 0.00 0.20 0.28 -0.69 0.00 0.00 0.00 174.94 174.72 1mex s VAL 3 N 0.80 5.28 -0.28 2.92 1.01 -1.26 -4.77 120.40 124.09 1mex s VAL 3 Ca 0.50 0.43 -0.10 0.00 0.00 0.00 0.00 61.98 62.81 1mex s VAL 3 Cb -0.21 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1mex s VAL 3 CO 0.28 0.29 0.16 -0.04 0.00 0.00 0.00 175.10 175.79 1mex s MET 4 N 1.24 3.77 -0.20 2.72 -1.94 -1.26 -0.93 119.30 122.71 1mex s MET 4 Ca 0.13 -0.43 -0.04 0.00 -1.71 0.00 0.00 55.69 53.64 1mex s MET 4 Cb -0.14 -3.59 -0.02 0.00 2.01 0.00 0.00 34.83 33.09 1mex s MET 4 CO 0.06 -0.23 -0.03 0.99 -0.01 0.00 0.00 175.02 175.80 1mex s THR 5 N 1.71 3.62 -0.43 2.05 2.01 0.93 -3.98 115.64 121.55 1mex s THR 5 Ca 0.07 -0.42 -0.06 0.00 0.31 0.00 0.00 61.69 61.58 1mex s THR 5 Cb -0.16 -2.63 0.11 0.00 0.01 0.00 0.00 72.50 69.83 1mex s THR 5 CO 0.09 0.43 0.27 -1.10 -0.69 0.00 0.00 174.62 173.62 1mex s GLN 6 N 1.14 2.31 0.43 4.92 -0.21 -1.26 -0.57 119.66 126.41 1mex s GLN 6 Ca 0.02 -1.73 0.29 0.00 0.02 0.00 0.00 55.36 53.96 1mex s GLN 6 Cb -0.15 -3.74 1.06 0.00 1.00 0.00 0.00 33.01 31.18 1mex s GLN 6 CO 0.00 -1.09 1.84 0.66 -2.12 0.00 0.00 175.29 174.58 1mex h SER 7 N 8.27 0.00 -3.76 5.90 4.64 -1.94 -3.42 113.55 123.24 1mex h SER 7 Ca -0.18 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.47 1mex h SER 7 Cb 1.06 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.97 1mex h SER 7 CO 0.77 0.00 -0.50 -1.10 -0.87 0.00 0.00 176.83 175.13 1mex s GLN 8 N -3.45 3.62 0.27 4.77 -1.52 -1.26 -4.94 119.66 117.16 1mex s GLN 8 Ca 0.04 -0.55 0.12 0.00 -1.95 0.00 0.00 55.36 53.02 1mex s GLN 8 Cb 0.09 -3.73 0.33 0.00 -0.22 0.00 0.00 33.01 29.47 1mex s GLN 8 CO 0.53 -0.36 1.58 0.87 -0.25 0.00 0.00 175.29 177.66 1mex h LYS 9 N 8.44 0.00 -4.77 2.91 1.79 -1.81 -3.38 116.57 119.75 1mex h LYS 9 Ca -0.33 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 57.84 1mex h LYS 9 Cb 1.17 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.61 1mex h LYS 9 CO 0.61 0.61 -0.74 -0.06 -1.08 0.00 0.00 179.45 178.79 1mex s PHE 10 N -3.44 0.81 -0.03 -1.35 0.40 -1.26 -0.62 117.98 112.50 1mex s PHE 10 Ca -0.00 -0.50 0.00 0.00 -0.60 0.00 0.00 56.93 55.83 1mex s PHE 10 Cb 0.12 -0.48 0.03 0.00 0.51 0.00 0.00 43.02 43.20 1mex s PHE 10 CO 0.75 -0.05 0.01 -1.64 0.70 0.00 0.00 175.22 175.00 1mex s MET 11 N -1.67 0.19 -0.07 0.44 -1.94 -0.35 -4.89 119.30 111.00 1mex s MET 11 Ca -0.07 0.13 -0.02 0.00 -1.71 0.00 0.00 55.69 54.01 1mex s MET 11 Cb -0.10 -0.42 -0.03 0.00 2.01 0.00 0.00 34.83 36.29 1mex s MET 11 CO 0.01 -0.16 0.03 0.45 -0.01 0.00 0.00 175.02 175.34 1mex s SER 12 N 1.11 5.44 -0.05 3.03 0.15 -1.26 -0.29 113.70 121.83 1mex s SER 12 Ca -0.09 0.18 -0.18 0.00 0.70 0.00 0.00 55.95 56.56 1mex s SER 12 Cb -0.13 -1.56 0.04 0.00 -1.71 0.00 0.00 66.02 62.65 1mex s SER 12 CO -0.02 0.36 0.41 0.28 1.20 0.00 0.00 173.24 175.47 1mex s THR 13 N -0.96 0.03 0.40 6.45 -1.32 -0.25 -4.94 115.64 115.05 1mex s THR 13 Ca 0.15 -0.28 -0.23 0.00 -1.21 0.00 0.00 61.69 60.12 1mex s THR 13 Cb -0.12 -0.69 -0.10 0.00 -1.51 0.00 0.00 72.50 70.08 1mex s THR 13 CO 0.05 -0.15 0.96 -0.44 -2.21 0.00 0.00 174.62 172.82 1mex s SER 14 N -0.97 7.03 0.38 8.08 0.01 -1.26 -0.81 113.70 126.16 1mex s SER 14 Ca -0.10 1.76 -0.28 0.00 1.31 0.00 0.00 55.95 58.64 1mex s SER 14 Cb -0.04 -2.55 -0.11 0.00 0.21 0.00 0.00 66.02 63.53 1mex s SER 14 CO 0.05 -0.29 1.47 0.18 0.41 0.00 0.00 173.24 175.05 1mex n LEU 15 N -0.27 4.75 0.00 2.44 4.77 -1.26 -2.09 117.00 125.34 1mex n LEU 15 Ca 0.05 1.22 0.00 0.00 -0.03 0.00 0.00 56.01 57.25 1mex n LEU 15 Cb 0.53 -1.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.00 1mex n LEU 15 CO 0.40 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1mex n GLY 16 N 0.48 1.43 4.02 -0.72 0.00 0.65 -4.87 105.19 106.18 1mex n GLY 16 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 1mex n GLY 16 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mex s ASN 17 N -3.04 4.76 -0.13 1.61 0.02 -0.89 -4.21 114.94 113.07 1mex s ASN 17 Ca 0.00 -0.71 -0.06 0.00 -1.02 0.00 0.00 52.86 51.08 1mex s ASN 17 Cb 0.00 0.26 -0.04 0.00 0.02 0.00 0.00 41.25 41.49 1mex s ASN 17 CO 0.00 -1.59 0.08 -0.60 0.02 0.00 0.00 177.10 175.01 1mex s ARG 18 N -4.87 3.44 0.05 -0.60 3.52 -1.26 -0.97 118.95 118.27 1mex s ARG 18 Ca 0.64 -0.27 0.04 0.00 -0.13 0.00 0.00 55.73 56.01 1mex s ARG 18 Cb -0.05 -3.08 -0.03 0.00 -1.56 0.00 0.00 34.95 30.24 1mex s ARG 18 CO 0.41 0.62 -0.12 0.54 -0.81 0.00 0.00 175.30 175.95 1mex s VAL 19 N -0.62 0.89 -0.01 7.11 0.11 -0.55 -5.00 120.40 122.33 1mex s VAL 19 Ca 0.12 -1.13 0.05 0.00 -2.93 0.00 0.00 61.98 58.09 1mex s VAL 19 Cb -0.12 -0.88 -0.01 0.00 -1.53 0.00 0.00 36.38 33.84 1mex s VAL 19 CO 0.02 -0.22 -0.16 -0.44 -3.33 0.00 0.00 175.10 170.98 1mex s SER 20 N -1.50 1.86 -0.11 3.54 0.01 -1.26 -0.94 113.70 115.29 1mex s SER 20 Ca -0.04 -0.29 0.01 0.00 1.31 0.00 0.00 55.95 56.95 1mex s SER 20 Cb -0.09 -0.21 -0.01 0.00 0.21 0.00 0.00 66.02 65.91 1mex s SER 20 CO 0.01 0.19 -0.16 -0.69 0.41 0.00 0.00 173.24 173.01 1mex s VAL 21 N -0.36 2.82 0.17 3.43 1.01 0.54 -4.96 120.40 123.05 1mex s VAL 21 Ca 0.06 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.33 1mex s VAL 21 Cb -0.06 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 1mex s VAL 21 CO -0.01 0.54 0.19 0.42 0.00 0.00 0.00 175.10 176.25 1mex s THR 22 N 0.17 4.74 -0.11 3.92 -4.23 -1.26 -0.99 115.64 117.88 1mex s THR 22 Ca -0.09 -1.00 -0.07 0.00 -1.18 0.00 0.00 61.69 59.36 1mex s THR 22 Cb -0.15 -3.44 0.04 0.00 1.34 0.00 0.00 72.50 70.28 1mex s THR 22 CO 0.05 -0.13 0.26 0.00 -0.54 0.00 0.00 174.62 174.27 1mex s LYS 24 N 0.88 2.63 -0.04 0.00 -0.14 0.26 -1.07 119.74 122.28 1mex s LYS 24 Ca -0.06 -0.86 -0.07 0.00 -1.36 0.00 0.00 55.97 53.62 1mex s LYS 24 Cb -0.07 -2.24 -0.04 0.00 -1.68 0.00 0.00 37.83 33.79 1mex s LYS 24 CO -0.06 0.40 0.23 0.00 -0.76 0.00 0.00 175.35 175.16 1mex s ALA 25 N -0.19 3.86 -0.44 5.17 0.00 0.12 -0.05 121.76 130.23 1mex s ALA 25 Ca -0.02 -0.59 0.26 0.00 0.00 0.00 0.00 51.96 51.61 1mex s ALA 25 Cb -0.14 -2.04 0.90 0.00 0.00 0.00 0.00 23.12 21.85 1mex s ALA 25 CO 0.03 0.64 1.77 0.66 0.00 0.00 0.00 175.76 178.86 1mex h SER 26 N 4.34 0.00 -5.27 0.00 4.64 -1.35 -3.45 113.55 112.47 1mex h SER 26 Ca -0.52 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.72 1mex h SER 26 Cb 1.21 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.19 1mex h SER 26 CO 0.63 0.00 -0.20 0.00 -0.87 0.00 0.00 176.83 176.40 1mex s GLN 27 N -3.30 1.42 0.20 4.77 -2.07 -1.26 -4.98 119.66 114.44 1mex s GLN 27 Ca 0.06 -1.24 -0.33 0.00 -1.82 0.00 0.00 55.36 52.04 1mex s GLN 27 Cb 0.09 0.44 -0.13 0.00 -1.09 0.00 0.00 33.01 32.32 1mex s GLN 27 CO 0.53 -0.57 1.53 -1.71 -1.32 0.00 0.00 175.29 173.75 1mex n ASN 28 N -0.33 3.06 -0.09 12.60 5.15 -1.26 -4.74 115.26 129.65 1mex n ASN 28 Ca -0.03 1.11 0.04 0.00 -0.60 0.00 0.00 54.58 55.09 1mex n ASN 28 Cb 0.63 -1.44 0.05 0.00 -0.53 0.00 0.00 39.78 38.48 1mex n ASN 28 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1mex n VAL 29 N 2.83 1.07 -2.75 3.44 0.24 -0.36 -5.03 118.33 117.78 1mex n VAL 29 Ca 0.15 -1.21 0.00 0.00 -2.04 