#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m4w h ALA 26 N 0.00 0.72 -0.97 3.55 0.00 -2.00 -3.08 119.26 117.47 3m4w h ALA 26 Ca 0.00 -0.70 0.10 0.00 0.00 0.00 0.00 54.91 54.31 3m4w h ALA 26 Cb 0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.59 3m4w h ALA 26 CO 0.00 0.96 0.62 0.77 0.00 0.00 0.00 179.25 181.61 3m4w h SER 27 N 0.00 0.92 0.38 0.00 0.02 -1.99 0.19 113.55 113.07 3m4w h SER 27 Ca -0.01 0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.86 3m4w h SER 27 Cb 1.37 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 3m4w h SER 27 CO 0.10 0.53 -0.49 1.23 -1.14 0.00 0.00 176.83 177.06 3m4w h GLY 28 N 1.01 0.14 0.65 -3.77 0.00 -1.85 -2.01 103.07 97.25 3m4w h GLY 28 Ca 0.46 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.61 3m4w h GLY 28 CO -0.21 0.14 -0.04 0.00 0.00 0.00 0.00 176.54 176.42 3m4w h ALA 29 N 1.39 0.10 -0.51 3.60 0.00 -1.06 -2.31 119.26 120.48 3m4w h ALA 29 Ca 0.00 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 54.75 3m4w h ALA 29 Cb 0.91 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 3m4w h ALA 29 CO 0.07 -0.13 0.13 -0.07 0.00 0.00 0.00 179.25 179.26 3m4w h LEU 30 N -0.23 0.07 -1.41 0.00 3.38 -1.00 -0.20 115.31 115.91 3m4w h LEU 30 Ca 0.02 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3m4w h LEU 30 Cb 0.50 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3m4w h LEU 30 CO 0.01 0.06 0.02 -0.07 0.09 0.00 0.00 178.44 178.56 3m4w h LEU 31 N 0.28 0.37 -0.56 1.67 3.38 -1.33 0.09 115.31 119.22 3m4w h LEU 31 Ca 0.26 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 58.02 3m4w h LEU 31 Cb 0.33 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3m4w h LEU 31 CO -0.31 0.42 -0.46 1.56 0.09 0.00 0.00 178.44 179.75 3m4w h GLN 32 N 0.40 0.63 -0.37 1.13 4.20 -0.68 -2.39 115.11 118.03 3m4w h GLN 32 Ca 0.09 -0.35 -0.14 0.00 0.06 0.00 0.00 58.65 58.31 3m4w h GLN 32 Cb 0.23 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 3m4w h GLN 32 CO 0.00 0.96 -0.33 1.96 -0.67 0.00 0.00 178.83 180.75 3m4w h GLN 33 N 0.51 0.84 -0.67 1.46 4.20 -0.18 -0.79 115.11 120.47 3m4w h GLN 33 Ca 0.03 -0.40 -0.03 0.00 0.06 0.00 0.00 58.65 58.30 3m4w h GLN 33 Cb 0.99 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.74 3m4w h GLN 33 CO 0.09 1.04 0.28 1.98 -0.67 0.00 0.00 178.83 181.55 3m4w h MET 34 N 0.70 0.99 -0.58 1.46 4.05 -0.92 0.15 114.93 120.79 3m4w h MET 34 Ca 0.07 -0.17 -0.10 0.00 -0.28 0.00 0.00 59.70 59.22 3m4w h MET 34 Cb 0.89 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 31.50 3m4w h MET 34 CO 0.08 0.81 -0.02 -0.97 0.23 0.00 0.00 176.91 177.04 3m4w h ASN 35 N 0.94 1.02 0.43 1.39 -1.24 -1.30 -2.40 115.58 114.42 3m4w h ASN 35 Ca 0.22 -0.32 -0.02 0.00 0.71 0.00 0.00 56.30 56.90 3m4w h ASN 35 Cb 0.18 -0.27 0.00 0.00 0.73 0.00 0.00 38.32 38.96 3m4w h ASN 35 CO -0.02 1.09 -0.21 0.25 -1.29 0.00 0.00 177.43 177.25 3m4w h LEU 36 N 0.92 -0.49 -0.94 0.34 5.85 -0.58 -2.73 115.31 117.69 3m4w h LEU 36 Ca 0.16 0.01 0.15 0.00 0.84 0.00 0.00 57.88 59.04 3m4w h LEU 36 Cb 0.58 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 41.64 3m4w h LEU 36 CO 0.03 -0.34 0.55 0.00 -0.34 0.00 0.00 178.44 178.34 3m4w h ALA 37 N -0.03 1.46 0.00 1.25 0.00 -0.65 0.11 119.26 121.40 3m4w h ALA 37 Ca -0.06 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3m4w h ALA 37 Cb 0.46 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 3m4w h ALA 37 CO 0.10 0.01 -0.06 0.77 0.00 0.00 0.00 179.25 180.08 3m4w h SER 38 N 0.77 0.00 0.00 0.00 0.02 -1.13 -0.53 113.55 112.68 3m4w h SER 38 Ca 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.46 3m4w h SER 38 Cb 0.68 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.22 3m4w h SER 38 CO -0.34 0.06 -1.66 0.00 -1.14 0.00 0.00 176.83 173.75 3m4w n GLN 39 N -3.60 0.57 -0.12 3.45 6.02 -0.13 -4.71 117.38 118.87 3m4w n GLN 39 Ca -0.02 -0.14 -0.23 0.00 -0.01 0.00 0.00 57.00 56.60 3m4w n GLN 39 Cb 0.17 -1.47 -0.11 0.00 1.02 0.00 0.00 30.24 29.84 3m4w n GLN 39 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3m4w n SER 40 N -2.01 1.98 -4.83 1.08 7.64 0.19 -4.88 113.62 112.79 3m4w n SER 40 Ca -0.02 0.13 -0.31 0.00 1.01 0.00 0.00 58.87 59.69 3m4w n SER 40 Cb 0.47 -0.66 0.05 0.00 -1.01 0.00 0.00 64.21 63.06 3m4w n SER 40 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3m4w s LEU 41 N -7.08 3.03 -0.22 -3.43 1.43 -0.27 -4.70 118.68 107.44 3m4w s LEU 41 Ca -0.35 1.49 -0.09 0.00 -1.03 0.00 0.00 54.13 54.16 3m4w s LEU 41 Cb 0.11 -4.34 -0.04 0.00 0.03 0.00 0.00 46.19 41.95 3m4w s LEU 41 CO 0.57 -1.44 0.10 0.20 0.23 0.00 0.00 176.35 176.01 3m4w s ASN 42 N -3.92 5.73 0.28 2.29 0.01 -1.26 -4.26 114.94 113.81 3m4w s ASN 42 Ca 0.58 0.04 -0.21 0.00 -0.71 0.00 0.00 52.86 52.56 3m4w s ASN 42 Cb -0.13 -2.01 0.04 0.00 0.41 0.00 0.00 41.25 39.55 3m4w s ASN 42 CO 0.54 0.09 0.79 -0.72 -1.51 0.00 0.00 177.10 176.30 3m4w s TYR 43 N 0.87 -0.10 -0.05 2.20 -0.85 0.73 -1.86 117.35 118.30 3m4w s TYR 43 Ca 0.05 -0.38 -0.01 0.00 -0.52 0.00 0.00 57.07 56.21 3m4w s TYR 43 Cb -0.13 0.73 0.03 0.00 0.38 0.00 0.00 41.96 42.96 3m4w s TYR 43 CO 0.03 -1.23 0.02 -2.00 -1.52 0.00 0.00 175.55 170.85 3m4w s GLU 44 N -3.37 0.35 -0.16 -3.49 2.12 -0.66 -0.89 118.70 112.59 3m4w s GLU 44 Ca 0.13 0.17 -0.02 0.00 0.36 0.00 0.00 54.97 55.61 3m4w s GLU 44 Cb -0.05 -0.72 -0.02 0.00 0.26 0.00 0.00 34.13 33.60 3m4w s GLU 44 CO 0.07 -0.27 -0.09 -0.51 -0.54 0.00 0.00 175.26 173.93 3m4w s LEU 45 N 1.79 2.88 -0.30 2.70 1.43 0.78 -2.28 118.68 125.67 3m4w s LEU 45 Ca 0.01 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 52.78 3m4w s LEU 45 Cb -0.13 -1.68 0.04 0.00 0.03 0.00 0.00 46.19 44.45 3m4w s LEU 45 CO -0.04 0.12 0.03 -0.44 0.23 0.00 0.00 176.35 176.26 3m4w s SER 46 N 0.62 4.95 0.31 2.29 0.01 -0.11 0.06 113.70 121.83 3m4w s SER 46 Ca -0.05 -1.08 0.05 0.00 1.31 0.00 0.00 55.95 56.18 3m4w s SER 46 Cb -0.15 -1.78 -0.03 0.00 0.21 0.00 0.00 66.02 64.27 3m4w s SER 46 CO 0.03 -0.25 0.24 0.72 0.41 0.00 0.00 173.24 174.39 3m4w s PHE 47 N 1.35 1.63 0.09 2.43 -0.12 -0.28 -0.75 117.98 122.33 3m4w s PHE 47 Ca -0.02 -1.58 0.08 0.00 -0.05 0.00 0.00 56.93 55.36 3m4w s PHE 47 Cb -0.19 -0.71 -0.03 0.00 -0.63 0.00 0.00 43.02 41.46 3m4w s PHE 47 CO 0.00 -0.79 -0.22 0.96 -0.05 0.00 0.00 175.22 175.12 3m4w s ILE 48 N -3.59 1.78 -0.18 -4.49 -4.36 -0.78 -0.80 121.20 108.78 3m4w s ILE 48 Ca 0.40 -1.49 -0.00 0.00 -0.26 0.00 0.00 60.65 59.29 3m4w s ILE 48 Cb 0.03 -1.59 0.01 0.00 1.25 0.00 0.00 42.46 42.16 3m4w s ILE 48 CO 0.24 0.02 -0.15 -0.55 0.24 0.00 0.00 174.94 174.74 3m4w s SER 49 N -1.75 3.54 -0.13 4.36 0.15 -0.69 -1.79 113.70 117.38 3m4w s SER 49 Ca 0.08 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.19 3m4w s SER 49 Cb -0.10 -1.56 -0.01 0.00 -1.71 0.00 0.00 66.02 62.64 3m4w s SER 49 CO 0.04 0.02 -0.14 -0.63 1.20 0.00 0.00 173.24 173.72 3m4w s ILE 50 N 1.21 2.93 0.33 6.45 1.01 -0.01 -1.63 121.20 131.49 3m4w s ILE 50 Ca 0.02 -0.70 -0.12 0.00 0.00 0.00 0.00 60.65 59.85 3m4w s ILE 50 Cb -0.14 -2.22 0.02 0.00 0.01 0.00 0.00 42.46 40.13 3m4w s ILE 50 CO -0.07 0.53 0.63 0.54 0.00 0.00 0.00 174.94 176.57 3m4w s ASN 51 N 0.39 0.19 0.66 3.58 2.20 -0.78 -0.78 114.94 120.41 3m4w s ASN 51 Ca -0.11 -1.11 0.24 0.00 -0.94 0.00 0.00 52.86 50.93 3m4w s ASN 51 Cb -0.16 0.73 1.28 0.00 -2.00 0.00 0.00 41.25 41.10 3m4w s ASN 51 CO 0.06 -1.42 1.72 0.07 -2.94 0.00 0.00 177.10 174.59 3m4w h LYS 52 N 2.08 0.00 -0.66 3.55 2.10 -1.93 0.13 116.57 121.84 3m4w h LYS 52 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 3m4w h LYS 52 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 3m4w h LYS 52 CO 0.36 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.81 3m4w n GLN 53 N -2.84 3.79 0.00 0.07 0.00 -1.26 -5.07 117.38 112.07 3m4w n GLN 53 Ca -0.01 -2.91 0.00 0.00 0.00 0.00 0.00 57.00 54.08 3m4w n GLN 53 Cb 0.53 -1.91 0.00 0.00 0.00 0.00 0.00 30.24 28.86 3m4w n GLN 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3m4w n GLY 54 N 1.14 0.54 2.96 2.61 0.00 0.03 -5.02 105.19 107.45 3m4w n GLY 54 Ca 0.26 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.81 3m4w n GLY 54 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m4w s VAL 55 N -0.77 1.66 -0.16 1.61 1.01 -1.26 -1.86 120.40 120.64 3m4w s VAL 55 Ca 0.00 -1.36 -0.07 0.00 0.00 0.00 0.00 61.98 60.54 3m4w s VAL 55 Cb 0.00 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 3m4w s VAL 55 CO 0.00 -0.14 0.09 -0.70 0.00 0.00 0.00 175.10 174.36 3m4w s GLU 56 N 1.32 3.81 -0.09 2.72 2.12 -0.65 -4.94 118.70 122.99 3m4w s GLU 56 Ca -0.05 -0.27 -0.22 0.00 0.36 0.00 0.00 54.97 54.79 3m4w s GLU 56 Cb -0.19 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 3m4w s GLU 56 CO -0.07 0.44 0.64 0.45 -0.54 0.00 0.00 175.26 176.19 3m4w s SER 57 N -0.09 6.89 0.06 -1.70 0.15 -1.26 -1.71 113.70 116.03 3m4w s SER 57 Ca 0.08 1.07 -0.00 0.00 0.70 0.00 0.00 55.95 57.80 3m4w s SER 57 Cb -0.12 -2.38 -0.04 0.00 -1.71 0.00 0.00 66.02 61.78 3m4w s SER 57 CO 0.01 -0.11 -0.04 -0.76 1.20 0.00 0.00 173.24 173.54 3m4w s LEU 58 N 0.88 2.46 -0.02 3.45 1.43 0.02 -2.26 118.68 124.65 3m4w s LEU 58 Ca 0.34 -0.94 0.00 0.00 -1.03 0.00 0.00 54.13 52.50 3m4w s LEU 58 Cb -0.17 0.12 0.02 0.00 0.03 0.00 0.00 46.19 46.19 3m4w s LEU 58 CO 0.15 -0.53 0.01 -0.60 0.23 0.00 0.00 176.35 175.61 3m4w s ARG 59 N -3.59 0.13 -0.12 1.70 3.52 -0.56 -1.13 118.95 118.90 3m4w s ARG 59 Ca 0.05 0.09 0.01 0.00 -0.13 0.00 0.00 55.73 55.75 3m4w s ARG 59 Cb 0.05 -0.31 0.02 0.00 -1.56 0.00 0.00 34.95 33.15 3m4w s ARG 59 CO -0.08 -0.11 -0.15 -0.47 -0.81 0.00 0.00 175.30 173.69 3m4w s TYR 60 N 0.80 2.00 -0.09 5.12 5.04 0.11 -0.74 117.35 129.59 3m4w s TYR 60 Ca -0.07 -1.00 0.02 0.00 -2.44 0.00 0.00 57.07 53.58 3m4w s TYR 60 Cb -0.10 -1.46 -0.02 0.00 0.35 0.00 0.00 41.96 40.73 3m4w s TYR 60 CO -0.02 -0.53 -0.15 1.03 -1.34 0.00 0.00 175.55 174.55 3m4w s ARG 