#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r4w s PRO 3 N 0.00 4.23 0.32 1.61 0.04 -1.26 -4.93 135.00 135.02 1r4w s PRO 3 Ca 0.00 2.38 -0.29 0.00 0.04 0.00 0.00 61.00 63.13 1r4w s PRO 3 Cb 0.00 -3.06 -0.12 0.00 0.04 0.00 0.00 34.50 31.36 1r4w s PRO 3 CO 0.00 -0.43 1.42 0.00 0.04 0.00 0.00 177.00 178.04 1r4w n ALA 4 N 1.65 1.77 -1.20 8.56 0.00 -1.26 -4.91 120.51 125.12 1r4w n ALA 4 Ca 0.05 0.37 -0.35 0.00 0.00 0.00 0.00 53.44 53.51 1r4w n ALA 4 Cb 0.40 -2.34 0.11 0.00 0.00 0.00 0.00 19.45 17.62 1r4w n ALA 4 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1r4w n PRO 5 N 1.15 0.30 -3.32 0.00 -0.04 -1.26 -4.97 135.00 126.86 1r4w n PRO 5 Ca 0.06 0.17 -0.38 0.00 -0.04 0.00 0.00 63.50 63.31 1r4w n PRO 5 Cb 0.36 -2.27 -0.06 0.00 -0.04 0.00 0.00 33.50 31.49 1r4w n PRO 5 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1r4w s ARG 6 N -3.67 4.23 0.06 0.54 3.00 -0.09 -4.79 118.95 118.24 1r4w s ARG 6 Ca 0.72 0.54 -0.26 0.00 0.00 0.00 0.00 55.73 56.73 1r4w s ARG 6 Cb -0.31 -3.35 -0.05 0.00 0.00 0.00 0.00 34.95 31.24 1r4w s ARG 6 CO 0.52 0.37 0.83 0.08 0.00 0.00 0.00 175.30 177.10 1r4w s VAL 7 N -0.12 4.67 -0.14 3.52 1.01 -1.26 0.25 120.40 128.34 1r4w s VAL 7 Ca 0.27 1.76 0.01 0.00 0.00 0.00 0.00 61.98 64.03 1r4w s VAL 7 Cb -0.17 -4.18 0.02 0.00 0.00 0.00 0.00 36.38 32.05 1r4w s VAL 7 CO 0.14 0.34 -0.17 -0.76 0.00 0.00 0.00 175.10 174.65 1r4w s LEU 8 N -0.01 1.86 -0.24 3.92 1.02 -0.13 -2.03 118.68 123.07 1r4w s LEU 8 Ca 0.41 -0.52 -0.08 0.00 0.02 0.00 0.00 54.13 53.95 1r4w s LEU 8 Cb -0.21 -1.26 -0.04 0.00 0.02 0.00 0.00 46.19 44.70 1r4w s LEU 8 CO 0.25 -0.00 0.10 -1.61 0.02 0.00 0.00 176.35 175.11 1r4w s GLU 9 N 1.19 3.83 -0.28 1.70 2.02 0.70 -1.21 118.70 126.65 1r4w s GLU 9 Ca -0.00 -0.39 -0.07 0.00 0.02 0.00 0.00 54.97 54.52 1r4w s GLU 9 Cb -0.14 -3.40 -0.01 0.00 0.10 0.00 0.00 34.13 30.69 1r4w s GLU 9 CO -0.07 -0.06 0.08 -1.17 0.02 0.00 0.00 175.26 174.06 1r4w s LEU 10 N 1.32 3.70 -0.18 1.80 2.96 -0.55 -0.69 118.68 127.05 1r4w s LEU 10 Ca 0.06 -0.51 -0.14 0.00 -0.22 0.00 0.00 54.13 53.32 1r4w s LEU 10 Cb -0.15 -1.90 -0.05 0.00 0.50 0.00 0.00 46.19 44.60 1r4w s LEU 10 CO 0.05 -0.13 0.29 -0.36 -1.32 0.00 0.00 176.35 174.87 1r4w s PHE 11 N 1.55 3.43 0.18 5.38 0.40 0.25 -0.45 117.98 128.72 1r4w s PHE 11 Ca 0.04 0.55 -0.11 0.00 -0.60 0.00 0.00 56.93 56.82 1r4w s PHE 11 Cb -0.16 -2.35 -0.00 0.00 0.51 0.00 0.00 43.02 41.01 1r4w s PHE 11 CO 0.03 0.19 0.35 1.52 0.70 0.00 0.00 175.22 178.01 1r4w s TYR 12 N 0.64 0.29 -0.02 0.36 1.13 -1.13 -2.72 117.35 115.90 1r4w s TYR 12 Ca 0.16 -0.65 -0.00 0.00 -1.41 0.00 0.00 57.07 55.16 1r4w s TYR 12 Cb -0.13 0.06 0.03 0.00 -1.10 0.00 0.00 41.96 40.82 1r4w s TYR 12 CO 0.04 -0.79 0.04 0.34 -2.51 0.00 0.00 175.55 172.67 1r4w s ASP 13 N -2.95 0.11 0.15 -0.18 -1.08 -1.26 -1.01 116.67 110.45 1r4w s ASP 13 Ca 0.16 0.06 0.13 0.00 -0.52 0.00 0.00 52.55 52.38 1r4w s ASP 13 Cb 0.02 -0.06 0.64 0.00 -1.46 0.00 0.00 42.92 42.06 1r4w s ASP 13 CO 0.00 -0.14 1.40 1.33 0.52 0.00 0.00 175.17 178.28 1r4w n VAL 14 N 4.25 1.37 0.26 1.11 0.24 -1.26 -1.01 118.33 123.29 1r4w n VAL 14 Ca -0.27 0.52 0.12 0.00 -2.04 0.00 0.00 64.34 62.68 1r4w n VAL 14 Cb 0.50 -1.48 0.69 0.00 -1.47 0.00 0.00 33.84 32.08 1r4w n VAL 14 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1r4w h LEU 15 N 0.00 0.00 -8.89 1.34 5.85 -1.96 -3.44 115.31 108.21 1r4w h LEU 15 Ca 0.00 0.00 -0.62 0.00 0.84 0.00 0.00 57.88 58.10 1r4w h LEU 15 Cb 0.08 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 40.99 1r4w h LEU 15 CO 0.00 0.13 0.20 -0.55 -0.34 0.00 0.00 178.44 177.89 1r4w s SER 16 N -6.19 