0.00 0.00 64.34 61.24 1mex n VAL 29 Cb 0.30 0.29 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 1mex n VAL 29 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1mex n GLY 30 N -0.72 3.00 1.26 7.63 0.00 -1.25 -1.47 105.19 113.64 1mex n GLY 30 Ca 0.06 -0.30 0.08 0.00 0.00 0.00 0.00 46.02 45.86 1mex n GLY 30 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mex n THR 31 N 0.00 2.24 -2.16 2.61 -2.24 -1.26 -0.70 114.28 112.77 1mex n THR 31 Ca 0.00 -1.56 -0.42 0.00 -2.27 0.00 0.00 64.05 59.80 1mex n THR 31 Cb 0.00 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 1mex n THR 31 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1mex n ASN 32 N 0.16 5.71 -4.09 3.42 5.03 -0.54 -1.80 115.26 123.14 1mex n ASN 32 Ca 0.23 -3.07 -0.24 0.00 0.87 0.00 0.00 54.58 52.37 1mex n ASN 32 Cb 0.94 -1.48 -0.16 0.00 -1.02 0.00 0.00 39.78 38.06 1mex n ASN 32 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1mex s VAL 33 N 0.44 1.19 0.26 2.41 1.01 -1.26 -1.02 120.40 123.43 1mex s VAL 33 Ca 0.44 -0.59 0.12 0.00 0.00 0.00 0.00 61.98 61.95 1mex s VAL 33 Cb 0.12 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 1mex s VAL 33 CO -0.03 0.35 -0.20 0.00 0.00 0.00 0.00 175.10 175.23 1mex s ALA 34 N 0.05 2.73 0.00 5.51 0.00 -0.18 -0.95 121.76 128.93 1mex s ALA 34 Ca -0.03 -1.81 0.07 0.00 0.00 0.00 0.00 51.96 50.19 1mex s ALA 34 Cb -0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.69 1mex s ALA 34 CO 0.01 0.31 -0.21 -1.58 0.00 0.00 0.00 175.76 174.30 1mex s TRP 35 N -2.32 1.85 0.07 0.00 0.52 -0.54 -1.12 118.94 117.40 1mex s TRP 35 Ca 0.28 -0.36 0.05 0.00 0.02 0.00 0.00 56.10 56.10 1mex s TRP 35 Cb -0.06 -1.16 -0.03 0.00 -1.15 0.00 0.00 33.47 31.07 1mex s TRP 35 CO 0.14 0.01 -0.14 -0.06 0.02 0.00 0.00 176.95 176.92 1mex s PHE 36 N -0.58 1.21 -0.09 -1.98 0.08 0.08 -0.64 117.98 116.06 1mex s PHE 36 Ca 0.08 -0.45 -0.02 0.00 0.12 0.00 0.00 56.93 56.66 1mex s PHE 36 Cb -0.08 -0.69 -0.03 0.00 -0.57 0.00 0.00 43.02 41.65 1mex s PHE 36 CO 0.00 0.05 -0.01 -1.14 -0.10 0.00 0.00 175.22 174.02 1mex s GLN 37 N -1.67 3.03 -0.06 0.44 0.74 0.03 -1.01 119.66 121.17 1mex s GLN 37 Ca -0.02 -0.44 -0.03 0.00 0.05 0.00 0.00 55.36 54.92 1mex s GLN 37 Cb -0.10 -2.78 0.03 0.00 1.10 0.00 0.00 33.01 31.26 1mex s GLN 37 CO 0.02 0.65 0.14 -1.14 -0.55 0.00 0.00 175.29 174.41 1mex s GLN 38 N -0.73 0.11 0.20 1.67 0.74 0.31 -0.18 119.66 121.78 1mex s GLN 38 Ca 0.11 0.32 0.06 0.00 0.05 0.00 0.00 55.36 55.90 1mex s GLN 38 Cb -0.12 -0.11 -0.04 0.00 1.10 0.00 0.00 33.01 33.85 1mex s GLN 38 CO 0.02 -0.12 0.13 0.15 -0.55 0.00 0.00 175.29 174.92 1mex s LYS 39 N 0.85 2.80 0.19 1.67 1.02 -1.26 -0.99 119.74 124.02 1mex s LYS 39 Ca -0.06 -1.01 -0.33 0.00 0.02 0.00 0.00 55.97 54.59 1mex s LYS 39 Cb -0.08 -2.54 -0.14 0.00 -0.52 0.00 0.00 37.83 34.55 1mex s LYS 39 CO -0.04 0.44 1.53 -2.30 -0.92 0.00 0.00 175.35 174.06 1mex n PRO 40 N -0.66 2.16 -0.90 -1.68 -0.02 -1.26 -1.57 135.00 131.07 1mex n PRO 40 Ca -0.08 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1mex n PRO 40 Cb 0.56 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1mex n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mex n GLY 41 N 3.01 0.56 3.69 -1.23 0.00 -1.26 -5.01 105.19 104.95 1mex n GLY 41 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 1mex n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1mex s GLN 42 N -0.43 2.45 0.74 1.61 -0.21 -0.61 -5.11 119.66 118.09 1mex s GLN 42 Ca 0.00 -1.32 -0.12 0.00 0.02 0.00 0.00 55.36 53.93 1mex s GLN 42 Cb 0.00 -2.26 0.04 0.00 1.00 0.00 0.00 33.01 31.79 1mex s GLN 42 CO 0.00 0.38 1.11 -1.54 -2.12 0.00 0.00 175.29 173.11 1mex s SER 43 N -3.70 4.63 0.83 5.90 1.04 -1.26 -4.64 113.70 116.50 1mex s SER 43 Ca 0.32 1.94 -0.11 0.00 0.48 0.00 0.00 55.95 58.57 1mex s SER 43 Cb -0.07 -2.54 0.09 0.00 0.10 0.00 0.00 66.02 63.61 1mex s SER 43 CO 0.21 -1.95 1.13 -2.84 0.98 0.00 0.00 173.24 170.77 1mex s PRO 44 N -4.53 1.68 -0.08 4.02 0.02 -1.26 -4.62 135.00 130.22 1mex s PRO 44 Ca 0.64 1.44 0.03 0.00 0.02 0.00 0.00 61.00 63.13 1mex s PRO 44 Cb -0.19 -1.81 0.01 0.00 0.02 0.00 0.00 34.50 32.53 1mex s PRO 44 CO 0.50 -2.12 -0.16 0.15 -0.33 0.00 0.00 177.00 175.04 1mex s LYS 45 N -4.61 2.12 0.07 5.54 1.02 0.74 -4.94 119.74 119.69 1mex s LYS 45 Ca 0.66 -0.56 -0.31 0.00 0.02 0.00 0.00 55.97 55.78 1mex s LYS 45 Cb -0.22 -1.69 -0.07 0.00 -0.52 0.00 0.00 37.83 35.33 1mex s LYS 45 CO 0.55 0.07 1.38 0.99 -0.92 0.00 0.00 175.35 177.42 1mex s THR 46 N 0.59 3.49 -0.21 2.17 2.01 -1.26 -0.79 115.64 121.64 1mex s THR 46 Ca -0.16 1.02 -0.08 0.00 0.31 0.00 0.00 61.69 62.78 1mex s THR 46 Cb -0.16 -3.66 -0.10 0.00 0.01 0.00 0.00 72.50 68.60 1mex s THR 46 CO 0.05 0.05 -0.25 0.18 -0.69 0.00 0.00 174.62 173.96 1mex n LEU 47 N 4.41 1.72 -3.98 4.42 4.77 0.18 -4.74 117.00 123.78 1mex n LEU 47 Ca 0.12 0.19 -0.16 0.00 -0.03 0.00 0.00 56.01 56.13 1mex n LEU 47 Cb 0.43 -0.62 -0.14 0.00 -2.33 0.00 0.00 43.42 40.76 1mex n LEU 47 CO 0.58 0.50 -0.40 -0.63 -1.33 0.00 0.00 177.39 176.11 1mex s ILE 48 N -2.38 0.45 0.19 -0.08 -1.09 -1.13 -1.16 121.20 116.00 1mex s ILE 48 Ca -0.28 -0.36 0.01 0.00 -2.23 0.00 0.00 60.65 57.79 1mex s ILE 48 Cb 0.10 -0.40 -0.05 0.00 -1.58 0.00 0.00 42.46 40.53 1mex s ILE 48 CO 0.38 0.05 0.03 -0.72 -1.23 0.00 0.00 174.94 173.45 1mex s TYR 49 N -0.31 1.26 -1.38 3.97 -0.85 0.11 -1.46 117.35 118.68 1mex s TYR 49 Ca 0.00 -1.09 -0.09 0.00 -0.52 0.00 0.00 57.07 55.37 1mex s TYR 49 Cb -0.03 -0.72 0.06 0.00 0.38 0.00 0.00 41.96 41.65 1mex s TYR 49 CO -0.00 -0.28 0.59 0.43 -1.52 0.00 0.00 175.55 174.77 1mex n SER 50 N -0.28 -4.33 0.00 -0.18 7.64 -1.03 -1.15 113.62 114.28 1mex n SER 50 Ca -0.05 -0.44 0.00 0.00 1.01 0.00 0.00 58.87 59.39 1mex n SER 50 Cb 0.64 -3.54 0.00 0.00 -1.01 0.00 0.00 64.21 60.30 1mex n SER 50 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1mex n ALA 51 N -3.71 0.00 -0.87 -0.43 0.00 -0.12 -4.21 120.51 111.16 1mex n ALA 51 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1mex n ALA 51 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 1mex n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1mex n SER 52 N 0.67 0.17 -4.74 0.00 3.41 -1.15 -2.77 113.62 109.21 1mex n SER 52 Ca 0.00 -1.04 -0.36 0.00 -0.26 0.00 0.00 58.87 57.21 1mex n SER 52 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 1mex n SER 52 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1mex s TYR 53 N -0.04 3.47 -0.01 7.33 4.12 -0.30 -4.45 117.35 127.47 1mex s TYR 53 Ca 0.00 0.55 -0.27 0.00 0.02 0.00 0.00 57.07 57.37 1mex s TYR 53 Cb 0.00 -2.28 -0.04 0.00 -1.52 0.00 0.00 41.96 38.13 1mex s TYR 53 CO 0.00 0.30 0.85 1.03 0.02 0.00 0.00 175.55 177.75 1mex s ARG 54 N 0.29 4.52 0.52 -0.62 0.52 -1.26 -0.71 118.95 122.20 1mex s ARG 54 Ca 0.15 1.18 -0.22 0.00 -0.52 0.00 0.00 55.73 56.32 1mex s ARG 54 Cb -0.13 -3.44 -0.06 0.00 0.52 0.00 0.00 34.95 31.85 1mex s ARG 54 CO 0.03 0.04 1.24 -0.47 0.02 0.00 0.00 175.30 176.16 1mex s TYR 55 N 0.75 2.58 0.21 -0.53 5.04 -0.31 -4.89 117.35 120.21 1mex s TYR 55 Ca 0.45 1.48 -0.32 0.00 -2.44 0.00 0.00 57.07 56.23 1mex s TYR 55 Cb -0.20 -3.54 -0.13 0.00 0.35 0.00 0.00 41.96 38.45 1mex s TYR 55 CO 0.24 -2.11 1.61 0.43 -1.34 0.00 0.00 175.55 174.38 1mex n SER 56 N -0.91 3.52 0.00 4.32 7.64 -1.26 -1.69 113.62 125.24 1mex n SER 56 Ca 0.10 1.10 0.00 0.00 1.01 0.00 0.00 58.87 61.07 1mex n SER 56 Cb 0.47 -1.