61 N 1.15 2.91 0.01 4.97 0.52 -0.13 -0.15 118.95 128.23 3m4w s ARG 61 Ca -0.03 -0.71 0.01 0.00 -0.52 0.00 0.00 55.73 54.48 3m4w s ARG 61 Cb -0.14 -2.48 -0.01 0.00 0.52 0.00 0.00 34.95 32.84 3m4w s ARG 61 CO -0.04 0.42 -0.03 -1.58 0.02 0.00 0.00 175.30 174.08 3m4w s HIS 62 N -0.19 0.28 0.25 -0.53 2.46 -0.07 -0.91 115.29 116.58 3m4w s HIS 62 Ca -0.00 -0.16 -0.17 0.00 0.47 0.00 0.00 55.06 55.19 3m4w s HIS 62 Cb -0.13 -0.18 0.01 0.00 -0.13 0.00 0.00 32.58 32.15 3m4w s HIS 62 CO 0.03 -0.04 0.59 0.00 -2.47 0.00 0.00 174.74 172.85 3m4w s ALA 63 N -0.41 -0.82 0.00 1.58 0.00 0.44 -0.19 121.76 122.36 3m4w s ALA 63 Ca -0.03 -0.47 0.07 0.00 0.00 0.00 0.00 51.96 51.53 3m4w s ALA 63 Cb -0.03 0.93 -0.02 0.00 0.00 0.00 0.00 23.12 24.00 3m4w s ALA 63 CO -0.00 -0.91 -0.21 1.03 0.00 0.00 0.00 175.76 175.67 3m4w s ARG 64 N -3.94 1.60 -0.28 0.00 0.52 -1.26 -0.11 118.95 115.48 3m4w s ARG 64 Ca 0.14 -0.80 -0.19 0.00 -0.52 0.00 0.00 55.73 54.37 3m4w s ARG 64 Cb -0.03 -1.59 0.08 0.00 0.52 0.00 0.00 34.95 33.93 3m4w s ARG 64 CO 0.05 0.43 0.71 -1.17 0.02 0.00 0.00 175.30 175.34 3m4w s LEU 65 N -0.68 -0.88 -1.46 2.53 2.96 -0.67 -4.88 118.68 115.60 3m4w s LEU 65 Ca 0.08 1.47 -0.06 0.00 -0.22 0.00 0.00 54.13 55.40 3m4w s LEU 65 Cb -0.08 2.39 0.03 0.00 0.50 0.00 0.00 46.19 49.02 3m4w s LEU 65 CO -0.00 -0.24 0.55 0.47 -1.32 0.00 0.00 176.35 175.81 3m4w n ASP 66 N 3.82 -5.27 -0.47 3.68 8.00 -1.26 -1.58 116.55 123.48 3m4w n ASP 66 Ca -0.18 -0.31 -0.06 0.00 0.71 0.00 0.00 54.79 54.95 3m4w n ASP 66 Cb 0.58 -4.28 -0.03 0.00 -0.02 0.00 0.00 41.12 37.37 3m4w n ASP 66 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3m4w n ASN 67 N -2.42 -3.97 -3.98 -2.24 3.02 -1.26 -5.02 115.26 99.39 3m4w n ASN 67 Ca -0.08 0.15 -0.10 0.00 -0.03 0.00 0.00 54.58 54.52 3m4w n ASN 67 Cb 0.59 -2.00 -0.11 0.00 -0.61 0.00 0.00 39.78 37.65 3m4w n ASN 67 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m4w s ARG 68 N -2.25 0.31 0.42 3.52 1.70 -0.61 -5.10 118.95 116.94 3m4w s ARG 68 Ca 0.00 -0.58 -0.25 0.00 -0.47 0.00 0.00 55.73 54.43 3m4w s ARG 68 Cb 0.00 0.06 -0.08 0.00 -0.57 0.00 0.00 34.95 34.36 3m4w s ARG 68 CO 0.00 -0.04 1.28 -2.14 -1.08 0.00 0.00 175.30 173.33 3m4w s PRO 69 N -1.36 3.88 -0.02 3.89 0.02 -1.26 -1.67 135.00 138.48 3m4w s PRO 69 Ca -0.14 2.10 0.02 0.00 0.02 0.00 0.00 61.00 63.00 3m4w s PRO 69 Cb -0.09 -2.67 0.00 0.00 0.02 0.00 0.00 34.50 31.76 3m4w s PRO 69 CO -0.01 -0.55 -0.08 -0.51 -0.33 0.00 0.00 177.00 175.53 3m4w s LEU 70 N -2.59 1.84 -0.06 -5.54 1.43 0.85 -1.45 118.68 113.16 3m4w s LEU 70 Ca 0.59 -0.16 -0.29 0.00 -1.03 0.00 0.00 54.13 53.24 3m4w s LEU 70 Cb -0.37 -0.47 0.09 0.00 0.03 0.00 0.00 46.19 45.48 3m4w s LEU 70 CO 0.47 0.07 0.81 0.00 0.23 0.00 0.00 176.35 177.92 3m4w s ALA 71 N 0.10 -1.82 -0.02 4.21 0.00 -0.89 -0.42 121.76 122.92 3m4w s ALA 71 Ca -0.01 1.27 -0.00 0.00 0.00 0.00 0.00 51.96 53.21 3m4w s ALA 71 Cb -0.07 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.00 3m4w s ALA 71 CO 0.00 -0.44 0.04 -1.14 0.00 0.00 0.00 175.76 174.22 3m4w s GLN 72 N -1.75 -0.02 -0.25 0.00 0.74 -0.09 -0.50 119.66 117.78 3m4w s GLN 72 Ca -0.04 0.20 -0.04 0.00 0.05 0.00 0.00 55.36 55.53 3m4w s GLN 72 Cb -0.00 -0.23 0.01 0.00 1.10 0.00 0.00 33.01 33.89 3m4w s GLN 72 CO 0.02 -0.16 -0.01 -1.17 -0.55 0.00 0.00 175.29 173.41 3m4w s LEU 73 N 1.03 3.29 -0.10 3.68 2.96 0.15 -0.96 118.68 128.73 3m4w s LEU 73 Ca -0.09 -0.65 0.02 0.00 -0.22 0.00 0.00 54.13 53.20 3m4w s LEU 73 Cb -0.12 -1.76 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 3m4w s LEU 73 CO -0.03 -0.11 -0.17 -0.22 -1.32 0.00 0.00 176.35 174.50 3m4w s LEU 74 N 1.43 2.50 -0.25 -0.68 2.96 0.08 -1.47 118.68 123.25 3m4w s LEU 74 Ca 0.03 -0.38 -0.25 0.00 -0.22 0.00 0.00 54.13 53.31 3m4w s LEU 74 Cb -0.16 -1.53 -0.00 0.00 0.50 0.00 0.00 46.19 45.00 3m4w s LEU 74 CO -0.02 0.21 0.87 -1.58 -1.32 0.00 0.00 176.35 174.51 3m4w s GLN 75 N 0.09 4.18 0.19 1.98 0.74 -0.55 -1.50 119.66 124.78 3m4w s GLN 75 Ca -0.08 0.99 0.09 0.00 0.05 0.00 0.00 55.36 56.41 3m4w s GLN 75 Cb -0.15 -3.65 0.05 0.00 1.10 0.00 0.00 33.01 30.36 3m4w s GLN 75 CO 0.05 -0.56 1.43 0.52 -0.55 0.00 0.00 175.29 176.18 3m4w h MET 76 N 7.68 0.00 -6.46 1.67 2.86 -1.78 -3.41 114.93 115.49 3m4w h MET 76 Ca -0.22 0.00 -0.63 0.00 -2.06 0.00 0.00 59.70 56.78 3m4w h MET 76 Cb 1.09 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.60 3m4w h MET 76 CO 0.90 0.82 -0.72 -0.51 1.06 0.00 0.00 176.91 178.45 3m4w s ASP 77 N -6.76 4.33 0.69 1.22 1.01 -1.26 -5.03 116.67 110.87 3m4w s ASP 77 Ca 0.00 -0.52 0.00 0.00 0.71 0.00 0.00 52.55 52.74 3m4w s ASP 77 Cb 0.11 -0.77 0.00 0.00 1.01 0.00 0.00 42.92 43.27 3m4w s ASP 77 CO 0.79 0.12 0.00 0.61 0.21 0.00 0.00 175.17 176.90 3m4w n GLY 78 N 0.18 2.06 3.68 0.21 0.00 -1.26 -4.77 105.19 105.29 3m4w n GLY 78 Ca -0.11 -0.56 -0.44 0.00 0.00 0.00 0.00 46.02 44.91 3m4w n GLY 78 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3m4w n PRO 79 N 12.30 2.06 -1.78 1.61 -0.02 -1.26 -4.85 135.00 143.05 3m4w n PRO 79 Ca 0.00 0.73 -0.42 0.00 -2.02 0.00 0.00 63.50 61.79 3m4w n PRO 79 Cb 0.00 -2.35 -0.00 0.00 -0.02 0.00 0.00 33.50 31.13 3m4w n PRO 79 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3m4w n ARG 80 N 1.43 2.98 -2.72 -0.52 0.63 -1.26 -4.82 116.66 112.37 3m4w n ARG 80 Ca 0.09 -2.69 -0.40 0.00 -0.92 0.00 0.00 57.85 53.92 3m4w n ARG 80 Cb 0.33 -3.23 -0.06 0.00 0.45 0.00 0.00 32.46 29.96 3m4w n ARG 80 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3m4w s ARG 81 N 2.82 4.83 -0.00 -0.14 0.52 -1.26 -4.53 118.95 121.20 3m4w s ARG 81 Ca 0.47 1.52 -0.14 0.00 -0.52 0.00 0.00 55.73 57.07 3m4w s ARG 81 Cb 0.14 -3.27 0.02 0.00 0.52 0.00 0.00 34.95 32.35 3m4w s ARG 81 CO -0.08 0.48 0.28 -2.00 0.02 0.00 0.00 175.30 174.01 3m4w s GLU 82 N -1.18 0.67 -0.03 3.54 2.12 -0.22 -1.48 118.70 122.12 3m4w s GLU 82 Ca 0.41 -0.28 0.01 0.00 0.36 0.00 0.00 54.97 55.47 3m4w s GLU 82 Cb -0.27 0.29 0.02 0.00 0.26 0.00 0.00 34.13 34.44 3m4w s GLU 82 CO 0.33 -0.19 -0.03 0.08 -0.54 0.00 0.00 175.26 174.91 3m4w s VAL 83 N -1.56 0.36 0.12 3.70 1.01 -0.54 -0.52 120.40 122.96 3m4w s VAL 83 Ca -0.12 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 61.89 3m4w s VAL 83 Cb -0.05 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 3m4w s VAL 83 CO 0.03 0.18 -0.19 0.68 0.00 0.00 0.00 175.10 175.80 3m4w s VAL 84 N 0.82 1.61 -0.07 2.92 -7.23 -0.44 -0.68 120.40 117.33 3m4w s VAL 84 Ca -0.10 -1.62 0.05 0.00 -1.81 0.00 0.00 61.98 58.50 3m4w s VAL 84 Cb -0.13 -1.56 -0.00 0.00 0.56 0.00 0.00 36.38 35.25 3m4w s VAL 84 CO -0.01 -0.18 -0.22 -1.58 -0.31 0.00 0.00 175.10 172.80 3m4w s GLN 85 N -2.18 2.50 -0.29 4.82 0.74 0.34 -1.04 119.66 124.54 3m4w s GLN 85 Ca 0.08 -0.78 -0.02 0.00 0.05 0.00 0.00 55.36 54.69 3m4w s GLN 85 Cb -0.08 -2.01 0.10 0.00 1.10 0.00 0.00 33.01 32.11 3m4w s GLN 85 CO 0.04 0.24 0.10 0.50 -0.55 0.00 0.00 175.29 175.62 3m4w s ARG 86 N 0.16 0.60 6.23 1.67 3.52 -0.34 -2.10 118.95 128.69 3m4w s ARG 86 Ca -0.11 -0.90 0.00 0.00 -0.13 0.00 0.00 55.73 54.60 3m4w s ARG 86 Cb -0.15 -1.82 0.00 0.00 -1.56 0.00 0.00 34.95 31.42 3m4w s ARG 86 CO 0.05 -0.96 0.00 0.41 -0.81 0.00 0.00 175.30 173.99 3m4w n GLY 87 N 4.95 2.50 1.63 8.12 0.00 -0.53 -1.83 105.19 120.03 3m4w n GLY 87 Ca -0.04 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 3m4w n GLY 87 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3m4w n ASN 88 N 3.15 3.62 -4.23 1.61 2.04 -1.26 -4.78 115.26 115.41 3m4w n ASN 88 Ca 0.00 -2.86 -0.33 0.00 -0.44 0.00 0.00 54.58 50.95 3m4w n ASN 88 Cb 0.00 -0.68 -0.15 0.00 -2.53 0.00 0.00 39.78 36.42 3m4w n ASN 88 CO 0.00 0.00 0.00 -1.61 -0.44 0.00 0.00 177.26 175.21 3m4w s GLU 89 N -2.05 3.16 -0.26 -3.83 2.02 -0.76 -1.45 118.70 115.53 3m4w s GLU 89 Ca 0.35 -0.77 -0.03 0.00 0.02 0.00 0.00 54.97 54.54 3m4w s GLU 89 Cb 0.28 -2.62 0.02 0.00 0.10 0.00 0.00 34.13 31.91 3m4w s GLU 89 CO 0.08 -0.04 -0.02 0.42 0.02 0.00 0.00 175.26 175.72 3m4w s ILE 90 N 0.95 3.24 -0.05 -1.63 -1.09 0.04 -1.20 121.20 121.46 3m4w s ILE 90 Ca -0.03 -0.89 -0.01 0.00 -2.23 0.00 0.00 60.65 57.48 3m4w s ILE 90 Cb -0.15 -2.65 -0.04 0.00 -1.58 0.00 0.00 42.46 38.05 3m4w s ILE 90 CO -0.03 0.17 0.04 -0.44 -1.23 0.00 0.00 174.94 173.45 3m4w s SER 91 N 1.39 5.46 -0.13 3.58 0.01 -0.21 -0.47 113.70 123.33 3m4w s SER 91 Ca 0.01 0.15 0.01 0.00 1.31 0.00 0.00 55.95 57.43 3m4w s SER 91 Cb -0.17 -1.55 -0.01 0.00 0.21 0.00 0.00 66.02 64.51 3m4w s SER 91 CO -0.02 0.33 -0.16 -0.31 0.41 0.00 0.00 173.24 173.49 3m4w s TYR 92 N -1.03 2.75 0.03 2.43 1.51 -0.23 -1.33 117.35 121.49 3m4w s TYR 92 Ca 0.17 -0.90 0.07 0.00 -1.01 0.00 0.00 57.07 55.41 3m4w s TYR 92 Cb -0.12 -1.84 -0.02 0.00 -0.11 0.00 0.00 41.96 39.87 3m4w s TYR 92 CO 0.07 -0.37 -0.22 -0.06 -1.11 0.00 0.00 175.55 173.87 3m4w s PHE 93 N 0.55 1.91 -0.24 2.71 0.40 0.32 -3.15 117.98 120.49 3m4w s PHE 93 Ca -0.10 -0.38 -0.26 0.00 -0.60 0.00 0.00 56.93 55.59 3m4w s PHE 93 Cb -0.16 -1.16 0.10 0.00 0.51 0.00 0.00 43.02 42.31 3m4w s PHE 93 CO 0.04 0.07 0.87 -2.00 0.70 0.00 0.00 175.22 174.91 3m4w s GLU 94 N -1.05 0.69 0.32 0.44 2.12 -1.26 -1.05 118.70 118.91 3m4w s GLU 94 Ca 0.08 0.68 -0.29 0.00 0.36 0.00 0.00 54.97 55.81 3m4w s GLU 94 Cb -0.09 0.34 -0.12 0.00 0.26 0.00 0.00 34.13 34.52 3m4w s GLU 94 CO 0.01 -0.11 1.37 -2.30 -0.54 0.00 0.00 175.26 173.69 3m4w n PRO 95 N 2.14 2.24 -1.04 4.30 -0.02 -1.26 -2.58 135.00 138.77 3m4w n PRO 95 Ca -0.13 0.79 -0.02 0.00 -2.02 0.00 0.00 63.50 62.12 3m4w n PRO 95 Cb 0.56 -2.42 -0.01 0.00 -0.02 0.00 0.00 33.50 31.61 3m4w n PRO 95 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m4w n GLY 96 N 1.13 0.52 3.00 -1.23 0.00 -1.26 -5.04 105.19 102.32 3m4w n GLY 96 Ca 0.06 -0.52 -0.11 0.00 0.00 0.00 0.00 46.02 45.45 3m4w n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m4w s LEU 97 N -0.35 2.22 -0.35 0.99 1.43 -1.07 -5.10 118.68 116.46 3m4w s LEU 97 Ca 0.00 -0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 52.34 3m4w s LEU 97 Cb 0.00 -0.02 -0.00 0.00 0.03 0.00 0.00 46.19 46.19 3m4w s LEU 97 CO 0.00 -0.23 1.54 -1.61 0.23 0.00 0.00 176.35 176.28 3m4w s GLU 98 N -1.37 3.57 0.48 1.70 0.41 -1.26 -4.70 118.70 117.54 3m4w s GLU 98 Ca -0.12 1.20 -0.23 0.00 -0.41 0.00 0.00 54.97 55.41 3m4w s GLU 98 Cb -0.09 -4.06 -0.07 0.00 -1.78 0.00 0.00 34.13 28.13 3m4w s GLU 98 CO -0.00 -1.57 1.29 -1.25 -0.49 0.00 0.00 175.26 173.23 3m4w s PRO 99 N 5.04 3.54 0.28 0.39 0.04 -1.26 -5.01 135.00 138.02 3m4w s PRO 99 Ca 0.67 2.08 0.03 0.00 0.04 0.00 0.00 61.00 63.83 3m4w s PRO 99 Cb -0.18 -2.43 -0.06 0.00 0.04 0.00 0.00 34.50 31.88 3m4w s PRO 99 CO 0.32 -0.82 0.03 -0.59 0.04 0.00 0.00 177.00 175.98 3m4w s PHE 100 N -1.37 1.76 -0.02 0.56 -0.12 -1.19 -4.84 117.98 112.77 3m4w s PHE 100 Ca 0.65 -0.96 0.04 0.00 -0.05 0.00 0.00 56.93 56.61 3m4w s PHE 100 Cb -0.36 -1.08 -0.01 0.00 -0.63 0.00 0.00 43.02 40.94 3m4w s PHE 100 CO 0.44 -0.04 -0.14 0.99 -0.05 0.00 0.00 175.22 176.42 3m4w s THR 101 N -3.39 1.13 0.40 -4.49 2.01 -1.20 -1.07 115.64 109.03 3m4w s THR 101 Ca 0.33 -0.60 0.02 0.00 0.31 0.00 0.00 61.69 61.76 3m4w s THR 101 Cb 0.07 -0.96 -0.01 0.00 0.01 0.00 0.00 72.50 71.62 3m4w s THR 101 CO 0.13 0.33 0.07 0.18 -0.69 0.00 0.00 174.62 174.64 3m4w n LEU 102 N 2.87 0.00 -4.73 4.42 4.77 0.38 -0.89 117.00 123.82 3m4w n LEU 102 Ca -0.15 -2.78 -0.29 0.00 -0.03 0.00 0.00 56.01 52.76 3m4w n LEU 102 Cb 0.55 0.65 -0.07 0.00 -2.33 0.00 0.00 43.42 42.22 3m4w n LEU 102 CO 0.24 -0.41 -0.29 0.20 -1.33 0.00 0.00 177.39 175.80 3m4w s ASN 103 N -3.32 5.20 0.00 -1.43 0.01 -1.26 -0.78 114.94 113.36 3m4w s ASN 103 Ca 0.10 -0.17 0.00 0.00 -0.71 0.00 0.00 52.86 52.08 3m4w s ASN 103 Cb 0.01 -1.28 0.00 0.00 0.41 0.00 0.00 41.25 40.38 3m4w s ASN 103 CO 0.07 0.13 0.00 0.61 -1.51 0.00 0.00 177.10 176.41 3m4w n GLY 104 N 0.19 1.80 0.27 0.66 0.00 -0.53 -4.83 105.19 102.75 3m4w n GLY 104 Ca -0.09 -0.68 0.13 0.00 0.00 0.00 0.00 46.02 45.37 3m4w n GLY 104 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3m4w n ASP 105 N 0.00 1.04 -3.65 1.61 8.00 -1.26 -4.12 116.55 118.17 3m4w n ASP 105 Ca 0.00 -0.95 -0.02 0.00 0.71 0.00 0.00 54.79 54.53 3m4w n ASP 105 Cb 0.00 0.10 -0.01 0.00 -0.02 0.00 0.00 41.12 41.18 3m4w n ASP 105 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3m4w s TYR 106 N -2.42 -0.12 -0.39 1.24 -0.85 -1.26 -4.99 117.35 108.55 3m4w s TYR 106 Ca 0.27 -0.05 -0.26 0.00 -0.52 0.00 0.00 57.07 56.51 3m4w s TYR 106 Cb 0.20 0.57 0.02 0.00 0.38 0.00 0.00 41.96 43.13 3m4w s TYR 106 CO 0.49 -0.49 0.94 0.42 -1.52 0.00 0.00 175.55 175.39 3m4w s ILE 107 N -2.81 4.54 0.28 -3.49 1.01 -1.26 -5.02 121.20 114.45 3m4w s ILE 107 Ca 0.12 1.11 -0.29 0.00 0.00 0.00 0.00 60.65 61.58 3m4w s ILE 107 Cb 0.01 -4.37 -0.10 0.00 0.01 0.00 0.00 42.46 38.01 3m4w s ILE 107 CO -0.03 -0.63 1.26 -0.69 0.00 0.00 0.00 174.94 174.86 3m4w s VAL 108 N 3.59 3.05 -0.05 2.92 1.01 -1.26 -2.44 120.40 127.22 3m4w s VAL 108 Ca 0.39 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.36 3m4w s VAL 108 Cb -0.11 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.64 3m4w s VAL 108 CO 0.21 0.21 0.00 0.47 0.00 0.00 0.00 175.10 175.99 3m4w n ASP 109 N 1.48 -3.69 0.11 3.32 8.00 -1.26 -4.86 116.55 119.65 3m4w n ASP 109 Ca 0.02 0.01 -0.23 0.00 0.71 0.00 0.00 54.79 55.30 3m4w n ASP 109 Cb 0.43 -1.23 -0.15 0.00 -0.02 0.00 0.00 41.12 40.14 3m4w n ASP 109 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3m4w h SER 110 N 0.00 0.70 -4.66 -2.24 4.64 -1.91 -3.47 113.55 106.61 3m4w h SER 110 Ca -0.01 -0.93 -0.29 0.00 -0.47 0.00 0.00 61.79 60.09 3m4w h SER 110 Cb 0.24 -0.23 -0.15 0.00 -0.31 0.00 0.00 62.40 61.96 3m4w h SER 110 CO 0.01 1.58 -0.65 -0.76 -0.87 0.00 0.00 176.83 176.15 3m4w s LEU 111 N -7.72 1.89 0.56 5.97 1.43 -1.26 -4.95 118.68 114.59 3m4w s LEU 111 Ca -0.11 -1.25 -0.20 0.00 -1.03 0.00 0.00 54.13 51.54 3m4w s LEU 111 Cb 0.03 0.03 -0.04 0.00 0.03 0.00 0.00 46.19 46.23 3m4w s LEU 111 CO 0.90 -0.65 1.27 -2.84 0.23 0.00 0.00 176.35 175.26 3m4w s PRO 112 N -3.98 3.11 0.55 1.29 0.02 -1.26 -4.83 135.00 129.90 3m4w s PRO 112 Ca 0.29 2.00 0.28 0.00 0.02 0.00 0.00 61.00 63.59 3m4w s PRO 112 Cb 0.07 -2.12 1.45 0.00 0.02 0.00 0.00 34.50 33.92 3m4w s PRO 112 CO 0.07 -1.14 1.95 0.77 -0.33 0.00 0.00 177.00 178.32 3m4w h SER 113 N 1.25 0.00 -1.00 2.53 0.02 -1.99 -0.96 113.55 113.40 3m4w h SER 113 Ca -0.50 0.00 0.22 0.00 -0.84 0.00 0.00 61.79 60.66 3m4w h SER 113 Cb 1.30 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.73 3m4w h SER 113 CO 0.56 0.00 0.62 0.25 -1.14 0.00 0.00 176.83 177.12 3m4w h LEU 114 N 0.00 0.68 -1.40 5.07 5.85 -1.88 -1.15 115.31 122.48 3m4w h LEU 114 Ca 0.28 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 59.06 3m4w h LEU 114 Cb 1.20 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 3m4w h LEU 114 CO -0.00 0.19 -0.17 0.40 -0.34 0.00 0.00 178.44 178.52 3m4w h ILE 115 N 0.63 0.50 -0.67 4.05 1.08 -1.52 -2.96 117.51 118.62 3m4w h ILE 115 Ca 0.59 -0.89 0.00 0.00 -0.39 0.00 0.00 64.86 64.18 3m4w h ILE 115 Cb 1.10 1.61 0.00 0.00 -3.07 0.00 0.00 36.82 36.47 3m4w h ILE 115 CO -0.38 0.17 0.00 -1.22 -0.69 0.00 0.00 178.15 176.03 3m4w n TYR 116 N -3.42 1.08 -2.76 1.37 4.02 -0.45 -4.52 117.16 112.48 3m4w n TYR 116 Ca -0.00 -0.54 -0.36 0.00 -0.01 0.00 0.00 57.90 56.99 3m4w n TYR 116 Cb 0.36 -0.07 -0.06 0.00 -0.02 0.00 0.00 39.34 39.54 3m4w n TYR 116 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3m4w s THR 117 N -1.26 4.17 -0.71 -0.72 2.01 -1.12 -5.02 115.64 112.99 3m4w s THR 117 Ca 0.47 1.72 -0.18 0.00 0.31 0.00 0.00 61.69 64.01 3m4w s THR 117 Cb 0.27 -3.92 0.13 0.00 0.01 0.00 0.00 72.50 68.99 3m4w s THR 117 CO 0.29 0.06 0.82 -0.62 -0.69 0.00 0.00 174.62 174.48 3m4w s ASP 118 N -1.68 6.39 0.62 3.53 2.15 -1.26 -4.91 116.67 121.50 3m4w s ASP 118 Ca 0.53 -1.79 0.40 0.00 0.43 0.00 0.00 52.55 52.12 3m4w s ASP 118 Cb -0.18 -2.31 2.01 0.00 -0.30 0.00 0.00 42.92 42.14 3m4w s ASP 118 CO 0.23 -1.02 2.22 -0.26 -0.17 0.00 0.00 175.17 176.17 3m4w h PHE 119 N 8.86 0.00 -0.24 -5.34 0.04 -1.93 -2.06 116.94 116.26 3m4w h PHE 119 Ca -0.12 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.52 3m4w h PHE 119 Cb 1.06 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.21 3m4w h PHE 119 CO 0.95 0.00 -0.34 0.87 -0.60 0.00 0.00 178.31 179.19 3m4w h LYS 120 N 0.00 0.66 -0.46 1.51 1.57 -1.92 -1.87 116.57 116.07 3m4w h LYS 120 Ca 0.00 -0.39 -0.02 0.00 -1.87 0.00 0.00 60.65 58.37 3m4w h LYS 120 Cb 0.20 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 3m4w h LYS 120 CO 0.00 1.00 0.19 -0.09 -0.57 0.00 0.00 179.45 179.98 3m4w h ARG 121 N 0.37 0.65 0.05 3.15 2.43 -1.80 -3.09 114.38 116.13 3m4w h ARG 121 Ca 0.03 -0.08 -0.24 0.00 -0.81 0.00 0.00 59.98 58.87 3m4w h ARG 121 Cb 0.93 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.34 3m4w h ARG 121 CO 0.08 0.53 -1.12 -0.07 -1.51 0.00 0.00 179.97 177.88 3m4w h LEU 122 N 0.64 0.15 -0.99 3.80 3.38 -1.43 -3.38 115.31 117.48 3m4w h LEU 122 Ca 0.16 -0.17 0.36 0.00 0.09 0.00 0.00 57.88 58.32 3m4w h LEU 122 Cb 0.12 -0.05 -0.17 0.00 0.09 0.00 0.00 40.66 40.65 3m4w h LEU 122 CO -0.02 1.13 0.50 0.77 0.09 0.00 0.00 178.44 180.92 3m4w h SER 123 N 0.03 0.33 0.23 -0.43 4.64 -1.25 0.13 113.55 117.24 3m4w h SER 123 Ca -0.07 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3m4w h SER 123 Cb 1.85 0.23 0.00 0.00 -0.31 0.00 0.00 62.40 64.17 3m4w h SER 123 CO 0.15 -0.29 0.00 -0.65 -0.87 0.00 0.00 176.83 175.17 3m4w h PRO 124 N 0.15 0.00 0.00 4.77 0.11 -1.77 -3.20 132.00 132.06 3m4w h PRO 124 Ca 0.77 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.82 3m4w h PRO 124 Cb 1.88 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.86 3m4w h PRO 124 CO -0.71 0.00 -0.58 2.48 -0.21 0.00 0.00 178.00 178.98 3m4w n TYR 125 N -2.96 0.00 -3.95 0.65 0.18 0.43 -5.06 117.16 106.45 3m4w n TYR 125 Ca -0.02 -0.55 -0.09 0.00 1.88 0.00 0.00 57.90 59.13 3m4w n TYR 125 Cb 0.12 -0.13 -0.09 0.00 -0.38 0.00 0.00 39.34 38.86 3m4w n TYR 125 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 176.86 175.49 3m4w s TYR 126 N -0.97 0.27 0.04 -3.48 1.51 -0.96 -2.37 117.35 111.41 3m4w s TYR 126 Ca 0.22 -0.67 0.03 0.00 -1.01 0.00 0.00 57.07 55.64 3m4w s TYR 126 Cb 0.22 -0.19 -0.04 0.00 -0.11 0.00 0.00 41.96 41.85 3m4w s TYR 126 CO -0.06 -0.41 -0.01 -0.51 -1.11 0.00 0.00 175.55 173.46 3m4w s ASP 127 N -2.49 5.01 -0.27 2.29 1.01 0.46 -4.74 116.67 117.93 3m4w s ASP 127 Ca 0.00 -0.11 0.02 0.00 0.71 0.00 0.00 52.55 53.18 3m4w s ASP 127 Cb 0.02 -1.24 0.07 0.00 1.01 0.00 0.00 42.92 42.79 3m4w s ASP 127 CO -0.07 0.23 -0.04 -0.36 0.21 0.00 0.00 175.17 175.13 3m4w s PHE 128 N -1.18 3.00 -0.11 4.23 2.99 -1.26 -2.26 117.98 123.39 3m4w s PHE 128 Ca 0.22 -2.27 -0.01 0.00 0.00 0.00 0.00 56.93 54.88 3m4w s PHE 128 Cb -0.12 -2.04 -0.03 0.00 0.00 0.00 0.00 43.02 40.84 3m4w s PHE 128 CO 0.14 -0.86 -0.07 0.42 -0.00 0.00 0.00 175.22 174.84 3m4w s ILE 129 N 1.18 3.61 0.48 0.64 1.01 -0.56 -4.48 121.20 123.10 3m4w s ILE 129 Ca -0.02 -0.49 -0.11 0.00 0.00 0.00 0.00 60.65 60.04 3m4w s ILE 129 Cb -0.19 -2.52 -0.06 0.00 0.01 0.00 0.00 42.46 39.70 3m4w s ILE 129 CO -0.07 0.55 0.86 -0.55 0.00 0.00 0.00 174.94 175.73 3m4w s SER 130 N -0.21 6.44 0.00 3.58 0.15 -1.26 0.46 113.70 122.86 3m4w s SER 130 Ca 0.03 1.23 0.00 0.00 0.70 0.00 0.00 55.95 57.91 3m4w s SER 130 Cb -0.13 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 61.81 3m4w s SER 130 CO 0.03 -0.56 0.11 0.52 1.20 0.00 0.00 173.24 174.54 3m4w n VAL 131 N -1.82 0.01 0.00 4.45 0.31 0.26 -4.83 118.33 116.71 3m4w n VAL 131 Ca 0.04 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 3m4w n VAL 131 Cb 0.54 1.78 0.00 0.00 -0.91 0.00 0.00 33.84 35.25 3m4w n VAL 131 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3m4w