6.53 0.25 1.25 0.15 -0.18 -4.97 113.70 110.55 1r4w s SER 16 Ca -0.03 0.48 0.04 0.00 0.70 0.00 0.00 55.95 57.15 1r4w s SER 16 Cb 0.13 -2.35 0.32 0.00 -1.71 0.00 0.00 66.02 62.41 1r4w s SER 16 CO 0.59 -0.51 1.61 1.55 1.20 0.00 0.00 173.24 177.69 1r4w h PRO 17 N 8.17 0.28 0.00 5.44 0.13 -1.87 -2.84 132.00 141.31 1r4w h PRO 17 Ca -0.26 -0.16 -0.10 0.00 -0.87 0.00 0.00 66.00 64.60 1r4w h PRO 17 Cb 1.11 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1r4w h PRO 17 CO 0.82 0.73 -0.49 1.88 -0.23 0.00 0.00 178.00 180.71 1r4w h TYR 18 N 0.22 0.00 -0.35 1.56 0.05 -1.93 -2.66 116.97 113.86 1r4w h TYR 18 Ca 0.01 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.76 1r4w h TYR 18 Cb 0.98 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.70 1r4w h TYR 18 CO 0.02 0.49 0.09 0.77 -1.05 0.00 0.00 178.16 178.48 1r4w h SER 19 N 0.00 0.46 -0.17 3.88 0.02 -1.75 -1.21 113.55 114.78 1r4w h SER 19 Ca -0.00 -0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 60.76 1r4w h SER 19 Cb 0.97 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 1r4w h SER 19 CO 0.06 0.47 -0.34 -0.25 -1.14 0.00 0.00 176.83 175.64 1r4w h TRP 20 N 0.50 0.79 -0.12 3.45 7.01 -1.28 0.20 115.95 126.50 1r4w h TRP 20 Ca 0.12 -0.21 -0.02 0.00 2.11 0.00 0.00 58.89 60.89 1r4w h TRP 20 Cb 0.19 -0.18 -0.00 0.00 -2.10 0.00 0.00 29.16 27.07 1r4w h TRP 20 CO 0.01 0.92 -0.00 -0.07 -2.79 0.00 0.00 178.44 176.51 1r4w h LEU 21 N 0.57 0.22 -0.85 0.65 3.38 -1.05 -0.16 115.31 118.08 1r4w h LEU 21 Ca 0.06 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1r4w h LEU 21 Cb 0.85 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.50 1r4w h LEU 21 CO 0.07 0.48 0.44 1.23 0.09 0.00 0.00 178.44 180.76 1r4w h GLY 22 N -0.05 1.28 0.80 0.83 0.00 -1.18 -2.14 103.07 102.62 1r4w h GLY 22 Ca 0.04 -0.60 0.02 0.00 0.00 0.00 0.00 47.33 46.78 1r4w h GLY 22 CO 0.01 0.58 0.05 -2.75 0.00 0.00 0.00 176.54 174.42 1r4w h PHE 23 N 1.19 0.09 -0.45 5.60 3.04 -0.44 -1.25 116.94 124.72 1r4w h PHE 23 Ca 0.30 0.01 -0.13 0.00 3.98 0.00 0.00 57.97 62.13 1r4w h PHE 23 Cb 0.06 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.55 1r4w h PHE 23 CO 0.01 0.04 -0.22 0.93 -2.02 0.00 0.00 178.31 177.05 1r4w h GLU 24 N 0.13 0.92 0.01 1.11 4.39 -0.73 0.22 114.58 120.63 1r4w h GLU 24 Ca 0.09 -0.38 0.02 0.00 0.34 0.00 0.00 59.36 59.42 1r4w h GLU 24 Cb 0.07 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1r4w h GLU 24 CO -0.11 1.04 -0.11 0.28 -1.16 0.00 0.00 179.01 178.95 1r4w h VAL 25 N 0.80 0.71 -0.29 3.13 2.07 -1.17 -0.98 116.25 120.52 1r4w h VAL 25 Ca 0.11 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.53 1r4w h VAL 25 Cb 0.77 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1r4w h VAL 25 CO 0.06 0.00 -0.21 -0.07 0.02 0.00 0.00 177.57 177.38 1r4w h LEU 26 N -0.20 0.53 -1.27 2.57 3.38 -1.07 -2.44 115.31 116.82 1r4w h LEU 26 Ca 0.04 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1r4w h LEU 26 Cb 0.25 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1r4w h LEU 26 CO -0.11 0.75 0.24 0.00 0.09 0.00 0.00 178.44 179.41 1r4w h ARG 28 N 0.74 0.00 0.00 0.00 3.08 -0.82 -3.26 114.38 114.12 1r4w h ARG 28 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1r4w h ARG 28 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1r4w h ARG 28 CO -0.02 0.36 -0.77 0.66 -1.07 0.00 0.00 179.97 179.12 1r4w n TYR 29 N -3.41 0.03 0.72 3.04 4.01 -0.95 -4.00 117.16 116.60 1r4w n TYR 29 Ca 0.00 0.01 0.07 0.00 -0.16 0.00 0.00 57.90 57.82 1r4w n TYR 29 Cb 0.54 -0.16 0.37 0.00 -0.31 0.00 0.00 39.34 39.78 1r4w n TYR 29 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r4w n