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.16 1mex n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mex n GLY 57 N 3.20 1.37 3.73 0.23 0.00 -1.26 -5.03 105.19 107.43 1mex n GLY 57 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1mex n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mex s VAL 58 N -2.54 3.97 0.53 1.61 1.01 -0.68 -4.97 120.40 119.32 1mex s VAL 58 Ca 0.00 1.64 -0.21 0.00 0.00 0.00 0.00 61.98 63.41 1mex s VAL 58 Cb 0.00 -4.05 -0.07 0.00 0.00 0.00 0.00 36.38 32.26 1mex s VAL 58 CO 0.00 0.26 1.05 -2.65 0.00 0.00 0.00 175.10 173.76 1mex n PRO 59 N 2.64 1.23 0.00 2.72 -0.02 -1.26 -4.85 135.00 135.46 1mex n PRO 59 Ca 0.04 0.46 0.07 0.00 -2.02 0.00 0.00 63.50 62.04 1mex n PRO 59 Cb 0.47 -2.21 0.37 0.00 -0.02 0.00 0.00 33.50 32.11 1mex n PRO 59 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1mex n ASP 60 N -0.34 0.00 0.25 2.55 8.00 -1.26 -1.97 116.55 123.77 1mex n ASP 60 Ca 0.11 0.09 0.17 0.00 0.71 0.00 0.00 54.79 55.88 1mex n ASP 60 Cb 0.44 -0.30 0.79 0.00 -0.02 0.00 0.00 41.12 42.04 1mex n ASP 60 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1mex h ARG 61 N 0.00 0.00 -5.55 -1.24 3.08 -1.88 -3.43 114.38 105.36 1mex h ARG 61 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1mex h ARG 61 Cb 0.15 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.10 1mex h ARG 61 CO 0.00 0.00 -0.35 -0.06 -1.07 0.00 0.00 179.97 178.49 1mex s PHE 62 N -3.72 3.51 0.08 3.04 0.08 -0.83 -0.78 117.98 119.36 1mex s PHE 62 Ca -0.01 0.60 0.00 0.00 0.12 0.00 0.00 56.93 57.65 1mex s PHE 62 Cb 0.10 -2.25 -0.04 0.00 -0.57 0.00 0.00 43.02 40.25 1mex s PHE 62 CO 0.42 0.37 -0.04 0.95 -0.10 0.00 0.00 175.22 176.82 1mex s THR 63 N 0.03 0.43 0.05 0.64 -4.23 -0.26 -4.91 115.64 107.38 1mex s THR 63 Ca 0.16 -1.88 0.01 0.00 -1.18 0.00 0.00 61.69 58.81 1mex s THR 63 Cb -0.13 -1.66 -0.03 0.00 1.34 0.00 0.00 72.50 72.02 1mex s THR 63 CO 0.04 -0.88 -0.06 -0.83 -0.54 0.00 0.00 174.62 172.36 1mex s GLY 64 N -3.00 0.52 0.10 3.99 0.00 -1.26 -0.65 107.32 107.02 1mex s GLY 64 Ca 0.11 -0.91 -0.10 0.00 0.00 0.00 0.00 44.72 43.82 1mex s GLY 64 CO -0.06 -0.98 0.23 -1.35 0.00 0.00 0.00 173.10 170.94 1mex s SER 65 N -2.02 0.06 0.00 1.64 1.04 -0.11 -4.25 113.70 110.05 1mex s SER 65 Ca -0.04 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 55.76 1mex s SER 65 Cb -0.05 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1mex s SER 65 CO -0.02 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.04 1mex n GLY 66 N -0.11 3.46 3.39 7.32 0.00 -1.26 -1.35 105.19 116.65 1mex n GLY 66 Ca -0.14 -1.89 -0.15 0.00 0.00 0.00 0.00 46.02 43.84 1mex n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1mex s SER 67 N 0.00 -0.46 0.00 1.61 0.15 -1.21 -4.77 113.70 109.02 1mex s SER 67 Ca 0.00 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.21 1mex s SER 67 Cb 0.00 0.58 0.00 0.00 -1.71 0.00 0.00 66.02 64.89 1mex s SER 67 CO 0.00 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 174.60 1mex n GLY 68 N 1.49 1.54 0.00 9.45 0.00 0.13 -3.93 105.19 113.87 1mex n GLY 68 Ca -0.19 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1mex n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mex n THR 69 N 0.00 0.00 -3.95 2.61 -2.24 -1.26 -1.23 114.28 108.22 1mex n THR 69 Ca 0.00 -0.22 -0.28 0.00 -2.27 0.00 0.00 64.05 61.27 1mex n THR 69 Cb 0.00 1.10 -0.17 0.00 -2.10 0.00 0.00 70.33 69.16 1mex n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1mex s ASP 70 N -0.37 2.51 0.08 3.42 1.11 -1.25 0.12 116.67 122.29 1mex s ASP 70 Ca 0.00 -0.45 0.06 0.00 0.18 0.00 0.00 52.55 52.34 1mex s ASP 70 Cb 0.00 -0.99 -0.03 0.00 1.07 0.00 0.00 42.92 42.97 1mex s ASP 70 CO 0.00 -0.11 -0.16 -0.36 1.18 0.00 0.00 175.17 175.72 1mex s PHE 71 N 1.60 1.36 -0.02 4.23 0.40 -0.23 -3.35 117.98 121.96 1mex s PHE 71 Ca 0.04 -0.45 -0.01 0.00 -0.60 0.00 0.00 56.93 55.91 1mex s PHE 71 Cb -0.13 -0.76 0.02 0.00 0.51 0.00 0.00 43.02 42.66 1mex s PHE 71 CO -0.09 0.10 0.05 0.99 0.70 0.00 0.00 175.22 176.97 1mex s THR 72 N -1.29 -0.03 -0.21 0.64 2.01 -0.45 -1.19 115.64 115.11 1mex s THR 72 Ca 0.00 0.12 -0.09 0.00 0.31 0.00 0.00 61.69 62.03 1mex s THR 72 Cb -0.10 -0.10 -0.05 0.00 0.01 0.00 0.00 72.50 72.27 1mex s THR 72 CO 0.03 0.05 0.12 -0.22 -0.69 0.00 0.00 174.62 173.90 1mex s LEU 73 N 0.63 4.02 -0.08 4.42 2.96 -0.16 -0.94 118.68 129.54 1mex s LEU 73 Ca -0.05 0.12 0.05 0.00 -0.22 0.00 0.00 54.13 54.03 1mex s LEU 73 Cb -0.07 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.56 1mex s LEU 73 CO -0.02 0.12 -0.24 -0.89 -1.32 0.00 0.00 176.35 174.00 1mex s THR 74 N 0.69 2.02 -0.22 3.68 2.01 0.17 -0.34 115.64 123.67 1mex s THR 74 Ca 0.06 -1.03 -0.01 0.00 0.31 0.00 0.00 61.69 61.03 1mex s THR 74 Cb -0.13 -1.73 0.02 0.00 0.01 0.00 0.00 72.50 70.67 1mex s THR 74 CO 0.01 0.56 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.76 1mex s ILE 75 N 0.08 2.68 0.26 1.82 1.01 -0.12 -1.11 121.20 125.82 1mex s ILE 75 Ca -0.11 -0.90 -0.05 0.00 0.00 0.00 0.00 60.65 59.60 1mex s ILE 75 Cb -0.16 -2.26 -0.05 0.00 0.01 0.00 0.00 42.46 40.00 1mex s ILE 75 CO 0.06 0.36 0.51 0.20 0.00 0.00 0.00 174.94 176.07 1mex s ASN 76 N 1.34 6.46 -1.25 3.58 0.01 0.04 -1.48 114.94 123.63 1mex s ASN 76 Ca 0.03 0.68 -0.16 0.00 -0.71 0.00 0.00 52.86 52.69 1mex s ASN 76 Cb -0.15 -2.13 0.00 0.00 0.41 0.00 0.00 41.25 39.39 1mex s ASN 76 CO -0.07 -0.14 0.62 -3.20 -1.51 0.00 0.00 177.10 172.80 1mex n ASN 77 N -0.74 -3.25 -4.67 -1.22 5.15 -0.97 -4.76 115.26 104.79 1mex n ASN 77 Ca -0.02 -1.08 -0.45 0.00 -0.60 0.00 0.00 54.58 52.43 1mex n ASN 77 Cb 0.54 -2.88 -0.03 0.00 -0.53 0.00 0.00 39.78 36.88 1mex n ASN 77 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1mex n VAL 78 N -4.43 0.86 -4.25 3.44 0.31 -0.14 -4.42 118.33 109.69 1mex n VAL 78 Ca -0.17 -0.22 -0.23 0.00 -0.01 0.00 0.00 64.34 63.71 1mex n VAL 78 Cb 0.62 -1.46 -0.06 0.00 -0.91 0.00 0.00 33.84 32.03 1mex n VAL 78 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1mex s GLN 79 N -0.29 2.46 0.27 5.55 -1.52 -1.26 -0.25 119.66 124.62 1mex s GLN 79 Ca 0.69 -1.31 -0.00 0.00 -1.95 0.00 0.00 55.36 52.78 1mex s GLN 79 Cb -0.66 -2.27 0.50 0.00 -0.22 0.00 0.00 33.01 30.36 1mex s GLN 79 CO 0.49 0.38 1.83 0.66 -0.25 0.00 0.00 175.29 178.40 1mex h SER 80 N 1.80 0.88 0.32 5.90 4.64 -1.93 -0.24 113.55 124.93 1mex h SER 80 Ca -0.45 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1mex h SER 80 Cb 1.25 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1mex h SER 80 CO 0.60 0.49 0.00 -1.84 -0.87 0.00 0.00 176.83 175.21 1mex n GLU 81 N -4.63 0.01 0.00 4.77 0.00 -1.26 -1.91 120.64 117.61 1mex n GLU 81 Ca 0.17 0.32 0.14 0.00 0.00 0.00 0.00 57.16 57.79 1mex n GLU 81 Cb 0.32 -1.50 0.56 0.00 0.00 0.00 0.00 31.44 30.82 1mex n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1mex n ASP 82 N -1.49 