n GLY 132 N -0.00 0.34 3.00 2.92 0.00 -1.24 -4.93 105.19 105.27 3m4w n GLY 132 Ca 0.00 -2.29 -0.23 0.00 0.00 0.00 0.00 46.02 43.50 3m4w n GLY 132 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m4w s ARG 133 N -0.06 1.42 0.23 1.61 3.52 -1.26 -0.51 118.95 123.91 3m4w s ARG 133 Ca 0.00 -0.34 -0.10 0.00 -0.13 0.00 0.00 55.73 55.16 3m4w s ARG 133 Cb 0.00 -1.22 -0.01 0.00 -1.56 0.00 0.00 34.95 32.15 3m4w s ARG 133 CO 0.00 0.02 0.38 0.95 -0.81 0.00 0.00 175.30 175.84 3m4w s THR 134 N 0.63 0.01 -0.14 4.11 -4.23 -0.62 -4.93 115.64 110.47 3m4w s THR 134 Ca -0.12 -1.54 -0.20 0.00 -1.18 0.00 0.00 61.69 58.65 3m4w s THR 134 Cb -0.15 -2.24 -0.03 0.00 1.34 0.00 0.00 72.50 71.42 3m4w s THR 134 CO 0.03 -0.02 0.58 -0.60 -0.54 0.00 0.00 174.62 174.06 3m4w s ARG 135 N -4.05 4.30 -0.04 3.99 3.52 -1.26 -0.28 118.95 125.13 3m4w s ARG 135 Ca 0.26 0.60 -0.02 0.00 -0.13 0.00 0.00 55.73 56.43 3m4w s ARG 135 Cb 0.01 -3.50 0.02 0.00 -1.56 0.00 0.00 34.95 29.93 3m4w s ARG 135 CO 0.09 -0.03 0.10 0.42 -0.81 0.00 0.00 175.30 175.07 3m4w s ILE 136 N 1.21 -0.03 -1.44 4.11 -1.09 -0.71 -4.83 121.20 118.42 3m4w s ILE 136 Ca 0.29 0.11 -0.01 0.00 -2.23 0.00 0.00 60.65 58.82 3m4w s ILE 136 Cb -0.16 -0.17 0.00 0.00 -1.58 0.00 0.00 42.46 40.56 3m4w s ILE 136 CO 0.12 0.04 0.05 0.00 -1.23 0.00 0.00 174.94 173.92 3m4w n ALA 137 N 3.70 -0.72 -2.85 9.38 0.00 -1.26 -1.03 120.51 127.73 3m4w n ALA 137 Ca -0.21 0.14 -0.21 0.00 0.00 0.00 0.00 53.44 53.17 3m4w n ALA 137 Cb 0.55 -2.00 0.03 0.00 0.00 0.00 0.00 19.45 18.02 3m4w n ALA 137 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3m4w n ASP 138 N -1.96 -5.80 -4.02 0.00 2.03 -1.26 -4.99 116.55 100.54 3m4w n ASP 138 Ca -0.19 -0.22 -0.14 0.00 0.52 0.00 0.00 54.79 54.76 3m4w n ASP 138 Cb 0.65 -4.66 -0.13 0.00 -0.72 0.00 0.00 41.12 36.26 3m4w n ASP 138 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3m4w s ARG 139 N -5.49 0.50 -0.01 -0.67 1.81 -0.20 -5.11 118.95 109.77 3m4w s ARG 139 Ca 0.23 -0.54 -0.30 0.00 -1.72 0.00 0.00 55.73 53.40 3m4w s ARG 139 Cb -0.10 -0.35 -0.03 0.00 -0.45 0.00 0.00 34.95 34.02 3m4w s ARG 139 CO 0.28 0.08 1.01 -1.17 -0.68 0.00 0.00 175.30 174.82 3m4w s LEU 140 N -1.01 4.35 0.15 2.53 2.96 -1.26 -1.74 118.68 124.66 3m4w s LEU 140 Ca -0.05 1.68 0.10 0.00 -0.22 0.00 0.00 54.13 55.63 3m4w s LEU 140 Cb -0.07 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.01 3m4w s LEU 140 CO 0.00 -0.32 -0.22 0.00 -1.32 0.00 0.00 176.35 174.50 3m4w s GLU 142 N -2.39 4.28 -0.25 0.00 2.56 -0.00 -1.59 118.70 121.30 3m4w s GLU 142 Ca 0.14 0.37 -0.08 0.00 0.00 0.00 0.00 54.97 55.41 3m4w s GLU 142 Cb -0.08 -3.48 -0.03 0.00 2.00 0.00 0.00 34.13 32.54 3m4w s GLU 142 CO 0.07 0.07 0.08 0.08 -0.56 0.00 0.00 175.26 175.00 3m4w s VAL 143 N 0.93 4.46 -0.02 3.70 1.01 0.34 -1.67 120.40 129.15 3m4w s VAL 143 Ca 0.24 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.12 3m4w s VAL 143 Cb -0.15 -3.09 -0.00 0.00 0.00 0.00 0.00 36.38 33.14 3m4w s VAL 143 CO 0.09 0.34 -0.09 -0.63 0.00 0.00 0.00 175.10 174.80 3m4w s ILE 144 N 1.55 0.77 -0.05 2.22 1.01 -0.24 -0.57 121.20 125.89 3m4w s ILE 144 Ca 0.06 -0.38 -0.04 0.00 0.00 0.00 0.00 60.65 60.29 3m4w s ILE 144 Cb -0.15 -0.66 -0.04 0.00 0.01 0.00 0.00 42.46 41.61 3m4w s ILE 144 CO 0.04 0.23 0.16 -0.13 0.00 0.00 0.00 174.94 175.25 3m4w s ARG 145 N 0.00 3.43 -0.29 2.79 0.52 0.17 -0.26 118.95 125.31 3m4w s ARG 145 Ca 0.00 -0.26 0.02 0.00 -0.52 0.00 0.00 55.73 54.97 3m4w s ARG 145 Cb -0.06 -3.12 0.08 0.00 0.52 0.00 0.00 34.95 32.37 3m4w s ARG 145 CO 0.00 0.71 -0.01 0.08 0.02 0.00 0.00 175.30 176.10 3m4w s VAL 146 N -1.22 1.89 -0.11 3.52 1.01 0.08 -1.49 120.40 124.09 3m4w s VAL 146 Ca 0.23 -1.77 0.03 0.00 0.00 0.00 0.00 61.98 60.47 3m4w s VAL 146 Cb -0.12 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 34.03 3m4w s VAL 146 CO 0.13 -0.33 -0.21 -0.69 0.00 0.00 0.00 175.10 174.00 3m4w s VAL 147 N 1.16 1.91 0.01 2.92 1.01 -0.96 -1.52 120.40 124.93 3m4w s VAL 147 Ca 0.01 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 60.78 3m4w s VAL 147 Cb -0.19 -1.67 -0.07 0.00 0.00 0.00 0.00 36.38 34.45 3m4w s VAL 147 CO -0.09 0.52 1.60 0.00 0.00 0.00 0.00 175.10 177.13 3m4w s ALA 148 N 0.58 3.64 0.42 5.51 0.00 -1.26 -0.40 121.76 130.24 3m4w s ALA 148 Ca -0.14 1.03 0.16 0.00 0.00 0.00 0.00 51.96 53.02 3m4w s ALA 148 Cb -0.17 -3.69 1.06 0.00 0.00 0.00 0.00 23.12 20.32 3m4w s ALA 148 CO 0.04 -1.17 1.89 -0.09 0.00 0.00 0.00 175.76 176.44 3m4w h ARG 149 N 8.67 0.41 -0.32 0.00 2.43 -1.78 -1.40 114.38 122.39 3m4w h ARG 149 Ca -0.40 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 3m4w h ARG 149 Cb 1.19 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 3m4w h ARG 149 CO 0.93 0.27 0.00 -0.40 -1.51 0.00 0.00 179.97 179.26 3m4w n ASP 150 N -4.49 0.78 -2.09 -3.80 3.85 -1.26 -4.88 116.55 104.66 3m4w n ASP 150 Ca 0.16 -2.03 -0.16 0.00 -0.71 0.00 0.00 54.79 52.05 3m4w n ASP 150 Cb 0.59 -0.18 -0.03 0.00 -1.35 0.00 0.00 41.12 40.15 3m4w n ASP 150 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3m4w n GLY 151 N 0.50 0.23 0.01 6.12 0.00 -0.53 -4.87 105.19 106.65 3m4w n GLY 151 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 3m4w n GLY 151 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3m4w n THR 152 N -3.11 0.03 -4.49 2.61 -2.24 -1.26 -5.02 114.28 100.80 3m4w n THR 152 Ca -0.18 -0.10 -0.29 0.00 -2.27 0.00 0.00 64.05 61.21 3m4w n THR 152 Cb 0.61 0.63 -0.08 0.00 -2.10 0.00 0.00 70.33 69.39 3m4w n THR 152 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3m4w s ARG 153 N -3.09 2.13 0.68 -0.78 3.00 -1.26 -4.41 118.95 115.21 3m4w s ARG 153 Ca 0.06 -2.15 -0.14 0.00 0.00 0.00 0.00 55.73 53.50 3m4w s ARG 153 Cb 0.16 -1.72 0.01 0.00 0.00 0.00 0.00 34.95 33.39 3m4w s ARG 153 CO 0.83 -0.24 1.10 0.71 0.00 0.00 0.00 175.30 177.70 3m4w s TYR 154 N -2.76 2.68 0.33 -0.53 4.12 -1.26 -4.69 117.35 115.25 3m4w s TYR 154 Ca 0.25 1.54 0.10 0.00 0.02 0.00 0.00 57.07 58.98 3m4w s TYR 154 Cb 0.04 -3.11 -0.06 0.00 -1.52 0.00 0.00 41.96 37.31 3m4w s TYR 154 CO 0.14 -1.62 -0.08 -1.54 0.02 0.00 0.00 175.55 172.47 3m4w s SER 155 N -2.83 3.85 0.21 2.29 1.04 -0.71 -4.65 113.70 112.89 3m4w s SER 155 Ca 0.65 -1.09 0.11 0.00 0.48 0.00 0.00 55.95 56.09 3m4w s SER 155 Cb -0.19 -0.41 -0.04 0.00 0.10 0.00 0.00 66.02 65.48 3m4w s SER 155 CO 0.45 -0.16 -0.18 -0.31 0.98 0.00 0.00 173.24 174.01 3m4w s TYR 156 N -2.56 2.41 -0.05 5.02 2.02 -0.58 -0.39 117.35 123.23 3m4w s TYR 156 Ca 0.33 -0.31 0.00 0.00 -0.37 0.00 0.00 57.07 56.72 3m4w s TYR 156 Cb 0.00 -1.16 0.02 0.00 -0.40 0.00 0.00 41.96 40.43 3m4w s TYR 156 CO 0.17 0.55 -0.03 0.42 -1.57 0.00 0.00 175.55 175.09 3m4w s ILE 157 N -1.85 0.45 0.03 2.71 1.01 -0.67 -0.74 121.20 122.14 3m4w s ILE 157 Ca 0.24 -0.03 0.07 0.00 0.00 0.00 0.00 60.65 60.93 3m4w s ILE 157 Cb -0.08 -0.52 -0.02 0.00 0.01 0.00 0.00 42.46 41.85 3m4w s ILE 157 CO 0.13 0.22 -0.20 0.54 0.00 0.00 0.00 174.94 175.63 3m4w s VAL 158 N 1.23 1.60 -0.25 2.92 0.11 0.64 -1.20 120.40 125.45 3m4w s VAL 158 Ca -0.06 -1.11 0.00 0.00 -2.93 0.00 0.00 61.98 57.88 3m4w s VAL 158 Cb -0.14 -1.38 0.04 0.00 -1.53 0.00 0.00 36.38 33.37 3m4w s VAL 158 CO -0.02 0.24 -0.09 0.26 -3.33 0.00 0.00 175.10 172.16 3m4w s TRP 159 N -0.73 3.14 0.05 1.54 0.51 0.29 -1.07 118.94 122.67 3m4w s TRP 159 Ca 0.07 -1.93 0.08 0.00 -2.12 0.00 0.00 56.10 52.21 3m4w s TRP 159 Cb -0.08 -2.00 -0.03 0.00 -0.81 0.00 0.00 33.47 30.54 3m4w s TRP 159 CO 0.01 -0.81 -0.21 0.00 -0.51 0.00 0.00 176.95 175.43 3m4w s MET 160 N 1.22 1.92 -0.12 4.98 0.23 -0.67 0.77 119.30 127.63 3m4w s MET 160 Ca -0.04 -1.06 -0.29 0.00 -1.03 0.00 0.00 55.69 53.27 3m4w s MET 160 Cb -0.18 -2.10 -0.04 0.00 -1.53 0.00 0.00 34.83 30.98 3m4w s MET 160 CO -0.05 0.52 1.56 0.34 -2.03 0.00 0.00 175.02 175.36 3m4w s ASP 161 N -1.48 6.66 0.54 -1.18 2.15 0.28 -0.82 116.67 122.81 3m4w s ASP 161 Ca 0.14 1.97 0.23 0.00 0.43 0.00 0.00 52.55 55.32 3m4w s ASP 161 Cb -0.10 -2.53 1.41 0.00 -0.30 0.00 0.00 42.92 41.39 3m4w s ASP 161 CO 0.05 -0.97 2.06 0.71 -0.17 0.00 0.00 175.17 176.85 3m4w h THR 162 N 5.69 0.76 0.02 1.71 1.35 -1.81 0.95 112.91 121.58 3m4w h THR 162 Ca -0.35 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.51 3m4w h THR 162 Cb 1.16 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 3m4w h THR 162 CO 0.97 0.00 -0.01 -0.08 -0.25 0.00 0.00 175.52 176.15 3m4w h GLU 163 N 0.00 -0.03 0.00 4.72 4.81 -1.90 -3.40 114.58 118.78 3m4w h GLU 163 Ca 0.14 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.25 3m4w h GLU 163 Cb 0.61 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 3m4w h GLU 163 CO -0.00 -0.02 -0.60 0.66 -0.73 0.00 0.00 179.01 178.32 3m4w h SER 164 N -0.33 0.00 0.00 1.04 4.64 -1.98 -3.47 113.55 113.45 3m4w h SER 164 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m4w h SER 164 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3m4w h SER 164 CO 0.00 0.60 0.00 0.29 -0.87 0.00 0.00 176.83 176.86 3m4w n LYS 165 N -3.29 0.00 -2.45 4.77 4.76 0.33 -4.80 118.16 117.48 3m4w n LYS 165 Ca 0.01 0.00 -0.37 0.00 -2.87 0.00 0.00 58.31 55.08 3m4w n LYS 165 Cb 0.76 -2.59 -0.03 0.00 -1.84 0.00 0.00 35.03 31.33 3m4w n LYS 165 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3m4w s LEU 166 N 0.00 4.14 0.15 -0.35 1.43 -1.25 -4.10 118.68 118.70 3m4w s LEU 166 Ca 0.00 2.15 -0.31 0.00 -1.03 0.00 0.00 54.13 54.94 3m4w s LEU 166 Cb 0.00 -4.15 -0.08 0.00 0.03 0.00 0.00 46.19 41.99 3m4w s LEU 166 CO 0.00 -0.59 1.33 -2.16 0.23 0.00 0.00 176.35 175.16 3m4w s PRO 167 N -2.46 4.37 -0.02 1.29 0.04 -1.26 -0.56 135.00 136.40 3m4w s PRO 167 Ca 0.58 2.03 0.16 0.00 0.04 0.00 0.00 61.00 63.81 3m4w s PRO 167 Cb -0.25 -3.23 -0.24 0.00 0.04 0.00 0.00 34.50 30.81 3m4w s PRO 167 CO 0.31 -0.33 0.35 -1.33 0.04 0.00 0.00 177.00 176.05 3m4w n MET 168 N 3.35 0.53 -3.62 4.56 2.81 0.23 -4.80 117.12 120.17 3m4w n MET 168 Ca 0.09 -0.14 -0.10 0.00 -1.81 0.00 0.00 57.70 55.74 3m4w n MET 168 Cb 0.43 -1.37 -0.07 0.00 -0.71 0.00 0.00 33.22 31.51 3m4w n MET 168 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 3m4w s ARG 169 N -3.06 0.58 -0.06 0.03 3.52 -1.04 -1.02 118.95 117.90 3m4w s ARG 169 Ca -0.05 0.51 -0.02 0.00 -0.13 0.00 0.00 55.73 56.03 3m4w s ARG 169 Cb 0.10 0.28 0.04 0.00 -1.56 0.00 0.00 34.95 33.81 3m4w s ARG 169 CO 0.65 -0.11 0.13 0.08 -0.81 0.00 0.00 175.30 175.24 3m4w s VAL 170 N -0.14 -0.10 -0.09 7.11 1.01 -0.18 -0.54 120.40 127.48 3m4w s VAL 170 Ca 0.01 0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.25 3m4w s VAL 170 Cb -0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 36.38 36.10 3m4w s VAL 170 CO -0.03 0.10 -0.17 -1.81 0.00 0.00 0.00 175.10 173.19 3m4w s ASP 171 N 1.43 3.73 -0.26 3.32 1.11 -0.34 -0.19 116.67 125.48 3m4w s ASP 171 Ca -0.06 -0.35 -0.10 0.00 0.18 0.00 0.00 52.55 52.23 3m4w s ASP 171 Cb -0.12 -1.17 -0.04 0.00 1.07 0.00 0.00 42.92 42.65 3m4w s ASP 171 CO -0.05 0.24 0.14 -0.22 1.18 0.00 0.00 175.17 176.46 3m4w s LEU 172 N -0.11 3.87 -0.01 1.23 2.96 -0.14 -1.67 118.68 124.82 3m4w s LEU 172 Ca -0.03 -0.03 0.05 0.00 -0.22 0.00 0.00 54.13 53.90 3m4w s LEU 172 Cb -0.14 -2.