GLN 30 N -1.55 0.26 0.00 -0.72 10.64 -0.71 -0.58 117.38 124.72 1r4w n GLN 30 Ca 0.04 0.12 0.07 0.00 -1.83 0.00 0.00 57.00 55.40 1r4w n GLN 30 Cb 0.34 -1.50 -0.06 0.00 -0.86 0.00 0.00 30.24 28.17 1r4w n GLN 30 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 1r4w n HIS 31 N -1.21 0.00 -0.04 2.61 8.25 -1.26 -4.60 115.22 118.97 1r4w n HIS 31 Ca 0.08 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.49 1r4w n HIS 31 Cb 0.10 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.17 1r4w n HIS 31 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1r4w n LEU 32 N -0.94 2.47 -4.92 2.41 4.77 -0.57 -5.06 117.00 115.16 1r4w n LEU 32 Ca 0.04 -0.03 -0.27 0.00 -0.03 0.00 0.00 56.01 55.72 1r4w n LEU 32 Cb 0.27 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.14 1r4w n LEU 32 CO 0.27 0.55 0.18 0.26 -1.33 0.00 0.00 177.39 177.32 1r4w s TRP 33 N -2.15 3.49 -1.44 -1.77 0.51 0.25 -4.97 118.94 112.86 1r4w s TRP 33 Ca -0.09 0.53 -0.12 0.00 -2.12 0.00 0.00 56.10 54.30 1r4w s TRP 33 Cb 0.03 -2.02 0.05 0.00 -0.81 0.00 0.00 33.47 30.71 1r4w s TRP 33 CO 0.19 0.16 2.27 -1.71 -0.51 0.00 0.00 176.95 177.35 1r4w n ASN 34 N -1.19 4.95 -4.50 2.95 5.15 -1.26 -4.81 115.26 116.54 1r4w n ASN 34 Ca -0.03 -2.87 -0.24 0.00 -0.60 0.00 0.00 54.58 50.85 1r4w n ASN 34 Cb 0.55 -1.60 -0.11 0.00 -0.53 0.00 0.00 39.78 38.09 1r4w n ASN 34 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1r4w s ILE 35 N 2.32 1.44 -0.22 -1.44 -4.36 -1.26 -0.91 121.20 116.77 1r4w s ILE 35 Ca 0.49 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.86 1r4w s ILE 35 Cb 0.14 -2.85 0.07 0.00 1.25 0.00 0.00 42.46 41.06 1r4w s ILE 35 CO -0.07 0.00 0.03 -0.75 0.24 0.00 0.00 174.94 174.40 1r4w s LYS 36 N -3.83 0.79 -0.10 0.37 2.47 0.14 -4.74 119.74 114.83 1r4w s LYS 36 Ca 0.36 -0.61 -0.27 0.00 -1.56 0.00 0.00 55.97 53.89 1r4w s LYS 36 Cb 0.09 -2.14 -0.02 0.00 -1.46 0.00 0.00 37.83 34.30 1r4w s LYS 36 CO 0.16 -0.70 0.89 -1.17 0.16 0.00 0.00 175.35 174.70 1r4w s LEU 37 N 1.76 4.25 -0.32 5.43 2.96 -1.26 -0.95 118.68 130.55 1r4w s LEU 37 Ca 0.00 1.38 0.03 0.00 -0.22 0.00 0.00 54.13 55.32 1r4w s LEU 37 Cb -0.17 -3.37 0.09 0.00 0.50 0.00 0.00 46.19 43.23 1r4w s LEU 37 CO -0.11 -0.35 0.01 -0.54 -1.32 0.00 0.00 176.35 174.04 1r4w s LYS 38 N 1.69 1.76 0.01 1.98 1.02 -0.35 -4.96 119.74 120.89 1r4w s LYS 38 Ca 0.44 -1.70 -0.30 0.00 0.02 0.00 0.00 55.97 54.42 1r4w s LYS 38 Cb -0.18 -3.13 -0.05 0.00 -0.52 0.00 0.00 37.83 33.95 1r4w s LYS 38 CO 0.18 -0.83 1.24 -0.51 -0.92 0.00 0.00 175.35 174.51 1r4w s LEU 39 N 0.98 4.33 -0.46 3.17 1.43 -1.26 -1.48 118.68 125.39 1r4w s LEU 39 Ca 0.04 1.97 0.03 0.00 -1.03 0.00 0.00 54.13 55.15 1r4w s LEU 39 Cb -0.19 -3.57 0.12 0.00 0.03 0.00 0.00 46.19 42.58 1r4w s LEU 39 CO -0.07 -0.55 0.20 -0.13 0.23 0.00 0.00 176.35 176.03 1r4w s ARG 40 N 1.67 1.85 0.14 1.70 1.81 0.41 -4.91 118.95 121.62 1r4w s ARG 40 Ca 0.59 -2.36 -0.31 0.00 -1.72 0.00 0.00 55.73 51.93 1r4w s ARG 40 Cb -0.28 -3.32 -0.10 0.00 -0.45 0.00 0.00 34.95 30.80 1r4w s ARG 40 CO 0.26 -1.06 1.75 -2.14 -0.68 0.00 0.00 175.30 173.43 1r4w s PRO 41 N 0.15 4.15 0.25 3.54 0.02 -1.26 -2.85 135.00 139.00 1r4w s PRO 41 Ca 0.15 2.53 0.03 0.00 0.02 0.00 0.00 61.00 63.72 1r4w s PRO 41 Cb -0.23 -3.44 -0.05 0.00 0.02 0.00 0.00 34.50 30.79 1r4w s PRO 41 CO -0.03 -0.78 0.04 0.00 -0.33 0.00 0.00 177.00 175.90 1r4w s ALA 42 N 2.23 1.82 -0.29 -1.55 0.00 -0.18 -4.59 121.76 119.20 1r4w s ALA 42 Ca 0.77 -1.83 -0.06 0.00 0.00 0.00 0.00 51.96 50.84 1r4w s ALA 42 Cb -0.45 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.40 1r4w s ALA 42 CO 0.34 -0.34 0.06 -1.17 0.00 0.00 0.00 