0.12 -4.63 -1.84 10.43 -0.10 -4.79 116.55 114.25 1mex n ASP 82 Ca 0.02 0.24 -0.43 0.00 2.57 0.00 0.00 54.79 57.20 1mex n ASP 82 Cb 0.11 -0.32 -0.03 0.00 1.84 0.00 0.00 41.12 42.72 1mex n ASP 82 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 1mex n LEU 83 N -1.45 3.79 -3.67 0.64 7.94 -0.80 -4.83 117.00 118.62 1mex n LEU 83 Ca 0.08 0.62 0.04 0.00 -1.11 0.00 0.00 56.01 55.63 1mex n LEU 83 Cb 0.33 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 42.74 1mex n LEU 83 CO 0.28 -0.16 1.19 0.00 -1.11 0.00 0.00 177.39 177.59 1mex s ALA 84 N 6.04 -2.52 -0.10 1.96 0.00 -1.26 -4.88 121.76 120.99 1mex s ALA 84 Ca 0.94 0.75 -0.10 0.00 0.00 0.00 0.00 51.96 53.55 1mex s ALA 84 Cb -0.40 0.40 -0.05 0.00 0.00 0.00 0.00 23.12 23.08 1mex s ALA 84 CO 0.40 -1.08 0.22 -2.00 0.00 0.00 0.00 175.76 173.29 1mex s GLU 85 N -2.07 3.69 -0.11 0.00 2.12 -0.16 -1.60 118.70 120.56 1mex s GLU 85 Ca 0.19 0.03 0.01 0.00 0.36 0.00 0.00 54.97 55.56 1mex s GLU 85 Cb 0.06 -3.23 -0.01 0.00 0.26 0.00 0.00 34.13 31.20 1mex s GLU 85 CO -0.05 0.68 -0.16 0.71 -0.54 0.00 0.00 175.26 175.89 1mex s TYR 86 N -0.82 2.72 -0.02 5.30 1.51 0.45 -0.53 117.35 125.96 1mex s TYR 86 Ca 0.17 -0.68 0.06 0.00 -1.01 0.00 0.00 57.07 55.60 1mex s TYR 86 Cb -0.13 -1.78 -0.01 0.00 -0.11 0.00 0.00 41.96 39.93 1mex s TYR 86 CO 0.06 -0.22 -0.19 -0.06 -1.11 0.00 0.00 175.55 174.03 1mex s PHE 87 N 0.21 1.77 0.40 2.71 0.40 -0.18 -0.81 117.98 122.48 1mex s PHE 87 Ca -0.10 -0.38 0.03 0.00 -0.60 0.00 0.00 56.93 55.88 1mex s PHE 87 Cb -0.16 -1.15 -0.01 0.00 0.51 0.00 0.00 43.02 42.22 1mex s PHE 87 CO 0.06 -0.06 0.58 0.00 0.70 0.00 0.00 175.22 176.50 1mex s GLN 89 N -4.39 0.59 -0.01 0.00 0.74 -0.27 -0.50 119.66 115.82 1mex s GLN 89 Ca 0.47 0.72 -0.02 0.00 0.05 0.00 0.00 55.36 56.57 1mex s GLN 89 Cb -0.10 0.28 -0.04 0.00 1.10 0.00 0.00 33.01 34.25 1mex s GLN 89 CO 0.35 -0.07 0.16 1.14 -0.55 0.00 0.00 175.29 176.32 1mex s GLN 90 N 0.33 3.36 -0.04 1.67 1.03 -0.18 -1.02 119.66 124.82 1mex s GLN 90 Ca -0.00 -0.36 0.18 0.00 0.04 0.00 0.00 55.36 55.22 1mex s GLN 90 Cb -0.04 -3.05 0.33 0.00 0.03 0.00 0.00 33.01 30.29 1mex s GLN 90 CO -0.00 0.67 1.14 2.48 -2.54 0.00 0.00 175.29 177.04 1mex n TYR 91 N 0.97 0.00 0.12 9.60 0.18 -0.19 -2.69 117.16 125.15 1mex n TYR 91 Ca -0.11 -0.58 -0.01 0.00 1.88 0.00 0.00 57.90 59.08 1mex n TYR 91 Cb 0.53 -0.15 0.25 0.00 -0.38 0.00 0.00 39.34 39.59 1mex n TYR 91 CO 0.00 0.00 0.00 -0.97 -2.08 0.00 0.00 176.86 173.81 1mex h ASN 92 N 0.75 0.18 -5.05 9.48 -0.00 -1.82 -3.46 115.58 115.65 1mex h ASN 92 Ca -0.14 -0.07 -0.06 0.00 -0.00 0.00 0.00 56.30 56.03 1mex h ASN 92 Cb 1.61 -0.05 -0.15 0.00 -0.00 0.00 0.00 38.32 39.74 1mex h ASN 92 CO 0.06 0.58 -0.06 -0.94 -0.00 0.00 0.00 177.43 177.07 1mex s SER 93 N -6.89 -0.29 0.21 1.15 1.04 -1.26 -5.11 113.70 102.56 1mex s SER 93 Ca -0.04 -0.14 -0.18 0.00 0.48 0.00 0.00 55.95 56.07 1mex s SER 93 Cb 0.14 0.46 -0.08 0.00 0.10 0.00 0.00 66.02 66.64 1mex s SER 93 CO 0.76 -0.78 0.69 -0.31 0.98 0.00 0.00 173.24 174.58 1mex s TYR 94 N -3.19 3.62 0.45 5.02 1.51 -1.26 -3.56 117.35 119.95 1mex s TYR 94 Ca -0.01 1.31 -0.21 0.00 -1.01 0.00 0.00 57.07 57.15 1mex s TYR 94 Cb 0.01 -2.56 -0.10 0.00 -0.11 0.00 0.00 41.96 39.20 1mex s TYR 94 CO -0.08 0.34 0.98 -1.25 -1.11 0.00 0.00 175.55 174.44 1mex s PRO 95 N -2.02 4.06 0.44 -1.71 0.04 -1.26 -4.98 135.00 129.57 1mex s PRO 95 Ca 0.42 1.21 -0.25 0.00 0.04 0.00 0.00 61.00 62.42 1mex s PRO 95 Cb -0.16 -2.15 -0.08 0.00 0.04 0.00 0.00 34.50 32.15 1mex s PRO 95 CO 0.20 -0.19 1.37 0.71 0.04 0.00 0.00 177.00 179.14 1mex s TYR 96 N -2.10 2.60 0.03 0.56 2.02 -1.23 -4.74 117.35 114.48 1mex s TYR 96 Ca 0.64 1.33 0.00 0.00 -0.37 0.00 0.00 57.07 58.67 1mex s TYR 96 Cb -0.12 -3.80 -0.02 0.00 -0.40 0.00 0.00 41.96 37.61 1mex s TYR 96 CO 0.16 -2.57 -0.03 0.95 -1.57 0.00 0.00 175.55 172.49 1mex s THR 97 N -1.24 0.18 0.13 -0.71 -4.23 -1.09 -5.01 115.64 103.66 1mex s THR 97 Ca 0.60 -1.10 0.10 0.00 -1.18 0.00 0.00 61.69 60.11 1mex s THR 97 Cb -0.41 -0.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.86 1mex s THR 97 CO 0.52 -0.58 -0.20 -0.36 -0.54 0.00 0.00 174.62 173.46 1mex s PHE 98 N -1.91 2.46 0.95 3.99 0.40 -1.26 -1.01 117.98 121.61 1mex s PHE 98 Ca -0.11 -0.30 -0.12 0.00 -0.60 0.00 0.00 56.93 55.80 1mex s PHE 98 Cb -0.07 -1.30 0.16 0.00 0.51 0.00 0.00 43.02 42.32 1mex s PHE 98 CO -0.02 0.39 1.10 0.20 0.70 0.00 0.00 175.22 177.58 1mex s GLY 99 N -2.20 1.58 0.00 4.36 0.00 0.34 -4.48 107.32 106.93 1mex s GLY 99 Ca 0.17 -0.28 0.30 0.00 0.00 0.00 0.00 44.72 44.91 1mex s GLY 99 CO 0.09 0.28 2.00 0.61 0.00 0.00 0.00 173.10 176.08 1mex n GLY 100 N -1.25 -1.13 0.00 0.20 0.00 -1.26 -4.73 105.19 97.01 1mex n GLY 100 Ca 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1mex n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mex n GLY 101 N 1.26 0.58 2.96 -0.02 0.00 -1.26 -5.05 105.19 103.66 1mex n GLY 101 Ca 0.15 -1.52 -0.26 0.00 0.00 0.00 0.00 46.02 44.39 1mex n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mex s THR 102 N -1.97 1.10 -0.13 2.61 2.01 0.01 -4.55 115.64 114.72 1mex s THR 102 Ca 0.00 -0.38 -0.18 0.00 0.31 0.00 0.00 61.69 61.44 1mex s THR 102 Cb 0.00 -1.06 -0.04 0.00 0.01 0.00 0.00 72.50 71.40 1mex s THR 102 CO 0.00 0.37 0.46 -0.54 -0.69 0.00 0.00 174.62 174.22 1mex s LYS 103 N 1.29 4.33 0.36 4.92 1.02 0.21 -0.41 119.74 131.45 1mex s LYS 103 Ca -0.03 0.41 -0.26 0.00 0.02 0.00 0.00 55.97 56.12 1mex s LYS 103 Cb -0.14 -3.44 -0.09 0.00 -0.52 0.00 0.00 37.83 33.64 1mex s LYS 103 CO -0.04 0.15 1.04 -1.17 -0.92 0.00 0.00 175.35 174.41 1mex s LEU 104 N 0.65 4.28 -0.04 3.17 2.96 -0.63 -1.21 118.68 127.86 1mex s LEU 104 Ca 0.25 2.05 0.07 0.00 -0.22 0.00 0.00 54.13 56.27 1mex s LEU 104 Cb -0.15 -4.02 -0.02 0.00 0.50 0.00 0.00 46.19 42.51 1mex s LEU 104 CO 0.10 -0.32 -0.25 -1.61 -1.32 0.00 0.00 176.35 172.95 1mex s GLU 105 N -2.16 2.35 -0.19 1.98 2.02 0.61 -4.58 118.70 118.72 1mex s GLU 105 Ca 0.53 -0.91 -0.10 0.00 0.02 0.00 0.00 54.97 54.52 1mex s GLU 105 Cb -0.24 -2.11 -0.05 0.00 0.10 0.00 0.00 34.13 31.83 1mex s GLU 105 CO 0.30 0.47 0.12 0.42 0.02 0.00 0.00 175.26 176.59 1mex s ILE 106 N -0.38 5.35 0.47 -1.63 -1.09 -1.26 -1.09 121.20 121.57 1mex s ILE 106 Ca 0.03 0.17 -0.21 0.00 -2.23 0.00 0.00 60.65 58.41 1mex s ILE 106 Cb -0.12 -3.43 -0.09 0.00 -1.58 0.00 0.00 42.46 37.23 1mex s ILE 106 CO 0.01 0.45 1.01 -0.54 -1.23 0.00 0.00 174.94 174.64 1mex s LYS 107 N 0.29 3.95 0.29 2.79 1.02 0.01 -4.90 119.74 123.18 1mex s LYS 107 Ca 0.08 1.28 -0.18 0.00 0.02 0.00 0.00 55.97 57.17 1mex s LYS 107 Cb -0.11 -2.13 0.02 0.00 -0.52 0.00 0.00 37.83 35.09 1mex s LYS 107 CO -0.01 -0.29 0.67 -0.98 -0.92 0.00 0.00 175.35 173.82 1mex s ARG 108 N -3.20 1.80 0.57 1.68 1.70 -1.26 -4.62 118.95 115.62 1mex s ARG 108 Ca 0.65 -1.12 -0.20 0.00 -0.47 0.00 0.00 55.73 54.59 1mex s ARG 108 Cb -0.14 0.58 -0.04 0.00 -0.57 0.00 0.00 34.95 34.78 1mex s ARG 108 CO 0.18 -0.81 1.25 0.00 -1.08 0.00 0.00 175.30 174.84 1mex s ALA 109 N -3.71 2.64 0.42 7.88 0.00 -1.26 -4.94 121.76 122.79 1mex s ALA 109 Ca 0.15 1.11 -0.26 0.00 0.00 