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 3m4w s LEU 172 CO 0.04 -0.00 -0.14 -0.76 -1.32 0.00 0.00 176.35 174.16 3m4w s LEU 173 N 1.45 2.76 0.75 -0.68 1.43 0.48 0.34 118.68 125.21 3m4w s LEU 173 Ca 0.07 -0.27 -0.12 0.00 -1.03 0.00 0.00 54.13 52.78 3m4w s LEU 173 Cb -0.15 -1.59 0.04 0.00 0.03 0.00 0.00 46.19 44.52 3m4w s LEU 173 CO 0.07 0.30 1.13 1.51 0.23 0.00 0.00 176.35 179.59 3m4w s ASP 174 N -1.10 5.04 0.00 2.29 1.47 -0.06 -1.74 116.67 122.57 3m4w s ASP 174 Ca 0.14 0.97 0.00 0.00 1.18 0.00 0.00 52.55 54.84 3m4w s ASP 174 Cb -0.11 -1.64 0.00 0.00 -0.34 0.00 0.00 42.92 40.83 3m4w s ASP 174 CO 0.03 -1.58 0.90 0.54 0.68 0.00 0.00 175.17 175.74 3m4w n ARG 175 N -3.14 0.00 -0.39 2.11 1.74 -1.26 -1.14 116.66 114.59 3m4w n ARG 175 Ca 0.07 0.40 0.08 0.00 -0.77 0.00 0.00 57.85 57.63 3m4w n ARG 175 Cb 0.59 -1.52 0.25 0.00 -1.02 0.00 0.00 32.46 30.76 3m4w n ARG 175 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3m4w n ASP 176 N -1.40 3.77 0.00 0.55 5.75 -1.26 -4.98 116.55 118.99 3m4w n ASP 176 Ca 0.00 -2.39 0.00 0.00 -0.01 0.00 0.00 54.79 52.39 3m4w n ASP 176 Cb 0.02 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 39.68 3m4w n ASP 176 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3m4w n GLY 177 N 0.49 2.22 3.77 6.12 0.00 -0.29 -5.06 105.19 112.44 3m4w n GLY 177 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 3m4w n GLY 177 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m4w s GLU 178 N -0.66 3.06 -0.14 1.61 2.02 -1.26 -4.74 118.70 118.58 3m4w s GLU 178 Ca 0.00 1.46 -0.23 0.00 0.02 0.00 0.00 54.97 56.22 3m4w s GLU 178 Cb 0.00 -1.98 -0.03 0.00 0.10 0.00 0.00 34.13 32.23 3m4w s GLU 178 CO 0.00 -1.06 0.72 0.99 0.02 0.00 0.00 175.26 175.93 3m4w s THR 179 N -2.13 4.99 -0.12 3.63 2.01 -1.26 -0.88 115.64 121.87 3m4w s THR 179 Ca 0.69 1.42 -0.10 0.00 0.31 0.00 0.00 61.69 64.00 3m4w s THR 179 Cb -0.21 -4.04 -0.26 0.00 0.01 0.00 0.00 72.50 68.00 3m4w s THR 179 CO 0.35 0.14 0.40 -0.07 -0.69 0.00 0.00 174.62 174.75 3m4w h LEU 180 N 7.69 0.38 -7.40 4.42 3.38 -0.46 -3.47 115.31 119.85 3m4w h LEU 180 Ca -0.34 -0.88 -0.10 0.00 0.09 0.00 0.00 57.88 56.64 3m4w h LEU 180 Cb 1.16 -0.12 -0.20 0.00 0.09 0.00 0.00 40.66 41.59 3m4w h LEU 180 CO 0.79 1.78 -0.17 -0.70 0.09 0.00 0.00 178.44 180.22 3m4w s GLU 181 N -2.52 0.76 -0.03 1.13 2.12 -1.18 -4.38 118.70 114.59 3m4w s GLU 181 Ca -0.22 -0.09 0.01 0.00 0.36 0.00 0.00 54.97 55.03 3m4w s GLU 181 Cb 0.06 0.34 0.02 0.00 0.26 0.00 0.00 34.13 34.81 3m4w s GLU 181 CO 0.75 -0.22 -0.02 -1.14 -0.54 0.00 0.00 175.26 174.10 3m4w s GLN 182 N -1.29 0.44 -0.19 4.30 0.74 0.04 -0.96 119.66 122.73 3m4w s GLN 182 Ca -0.13 -0.02 -0.05 0.00 0.05 0.00 0.00 55.36 55.21 3m4w s GLN 182 Cb -0.04 -0.53 -0.03 0.00 1.10 0.00 0.00 33.01 33.51 3m4w s GLN 182 CO 0.06 -0.07 0.01 0.12 -0.55 0.00 0.00 175.29 174.85 3m4w s PHE 183 N 0.75 3.07 -0.14 1.67 5.36 0.73 -0.83 117.98 128.59 3m4w s PHE 183 Ca -0.08 -0.34 -0.04 0.00 -0.96 0.00 0.00 56.93 55.51 3m4w s PHE 183 Cb -0.11 -2.07 0.05 0.00 -0.34 0.00 0.00 43.02 40.55 3m4w s PHE 183 CO -0.01 -0.15 0.08 1.03 -1.46 0.00 0.00 175.22 174.72 3m4w s ARG 184 N 0.83 0.04 0.23 10.12 0.52 -0.74 -1.01 118.95 128.95 3m4w s ARG 184 Ca 0.01 0.01 -0.30 0.00 -0.52 0.00 0.00 55.73 54.93 3m4w s ARG 184 Cb -0.14 -1.57 -0.09 0.00 0.52 0.00 0.00 34.95 33.67 3m4w s ARG 184 CO 0.02 -0.60 1.30 0.08 0.02 0.00 0.00 175.30 176.12 3m4w s VAL 185 N 2.14 3.11 -0.06 3.52 1.01 -0.19 -1.86 120.40 128.08 3m4w s VAL 185 Ca 0.03 0.97 0.08 0.00 0.00 0.00 0.00 61.98 63.06 3m4w s VAL 185 Cb -0.15 -3.62 -0.12 0.00 0.00 0.00 0.00 36.38 32.49 3m4w s VAL 185 CO -0.08 0.17 0.08 -0.38 0.00 0.00 0.00 175.10 174.90 3m4w n ILE 186 N 2.13 0.41 -3.61 2.22 2.08 0.07 -4.64 119.36 118.04 3m4w n ILE 186 Ca 0.04 -0.32 -0.12 0.00 0.56 0.00 0.00 62.75 62.91 3m4w n ILE 186 Cb 0.43 -0.44 -0.07 0.00 -0.75 0.00 0.00 39.64 38.81 3m4w n ILE 186 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3m4w s ALA 187 N -2.35 -1.88 0.27 -1.39 0.00 -1.05 -4.99 121.76 110.37 3m4w s ALA 187 Ca -0.04 1.78 -0.19 0.00 0.00 0.00 0.00 51.96 53.50 3m4w s ALA 187 Cb 0.04 -1.00 0.02 0.00 0.00 0.00 0.00 23.12 22.17 3m4w s ALA 187 CO 0.37 -0.30 0.67 -0.59 0.00 0.00 0.00 175.76 175.91 3m4w s PHE 188 N -0.20 -0.09 -0.13 0.00 -0.12 -1.26 -0.94 117.98 115.24 3m4w s PHE 188 Ca -0.01 -0.35 -0.26 0.00 -0.05 0.00 0.00 56.93 56.27 3m4w s PHE 188 Cb -0.03 0.60 0.06 0.00 -0.63 0.00 0.00 43.02 43.02 3m4w s PHE 188 CO -0.00 -1.18 0.63 0.54 -0.05 0.00 0.00 175.22 175.16 3m4w s ASN 189 N -2.94 -0.62 -0.06 1.98 4.22 -0.97 -5.01 114.94 111.55 3m4w s ASN 189 Ca 0.13 0.92 0.02 0.00 -2.14 0.00 0.00 52.86 51.80 3m4w s ASN 189 Cb -0.05 0.87 -0.03 0.00 1.28 0.00 0.00 41.25 43.33 3m4w s ASN 189 CO 0.07 -0.42 -0.11 -0.69 -2.04 0.00 0.00 177.10 173.90 3m4w s VAL 190 N -0.52 3.33 -0.06 3.54 1.01 -1.26 -1.66 120.40 124.78 3m4w s VAL 190 Ca -0.06 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.33 3m4w s VAL 190 Cb -0.03 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 34.03 3m4w s VAL 190 CO 0.05 0.59 -0.18 0.20 0.00 0.00 0.00 175.10 175.77 3m4w s ASN 191 N -0.75 2.31 0.21 3.32 -0.87 -0.77 -5.01 114.94 113.37 3m4w s ASN 191 Ca 0.12 -0.39 -0.10 0.00 -1.57 0.00 0.00 52.86 50.91 3m4w s ASN 191 Cb -0.11 -0.79 0.28 0.00 -0.02 0.00 0.00 41.25 40.61 3m4w s ASN 191 CO 0.01 0.14 1.70 1.56 -2.57 0.00 0.00 177.10 177.94 3m4w h GLN 192 N 6.45 0.24 -5.90 -0.60 4.20 -2.00 -3.38 115.11 114.11 3m4w h GLN 192 Ca -0.30 -0.01 -0.51 0.00 0.06 0.00 0.00 58.65 57.88 3m4w h GLN 192 Cb 1.19 -0.05 -0.21 0.00 0.30 0.00 0.00 27.48 28.71 3m4w h GLN 192 CO 0.48 0.16 -0.80 0.16 -0.67 0.00 0.00 178.83 178.15 3m4w s ASP 193 N -5.30 2.35 0.37 1.46 -4.77 -1.26 -4.92 116.67 104.61 3m4w s ASP 193 Ca -0.13 -0.71 -0.28 0.00 -3.30 0.00 0.00 52.55 48.13 3m4w s ASP 193 Cb 0.17 -0.12 -0.11 0.00 -1.09 0.00 0.00 42.92 41.77 3m4w s ASP 193 CO 0.74 -0.00 1.40 0.00 0.70 0.00 0.00 175.17 178.00 3m4w n ILE 194 N 0.94 2.09 -1.33 2.11 3.06 -1.26 -5.04 119.36 119.93 3m4w n ILE 194 Ca -0.18 -0.50 -0.08 0.00 -2.50 0.00 0.00 62.75 59.48 3m4w n ILE 194 Cb 0.55 -1.79 0.06 0.00 0.54 0.00 0.00 39.64 38.99 3m4w n ILE 194 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 3m4w n SER 195 N 0.51 0.05 0.07 9.51 3.41 -1.26 -4.94 113.62 120.97 3m4w n SER 195 Ca 0.03 -1.15 -0.08 0.00 -0.26 0.00 0.00 58.87 57.41 3m4w n SER 195 Cb 0.38 -0.28 -0.06 0.00 -0.26 0.00 0.00 64.21 63.99 3m4w n SER 195 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 3m4w h SER 196 N -0.47 -0.23 -1.05 4.04 0.87 -1.98 -2.85 113.55 111.87 3m4w h SER 196 Ca -0.12 -0.21 0.29 0.00 -1.23 0.00 0.00 61.79 60.51 3m4w h SER 196 Cb 0.34 0.06 -0.12 0.00 -0.44 0.00 0.00 62.40 62.24 3m4w h SER 196 CO 0.09 0.30 0.65 0.28 -0.53 0.00 0.00 176.83 177.62 3m4w h SER 197 N -0.98 0.51 0.70 6.23 0.02 -1.98 0.69 113.55 118.74 3m4w h SER 197 Ca -0.03 0.13 -0.26 0.00 -0.84 0.00 0.00 61.79 60.78 3m4w h SER 197 Cb 0.43 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 3m4w h SER 197 CO 0.05 0.02 -1.23 0.24 -1.14 0.00 0.00 176.83 174.77 3m4w h MET 198 N 0.40 0.19 -0.35 3.45 2.07 -1.97 -1.49 114.93 117.24 3m4w h MET 198 Ca 0.66 -0.33 -0.08 0.00 -2.07 0.00 0.00 59.70 57.88 3m4w h MET 198 Cb 1.57 0.12 -0.02 0.00 -1.87 0.00 0.00 31.60 31.41 3m4w h MET 198 CO -0.42 1.13 -0.12 1.96 1.07 0.00 0.00 176.91 180.53 3m4w h GLN 199 N 0.05 0.60 -0.22 1.72 4.20 -0.42 -1.19 115.11 119.85 3m4w h GLN 199 Ca -0.12 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.33 3m4w h GLN 199 Cb 1.93 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.64 3m4w h GLN 199 CO 0.18 0.71 -0.14 1.15 -0.67 0.00 0.00 178.83 180.05 3m4w h THR 200 N 0.55 1.31 -0.97 -0.54 2.02 0.26 -3.08 112.91 112.46 3m4w h THR 200 Ca 0.10 -1.24 0.08 0.00 0.77 0.00 0.00 66.41 66.12 3m4w h THR 200 Cb 0.53 1.64 -0.07 0.00 -1.74 0.00 0.00 68.15 68.51 3m4w h THR 200 CO 0.03 0.38 0.61 0.25 0.37 0.00 0.00 175.52 177.17 3m4w h LEU 201 N 0.19 0.95 -1.61 2.58 5.85 -0.78 -0.87 115.31 121.63 3m4w h LEU 201 Ca 0.05 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.83 3m4w h LEU 201 Cb 0.66 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 3m4w h LEU 201 CO 0.04 0.57 0.33 0.00 -0.34 0.00 0.00 178.44 179.04 3m4w h ALA 202 N 1.47 1.84 -0.43 1.25 0.00 -1.15 -1.41 119.26 120.83 3m4w h ALA 202 Ca 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3m4w h ALA 202 Cb 0.27 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3m4w h ALA 202 CO -0.20 0.09 0.00 1.63 0.00 0.00 0.00 179.25 180.77 3m4w n LYS 203 N -4.48 2.45 -2.03 0.00 5.02 -0.44 -4.98 118.16 113.72 3m4w n LYS 203 Ca 0.06 -2.21 -0.38 0.00 -2.02 0.00 0.00 58.31 53.76 3m4w n LYS 203 Cb 0.19 -1.51 0.01 0.00 -0.02 0.00 0.00 35.03 33.71 3m4w n LYS 203 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3m4w s ALA 204 N -1.44 2.92 -0.74 7.82 0.00 -0.53 -4.94 121.76 124.84 3m4w s ALA 204 Ca 0.40 1.13 -0.20 0.00 0.00 0.00 0.00 51.96 53.29 3m4w s ALA 204 Cb 0.23 -3.47 0.11 0.00 0.00 0.00 0.00 23.12 19.98 3m4w s ALA 204 CO 0.31 -1.00 0.93 1.21 0.00 0.00 0.00 175.76 177.22 3m4w s ASN 205 N -1.14 6.36 0.26 0.00 3.84 -1.26 -5.02 114.94 117.98 3m4w s ASN 205 Ca 0.67 -1.57 -0.09 0.00 0.21 0.00 0.00 52.86 52.08 3m4w s ASN 205 Cb -0.34 -2.37 -0.07 0.00 -0.55 0.00 0.00 41.25 37.92 3m4w s ASN 205 CO 0.41 -1.17 0.58 -0.76 -2.79 0.00 0.00 177.10 173.37 3m4w s LEU 206 N 2.99 4.11 0.40 3.21 1.43 -1.26 -5.05 118.68 124.51 3m4w s LEU 206 Ca 0.22 0.91 -0.24 0.00 -1.03 0.00 0.00 54.13 53.99 3m4w s LEU 206 Cb -0.14 -3.70 -0.11 0.00 0.03 0.00 0.00 46.19 42.26 3m4w s LEU 206 CO 0.01 -0.13 0.92 -0.81 0.23 0.00 0.00 176.35 176.57 3m4w n PRO 207 N -0.42 1.19 -1.69 1.29 -0.04 -1.26 -4.91 135.00 129.15 3m4w n PRO 207 Ca 0.00 0.43 -0.41 0.00 -0.04 0.00 0.00 63.50 63.48 3m4w n PRO 207 Cb 0.53 -1.91 0.01 0.00 -0.04 0.00 0.00 33.50 32.09 3m4w n PRO 207 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3m4w n PRO 208 N 0.28 1.81 -2.07 0.54 -0.04 -1.26 -4.40 135.00 129.85 3m4w n PRO 208 Ca 0.10 0.64 -0.41 0.00 -0.04 0.00 0.00 63.50 63.79 3m4w n PRO 208 Cb 0.38 -2.33 -0.02 0.00 -0.04 0.00 0.00 33.50 31.49 3m4w n PRO 208 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3m4w s LEU 209 N -1.58 4.40 -0.06 1.53 2.96 -1.26 -3.24 118.68 121.43 3m4w s LEU 209 Ca 0.62 2.66 -0.11 0.00 -0.22 0.00 0.00 54.13 57.08 3m4w s LEU 209 Cb -0.51 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.50 3m4w s LEU 209 CO 0.57 -0.62 0.28 -0.76 -1.32 0.00 0.00 176.35 174.51 3m4w s LEU 210 N -1.00 4.43 -0.14 -0.68 1.02 -0.07 -4.94 118.68 117.30 3m4w s LEU 210 Ca 0.54 0.73 -0.21 0.00 0.02 0.00 0.00 54.13 55.21 3m4w s LEU 210 Cb -0.40 -2.35 -0.03 0.00 0.02 0.00 0.00 46.19 43.43 3m4w s LEU 210 CO 0.47 0.36 0.63 -0.55 0.02 0.00 0.00 176.35 177.29 3m4w s SER 211 N -1.07 6.78 -0.06 2.29 0.15 -1.26 -4.85 113.70 115.69 3m4w s SER 211 Ca 0.20 0.95 -0.02 0.00 0.70 0.00 0.00 55.95 57.77 3m4w s SER 211 Cb -0.14 -2.36 0.04 0.00 -1.71 0.00 0.00 66.02 61.84 3m4w s SER 211 CO 0.09 -0.18 0.12 -0.69 1.20 0.00 0.00 173.24 173.77 3m4w s VAL 212 N 1.37 -0.13 -0.07 4.45 1.01 -1.26 -5.12 120.40 120.66 3m4w s VAL 212 Ca 0.31 0.28 -0.39 0.00 0.00 0.00 0.00 61.98 62.18 3m4w s VAL 212 Cb -0.16 -0.22 -0.18 0.00 0.00 0.00 0.00 36.38 35.83 3m4w s VAL 212 CO 0.13 0.11 1.39 -2.65 0.00 0.00 0.00 175.10 174.08 3m4w n PRO 213 N 4.70 0.78 -3.71 2.72 -0.02 -1.26 -4.97 135.00 133.25 3m4w n PRO 213 Ca -0.17 0.28 -0.14 0.00 -2.02 0.00 0.00 63.50 61.46 3m4w n PRO 213 Cb 0.51 -1.89 -0.14 0.00 -0.02 0.00 0.00 33.50 31.95 3m4w n PRO 213 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3m4w s VAL 214 N 1.27 -0.16 0.00 -1.45 1.01 -1.26 -4.91 120.40 114.90 3m4w s VAL 214 Ca 0.91 0.23 0.00 0.00 0.00 0.00 0.00 61.98 63.12 3m4w s VAL 214 Cb -1.10 -0.32 0.00 0.00 0.00 0.00 0.00 36.38 34.95 3m4w s VAL 214 CO 0.56 0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.37 3m4w n GLY 215 N 4.66 1.84 3.81 4.51 0.00 -1.26 -5.11 105.19 113.64 3m4w n GLY 215 Ca -0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 3m4w n GLY 215 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m4w s GLU 216 N -0.44 4.26 -0.35 1.61 2.02 -1.26 -4.98 118.70 119.56 3m4w s GLU 216 Ca 0.00 0.80 0.12 0.00 0.02 0.00 0.00 54.97 55.91 3m4w s GLU 216 Cb 0.00 -3.23 0.45 0.00 0.10 0.00 0.00 34.13 31.45 3m4w s GLU 216 CO 0.00 0.62 1.08 1.63 0.02 0.00 0.00 175.26 178.61 3m4w n LYS 217 N 1.66 2.51 -1.43 1.61 4.76 -1.25 -2.96 118.16 123.06 3m4w n LYS 217 Ca -0.09 -3.91 -0.38 0.00 -2.87 0.00 0.00 58.31 51.06 3m4w n LYS 217 Cb 0.50 -1.85 0.04 0.00 -1.84 0.00 0.00 35.03 31.88 3m4w n LYS 217 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3m4w n ALA 218 N -0.42 -1.30 -2.78 7.82 0.00 -0.71 -4.97 120.51 118.15 3m4w n ALA 218 Ca 0.26 -0.06 -0.37 0.00 0.00 0.00 0.00 53.44 53.27 3m4w n ALA 218 Cb 0.79 -1.81 -0.11 0.00 0.00 0.00 0.00 19.45 18.32 3m4w n ALA 218 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3m4w s LYS 219 N -2.13 3.90 0.23 0.00 1.02 -1.26 -4.89 119.74 116.61 3m4w s LYS 219 Ca 0.68 -0.36 0.09 0.00 0.02 0.00 0.00 55.97 56.40 3m4w s LYS 219 Cb -0.43 -3.45 -0.05 0.00 -0.52 0.00 0.00 37.83 33.38 3m4w s LYS 219 CO 0.55 -0.04 -0.16 -0.06 -0.92 0.00 0.00 175.35 174.72 3m4w s PHE 220 N 1.28 1.90 -0.18 3.18 0.08 -1.26 -5.05 117.98 117.93 3m4w s PHE 220 Ca 0.06 -0.49 0.17 0.00 0.12 0.00 0.00 56.93 56.79 3m4w s PHE 220 Cb -0.14 -0.86 0.04 0.00 -0.57 0.00 0.00 43.02 41.48 3m4w s PHE 220 CO 0.05 0.47 1.29 0.66 -0.10 0.00 0.00 175.22 177.60 3m4w h SER 221 N 2.49 0.00 -3.05 1.36 4.64 -1.96 -3.46 113.55 113.57 3m4w h SER 221 Ca -0.39 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.33 3m4w h SER 221 Cb 1.23 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.27 3m4w h SER 221 CO 0.61 0.44 -0.20 -1.66 -0.87 0.00 0.00 176.83 175.15 3m4w s TRP 222 N -3.00 3.71 -0.04 4.77 1.48 -1.26 -3.74 118.94 120.85 3m4w s TRP 222 Ca 0.02 0.98 -0.02 0.00 -1.06 0.00 0.00 56.10 56.03 3m4w s TRP 222 Cb 0.08 -2.28 0.03 0.00 -1.16 0.00 0.00 33.47 30.14 3m4w s TRP 222 CO 0.76 0.61 0.09 -0.08 -4.06 0.00 0.00 176.95 174.27 3m4w s THR 223 N -1.15 -0.05 -0.44 0.66 -1.32 -0.86 -4.98 115.64 107.51 3m4w s THR 223 Ca 0.26 0.17 -0.27 0.00 -1.21 0.00 0.00 61.69 60.64 3m4w s THR 223 Cb -0.16 -0.16 -0.04 0.00 -1.51 0.00 0.00 72.50 70.63 3m4w s THR 223 CO 0.15 0.07 2.03 -2.84 -2.21 0.00 0.00 174.62 171.82 3m4w s PRO 224 N 0.99 2.78 0.00 7.08 0.02 -1.26 -2.05 135.00 142.56 3m4w s PRO 224 Ca -0.08 1.27 0.22 0.00 0.02 0.00 0.00 61.00 62.44 3m4w s PRO 224 Cb -0.11 -4.38 1.12 0.00 0.02 0.00 0.00 34.50 31.15 3m4w s PRO 224 CO -0.04 -2.51 1.71 0.25 -0.33 0.00 0.00 177.00 176.08 3m4w n THR 225 N 7.55 0.30 -3.73 0.99 -2.24 -0.35 -4.64 114.28 112.16 3m4w n THR 225 Ca 0.27 0.08 -0.13 0.00 -2.27 0.00 0.00 64.05 61.99 3m4w n THR 225 Cb 0.50 -0.71 -0.14 0.00 -2.10 0.00 0.00 70.33 67.88 3m4w n THR 225 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3m4w s TRP 226 N -2.55 -0.23 -0.03 4.78 -0.00 -1.26 -5.07 118.94 114.58 3m4w s TRP 226 Ca 0.21 0.62 -0.09 0.00 -0.00 0.00 0.00 56.10 56.84 3m4w s TRP 226 Cb 0.15 -0.05 0.01 0.00 -0.00 0.00 0.00 33.47 33.58 3m4w s TRP 226 CO 0.33 -0.21 0.20 -0.51 -0.00 0.00 0.00 176.95 176.77 3m4w s LEU 227 N 1.33 1.29 0.64 5.86 1.43 -1.26 -4.63 118.68 123.35 3m4w s LEU 227 Ca -0.08 0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 52.90 3m4w s LEU 227 Cb -0.11 0.82 -0.01 0.00 0.03 0.00 0.00 46.19 46.92 3m4w s LEU 227 CO -0.07 -0.30 1.23 -2.16 0.23 0.00 0.00 176.35 175.28 3m4w s PRO 228 N -0.91 2.65 0.39 1.29 0.04 -1.26 -4.90 135.00 132.31 3m4w s PRO 228 Ca -0.10 1.85 -0.24 0.00 0.04 0.00 0.00 61.00 62.55 3m4w s PRO 228 Cb -0.05 -1.88 -0.12 0.00 0.04 0.00 0.00 34.50 32.49 3m4w s PRO 228 CO 0.02 -1.46 0.87 1.04 0.04 0.00 0.00 177.00 177.51 3m4w n GLN 229 N -1.98 1.10 0.00 4.56 1.13 -1.26 -2.82 117.38 118.11 3m4w n GLN 229 Ca 0.14 0.39 0.00 0.00 -1.94 0.00 0.00 57.00 55.59 3m4w n GLN 229 Cb 0.49 -1.84 0.00 0.00 0.11 0.00 0.00 30.24 29.00 3m4w n GLN 229 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3m4w n GLY 230 N 1.37 3.26 3.82 1.08 0.00 -1.26 -5.00 105.19 108.46 3m4w n GLY 230 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 3m4w n GLY 230 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3m4w s PHE 231 N -2.45 3.23 0.02 1.61 0.40 -1.13 -4.42 117.98 115.25 3m4w s PHE 231 Ca 0.00 1.57 -0.10 0.00 -0.60 0.00 0.00 56.93 57.80 3m4w s PHE 231 Cb 0.00 -2.91 0.01 0.00 0.51 0.00 0.00 43.02 40.63 3m4w s PHE 231 CO 0.00 -0.42 0.21 -1.12 0.70 0.00 0.00 175.22 174.59 3m4w s SER 232 N -2.33 -0.01 0.20 1.36 0.01 -0.84 -4.97 113.70 107.11 3m4w s SER 232 Ca 0.63 -0.25 -0.27 0.00 1.31 0.00 0.00 55.95 57.37 3m4w s SER 232 Cb -0.12 0.28 -0.08 0.00 0.21 0.00 0.00 66.02 66.31 3m4w s SER 232 CO 0.20 -0.50 0.84 -0.70 0.41 0.00 0.00 173.24 173.48 3m4w s GLU 233 N -2.10 4.67 0.00 12.44 2.12 -1.26 -2.11 118.70 132.45 3m4w s GLU 233 Ca -0.09 1.28 0.00 0.00 0.36 0.00 0.00 54.97 56.52 3m4w s GLU 233 Cb -0.03 -3.25 0.00 0.00 0.26 0.00 0.00 34.13 31.11 3m4w s GLU 233 CO -0.01 0.54 0.45 1.33 -0.54 0.00 0.00 175.26 177.03 3m4w n VAL 234 N 1.50 0.04 -3.59 3.70 0.24 -0.11 -4.97 118.33 115.14 3m4w n VAL 234 Ca -0.04 -0.45 -0.09 0.00 -2.04 0.00 0.00 64.34 61.72 3m4w n VAL 234 Cb 0.48 1.12 -0.05 0.00 -1.47 0.00 0.00 33.84 33.92 3m4w n VAL 234 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3m4w s SER 235 N -0.04 -0.33 -0.27 -1.34 0.01 -1.19 -4.90 113.70 105.63 3m4w s SER 235 Ca 0.00 0.40 0.00 0.00 1.31 0.00 0.00 55.95 57.66 3m4w s SER 235 Cb 0.00 0.32 0.16 0.00 0.21 0.00 0.00 66.02 66.71 3m4w s SER 235 CO 0.00 -0.27 0.44 -0.94 0.41 0.00 0.00 173.24 172.88 3m4w s SER 236 N -0.92 -0.13 0.00 2.44 1.04 -1.15 -0.92 113.70 114.05 3m4w s SER 236 Ca 0.00 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.52 3m4w s SER 236 Cb -0.01 1.36 0.00 0.00 0.10 0.00 0.00 66.02 67.47 3m4w s SER 236 CO -0.01 -0.31 0.00 -1.54 0.98 0.00 0.00 173.24 172.36 3m4w n SER 237 N 5.38 0.00 -3.92 7.02 3.41 -0.55 -1.73 113.62 123.22 3m4w n SER 237 Ca -0.01 -0.74 -0.10 0.00 -0.26 0.00 0.00 58.87 57.76 3m4w n SER 237 Cb 0.50 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.34 3m4w n SER 237 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3m4w s ARG 238 N -1.22 0.27 0.00 4.33 1.70 -1.25 -0.59 118.95 122.19 3m4w s ARG 238 Ca 0.00 -0.36 0.00 0.00 -0.47 