175.76 174.65 1r4w s LEU 43 N -3.32 3.72 0.19 0.00 0.20 -1.26 -4.11 118.68 114.09 1r4w s LEU 43 Ca 0.33 -0.72 -0.16 0.00 0.69 0.00 0.00 54.13 54.27 1r4w s LEU 43 Cb 0.07 -1.85 0.17 0.00 -0.43 0.00 0.00 46.19 44.16 1r4w s LEU 43 CO 0.11 -0.17 1.63 0.25 -0.29 0.00 0.00 176.35 177.87 1r4w h LEU 44 N 8.20 -0.65 -0.75 -0.68 5.85 -1.94 0.52 115.31 125.86 1r4w h LEU 44 Ca -0.32 0.18 0.14 0.00 0.84 0.00 0.00 57.88 58.72 1r4w h LEU 44 Cb 1.13 0.39 -0.10 0.00 0.37 0.00 0.00 40.66 42.45 1r4w h LEU 44 CO 0.60 -0.22 0.29 0.00 -0.34 0.00 0.00 178.44 178.77 1r4w h ALA 45 N 1.41 1.04 -0.70 1.25 0.00 -1.98 0.60 119.26 120.88 1r4w h ALA 45 Ca 0.26 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 1r4w h ALA 45 Cb 0.45 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1r4w h ALA 45 CO -0.58 -0.23 0.33 0.78 0.00 0.00 0.00 179.25 179.55 1r4w h GLY 46 N 0.42 1.08 1.30 0.00 0.00 -1.39 -0.96 103.07 103.52 1r4w h GLY 46 Ca 0.41 -0.54 -0.08 0.00 0.00 0.00 0.00 47.33 47.12 1r4w h GLY 46 CO -0.41 0.51 -0.01 -2.22 0.00 0.00 0.00 176.54 174.41 1r4w h ILE 47 N 0.97 1.25 -0.16 2.60 1.08 0.13 0.16 117.51 123.55 1r4w h ILE 47 Ca 0.24 -1.06 -0.04 0.00 -0.39 0.00 0.00 64.86 63.61 1r4w h ILE 47 Cb 0.12 0.88 -0.01 0.00 -3.07 0.00 0.00 36.82 34.75 1r4w h ILE 47 CO -0.03 0.37 -0.10 0.24 -0.69 0.00 0.00 178.15 177.94 1r4w h MET 48 N 0.78 0.24 0.00 2.37 2.86 0.28 -3.10 114.93 118.36 1r4w h MET 48 Ca 0.15 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.60 1r4w h MET 48 Cb 0.49 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 1r4w h MET 48 CO 0.02 0.35 -0.78 -0.22 1.06 0.00 0.00 176.91 177.35 1r4w h LYS 49 N 0.23 0.00 -1.01 1.72 3.64 -0.71 0.27 116.57 120.71 1r4w h LYS 49 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1r4w h LYS 49 Cb 0.33 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1r4w h LYS 49 CO 0.02 0.85 0.00 -0.25 -2.27 0.00 0.00 179.45 177.80 1r4w n ASP 50 N -4.52 1.53 0.00 4.20 8.00 0.53 -2.41 116.55 123.87 1r4w n ASP 50 Ca -0.22 -1.50 0.00 0.00 0.71 0.00 0.00 54.79 53.78 1r4w n ASP 50 Cb 0.55 -0.37 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 1r4w n ASP 50 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1r4w n SER 51 N 0.39 0.00 -2.35 -2.24 3.41 -1.17 -4.92 113.62 106.73 1r4w n SER 51 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 1r4w n SER 51 Cb 0.28 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.28 1r4w n SER 51 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1r4w n GLY 52 N 0.00 0.03 3.18 5.00 0.00 -0.85 -5.02 105.19 107.53 1r4w n GLY 52 Ca 0.00 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 1r4w n GLY 52 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1r4w s ASN 53 N -3.48 4.13 0.76 1.61 2.47 0.02 -5.03 114.94 115.42 1r4w s ASN 53 Ca 0.17 -0.88 -0.11 0.00 0.42 0.00 0.00 52.86 52.47 1r4w s ASN 53 Cb -0.08 -1.62 0.05 0.00 -1.45 0.00 0.00 41.25 38.15 1r4w s ASN 53 CO 0.42 -0.11 1.08 -1.10 -3.72 0.00 0.00 177.10 173.68 1r4w s GLN 54 N 1.30 2.41 0.31 0.43 -1.52 -1.26 -4.63 119.66 116.69 1r4w s GLN 54 Ca 0.00 0.74 -0.29 0.00 -1.95 0.00 0.00 55.36 53.85 1r4w s GLN 54 Cb -0.16 -1.95 -0.12 0.00 -0.22 0.00 0.00 33.01 30.56 1r4w s GLN 54 CO -0.06 -1.42 1.45 -0.35 -0.25 0.00 0.00 175.29 174.66 1r4w n PRO 55 N -3.31 2.39 0.11 2.91 -0.04 -1.26 -4.88 135.00 130.92 1r4w n PRO 55 Ca 0.07 0.84 0.09 0.00 -0.04 0.00 0.00 63.50 64.47 1r4w n PRO 55 Cb 0.55 -2.53 0.44 0.00 -0.04 0.00 0.00 33.50 31.92 1r4w n PRO 55 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1r4w n PRO 56 N 1.34 0.12 0.01 0.54 -0.04 -1.26 -2.44 135.00 133.27 1r4w n PRO 56 Ca 