0.00 0.00 51.96 52.96 1mex s ALA 109 Cb -0.05 -3.49 -0.09 0.00 0.00 0.00 0.00 23.12 19.49 1mex s ALA 109 CO 0.08 -1.21 1.35 -0.25 0.00 0.00 0.00 175.76 175.73 1mex n ASP 110 N -1.36 2.98 -3.75 0.00 8.00 -1.26 -4.78 116.55 116.37 1mex n ASP 110 Ca 0.12 1.13 -0.15 0.00 0.71 0.00 0.00 54.79 56.60 1mex n ASP 110 Cb 0.48 -1.55 -0.16 0.00 -0.02 0.00 0.00 41.12 39.87 1mex n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mex s ALA 111 N -1.18 0.05 0.39 2.24 0.00 -0.31 -4.92 121.76 118.04 1mex s ALA 111 Ca 0.60 0.35 -0.25 0.00 0.00 0.00 0.00 51.96 52.66 1mex s ALA 111 Cb -0.49 -0.33 -0.09 0.00 0.00 0.00 0.00 23.12 22.22 1mex s ALA 111 CO 0.59 -0.17 1.11 0.00 0.00 0.00 0.00 175.76 177.28 1mex s ALA 112 N 1.24 3.13 0.50 0.00 0.00 -1.26 -1.36 121.76 124.02 1mex s ALA 112 Ca -0.07 0.84 -0.21 0.00 0.00 0.00 0.00 51.96 52.52 1mex s ALA 112 Cb -0.13 -3.33 -0.07 0.00 0.00 0.00 0.00 23.12 19.60 1mex s ALA 112 CO -0.03 -0.37 1.12 -1.25 0.00 0.00 0.00 175.76 175.22 1mex s PRO 113 N -2.35 3.58 -0.31 0.00 0.04 -1.26 -4.52 135.00 130.19 1mex s PRO 113 Ca 0.57 1.60 -0.17 0.00 0.04 0.00 0.00 61.00 63.04 1mex s PRO 113 Cb -0.27 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.10 1mex s PRO 113 CO 0.33 -0.66 0.45 0.99 0.04 0.00 0.00 177.00 178.16 1mex s THR 114 N -1.75 5.10 -0.13 1.26 2.01 -0.14 -4.84 115.64 117.16 1mex s THR 114 Ca 0.69 0.48 -0.03 0.00 0.31 0.00 0.00 61.69 63.14 1mex s THR 114 Cb -0.24 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 68.42 1mex s THR 114 CO 0.27 -0.02 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.45 1mex s VAL 115 N 2.22 3.87 -0.02 3.82 1.01 -1.26 -0.65 120.40 129.40 1mex s VAL 115 Ca 0.17 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 61.78 1mex s VAL 115 Cb -0.16 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.57 1mex s VAL 115 CO 0.11 0.53 -0.05 -0.44 0.00 0.00 0.00 175.10 175.25 1mex s SER 116 N 0.01 0.75 0.05 3.32 0.01 -0.21 -4.96 113.70 112.67 1mex s SER 116 Ca 0.00 -0.11 0.08 0.00 1.31 0.00 0.00 55.95 57.23 1mex s SER 116 Cb -0.13 -0.23 -0.03 0.00 0.21 0.00 0.00 66.02 65.83 1mex s SER 116 CO 0.03 0.01 -0.20 -0.51 0.41 0.00 0.00 173.24 172.98 1mex s ILE 117 N 0.37 2.67 -0.07 1.44 2.07 -1.26 -0.90 121.20 125.51 1mex s ILE 117 Ca -0.04 -1.24 0.00 0.00 -1.41 0.00 0.00 60.65 57.95 1mex s ILE 117 Cb -0.08 -2.11 0.02 0.00 0.13 0.00 0.00 42.46 40.42 1mex s ILE 117 CO -0.00 0.33 -0.04 -0.36 -1.91 0.00 0.00 174.94 172.96 1mex s PHE 118 N -0.91 0.91 0.91 3.50 0.40 0.57 -5.00 117.98 118.36 1mex s PHE 118 Ca 0.14 -0.32 -0.11 0.00 -0.60 0.00 0.00 56.93 56.04 1mex s PHE 118 Cb -0.10 -0.85 0.14 0.00 0.51 0.00 0.00 43.02 42.71 1mex s PHE 118 CO 0.05 -0.31 1.10 -2.14 0.70 0.00 0.00 175.22 174.62 1mex s PRO 119 N 1.42 1.10 0.36 0.24 0.02 -1.26 -1.98 135.00 134.90 1mex s PRO 119 Ca -0.03 1.17 -0.27 0.00 0.02 0.00 0.00 61.00 61.89 1mex s PRO 119 Cb -0.13 -1.76 -0.12 0.00 0.02 0.00 0.00 34.50 32.51 1mex s PRO 119 CO -0.03 -2.45 1.24 -2.30 -0.33 0.00 0.00 177.00 173.13 1mex n PRO 120 N -4.07 1.97 -2.10 5.54 -0.02 -1.18 -4.80 135.00 130.34 1mex n PRO 120 Ca 0.09 0.69 -0.33 0.00 -2.02 0.00 0.00 63.50 61.93 1mex n PRO 120 Cb 0.53 -2.29 0.01 0.00 -0.02 0.00 0.00 33.50 31.74 1mex n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1mex s SER 121 N -0.41 5.70 0.25 2.55 1.04 -1.26 -4.93 113.70 116.63 1mex s SER 121 Ca 0.57 1.95 -0.04 0.00 0.48 0.00 0.00 55.95 58.92 1mex s SER 121 Cb -0.56 -2.55 0.37 0.00 0.10 0.00 0.00 66.02 63.38 1mex s SER 121 CO 0.61 -1.23 1.86 0.77 0.98 0.00 0.00 173.24 176.23 1mex h SER 122 N 0.68 0.90 -0.53 7.02 4.64 -1.99 -1.39 113.55 122.87 1mex h SER 122 Ca -0.48 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1mex h SER 122 Cb 1.24 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 63.13 1mex h SER 122 CO 0.57 0.56 0.35 -0.33 -0.87 0.00 0.00 176.83 177.11 1mex h GLU 123 N 1.03 0.70 -0.36 4.77 3.07 -1.99 -2.61 114.58 119.19 1mex h GLU 123 Ca 0.40 -0.04 -0.08 0.00 -0.50 0.00 0.00 59.36 59.14 1mex h GLU 123 Cb 0.20 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 1mex h GLU 123 CO -0.18 0.47 -0.09 0.37 -1.40 0.00 0.00 179.01 178.17 1mex h GLN 124 N 0.72 0.69 -0.18 2.33 4.15 -1.74 -2.87 115.11 118.21 1mex h GLN 124 Ca 0.19 -0.27 0.05 0.00 0.77 0.00 0.00 58.65 59.40 1mex h GLN 124 Cb -0.08 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 1mex h GLN 124 CO -0.04 0.85 0.19 -0.07 -1.93 0.00 0.00 178.83 177.83 1mex h LEU 125 N 0.49 0.00 -1.54 -2.39 3.38 -0.91 -1.49 115.31 112.84 1mex h LEU 125 Ca 0.09 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1mex h LEU 125 Cb 0.60 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1mex h LEU 125 CO 0.04 0.00 -0.23 0.74 0.09 0.00 0.00 178.44 179.07 1mex h THR 126 N 0.00 1.13 -0.05 0.22 2.02 -1.25 -1.78 112.91 113.20 1mex h THR 126 Ca 0.09 -0.81 0.00 0.00 0.77 0.00 0.00 66.41 66.45 1mex h THR 126 Cb 0.46 1.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 1mex h THR 126 CO -0.00 0.23 0.00 0.61 0.37 0.00 0.00 175.52 176.73 1mex n GLY 127 N -0.82 0.24 0.00 2.16 0.00 -0.57 -4.94 105.19 101.25 1mex n GLY 127 Ca -0.02 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1mex n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mex n GLY 128 N 1.21 0.55 3.58 -0.02 0.00 -0.67 -5.05 105.19 104.78 1mex n GLY 128 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 1mex n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mex s GLY 129 N -0.91 1.91 -0.28 -0.02 0.00 -1.24 -0.55 107.32 106.24 1mex s GLY 129 Ca 0.00 -1.87 -0.01 0.00 0.00 0.00 0.00 44.72 42.85 1mex s GLY 129 CO 0.00 -1.89 0.30 0.00 0.00 0.00 0.00 173.10 171.51 1mex s ALA 130 N -2.47 -0.53 -0.20 3.20 0.00 -0.19 -3.25 121.76 118.31 1mex s ALA 130 Ca 0.32 -0.15 -0.09 0.00 0.00 0.00 0.00 51.96 52.04 1mex s ALA 130 Cb -0.03 -1.77 -0.04 0.00 0.00 0.00 0.00 23.12 21.28 1mex s ALA 130 CO 0.18 -1.64 0.10 -1.12 0.00 0.00 0.00 175.76 173.27 1mex s SER 131 N 2.38 5.84 -0.21 0.00 0.01 -1.26 -0.37 113.70 120.09 1mex s SER 131 Ca 0.09 0.11 -0.09 0.00 1.31 0.00 0.00 55.95 57.38 1mex s SER 131 Cb -0.14 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.03 1mex s SER 131 CO -0.30 0.15 0.10 -0.69 0.41 0.00 0.00 173.24 172.91 1mex s VAL 132 N 0.55 4.99 -0.04 3.43 1.01 0.37 -3.08 120.40 127.62 1mex s VAL 132 Ca 0.05 0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.13 1mex s VAL 132 Cb -0.12 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.94 1mex s VAL 132 CO 0.01 0.40 -0.18 -0.69 0.00 0.00 0.00 175.10 174.64 1mex s VAL 133 N 0.75 2.73 -0.06 2.92 1.01 -0.84 -0.74 120.40 126.18 1mex s VAL 133 Ca 0.05 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.21 1mex s VAL 133 Cb -0.13 -2.04 0.01 0.00 0.00 0.00 0.00 36.38 34.22 1mex s VAL 133 CO 0.02 0.59 -0.14 0.00 0.00 0.00 0.00 175.10 175.57 1mex s PHE 135 N 0.41 3.12 -0.34 0.00 0.08 -0.08 -0.54 117.98 120.64 1mex s PHE 135 Ca -0.11 0.08 0.02 0.00 0.12 0.00 0.00 56.93 57.04 1mex s PHE 135 Cb -0.14 -1.84 0.10 0.00 -0.57 0.00 0.00 43.02 40.58 1mex s PHE 135 CO 0.03 0.34 0.09 -0.51 -0.10 0.00 0.00 175.22 175.07 