0.00 0.00 55.73 54.90 3m4w s ARG 238 Cb 0.00 0.11 0.00 0.00 -0.57 0.00 0.00 34.95 34.49 3m4w s ARG 238 CO 0.00 -0.05 0.00 0.54 -1.08 0.00 0.00 175.30 174.71 3m4w n ARG 239 N 2.01 0.61 -2.17 3.89 1.74 -0.76 -4.94 116.66 117.03 3m4w n ARG 239 Ca -0.20 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.78 3m4w n ARG 239 Cb 0.57 -0.05 -0.02 0.00 -1.02 0.00 0.00 32.46 31.94 3m4w n ARG 239 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 3m4w n MET 247 N 0.00 -1.41 -2.80 5.56 2.00 -1.26 -4.59 117.12 114.62 3m4w n MET 247 Ca 0.00 0.03 -0.41 0.00 0.00 0.00 0.00 57.70 57.32 3m4w n MET 247 Cb 0.00 -2.17 -0.03 0.00 0.00 0.00 0.00 33.22 31.02 3m4w n MET 247 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 3m4w s PRO 248 N -3.13 4.52 -0.09 0.03 0.04 -1.26 -5.05 135.00 130.06 3m4w s PRO 248 Ca 0.19 1.27 0.01 0.00 0.04 0.00 0.00 61.00 62.52 3m4w s PRO 248 Cb -0.11 -3.46 0.02 0.00 0.04 0.00 0.00 34.50 30.98 3m4w s PRO 248 CO 0.24 -0.03 -0.12 0.42 0.04 0.00 0.00 177.00 177.54 3m4w s ILE 249 N 1.00 1.24 -0.54 0.56 1.01 -1.26 -4.70 121.20 118.51 3m4w s ILE 249 Ca 0.48 -0.49 -0.18 0.00 0.00 0.00 0.00 60.65 60.46 3m4w s ILE 249 Cb -0.20 -1.16 0.09 0.00 0.01 0.00 0.00 42.46 41.20 3m4w s ILE 249 CO 0.25 0.39 0.61 -1.61 0.00 0.00 0.00 174.94 174.57 3m4w s GLU 250 N 1.03 3.06 -0.22 2.79 2.02 -1.17 -1.83 118.70 124.36 3m4w s GLU 250 Ca -0.07 -1.22 -0.04 0.00 0.02 0.00 0.00 54.97 53.66 3m4w s GLU 250 Cb -0.15 -4.19 -0.01 0.00 0.10 0.00 0.00 34.13 29.88 3m4w s GLU 250 CO -0.01 -1.33 -0.03 0.45 0.02 0.00 0.00 175.26 174.37 3m4w s SER 251 N 3.14 4.42 -0.27 -0.19 0.15 0.24 -2.02 113.70 119.16 3m4w s SER 251 Ca 0.11 -0.36 -0.08 0.00 0.70 0.00 0.00 55.95 56.31 3m4w s SER 251 Cb -0.23 -1.77 -0.02 0.00 -1.71 0.00 0.00 66.02 62.29 3m4w s SER 251 CO 0.08 -0.02 0.11 -0.13 1.20 0.00 0.00 173.24 174.48 3m4w s ARG 252 N 1.49 3.57 -0.18 5.44 0.52 -0.92 -1.48 118.95 127.39 3m4w s ARG 252 Ca 0.06 -0.55 -0.15 0.00 -0.52 0.00 0.00 55.73 54.58 3m4w s ARG 252 Cb -0.14 -3.44 -0.04 0.00 0.52 0.00 0.00 34.95 31.84 3m4w s ARG 252 CO -0.02 -0.27 0.33 -1.17 0.02 0.00 0.00 175.30 174.19 3m4w s LEU 253 N 1.63 4.20 0.30 2.53 2.96 -0.10 -0.04 118.68 130.16 3m4w s LEU 253 Ca 0.06 0.49 0.10 0.00 -0.22 0.00 0.00 54.13 54.56 3m4w s LEU 253 Cb -0.16 -2.42 -0.05 0.00 0.50 0.00 0.00 46.19 44.06 3m4w s LEU 253 CO 0.05 0.03 -0.07 -0.31 -1.32 0.00 0.00 176.35 174.73 3m4w s TYR 254 N 0.83 2.50 -0.22 5.38 2.02 0.99 -0.94 117.35 127.90 3m4w s TYR 254 Ca 0.17 -0.34 -0.27 0.00 -0.37 0.00 0.00 57.07 56.26 3m4w s TYR 254 Cb -0.14 -1.23 0.11 0.00 -0.40 0.00 0.00 41.96 40.29 3m4w s TYR 254 CO 0.06 0.60 0.91 0.45 -1.57 0.00 0.00 175.55 176.00 3m4w s SER 255 N -3.63 -0.53 -0.12 2.29 0.15 -0.90 -1.59 113.70 109.38 3m4w s SER 255 Ca 0.32 0.88 0.15 0.00 0.70 0.00 0.00 55.95 58.00 3m4w s SER 255 Cb -0.03 0.85 0.44 0.00 -1.71 0.00 0.00 66.02 65.56 3m4w s SER 255 CO 0.18 -0.27 1.35 -0.90 1.20 0.00 0.00 173.24 174.80 3m4w n ASP 256 N 1.85 3.48 0.00 5.45 3.85 -0.52 -1.98 116.55 128.67 3m4w n ASP 256 Ca -0.13 -2.69 0.00 0.00 -0.71 0.00 0.00 54.79 51.26 3m4w n ASP 256 Cb 0.56 -0.43 0.00 0.00 -1.35 0.00 0.00 41.12 39.90 3m4w n ASP 256 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3m4w n GLY 257 N -0.25 3.28 0.92 6.12 0.00 -1.26 -4.77 105.19 109.23 3m4w n GLY 257 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.17 3m4w n GLY 257 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3m4w n LEU 258 N 0.00 0.54 -4.71 0.99 7.94 -1.26 -4.63 117.00 115.86 3m4w n LEU 258 Ca 0.00 0.08 -0.24 0.00 -1.11 0.00 0.00 56.01 54.74 3m4w n LEU 258 Cb 0.00 -0.18 -0.06 0.00 0.53 0.00 0.00 43.42 43.70 3m4w n LEU 258 CO 0.00 -0.19 -0.28 -0.36 -1.11 0.00 0.00 177.39 175.45 3m4w s PHE 259 N -2.07 2.88 0.08 1.96 0.08 -1.26 -4.83 117.98 114.82 3m4w s PHE 259 Ca -0.04 -0.15 -0.02 0.00 0.12 0.00 0.00 56.93 56.84 3m4w s PHE 259 Cb 0.01 -1.33 -0.04 0.00 -0.57 0.00 0.00 43.02 41.10 3m4w s PHE 259 CO 0.05 0.56 0.03 -1.54 -0.10 0.00 0.00 175.22 174.21 3m4w s SER 260 N -3.44 0.38 -0.11 1.36 1.04 -1.26 -1.44 113.70 110.22 3m4w s SER 260 Ca 0.30 -1.02 -0.30 0.00 0.48 0.00 0.00 55.95 55.41 3m4w s SER 260 Cb -0.08 0.25 0.11 0.00 0.10 0.00 0.00 66.02 66.40 3m4w s SER 260 CO 0.21 -0.66 0.92 0.72 0.98 0.00 0.00 173.24 175.41 3m4w s PHE 261 N -3.95 -0.42 -0.10 5.02 -0.12 -0.62 -2.24 117.98 115.55 3m4w s PHE 261 Ca 0.12 0.66 -0.02 0.00 -0.05 0.00 0.00 56.93 57.64 3m4w s PHE 261 Cb 0.07 0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 42.89 3m4w s PHE 261 CO -0.06 -0.43 -0.02 -1.54 -0.05 0.00 0.00 175.22 173.12 3m4w s SER 262 N -1.36 5.07 -0.53 1.98 1.04 0.43 -0.01 113.70 120.32 3m4w s SER 262 Ca -0.02 0.07 -0.09 0.00 0.48 0.00 0.00 55.95 56.38 3m4w s SER 262 Cb -0.00 -1.49 0.14 0.00 0.10 0.00 0.00 66.02 64.76 3m4w s SER 262 CO 0.01 0.33 0.41 -0.69 0.98 0.00 0.00 173.24 174.29 3m4w s VAL 263 N -0.61 4.37 -0.16 5.02 1.01 0.95 -1.70 120.40 129.28 3m4w s VAL 263 Ca 0.10 -1.96 -0.14 0.00 0.00 0.00 0.00 61.98 59.98 3m4w s VAL 263 Cb -0.12 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 3m4w s VAL 263 CO 0.02 -0.82 0.29 0.20 0.00 0.00 0.00 175.10 174.79 3m4w s ASN 264 N 2.48 6.44 -0.14 3.32 0.01 0.75 -2.18 114.94 125.63 3m4w s ASN 264 Ca 0.08 0.51 -0.01 0.00 -0.71 0.00 0.00 52.86 52.73 3m4w s ASN 264 Cb -0.24 -2.18 0.04 0.00 0.41 0.00 0.00 41.25 39.28 3m4w s ASN 264 CO -0.02 0.12 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.97 3m4w s VAL 265 N 0.37 0.83 0.20 1.60 1.01 -0.86 -0.17 120.40 123.38 3m4w s VAL 265 Ca 0.16 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.77 3m4w s VAL 265 Cb -0.13 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.17 3m4w s VAL 265 CO 0.04 0.14 0.02 0.54 0.00 0.00 0.00 175.10 175.84 3m4w s ASN 266 N 1.76 1.32 0.28 3.32 4.22 -0.99 -3.07 114.94 121.78 3m4w s ASN 266 Ca 0.02 -1.23 -0.29 0.00 -2.14 0.00 0.00 52.86 49.22 3m4w s ASN 266 Cb -0.14 0.11 -0.10 0.00 1.28 0.00 0.00 41.25 42.39 3m4w s ASN 266 CO -0.07 -0.59 1.31 -0.13 -2.04 0.00 0.00 177.10 175.57 3m4w s ARG 267 N -3.93 4.38 0.32 3.55 1.81 -1.26 0.55 118.95 124.35 3m4w s ARG 267 Ca 0.28 2.15 -0.28 0.00 -1.72 0.00 0.00 55.73 56.16 3m4w s ARG 267 Cb 0.06 -3.12 -0.09 0.00 -0.45 0.00 0.00 34.95 31.35 3m4w s ARG 267 CO 0.07 -0.20 1.09 0.00 -0.68 0.00 0.00 175.30 175.57 3m4w s ALA 268 N -0.67 3.31 0.60 2.13 0.00 -1.14 -4.57 121.76 121.42 3m4w s ALA 268 Ca 0.52 0.85 -0.05 0.00 0.00 0.00 0.00 51.96 53.28 3m4w s ALA 268 Cb -0.39 -3.31 0.02 0.00 0.00 0.00 0.00 23.12 19.44 3m4w s ALA 268 CO 0.47 -0.18 0.89 0.95 0.00 0.00 0.00 175.76 177.89 3m4w s THR 269 N -1.30 3.35 -1.25 0.00 -4.23 -1.26 -4.94 115.64 106.02 3m4w s THR 269 Ca 0.48 -0.14 0.13 0.00 -1.18 0.00 0.00 61.69 60.98 3m4w s THR 269 Cb -0.29 -3.34 0.17 0.00 1.34 0.00 0.00 72.50 70.39 3m4w s THR 269 CO 0.37 -0.33 1.36 -2.65 -0.54 0.00 0.00 174.62 172.83 3m4w n PRO 270 N -2.58 0.11 0.00 3.99 -0.02 -1.26 -3.30 135.00 131.93 3m4w n PRO 270 Ca 0.05 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3m4w n PRO 270 Cb 0.58 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 3m4w n PRO 270 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3m4w n SER 271 N -1.38 0.87 -4.77 2.55 3.41 -1.26 -5.05 113.62 108.00 3m4w n SER 271 Ca 0.05 -0.94 -0.40 0.00 -0.26 0.00 0.00 58.87 57.32 3m4w n SER 271 Cb 0.12 0.17 -0.01 0.00 -0.26 0.00 0.00 64.21 64.24 3m4w n SER 271 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3m4w s SER 272 N -0.23 6.49 0.30 4.04 1.04 -1.21 -5.03 113.70 119.10 3m4w s SER 272 Ca 0.01 2.69 0.11 0.00 0.48 0.00 0.00 55.95 59.24 3m4w s SER 272 Cb 0.01 -2.64 -0.05 0.00 0.10 0.00 0.00 66.02 63.43 3m4w s SER 272 CO 0.01 -0.73 -0.17 0.42 0.98 0.00 0.00 173.24 173.75 3m4w s THR 273 N -1.21 2.42 0.30 2.02 -4.23 -1.26 -4.95 115.64 108.73 3m4w s THR 273 Ca 0.54 -2.35 -0.29 0.00 -1.18 0.00 0.00 61.69 58.41 3m4w s THR 273 Cb -0.39 -2.40 -0.09 0.00 1.34 0.00 0.00 72.50 70.96 3m4w s THR 273 CO 0.51 -0.34 1.11 -1.81 -0.54 0.00 0.00 174.62 173.54 3m4w s ASP 274 N -3.54 7.14 0.23 3.99 1.11 -1.26 -4.82 116.67 119.52 3m4w s ASP 274 Ca 0.31 2.27 -0.21 0.00 0.18 0.00 0.00 52.55 55.10 3m4w s ASP 274 Cb -0.03 -2.62 0.04 0.00 1.07 0.00 0.00 42.92 41.37 3m4w s ASP 274 CO 0.15 -0.23 0.64 0.00 1.18 0.00 0.00 175.17 176.91 3m4w s GLN 275 N -1.63 1.55 -0.23 8.23 -2.07 -0.28 -4.96 119.66 120.28 3m4w s GLN 275 Ca 0.47 -0.81 -0.08 0.00 -1.82 0.00 0.00 55.36 53.12 3m4w s GLN 275 Cb -0.31 0.58 0.10 0.00 -1.09 0.00 0.00 33.01 32.29 3m4w s GLN 275 CO 0.40 -0.69 0.49 1.41 -1.32 0.00 0.00 175.29 175.57 3m4w s MET 276 N -3.86 0.40 0.16 9.60 1.75 -1.25 -0.14 119.30 125.96 3m4w s MET 276 Ca 0.08 1.15 0.00 0.00 -1.25 0.00 0.00 55.69 55.67 3m4w s MET 276 Cb -0.03 0.48 -0.04 0.00 2.84 0.00 0.00 34.83 38.07 3m4w s MET 276 CO -0.01 -0.23 0.05 -0.48 -0.65 0.00 0.00 175.02 173.69 3m4w s LEU 277 N 2.67 1.83 0.02 4.11 2.34 -0.70 -5.01 118.68 123.95 3m4w s LEU 277 Ca -0.03 -1.23 0.03 0.00 0.06 0.00 0.00 54.13 52.96 3m4w s LEU 277 Cb -0.12 0.16 -0.02 0.00 -0.56 0.00 0.00 46.19 45.65 3m4w s LEU 277 CO -0.15 -0.68 -0.09 -0.60 -1.06 0.00 0.00 176.35 173.77 3m4w s ARG 278 N -4.01 0.63 -0.41 1.48 3.52 -1.26 -2.49 118.95 116.41 3m4w s ARG 278 Ca 0.26 -0.56 0.10 0.00 -0.13 0.00 0.00 55.73 55.40 3m4w s ARG 278 Cb 0.07 -0.54 0.30 0.00 -1.56 0.00 0.00 34.95 33.22 3m4w s ARG 278 CO 0.04 0.13 0.66 2.41 -0.81 0.00 0.00 175.30 177.74 3m4w n THR 279 N 2.11 0.01 0.00 4.11 -1.04 -0.73 -5.04 114.28 113.70 3m4w n THR 279 Ca -0.18 -4.47 0.00 0.00 -2.04 0.00 0.00 64.05 57.36 3m4w n THR 279 Cb 0.56 -1.