0.07 0.49 0.11 0.00 -0.04 0.00 0.00 63.50 64.13 1r4w n PRO 56 Cb 0.36 -1.81 0.49 0.00 -0.04 0.00 0.00 33.50 32.50 1r4w n PRO 56 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r4w n ALA 57 N -1.70 2.05 0.01 0.55 0.00 -1.26 -3.67 120.51 116.49 1r4w n ALA 57 Ca 0.01 -0.07 0.18 0.00 0.00 0.00 0.00 53.44 53.56 1r4w n ALA 57 Cb 0.12 -1.37 0.66 0.00 0.00 0.00 0.00 19.45 18.86 1r4w n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r4w h MET 58 N 0.00 0.05 -5.43 0.00 -0.00 -1.86 -3.34 114.93 104.34 1r4w h MET 58 Ca 0.00 -0.00 -0.64 0.00 -0.00 0.00 0.00 59.70 59.06 1r4w h MET 58 Cb 0.41 -0.01 -0.15 0.00 -0.00 0.00 0.00 31.60 31.85 1r4w h MET 58 CO 0.00 0.03 0.40 0.08 -0.00 0.00 0.00 176.91 177.43 1r4w s VAL 59 N -5.07 4.51 0.11 -0.10 1.01 -1.24 -4.97 120.40 114.65 1r4w s VAL 59 Ca -0.05 -0.20 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 1r4w s VAL 59 Cb 0.19 -4.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.00 1r4w s VAL 59 CO 0.73 -1.15 1.12 -0.81 0.00 0.00 0.00 175.10 174.98 1r4w n PRO 60 N 7.16 -0.30 0.02 2.72 -0.04 -1.25 0.40 135.00 143.70 1r4w n PRO 60 Ca -0.03 1.09 0.19 0.00 -0.04 0.00 0.00 63.50 64.72 1r4w n PRO 60 Cb 0.46 -1.61 0.69 0.00 -0.04 0.00 0.00 33.50 33.00 1r4w n PRO 60 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1r4w h HIS 61 N 0.00 0.00 0.04 0.54 3.86 -1.93 -2.50 115.15 115.15 1r4w h HIS 61 Ca 0.11 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.17 1r4w h HIS 61 Cb 0.28 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.76 1r4w h HIS 61 CO -0.76 0.00 -0.59 -0.22 0.86 0.00 0.00 177.93 177.21 1r4w h LYS 62 N 0.00 0.34 -0.88 2.45 3.64 -0.37 -2.89 116.57 118.85 1r4w h LYS 62 Ca 0.23 -0.41 0.01 0.00 -1.27 0.00 0.00 60.65 59.21 1r4w h LYS 62 Cb 0.94 0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.84 1r4w h LYS 62 CO -0.00 1.11 0.58 0.78 -2.27 0.00 0.00 179.45 179.65 1r4w h GLY 63 N -0.25 1.24 1.12 5.01 0.00 -0.91 -1.35 103.07 107.93 1r4w h GLY 63 Ca -0.08 -0.46 0.04 0.00 0.00 0.00 0.00 47.33 46.82 1r4w h GLY 63 CO 0.11 0.44 0.51 1.46 0.00 0.00 0.00 176.54 179.06 1r4w h GLN 64 N 1.18 0.90 -0.55 4.80 4.20 -1.59 -1.90 115.11 122.15 1r4w h GLN 64 Ca 0.33 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.95 1r4w h GLN 64 Cb -0.12 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.43 1r4w h GLN 64 CO -0.08 0.60 0.21 -0.92 -0.67 0.00 0.00 178.83 177.97 1r4w h TYR 65 N 0.93 0.86 -0.10 2.96 3.20 -1.05 -2.24 116.97 121.54 1r4w h TYR 65 Ca 0.31 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 62.12 1r4w h TYR 65 Cb 0.07 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.07 1r4w h TYR 65 CO -0.00 0.71 0.02 0.82 -1.64 0.00 0.00 178.16 178.06 1r4w h ILE 66 N 0.76 0.95 0.00 1.81 1.08 -0.68 0.38 117.51 121.81 1r4w h ILE 66 Ca 0.18 -0.02 -0.06 0.00 -0.39 0.00 0.00 64.86 64.58 1r4w h ILE 66 Cb 0.23 0.89 -0.01 0.00 -3.07 0.00 0.00 36.82 34.86 1r4w h ILE 66 CO -0.01 0.01 -0.27 -0.07 -0.69 0.00 0.00 178.15 177.12 1r4w h LEU 67 N 0.06 0.00 0.04 1.44 3.38 -1.38 -1.62 115.31 117.22 1r4w h LEU 67 Ca 0.04 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.77 1r4w h LEU 67 Cb 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1r4w h LEU 67 CO -0.06 0.27 -1.17 0.11 0.09 0.00 0.00 178.44 177.68 1r4w h LYS 68 N 0.00 0.08 -0.11 1.13 1.57 -1.08 -3.37 116.57 114.79 1r4w h LYS 68 Ca -0.00 -0.13 -0.19 0.00 -1.87 0.00 0.00 60.65 58.45 1r4w h LYS 68 Cb 0.59 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.95 1r4w h LYS 68 CO 0.03 1.00 -0.73 1.49 -0.57 0.00 0.00 179.45 180.68 1r4w h GLU 69 N 0.02 0.55 -0.57 3.15 4.81 -0.52 -3.35 114.58 118.66 