1mex s LEU 136 N -0.55 3.53 0.05 -0.37 1.02 0.09 -1.04 118.68 121.41 1mex s LEU 136 Ca 0.09 -1.99 0.07 0.00 0.02 0.00 0.00 54.13 52.32 1mex s LEU 136 Cb -0.12 -1.26 -0.03 0.00 0.02 0.00 0.00 46.19 44.80 1mex s LEU 136 CO 0.02 -0.38 -0.16 0.20 0.02 0.00 0.00 176.35 176.05 1mex s ASN 137 N 1.14 3.95 -1.12 2.29 0.01 0.18 -0.55 114.94 120.84 1mex s ASN 137 Ca 0.11 -0.40 -0.06 0.00 -0.71 0.00 0.00 52.86 51.80 1mex s ASN 137 Cb -0.19 -0.68 -0.04 0.00 0.41 0.00 0.00 41.25 40.76 1mex s ASN 137 CO -0.15 0.25 0.90 0.59 -1.51 0.00 0.00 177.10 177.18 1mex n ASN 138 N 1.42 -4.80 -4.64 -1.22 4.13 -0.66 -0.96 115.26 108.52 1mex n ASN 138 Ca -0.16 -0.74 -0.24 0.00 1.68 0.00 0.00 54.58 55.13 1mex n ASN 138 Cb 0.52 -4.85 -0.08 0.00 -1.54 0.00 0.00 39.78 33.84 1mex n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1mex s PHE 139 N -3.42 2.60 -0.24 3.10 -0.71 0.37 -4.54 117.98 115.14 1mex s PHE 139 Ca 0.30 -0.37 -0.19 0.00 -1.04 0.00 0.00 56.93 55.63 1mex s PHE 139 Cb -0.05 -1.42 0.07 0.00 -1.21 0.00 0.00 43.02 40.40 1mex s PHE 139 CO 0.76 0.50 0.62 -0.47 -1.34 0.00 0.00 175.22 175.29 1mex s TYR 140 N -2.45 -0.77 1.05 3.49 6.14 -0.46 -0.51 117.35 123.83 1mex s TYR 140 Ca 0.34 1.75 -0.17 0.00 0.64 0.00 0.00 57.07 59.64 1mex s TYR 140 Cb -0.02 0.33 0.23 0.00 0.42 0.00 0.00 41.96 42.92 1mex s TYR 140 CO 0.20 -0.38 1.23 -1.25 0.64 0.00 0.00 175.55 175.99 1mex s PRO 141 N 0.73 -0.04 0.42 4.97 0.04 -1.26 -1.16 135.00 138.71 1mex s PRO 141 Ca -0.03 -0.24 0.23 0.00 0.04 0.00 0.00 61.00 61.00 1mex s PRO 141 Cb -0.05 -1.75 0.84 0.00 0.04 0.00 0.00 34.50 33.58 1mex s PRO 141 CO -0.05 -2.89 1.79 1.57 0.04 0.00 0.00 177.00 177.46 1mex h LYS 142 N -1.99 0.00 -6.56 4.56 2.10 -1.98 -3.44 116.57 109.27 1mex h LYS 142 Ca -0.45 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 57.67 1mex h LYS 142 Cb 1.26 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.61 1mex h LYS 142 CO 0.38 0.26 0.68 0.34 -2.00 0.00 0.00 179.45 179.10 1mex s ASP 143 N -6.24 6.89 -0.07 7.07 2.15 -1.26 -5.00 116.67 120.21 1mex s ASP 143 Ca 0.01 2.28 -0.25 0.00 0.43 0.00 0.00 52.55 55.01 1mex s ASP 143 Cb 0.10 -2.59 0.06 0.00 -0.30 0.00 0.00 42.92 40.19 1mex s ASP 143 CO 0.65 -0.59 0.58 -0.51 -0.17 0.00 0.00 175.17 175.13 1mex s ILE 144 N 0.89 0.01 -0.08 4.11 2.07 -1.26 -4.65 121.20 122.29 1mex s ILE 144 Ca 0.62 -0.12 0.04 0.00 -1.41 0.00 0.00 60.65 59.78 1mex s ILE 144 Cb -0.35 -0.88 0.00 0.00 0.13 0.00 0.00 42.46 41.36 1mex s ILE 144 CO 0.32 -0.06 -0.21 0.21 -1.91 0.00 0.00 174.94 173.28 1mex s ASN 145 N -0.94 2.68 -0.05 4.50 3.84 -0.35 -4.99 114.94 119.63 1mex s ASN 145 Ca -0.10 -0.47 0.05 0.00 0.21 0.00 0.00 52.86 52.56 1mex s ASN 145 Cb -0.02 -1.09 -0.01 0.00 -0.55 0.00 0.00 41.25 39.59 1mex s ASN 145 CO 0.07 0.15 -0.22 -0.69 -2.79 0.00 0.00 177.10 173.62 1mex s VAL 146 N 0.29 1.80 -0.03 -5.21 1.01 -1.26 -0.71 120.40 116.28 1mex s VAL 146 Ca -0.14 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 60.98 1mex s VAL 146 Cb -0.16 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 1mex s VAL 146 CO 0.06 0.51 -0.21 -0.54 0.00 0.00 0.00 175.10 174.92 1mex s LYS 147 N -0.05 1.92 -0.12 2.72 1.02 0.20 -4.97 119.74 120.46 1mex s LYS 147 Ca -0.05 -0.74 -0.08 0.00 0.02 0.00 0.00 55.97 55.12 1mex s LYS 147 Cb -0.13 -1.74 -0.04 0.00 -0.52 0.00 0.00 37.83 35.40 1mex s LYS 147 CO 0.03 0.37 0.17 -1.58 -0.92 0.00 0.00 175.35 173.42 1mex s TRP 148 N -0.26 3.58 -0.05 3.18 0.52 -1.26 -0.77 118.94 123.89 1mex s TRP 148 Ca 0.02 0.55 0.03 0.00 0.02 0.00 0.00 56.10 56.71 1mex s TRP 148 Cb -0.10 -2.01 0.01 0.00 -1.15 0.00 0.00 33.47 30.22 1mex s TRP 148 CO 0.01 0.66 -0.11 0.15 0.02 0.00 0.00 176.95 177.68 1mex s LYS 149 N -0.82 1.39 -0.23 4.98 1.02 -0.30 -1.37 119.74 124.41 1mex s LYS 149 Ca 0.15 -0.37 0.01 0.00 0.02 0.00 0.00 55.97 55.77 1mex s LYS 149 Cb -0.12 -1.21 0.03 0.00 -0.52 0.00 0.00 37.83 36.01 1mex s LYS 149 CO 0.04 0.07 -0.12 0.42 -0.92 0.00 0.00 175.35 174.84 1mex s ILE 150 N 0.45 2.38 -1.62 2.17 1.01 0.31 -1.04 121.20 124.87 1mex s ILE 150 Ca -0.09 -1.17 -0.14 0.00 0.00 0.00 0.00 60.65 59.25 1mex s ILE 150 Cb -0.13 -2.19 0.12 0.00 0.01 0.00 0.00 42.46 40.26 1mex s ILE 150 CO 0.02 0.26 0.73 0.47 0.00 0.00 0.00 174.94 176.42 1mex n ASP 151 N 4.58 -2.87 0.00 3.58 8.00 0.38 -1.45 116.55 128.77 1mex n ASP 151 Ca -0.17 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.34 1mex n ASP 151 Cb 0.47 -2.96 0.00 0.00 -0.02 0.00 0.00 41.12 38.61 1mex n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mex n GLY 152 N -1.57 1.45 3.52 0.44 0.00 -1.26 -5.03 105.19 102.74 1mex n GLY 152 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1mex n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mex s SER 153 N -2.77 4.41 0.31 1.61 0.01 -0.53 -5.00 113.70 111.73 1mex s SER 153 Ca 0.00 -0.12 -0.29 0.00 1.31 0.00 0.00 55.95 56.85 1mex s SER 153 Cb 0.00 -1.20 -0.10 0.00 0.21 0.00 0.00 66.02 64.93 1mex s SER 153 CO 0.00 0.31 1.25 -0.70 0.41 0.00 0.00 173.24 174.52 1mex s GLU 154 N -0.52 4.43 -0.06 12.44 2.12 -1.26 -0.53 118.70 135.33 1mex s GLU 154 Ca 0.07 2.10 0.02 0.00 0.36 0.00 0.00 54.97 57.52 1mex s GLU 154 Cb -0.12 -3.11 0.02 0.00 0.26 0.00 0.00 34.13 31.18 1mex s GLU 154 CO 0.02 -0.09 -0.09 0.50 -0.54 0.00 0.00 175.26 175.06 1mex s ARG 155 N -1.59 1.34 -0.11 4.30 6.06 -0.47 -4.90 118.95 123.58 1mex s ARG 155 Ca 0.48 -0.29 0.04 0.00 -2.50 0.00 0.00 55.73 53.47 1mex s ARG 155 Cb -0.38 -1.18 -0.10 0.00 0.06 0.00 0.00 34.95 33.36 1mex s ARG 155 CO 0.49 -0.02 -0.05 1.04 -2.50 0.00 0.00 175.30 174.26 1mex n GLN 156 N 3.92 1.24 -1.71 5.12 3.00 -1.26 -4.20 117.38 123.48 1mex n GLN 156 Ca -0.24 0.04 -0.43 0.00 -0.01 0.00 0.00 57.00 56.37 1mex n GLN 156 Cb 0.51 -1.24 -0.03 0.00 0.00 0.00 0.00 30.24 29.48 1mex n GLN 156 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1mex n ASN 157 N -2.64 3.86 0.00 1.08 4.05 -1.26 -1.94 115.26 118.41 1mex n ASN 157 Ca -0.19 1.07 0.00 0.00 0.45 0.00 0.00 54.58 55.91 1mex n ASN 157 Cb 0.76 -1.55 0.00 0.00 1.23 0.00 0.00 39.78 40.22 1mex n ASN 157 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1mex n GLY 158 N 3.78 0.75 3.71 8.20 0.00 -1.26 -4.84 105.19 115.52 1mex n GLY 158 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 1mex n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mex s VAL 159 N -2.61 5.36 -0.09 1.61 1.01 -0.82 -0.85 120.40 124.00 1mex s VAL 159 Ca 0.00 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.31 1mex s VAL 159 Cb 0.00 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.86 1mex s VAL 159 CO 0.00 0.39 -0.17 -0.76 0.00 0.00 0.00 175.10 174.56 1mex s LEU 160 N 0.65 1.80 0.08 3.92 1.43 -0.35 -4.97 118.68 121.24 1mex s LEU 160 Ca 0.11 -0.43 0.06 0.00 -1.03 0.00 0.00 54.13 52.84 1mex s LEU 160 Cb -0.12 -1.10 -0.04 0.00 0.03 0.00 0.00 46.19 44.96 1mex s LEU 160 CO 0.02 0.06 -0.08 0.20 0.23 0.00 0.00 176.35 176.77 1mex s ASN 161 N 0.71 4.50 -0.02 2.29 0.02 -1.26 -0.66 114.94 120.52 1mex s ASN 161 Ca -0.12 -0.31 -0.08 0.00 -1.02 0.00 0.00 52.86 51.32 1mex s ASN 161 Cb -0.16 -0.92 0.01 0.00 0.02 0.00 0.00 41.25 