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.95 3m4w n THR 279 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3m4w n GLY 280 N 0.72 1.52 0.13 3.41 0.00 -1.26 -2.82 105.19 106.88 3m4w n GLY 280 Ca 0.24 0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.37 3m4w n GLY 280 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3m4w h ARG 281 N 0.00 0.00 -5.80 1.61 0.11 -1.95 -3.46 114.38 104.89 3m4w h ARG 281 Ca 0.00 0.00 -0.58 0.00 0.10 0.00 0.00 59.98 59.50 3m4w h ARG 281 Cb 0.00 0.00 -0.08 0.00 1.11 0.00 0.00 29.97 31.00 3m4w h ARG 281 CO 0.00 0.18 0.14 1.03 0.10 0.00 0.00 179.97 181.42 3m4w s ARG 282 N -3.13 4.29 -0.00 0.08 0.52 -1.13 -4.07 118.95 115.51 3m4w s ARG 282 Ca 0.01 0.74 0.03 0.00 -0.52 0.00 0.00 55.73 55.99 3m4w s ARG 282 Cb 0.08 -3.54 -0.03 0.00 0.52 0.00 0.00 34.95 31.98 3m4w s ARG 282 CO 0.77 -0.16 -0.08 0.99 0.02 0.00 0.00 175.30 176.85 3m4w s THR 283 N 1.60 3.54 -0.19 0.02 2.01 0.11 -1.78 115.64 120.96 3m4w s THR 283 Ca 0.32 -0.77 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 3m4w s THR 283 Cb -0.16 -2.52 0.05 0.00 0.01 0.00 0.00 72.50 69.88 3m4w s THR 283 CO 0.12 0.43 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.78 3m4w s VAL 284 N -0.95 0.94 -0.18 3.82 1.01 -1.04 -1.52 120.40 122.48 3m4w s VAL 284 Ca 0.16 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.44 3m4w s VAL 284 Cb -0.11 -1.27 0.02 0.00 0.00 0.00 0.00 36.38 35.02 3m4w s VAL 284 CO 0.06 -0.06 -0.19 -0.55 0.00 0.00 0.00 175.10 174.36 3m4w s SER 285 N 1.68 3.08 -0.27 3.32 0.15 -0.31 -1.71 113.70 119.64 3m4w s SER 285 Ca -0.01 -0.63 -0.04 0.00 0.70 0.00 0.00 55.95 55.96 3m4w s SER 285 Cb -0.17 -1.44 0.02 0.00 -1.71 0.00 0.00 66.02 62.72 3m4w s SER 285 CO -0.07 -0.01 0.01 -0.89 1.20 0.00 0.00 173.24 173.48 3m4w s THR 286 N 1.31 3.40 -0.04 6.45 2.01 0.81 -0.44 115.64 129.14 3m4w s THR 286 Ca 0.05 -0.88 0.02 0.00 0.31 0.00 0.00 61.69 61.18 3m4w s THR 286 Cb -0.13 -2.75 -0.03 0.00 0.01 0.00 0.00 72.50 69.60 3m4w s THR 286 CO -0.13 0.13 -0.06 -0.44 -0.69 0.00 0.00 174.62 173.44 3m4w s SER 287 N 1.40 4.73 -0.16 3.53 0.01 0.11 -1.13 113.70 122.19 3m4w s SER 287 Ca 0.01 -0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.22 3m4w s SER 287 Cb -0.17 -1.17 0.00 0.00 0.21 0.00 0.00 66.02 64.89 3m4w s SER 287 CO -0.01 0.33 -0.16 -0.69 0.41 0.00 0.00 173.24 173.12 3m4w s VAL 288 N -0.91 2.58 -0.16 3.43 1.01 -1.26 -0.19 120.40 124.90 3m4w s VAL 288 Ca 0.15 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.03 3m4w s VAL 288 Cb -0.11 -2.09 0.13 0.00 0.00 0.00 0.00 36.38 34.31 3m4w s VAL 288 CO 0.05 0.51 1.03 0.00 0.00 0.00 0.00 175.10 176.69 3m4w s ARG 289 N 0.92 0.55 -1.30 2.72 1.70 -0.77 -4.96 118.95 117.82 3m4w s ARG 289 Ca -0.03 0.08 -0.10 0.00 -0.47 0.00 0.00 55.73 55.21 3m4w s ARG 289 Cb -0.15 0.26 0.07 0.00 -0.57 0.00 0.00 34.95 34.57 3m4w s ARG 289 CO -0.02 -0.18 0.50 -0.25 -1.08 0.00 0.00 175.30 174.26 3m4w n ASP 290 N 0.58 -3.70 -2.03 -2.89 8.00 -1.26 -0.24 116.55 115.02 3m4w n ASP 290 Ca -0.09 -0.41 -0.15 0.00 0.71 0.00 0.00 54.79 54.86 3m4w n ASP 290 Cb 0.58 -3.06 0.02 0.00 -0.02 0.00 0.00 41.12 38.64 3m4w n ASP 290 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3m4w n ASN 291 N -2.30 -4.57 -4.05 -2.24 4.05 -1.26 -5.03 115.26 99.86 3m4w n ASN 291 Ca -0.01 -0.17 -0.17 0.00 0.45 0.00 0.00 54.58 54.68 3m4w n ASN 291 Cb 0.54 -3.47 -0.13 0.00 1.23 0.00 0.00 39.78 37.95 3m4w n ASN 291 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3m4w s ALA 292 N -2.93 0.73 -0.48 5.20 0.00 0.66 -2.88 121.76 122.06 3m4w s ALA 292 Ca 0.18 -0.57 -0.14 0.00 0.00 0.00 0.00 51.96 51.43 3m4w s ALA 292 Cb -0.08 -0.10 0.10 0.00 0.00 0.00 0.00 23.12 23.04 3m4w s ALA 292 CO 0.22 0.11 0.40 -2.00 0.00 0.00 0.00 175.76 174.49 3m4w s GLU 293 N -0.84 2.87 -0.45 0.00 2.12 0.19 -1.85 118.70 120.74 3m4w s GLU 293 Ca -0.01 -1.52 -0.18 0.00 0.36 0.00 0.00 54.97 53.62 3m4w s GLU 293 Cb -0.06 -4.10 0.04 0.00 0.26 0.00 0.00 34.13 30.26 3m4w s GLU 293 CO 0.00 -1.12 0.49 0.42 -0.54 0.00 0.00 175.26 174.52 3m4w s ILE 294 N 1.57 5.04 -0.14 -3.70 1.01 0.73 -2.36 121.20 123.34 3m4w s ILE 294 Ca 0.04 -0.48 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 3m4w s ILE 294 Cb -0.26 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.05 3m4w s ILE 294 CO 0.04 -0.57 -0.05 -0.89 0.00 0.00 0.00 174.94 173.48 3m4w s THR 295 N 2.24 3.83 -0.17 2.92 2.01 0.76 0.06 115.64 127.29 3m4w s THR 295 Ca 0.12 -0.39 0.01 0.00 0.31 0.00 0.00 61.69 61.74 3m4w s THR 295 Cb -0.19 -2.66 0.01 0.00 0.01 0.00 0.00 72.50 69.67 3m4w s THR 295 CO 0.12 0.51 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.76 3m4w s ILE 296 N 0.19 2.35 -0.06 1.82 1.01 0.42 -0.18 121.20 126.75 3m4w s ILE 296 Ca -0.02 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 59.80 3m4w s ILE 296 Cb -0.14 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.35 3m4w s ILE 296 CO 0.03 0.52 -0.18 -0.69 0.00 0.00 0.00 174.94 174.62 3m4w s VAL 297 N 1.09 1.54 -5.00 2.92 1.01 -0.69 -1.16 120.40 120.12 3m4w s VAL 297 Ca -0.00 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3m4w s VAL 297 Cb -0.14 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 34.90 3m4w s VAL 297 CO -0.06 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.09 3m4w n GLY 298 N 3.36 0.44 2.44 4.51 0.00 -0.58 -0.43 105.19 114.93 3m4w n GLY 298 Ca -0.19 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 43.72 3m4w n GLY 298 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m4w n GLU 299 N 0.00 3.77 -4.38 1.61 1.02 -0.95 0.07 120.64 121.78 3m4w n GLU 299 Ca 0.00 -2.60 -0.19 0.00 -0.02 0.00 0.00 57.16 54.34 3m4w n GLU 299 Cb 0.00 -2.84 -0.15 0.00 -0.02 0.00 0.00 31.44 28.43 3m4w n GLU 299 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3m4w s LEU 300 N -0.04 1.95 0.33 -4.62 1.43 -1.26 -4.74 118.68 111.72 3m4w s LEU 300 Ca 0.61 -0.17 -0.28 0.00 -1.03 0.00 0.00 54.13 53.26 3m4w s LEU 300 Cb 0.17 -0.49 -0.12 0.00 0.03 0.00 0.00 46.19 45.77 3m4w s LEU 300 CO -0.07 0.10 1.31 -2.65 0.23 0.00 0.00 176.35 175.27 3m4w n PRO 301 N 2.98 2.12 -0.29 1.29 -0.02 -1.26 -4.56 135.00 135.26 3m4w n PRO 301 Ca -0.15 0.74 0.11 0.00 -2.02 0.00 0.00 63.50 62.19 3m4w n PRO 301 Cb 0.56 -2.33 0.26 0.00 -0.02 0.00 0.00 33.50 31.97 3m4w n PRO 301 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3m4w h PRO 302 N 2.80 0.23 0.00 0.52 0.11 -1.97 -0.07 132.00 133.62 3m4w h PRO 302 Ca -0.46 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 3m4w h PRO 302 Cb 1.28 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3m4w h PRO 302 CO 0.65 0.15 -0.13 0.37 -0.21 0.00 0.00 178.00 178.83 3m4w h GLN 303 N 0.24 0.00 0.04 1.05 4.15 -1.97 -1.71 115.11 116.91 3m4w h GLN 303 Ca 0.52 0.00 -0.23 0.00 0.77 0.00 0.00 58.65 59.71 3m4w h GLN 303 Cb 1.01 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.69 3m4w h GLN 303 CO -0.61 0.13 -1.02 1.15 -1.93 0.00 0.00 178.83 176.54 3m4w h THR 304 N 0.00 1.53 0.26 2.39 2.02 -1.32 -2.72 112.91 115.07 3m4w h THR 304 Ca -0.00 -2.88 -0.01 0.00 0.77 0.00 0.00 66.41 64.29 3m4w h THR 304 Cb 0.24 2.68 0.00 0.00 -1.74 0.00 0.00 68.15 69.33 3m4w h THR 304 CO 0.02 0.84 -0.13 0.00 0.37 0.00 0.00 175.52 176.62 3m4w h ALA 305 N 0.83 -0.35 -0.59 6.16 0.00 -0.93 -2.26 119.26 122.13 3m4w h ALA 305 Ca -0.07 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.79 3m4w h ALA 305 Cb 1.70 0.14 -0.09 0.00 0.00 0.00 0.00 17.79 19.54 3m4w h ALA 305 CO 0.16 -0.56 0.11 -0.22 0.00 0.00 0.00 179.25 178.73 3m4w h LYS 306 N -0.62 0.23 -0.54 0.00 3.64 -1.39 0.31 116.57 118.20 3m4w h LYS 306 Ca -0.04 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 3m4w h LYS 306 Cb 0.44 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.19 3m4w h LYS 306 CO 0.06 0.15 0.29 -0.09 -2.27 0.00 0.00 179.45 177.58 3m4w h ARG 307 N 0.23 0.74 -0.19 1.90 2.43 -1.43 -0.31 114.38 117.75 3m4w h ARG 307 Ca 0.31 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.32 3m4w h ARG 307 Cb 0.47 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3m4w h ARG 307 CO -0.41 0.55 -0.19 0.82 -1.51 0.00 0.00 179.97 179.23 3m4w h ILE 308 N 0.74 1.33 0.00 1.20 2.04 -0.28 -2.76 117.51 119.78 3m4w h ILE 308 Ca 0.19 -1.35 -0.02 0.00 1.00 0.00 0.00 64.86 64.68 3m4w h ILE 308 Cb 0.03 1.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.89 3m4w h ILE 308 CO -0.03 0.41 -0.08 0.00 0.00 0.00 0.00 178.15 178.45 3m4w h ALA 309 N 0.64 1.59 -0.19 1.87 0.00 0.18 -2.49 119.26 120.86 3m4w h ALA 309 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3m4w h ALA 309 Cb 0.73 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3m4w h ALA 309 CO 0.05 0.09 0.00 -0.85 0.00 0.00 0.00 179.25 178.54 3m4w n GLU 310 N -4.03 2.32 -0.24 0.00 0.28 -0.19 -4.09 120.64 114.68 3m4w n GLU 310 Ca -0.03 -2.05 0.07 0.00 -0.16 0.00 0.00 57.16 54.99 3m4w n GLU 310 Cb 0.16 -1.47 0.19 0.00 1.43 0.00 0.00 31.44 31.76 3m4w n GLU 310 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3m4w n ASN 311 N 1.37 3.23 -4.61 -1.84 3.02 -0.94 -4.92 115.26 110.57 3m4w n ASN 311 Ca 0.16 -2.10 -0.43 0.00 -0.03 0.00 0.00 54.58 52.18 3m4w n ASN 311 Cb 0.58 -0.31 -0.02 0.00 -0.61 0.00 0.00 39.78 39.43 3m4w n ASN 311 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3m4w s ILE 312 N -1.18 4.20 -0.09 2.41 1.01 -1.20 -1.21 121.20 125.14 3m4w s ILE 312 Ca 0.30 1.25 -0.23 0.00 0.00 0.00 0.00 60.65 61.97 3m4w s ILE 312 Cb 0.17 -4.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 3m4w s ILE 312 CO 0.18 -0.90 0.70 -0.75 0.00 0.00 0.00 174.94 174.17 3m4w s LYS 313 N 4.41 4.40 0.66 2.79 2.36 -0.87 -4.88 119.74 128.62 3m4w s LYS 313 Ca 0.50 0.86 -0.01 0.00 -2.55 0.00 0.00 55.97 54.76 3m4w s LYS 313 Cb -0.09 -3.47 0.09 0.00 -1.05 0.00 0.00 37.83 33.31 3m4w s LYS 313 CO 0.30 0.01 0.93 -0.06 1.55 0.00 0.00 175.35 178.07 3m4w s PHE 314 N 1.01 2.23 0.00 4.03 0.40 -1.26 -2.02 117.98 122.37 3m4w s PHE 314 Ca 0.36 -0.07 0.00 0.00 -0.60 0.00 0.00 56.93 56.63 3m4w s PHE 314 Cb -0.17 -2.97 0.00 0.00 0.51 0.00 0.00 43.02 40.39 3m4w s PHE 314 CO 0.17 -1.40 0.00 0.41 0.70 0.00 0.00 175.22 175.10