1r4w h GLU 69 Ca -0.08 -0.44 0.09 0.00 -0.13 0.00 0.00 59.36 58.80 1r4w h GLU 69 Cb 1.86 0.09 -0.07 0.00 0.63 0.00 0.00 28.75 31.25 1r4w h GLU 69 CO 0.14 1.06 0.17 0.82 -0.73 0.00 0.00 179.01 180.48 1r4w h ILE 70 N 0.38 0.73 0.00 2.32 1.08 -1.46 -0.34 117.51 120.22 1r4w h ILE 70 Ca -0.03 -0.11 -0.02 0.00 -0.39 0.00 0.00 64.86 64.31 1r4w h ILE 70 Cb 1.32 0.37 -0.00 0.00 -3.07 0.00 0.00 36.82 35.44 1r4w h ILE 70 CO 0.13 0.06 -0.07 -0.65 -0.69 0.00 0.00 178.15 176.93 1r4w h PRO 71 N 0.33 0.00 0.19 2.37 0.11 -1.77 0.17 132.00 133.40 1r4w h PRO 71 Ca 0.29 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 66.05 1r4w h PRO 71 Cb 0.38 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.50 1r4w h PRO 71 CO -0.33 0.07 -1.76 -0.07 -0.21 0.00 0.00 178.00 175.70 1r4w h LEU 72 N 0.00 0.61 -1.00 2.35 3.38 -1.42 -3.32 115.31 115.91 1r4w h LEU 72 Ca -0.00 -0.93 -0.10 0.00 0.09 0.00 0.00 57.88 56.94 1r4w h LEU 72 Cb 0.13 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1r4w h LEU 72 CO 0.01 1.79 -0.39 -0.07 0.09 0.00 0.00 178.44 179.86 1r4w h LEU 73 N 0.11 0.22 -1.39 1.67 3.38 -0.85 -2.86 115.31 115.59 1r4w h LEU 73 Ca -0.35 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 1r4w h LEU 73 Cb 2.10 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.78 1r4w h LEU 73 CO 0.18 0.60 -0.14 0.07 0.09 0.00 0.00 178.44 179.23 1r4w h LYS 74 N 0.18 0.24 0.03 1.13 2.10 -1.10 0.80 116.57 119.94 1r4w h LYS 74 Ca 0.02 -0.06 -0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1r4w h LYS 74 Cb 0.78 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.08 1r4w h LYS 74 CO 0.06 0.38 -0.01 1.96 -2.00 0.00 0.00 179.45 179.84 1r4w h GLN 75 N 0.22 -0.04 -0.29 0.07 4.20 -1.61 0.18 115.11 117.85 1r4w h GLN 75 Ca 0.04 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.83 1r4w h GLN 75 Cb 0.39 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.10 1r4w h GLN 75 CO 0.02 0.58 -0.24 1.25 -0.67 0.00 0.00 178.83 179.78 1r4w h LEU 76 N -0.71 -0.78 -0.14 1.46 6.46 -1.33 -2.25 115.31 118.02 1r4w h LEU 76 Ca -0.00 0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1r4w h LEU 76 Cb 0.64 0.38 0.00 0.00 -0.73 0.00 0.00 40.66 40.95 1r4w h LEU 76 CO 0.01 -0.27 0.00 -0.26 -0.62 0.00 0.00 178.44 177.30 1r4w h PHE 77 N -0.22 0.00 -5.20 1.25 -1.00 -0.91 -3.44 116.94 107.42 1r4w h PHE 77 Ca 0.15 0.00 -0.27 0.00 2.81 0.00 0.00 57.97 60.66 1r4w h PHE 77 Cb 0.46 0.00 0.16 0.00 3.61 0.00 0.00 35.95 40.17 1r4w h PHE 77 CO -0.42 0.00 -0.70 1.04 -1.61 0.00 0.00 178.31 176.63 1r4w n GLN 78 N -2.44 -4.98 -3.97 1.51 6.02 0.55 -4.82 117.38 109.25 1r4w n GLN 78 Ca 0.05 0.75 -0.29 0.00 -0.01 0.00 0.00 57.00 57.50 1r4w n GLN 78 Cb 0.42 -5.44 -0.16 0.00 1.02 0.00 0.00 30.24 26.08 1r4w n GLN 78 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1r4w s VAL 79 N -3.32 1.43 -0.08 5.09 1.01 -0.58 -5.04 120.40 118.90 1r4w s VAL 79 Ca 0.09 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 1r4w s VAL 79 Cb -0.01 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1r4w s VAL 79 CO 0.64 0.28 1.15 -0.81 0.00 0.00 0.00 175.10 176.37 1r4w n PRO 80 N 4.78 0.19 -4.10 2.72 -0.04 -1.26 -4.71 135.00 132.58 1r4w n PRO 80 Ca -0.15 -0.64 -0.22 0.00 -0.04 0.00 0.00 63.50 62.46 1r4w n PRO 80 Cb 0.48 -2.09 -0.05 0.00 -0.04 0.00 0.00 33.50 31.81 1r4w n PRO 80 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r4w s MET 81 N 5.05 2.83 -0.14 0.54 0.23 -1.26 -4.46 119.30 122.08 1r4w s MET 81 Ca 0.10 -1.13 -0.10 0.00 -1.03 0.00 0.00 55.69 53.53 1r4w s MET 81 Cb 0.02 -2.51 0.05 0.00 -1.53 0.00 0.00 34.83 30.86 1r4w s MET 81 CO 0.03 0.36 0.36 0.45 -2.03 0.00 0.00 175.02 174.19 1r4w s SER 82 N -3.84 -0.41 0.16 -1.18 0.15 -0.55 -4.96 113.70 103.06 1r4w s SER 82 Ca 0.34 0.76 -0.31 0.00 0.70 0.00 0.00 55.95 57.43 1r4w s SER 82 Cb -0.07 0.69 -0.09 0.00 -1.71 0.00 0.00 66.02 64.84 1r4w s SER 82 CO 0.25 -0.16 1.46 -0.69 1.20 0.00 0.00 173.24 175.29 1r4w s VAL 83 N 0.87 2.95 1.40 4.45 1.01 -1.26 -4.55 120.40 125.28 1r4w s VAL 83 Ca -0.06 0.71 -0.23 0.00 0.00 0.00 0.00 61.98 62.40 1r4w s VAL 83 Cb -0.06 -3.45 0.36 0.00 0.00 0.00 0.00 36.38 33.23 1r4w s VAL 83 CO -0.06 0.07 0.95 -2.84 0.00 0.00 0.00 175.10 173.21 1r4w s PRO 84 N 0.84 -2.80 -0.03 2.72 0.02 -1.26 -5.04 135.00 129.45 1r4w s PRO 84 Ca 0.65 0.10 -0.02 0.00 0.02 0.00 0.00 61.00 61.75 1r4w s PRO 84 Cb -0.40 -1.40 -0.01 0.00 0.02 0.00 0.00 34.50 32.72 1r4w s PRO 84 CO 0.33 -4.78 -0.05 1.63 -0.33 0.00 0.00 177.00 173.80 1r4w n LYS 85 N -5.56 0.09 -2.51 5.54 4.01 -1.26 -4.58 118.16 113.89 1r4w n LYS 85 Ca 0.13 0.20 -0.41 0.00 -0.51 0.00 0.00 58.31 57.72 1r4w n LYS 85 Cb 0.60 -0.84 0.02 0.00 -0.51 0.00 0.00 35.03 34.31 1r4w n LYS 85 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1r4w n ASP 86 N -2.78 7.41 -0.35 4.39 -0.08 -1.26 -4.79 116.55 119.09 1r4w n ASP 86 Ca -0.02 -3.70 0.26 0.00 -1.51 0.00 0.00 54.79 49.83 1r4w n ASP 86 Cb 0.07 -1.16 0.51 0.00 2.34 0.00 0.00 41.12 42.88 1r4w n ASP 86 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1r4w h PHE 87 N 4.04 0.85 0.00 -0.67 3.57 -1.97 -1.56 116.94 121.21 1r4w h PHE 87 Ca 0.55 0.03 0.00 0.00 3.53 0.00 0.00 57.97 62.08 1r4w h PHE 87 Cb 0.28 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.79 1r4w h PHE 87 CO 1.32 -0.18 0.00 1.19 -2.23 0.00 0.00 178.31 178.41 1r4w n PHE 88 N -4.99 0.00 0.41 0.41 3.72 -1.26 0.11 117.46 115.86 1r4w n PHE 88 Ca 0.32 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.72 1r4w n PHE 88 Cb 1.06 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.58 1r4w n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1r4w n GLY 89 N 2.42 0.69 0.00 1.37 0.00 -1.23 0.16 105.19 108.60 1r4w n GLY 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1r4w n GLY 89 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1r4w n GLU 90 N 0.45 0.00 -0.01 1.61 4.07 -0.60 -4.87 120.64 121.30 1r4w n GLU 90 Ca 0.00 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.98 1r4w n GLU 90 Cb 0.14 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.45 1r4w n GLU 90 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1r4w h HIS 91 N 0.00 0.11 0.17 4.31 3.86 -1.54 -1.74 115.15 120.32 1r4w h HIS 91 Ca 0.00 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1r4w h HIS 91 Cb 0.00 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.44 1r4w h HIS 91 CO 0.00 0.23 -0.08 0.28 0.86 0.00 0.00 177.93 179.22 1r4w h VAL 92 N -0.04 0.00 -0.77 2.45 2.07 0.71 -2.98 116.25 117.68 1r4w h VAL 92 Ca 0.03 -0.63 0.28 0.00 0.82 0.00 0.00 66.70 67.19 1r4w h VAL 92 Cb 0.17 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.80 1r4w h VAL 92 CO -0.00 0.00 0.24 1.17 0.02 0.00 0.00 177.57 179.00 1r4w n LYS 93 N -4.35 -0.05 0.00 1.57 4.81 0.43 -1.82 118.16 118.75 1r4w n LYS 93 Ca -0.03 1.11 0.00 0.00 -0.87 0.00 0.00 58.31 58.52 1r4w n LYS 93 Cb 0.09 -1.89 0.00 0.00 0.02 0.00 0.00 35.03 33.25 1r4w n LYS 93 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1r4w n LYS 94 N -4.90 0.00 0.00 1.64 5.02 -0.65 -4.98 118.16 114.30 1r4w n LYS 94 Ca 0.25 0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.76 1r4w n LYS 94 Cb 0.82 -1.07 0.00 0.00 -0.02 0.00 0.00 35.03 34.76 1r4w n LYS 94 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r4w