40.20 1mex s ASN 161 CO 0.03 0.20 0.18 -0.55 0.02 0.00 0.00 177.10 176.98 1mex s SER 162 N -2.05 -0.08 -0.04 -1.22 0.15 -0.20 -5.00 113.70 105.26 1mex s SER 162 Ca 0.21 0.03 0.03 0.00 0.70 0.00 0.00 55.95 56.91 1mex s SER 162 Cb -0.11 0.28 0.01 0.00 -1.71 0.00 0.00 66.02 64.49 1mex s SER 162 CO 0.13 -0.28 -0.12 0.26 1.20 0.00 0.00 173.24 174.43 1mex s TRP 163 N -0.89 1.29 0.68 3.44 0.51 -1.26 -0.53 118.94 122.19 1mex s TRP 163 Ca -0.10 -0.40 -0.14 0.00 -2.12 0.00 0.00 56.10 53.35 1mex s TRP 163 Cb -0.05 -0.93 0.01 0.00 -0.81 0.00 0.00 33.47 31.69 1mex s TRP 163 CO 0.01 -0.18 1.10 0.95 -0.51 0.00 0.00 176.95 178.32 1mex s THR 164 N 0.36 3.35 0.81 2.01 -4.23 -0.82 -5.01 115.64 112.11 1mex s THR 164 Ca -0.08 0.58 -0.13 0.00 -1.18 0.00 0.00 61.69 60.88 1mex s THR 164 Cb -0.12 -3.10 0.08 0.00 1.34 0.00 0.00 72.50 70.70 1mex s THR 164 CO 0.02 -0.44 1.18 0.47 -0.54 0.00 0.00 174.62 175.31 1mex n ASP 165 N -2.63 0.92 -4.67 3.99 10.43 -1.26 -4.59 116.55 118.73 1mex n ASP 165 Ca 0.10 0.58 -0.44 0.00 2.57 0.00 0.00 54.79 57.59 1mex n ASP 165 Cb 0.52 -1.50 -0.02 0.00 1.84 0.00 0.00 41.12 41.97 1mex n ASP 165 CO 0.00 0.00 0.00 1.67 -1.07 0.00 0.00 177.20 177.80 1mex n GLN 166 N -3.25 1.98 -2.23 -1.24 7.27 -1.26 -4.78 117.38 113.87 1mex n GLN 166 Ca 0.13 0.70 -0.42 0.00 0.07 0.00 0.00 57.00 57.49 1mex n GLN 166 Cb 0.50 -2.30 -0.03 0.00 2.41 0.00 0.00 30.24 30.83 1mex n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1mex s ASP 167 N -0.02 6.90 0.34 1.69 2.15 0.18 -4.90 116.67 123.01 1mex s ASP 167 Ca 0.63 2.34 0.26 0.00 0.43 0.00 0.00 52.55 56.21 1mex s ASP 167 Cb -0.63 -2.60 0.87 0.00 -0.30 0.00 0.00 42.92 40.26 1mex s ASP 167 CO 0.55 -0.55 1.77 0.77 -0.17 0.00 0.00 175.17 177.54 1mex h SER 168 N 5.90 0.00 0.00 -0.34 4.64 -1.90 -1.30 113.55 120.55 1mex h SER 168 Ca -0.44 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.72 1mex h SER 168 Cb 1.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 1mex h SER 168 CO 0.80 0.00 -1.01 0.50 -0.87 0.00 0.00 176.83 176.25 1mex h LYS 169 N 0.00 0.00 -0.01 4.77 1.63 -1.95 -3.44 116.57 117.58 1mex h LYS 169 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1mex h LYS 169 Cb 0.65 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.28 1mex h LYS 169 CO 0.00 0.75 -0.04 -0.40 -3.45 0.00 0.00 179.45 176.31 1mex n ASP 170 N -4.49 1.63 -0.68 4.20 5.68 -1.24 -5.00 116.55 116.64 1mex n ASP 170 Ca -0.25 -1.31 -0.09 0.00 -0.50 0.00 0.00 54.79 52.64 1mex n ASP 170 Cb 0.56 0.11 -0.04 0.00 -1.14 0.00 0.00 41.12 40.62 1mex n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1mex n SER 171 N 0.33 -4.57 -4.80 -1.12 7.64 -0.49 -4.98 113.62 105.65 1mex n SER 171 Ca 0.05 0.22 -0.23 0.00 1.01 0.00 0.00 58.87 59.92 1mex n SER 171 Cb 0.22 -2.84 0.08 0.00 -1.01 0.00 0.00 64.21 60.66 1mex n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1mex s THR 172 N -2.16 2.33 0.19 0.44 -4.23 -1.26 -4.65 115.64 106.30 1mex s THR 172 Ca 0.00 -0.58 0.11 0.00 -1.18 0.00 0.00 61.69 60.05 1mex s THR 172 Cb 0.00 -2.75 -0.04 0.00 1.34 0.00 0.00 72.50 71.04 1mex s THR 172 CO 0.00 0.00 -0.23 -0.31 -0.54 0.00 0.00 174.62 173.54 1mex s TYR 173 N -3.03 2.24 0.08 3.99 2.02 0.33 -0.64 117.35 122.34 1mex s TYR 173 Ca 0.63 -0.37 0.02 0.00 -0.37 0.00 0.00 57.07 56.98 1mex s TYR 173 Cb -0.08 -1.11 -0.03 0.00 -0.40 0.00 0.00 41.96 40.34 1mex s TYR 173 CO 0.42 0.49 -0.07 -1.12 -1.57 0.00 0.00 175.55 173.70 1mex s SER 174 N -2.71 1.06 -0.00 2.29 0.01 -1.26 -0.48 113.70 112.61 1mex s SER 174 Ca 0.21 -0.82 -0.03 0.00 1.31 0.00 0.00 55.95 56.61 1mex s SER 174 Cb -0.08 0.07 -0.00 0.00 0.21 0.00 0.00 66.02 66.22 1mex s SER 174 CO 0.10 -0.35 0.05 -0.32 0.41 0.00 0.00 173.24 173.12 1mex s MET 175 N -2.93 0.27 0.03 12.44 1.75 0.29 -1.95 119.30 129.20 1mex s MET 175 Ca 0.03 -0.29 0.07 0.00 -1.25 0.00 0.00 55.69 54.25 1mex s MET 175 Cb -0.01 0.11 -0.03 0.00 2.84 0.00 0.00 34.83 37.74 1mex s MET 175 CO -0.03 -0.05 -0.18 -1.54 -0.65 0.00 0.00 175.02 172.57 1mex s SER 176 N -0.88 3.78 -0.07 1.11 1.04 0.31 -0.73 113.70 118.26 1mex s SER 176 Ca -0.10 -0.40 0.01 0.00 0.48 0.00 0.00 55.95 55.95 1mex s SER 176 Cb -0.06 -0.62 0.02 0.00 0.10 0.00 0.00 66.02 65.46 1mex s SER 176 CO 0.00 0.27 -0.09 -0.55 0.98 0.00 0.00 173.24 173.85 1mex s SER 177 N -1.29 1.66 -0.15 7.02 0.15 0.30 -1.04 113.70 120.35 1mex s SER 177 Ca 0.14 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.54 1mex s SER 177 Cb -0.10 -0.73 0.03 0.00 -1.71 0.00 0.00 66.02 63.50 1mex s SER 177 CO 0.04 -0.02 -0.11 -0.89 1.20 0.00 0.00 173.24 173.46 1mex s THR 178 N 0.96 1.40 -0.34 6.45 2.01 0.16 -0.39 115.64 125.89 1mex s THR 178 Ca -0.10 -0.61 -0.13 0.00 0.31 0.00 0.00 61.69 61.17 1mex s THR 178 Cb -0.15 -1.39 -0.02 0.00 0.01 0.00 0.00 72.50 70.96 1mex s THR 178 CO 0.00 0.36 0.23 -0.22 -0.69 0.00 0.00 174.62 174.30 1mex s LEU 179 N 1.54 4.49 -0.23 4.42 2.96 0.08 -1.21 118.68 130.74 1mex s LEU 179 Ca 0.04 -0.43 -0.05 0.00 -0.22 0.00 0.00 54.13 53.47 1mex s LEU 179 Cb -0.14 -2.13 -0.02 0.00 0.50 0.00 0.00 46.19 44.41 1mex s LEU 179 CO -0.09 -0.23 -0.00 -0.89 -1.32 0.00 0.00 176.35 173.81 1mex s THR 180 N 1.72 3.74 0.39 3.68 2.01 -0.03 -0.48 115.64 126.66 1mex s THR 180 Ca 0.06 -0.37 0.08 0.00 0.31 0.00 0.00 61.69 61.77 1mex s THR 180 Cb -0.17 -2.72 -0.07 0.00 0.01 0.00 0.00 72.50 69.56 1mex s THR 180 CO 0.10 0.40 0.05 -0.76 -0.69 0.00 0.00 174.62 173.72 1mex s LEU 181 N 1.45 2.95 0.69 4.42 1.43 0.50 -4.69 118.68 125.42 1mex s LEU 181 Ca 0.05 -1.19 -0.11 0.00 -1.03 0.00 0.00 54.13 51.85 1mex s LEU 181 Cb -0.15 -1.16 0.01 0.00 0.03 0.00 0.00 46.19 44.93 1mex s LEU 181 CO -0.00 -0.41 1.07 0.42 0.23 0.00 0.00 176.35 177.66 1mex s THR 182 N -2.63 3.58 0.17 5.49 -4.23 -1.26 -1.02 115.64 115.74 1mex s THR 182 Ca 0.36 0.45 -0.13 0.00 -1.18 0.00 0.00 61.69 61.19 1mex s THR 182 Cb 0.05 -3.50 0.06 0.00 1.34 0.00 0.00 72.50 70.46 1mex s THR 182 CO 0.19 -0.64 1.76 0.50 -0.54 0.00 0.00 174.62 175.89 1mex h LYS 183 N -0.58 0.78 -0.79 3.99 3.64 -1.06 0.13 116.57 122.69 1mex h LYS 183 Ca -0.45 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 58.81 1mex h LYS 183 Cb 1.25 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.89 1mex h LYS 183 CO 0.63 0.63 0.46 -0.44 -2.27 0.00 0.00 179.45 178.47 1mex h ASP 184 N 0.74 0.96 0.18 4.20 3.32 -1.94 -1.23 116.42 122.64 1mex h ASP 184 Ca 0.19 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1mex h ASP 184 Cb 0.10 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.41 1mex h ASP 184 CO -0.03 0.75 -0.09 -0.08 -1.72 0.00 0.00 179.24 178.07 1mex h GLU 185 N 1.09 -0.23 -0.75 3.56 4.81 -1.90 -2.61 114.58 118.56 1mex h GLU 185 Ca 0.28 0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.65 1mex h GLU 185 Cb -0.02 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 29.33 1mex h GLU 185 CO -0.05 0.09 0.35 -0.92 -0.73 0.00 0.00 179.01 177.75 1mex h TYR 186 N -0.57 0.61 -0.00 0.92 3.20 -0.66 -1.71 116.97 118.77 1mex h TYR 186 Ca -0.02 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1mex h TYR 186 Cb 0.43 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.54 1mex h TYR 186 CO 0.03 0.16 -0.00 0.39 -1.64 0.00 0.00 178.16 177.10 1mex n GLU 187 N -4.91 0.99 0.00 1.82 1.02 -0.49 -2.73 120.64 116.34 1mex n GLU 187 Ca 0.13 -0.10 0.12 0.00 -0.02 0.00 0.00 57.16 57.29 1mex n GLU 187 Cb 0.35 -1.50 0.26 0.00 -0.02 0.00 0.00 31.44 30.53 1mex n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1mex n ARG 188 N -0.91 1.23 -4.30 3.49 1.74 -0.64 -4.95 116.66 112.31 1mex n ARG 188 Ca 0.22 -0.86 -0.16 0.00 -0.77 0.00 0.00 57.85 56.28 1mex n ARG 188 Cb 0.16 -1.48 -0.10 0.00 -1.02 0.00 0.00 32.46 30.01 1mex n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1mex s HIS 189 N -2.36 1.46 -0.03 -1.55 3.76 -1.10 -5.10 115.29 110.36 1mex s HIS 189 Ca 0.25 -0.85 -0.08 0.00 -0.15 0.00 0.00 55.06 54.24 1mex s HIS 189 Cb 0.19 -0.80 -0.03 0.00 1.11 0.00 0.00 32.58 33.05 1mex s HIS 189 CO 0.48 0.02 -0.15 -1.71 -0.85 0.00 0.00 174.74 172.53 1mex n ASN 190 N -0.34 1.38 -4.69 1.40 5.15 -1.26 -4.72 115.26 112.18 1mex n ASN 190 Ca -0.07 0.21 -0.40 0.00 -0.60 0.00 0.00 54.58 53.72 1mex n ASN 190 Cb 0.63 -0.50 -0.05 0.00 -0.53 0.00 0.00 39.78 39.33 1mex n ASN 190 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1mex s SER 191 N -5.84 6.94 -0.13 1.20 0.15 -1.26 0.16 113.70 114.92 1mex s SER 191 Ca -0.12 1.14 0.02 0.00 0.70 0.00 0.00 55.95 57.69 1mex s SER 191 Cb 0.02 -2.42 0.01 0.00 -1.71 0.00 0.00 66.02 61.92 1mex s SER 191 CO 0.19 -0.24 -0.20 -0.31 1.20 0.00 0.00 173.24 173.87 1mex s TYR 192 N 1.42 2.50 -0.04 3.44 2.02 -0.17 -0.47 117.35 126.05 1mex s TYR 192 Ca 0.37 -1.24 0.02 0.00 -0.37 0.00 0.00 57.07 55.86 1mex s TYR 192 Cb -0.17 -1.72 0.01 0.00 -0.40 0.00 0.00 41.96 39.68 1mex s TYR 192 CO 0.15 -0.57 -0.09 0.99 -1.57 0.00 0.00 175.55 174.46 1mex s THR 193 N 0.83 0.83 -0.17 -0.71 2.01 -0.20 -1.29 115.64 116.93 1mex s THR 193 Ca -0.07 -0.34 -0.03 0.00 0.31 0.00 0.00 61.69 61.56 1mex s THR 193 Cb -0.15 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 71.58 1mex s THR 193 CO -0.01 0.27 -0.07 0.00 -0.69 0.00 0.00 174.62 174.12 1mex s GLU 195 N 0.75 2.28 -0.07 0.00 2.12 0.05 -1.21 118.70 122.63 1mex s GLU 195 Ca -0.03 -0.58 0.03 0.00 0.36 0.00 0.00 54.97 54.75 1mex s GLU 195 Cb -0.15 -1.98 -0.02 0.00 0.26 0.00 0.00 34.13 32.25 1mex s GLU 195 CO 0.02 -0.11 -0.15 0.00 -0.54 0.00 0.00 175.26 174.48 1mex s ALA 196 N 1.11 2.59 -0.21 6.30 0.00 0.74 -0.63 121.76 131.66 1mex s ALA 196 Ca -0.04 -0.96 -0.03 0.00 0.00 0.00 0.00 51.96 50.93 1mex s ALA 196 Cb -0.14 -1.00 -0.01 0.00 0.00 0.00 0.00 23.12 21.97 1mex s ALA 196 CO -0.04 0.45 -0.06 0.99 0.00 0.00 0.00 175.76 177.10 1mex s THR 197 N -0.34 3.31 0.01 0.00 2.01 0.11 0.07 115.64 120.79 1mex s THR 197 Ca 0.03 -0.52 -0.09 0.00 0.31 0.00 0.00 61.69 61.42 1mex s THR 197 Cb -0.13 -2.49 0.01 0.00 0.01 0.00 0.00 72.50 69.90 1mex s THR 197 CO 0.02 0.44 0.18 -2.28 -0.69 0.00 0.00 174.62 172.30 1mex s HIS 198 N 1.31 0.00 -0.43 4.92 2.46 -1.26 -1.21 115.29 121.07 1mex s HIS 198 Ca 0.04 -0.08 0.22 0.00 0.47 0.00 0.00 55.06 55.71 1mex s HIS 198 Cb -0.14 -0.02 1.00 0.00 -0.13 0.00 0.00 32.58 33.29 1mex s HIS 198 CO -0.03 -0.34 1.67 0.36 -2.47 0.00 0.00 174.74 173.94 1mex n LYS 199 N 1.27 0.17 0.03 2.88 2.85 -1.26 -2.05 118.16 122.04 1mex n LYS 199 Ca -0.22 0.48 0.10 0.00 -1.05 0.00 0.00 58.31 57.62 1mex n LYS 199 Cb 0.56 -1.88 0.41 0.00 -0.65 0.00 0.00 35.03 33.48 1mex n LYS 199 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1mex n THR 200 N -2.20 0.74 -3.85 0.58 -2.24 -1.26 -4.70 114.28 101.35 1mex n THR 200 Ca 0.01 0.16 -0.12 0.00 -2.27 0.00 0.00 64.05 61.83 1mex n THR 200 Cb 0.17 -0.90 -0.14 0.00 -2.10 0.00 0.00 70.33 67.36 1mex n THR 200 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1mex s SER 201 N -3.31 -0.04 0.29 3.42 1.04 -0.87 -5.00 113.70 109.23 1mex s SER 201 Ca 0.08 0.09 0.26 0.00 0.48 0.00 0.00 55.95 56.86 1mex s SER 201 Cb 0.12 0.09 0.84 0.00 0.10 0.00 0.00 66.02 67.16 1mex s SER 201 CO 0.36 -0.02 1.75 0.00 0.98 0.00 0.00 173.24 176.31 1mex h THR 202 N 5.16 0.00 -3.60 2.02 1.03 -1.84 -3.42 112.91 112.26 1mex h THR 202 Ca -0.26 -0.49 -0.68 0.00 -0.01 0.00 0.00 66.41 64.97 1mex h THR 202 Cb 1.20 1.42 -0.20 0.00 -1.07 0.00 0.00 68.15 69.51 1mex h THR 202 CO 0.48 0.00 -0.69 -0.44 -0.01 0.00 0.00 175.52 174.86 1mex s SER 203 N -4.81 4.64 0.63 0.00 0.01 -1.26 -5.08 113.70 107.83 1mex s SER 203 Ca 0.08 -0.05 -0.18 0.00 1.31 0.00 0.00 55.95 57.10 1mex s SER 203 Cb 0.10 -1.27 -0.02 0.00 0.21 0.00 0.00 66.02 65.04 1mex s SER 203 CO 0.55 0.33 1.20 -2.65 0.41 0.00 0.00 173.24 173.08 1mex n PRO 204 N 2.45 1.09 -3.23 12.44 -0.02 -1.26 -4.89 135.00 141.58 1mex n PRO 204 Ca -0.18 0.42 -0.39 0.00 -2.02 0.00 0.00 63.50 61.33 1mex n PRO 204 Cb 0.53 -2.43 -0.07 0.00 -0.02 0.00 0.00 33.50 31.51 1mex n PRO 204 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1mex s ILE 205 N -1.42 5.09 -0.13 4.25 1.01 0.11 -4.88 121.20 125.23 1mex s ILE 205 Ca 0.80 0.95 0.02 0.00 0.00 0.00 0.00 60.65 62.42 1mex s ILE 205 Cb -0.39 -3.85 -0.00 0.00 0.01 0.00 0.00 42.46 38.23 1mex s ILE 205 CO 0.43 0.14 -0.18 -0.69 0.00 0.00 0.00 174.94 174.64 1mex s VAL 206 N 1.87 2.46 -0.03 2.92 1.01 -1.26 -0.19 120.40 127.18 1mex s VAL 206 Ca 0.24 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.42 1mex s VAL 206 Cb -0.15 -2.01 -0.01 0.00 0.00 0.00 0.00 36.38 34.21 1mex s VAL 206 CO 0.09 0.53 -0.20 -0.54 0.00 0.00 0.00 175.10 174.99 1mex s LYS 207 N 0.62 1.86 0.13 2.72 -0.14 -0.35 -5.01 119.74 119.58 1mex s LYS 207 Ca -0.10 -0.72 -0.08 0.00 -1.36 0.00 0.00 55.97 53.71 1mex s LYS 207 Cb -0.16 -1.69 -0.01 0.00 -1.68 0.00 0.00 37.83 34.29 1mex s LYS 207 CO 0.03 0.37 0.22 -1.12 -0.76 0.00 0.00 175.35 174.08 1mex s SER 208 N -0.25 0.11 0.08 2.83 0.01 -1.26 -0.87 113.70 114.35 1mex s SER 208 Ca 0.02 -0.83 -0.07 0.00 1.31 0.00 0.00 55.95 56.38 1mex s SER 208 Cb -0.10 0.38 -0.01 0.00 0.21 0.00 0.00 66.02 66.50 1mex s SER 208 CO 0.01 -0.81 0.14 0.72 0.41 0.00 0.00 173.24 173.71 1mex s PHE 209 N -3.94 0.25 -0.24 2.43 -0.12 -0.41 -5.01 117.98 110.94 1mex s PHE 209 Ca 0.13 -0.71 -0.06 0.00 -0.05 0.00 0.00 56.93 56.25 1mex s PHE 209 Cb 0.04 -0.14 -0.01 0.00 -0.63 0.00 0.00 43.02 42.28 1mex s PHE 209 CO -0.04 -0.51 0.02 -0.80 -0.05 0.00 0.00 175.22 173.85 1mex s ASN 210 N -2.88 4.79 0.37 1.98 0.01 -1.26 -1.00 114.94 116.95 1mex s ASN 210 Ca 0.06 -0.36 0.15 0.00 -0.71 0.00 0.00 52.86 52.00 1mex s ASN 210 Cb 0.06 -1.84 1.01 0.00 0.41 0.00 0.00 41.25 40.89 1mex s ASN 210 CO -0.10 -0.05 1.76 -0.09 -1.51 0.00 0.00 177.10 177.11 1mex h ARG 211 N 8.18 0.47 0.00 -0.60 2.43 -0.57 -1.27 114.38 123.02 1mex h ARG 211 Ca -0.39 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 1mex h ARG 211 Cb 1.16 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1mex h ARG 211 CO 0.59 0.31 0.00 0.09 -1.51 0.00 0.00 179.97 179.45 1mex n ASN 212 N -4.71 0.33 -0.89 -3.80 5.03 -1.26 -5.12 115.26 104.84 1mex n ASN 212 Ca 0.25 0.59 0.11 0.00 0.87 0.00 0.00 54.58 56.41 1mex n ASN 212 Cb 0.81 -0.66 0.09 0.00 -1.02 0.00 0.00 39.78 39.00 1mex n ASN 212 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81