n GLY 95 N 0.20 3.47 0.06 0.72 0.00 -0.76 -4.96 105.19 103.92 1r4w n GLY 95 Ca 0.00 -1.81 0.01 0.00 0.00 0.00 0.00 46.02 44.21 1r4w n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r4w n THR 96 N -1.51 0.46 -0.31 2.61 -2.24 -1.26 -4.80 114.28 107.22 1r4w n THR 96 Ca 0.00 -0.73 0.29 0.00 -2.27 0.00 0.00 64.05 61.34 1r4w n THR 96 Cb 0.00 0.78 0.50 0.00 -2.10 0.00 0.00 70.33 69.52 1r4w n THR 96 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1r4w n VAL 97 N -0.14 -0.27 0.09 2.28 0.31 -1.26 -0.24 118.33 119.09 1r4w n VAL 97 Ca 0.01 1.53 -0.12 0.00 -0.01 0.00 0.00 64.34 65.75 1r4w n VAL 97 Cb 0.14 -2.50 -0.08 0.00 -0.91 0.00 0.00 33.84 30.49 1r4w n VAL 97 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 1r4w h ASN 98 N 0.00 -0.24 -0.73 4.52 4.21 -1.89 -0.76 115.58 120.69 1r4w h ASN 98 Ca 0.69 -0.28 -0.03 0.00 1.21 0.00 0.00 56.30 57.89 1r4w h ASN 98 Cb 2.01 0.06 -0.03 0.00 -1.12 0.00 0.00 38.32 39.24 1r4w h ASN 98 CO -0.50 0.22 0.35 0.00 -1.29 0.00 0.00 177.43 176.21 1r4w h ALA 99 N -0.16 0.94 0.00 -0.83 0.00 -0.87 0.52 119.26 118.87 1r4w h ALA 99 Ca -0.03 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 1r4w h ALA 99 Cb 0.51 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1r4w h ALA 99 CO 0.05 0.51 -0.51 0.52 0.00 0.00 0.00 179.25 179.81 1r4w h MET 100 N 1.03 0.00 -0.24 0.00 2.86 -0.64 -0.81 114.93 117.13 1r4w h MET 100 Ca 0.25 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.69 1r4w h MET 100 Cb 0.12 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1r4w h MET 100 CO -0.03 0.51 -0.62 0.00 1.06 0.00 0.00 176.91 177.82 1r4w h ARG 101 N 0.00 0.84 -0.29 1.72 3.08 -0.62 -0.13 114.38 118.98 1r4w h ARG 101 Ca -0.01 -0.59 -0.01 0.00 0.07 0.00 0.00 59.98 59.45 1r4w h ARG 101 Cb 0.96 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 1r4w h ARG 101 CO 0.07 1.21 0.14 0.35 -1.07 0.00 0.00 179.97 180.67 1r4w h PHE 102 N 0.61 0.42 -0.31 3.04 3.57 -0.72 -0.96 116.94 122.59 1r4w h PHE 102 Ca -0.01 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.49 1r4w h PHE 102 Cb 1.24 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.84 1r4w h PHE 102 CO 0.08 0.38 0.21 -0.07 -2.23 0.00 0.00 178.31 176.68 1r4w h LEU 103 N 0.34 0.29 -0.42 0.59 3.38 -1.06 0.16 115.31 118.59 1r4w h LEU 103 Ca 0.10 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1r4w h LEU 103 Cb 0.11 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1r4w h LEU 103 CO -0.01 0.20 -0.15 0.74 0.09 0.00 0.00 178.44 179.31 1r4w h THR 104 N 0.34 1.28 -0.61 0.22 2.02 -0.13 -0.52 112.91 115.51 1r4w h THR 104 Ca 0.12 -1.28 -0.06 0.00 0.77 0.00 0.00 66.41 65.96 1r4w h THR 104 Cb 0.08 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 1r4w h THR 104 CO -0.03 0.43 0.13 0.00 0.37 0.00 0.00 175.52 176.42 1r4w h ALA 105 N 0.84 1.07 -0.73 6.16 0.00 -0.14 -1.20 119.26 125.26 1r4w h ALA 105 Ca 0.10 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1r4w h ALA 105 Cb 0.70 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1r4w h ALA 105 CO 0.05 0.61 0.20 0.28 0.00 0.00 0.00 179.25 180.39 1r4w h VAL 106 N 0.92 1.26 0.00 0.00 2.07 -0.43 0.18 116.25 120.26 1r4w h VAL 106 Ca 0.19 -0.94 -0.06 0.00 0.82 0.00 0.00 66.70 66.71 1r4w h VAL 106 Cb 0.36 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1r4w h VAL 106 CO 0.00 0.37 -0.30 0.77 0.02 0.00 0.00 177.57 178.43 1r4w h SER 107 N 1.09 0.00 0.06 0.57 4.64 -0.51 0.14 113.55 119.54 1r4w h SER 107 Ca 0.23 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.47 1r4w h SER 107 Cb 0.34 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1r4w h SER 107 CO -0.00 0.30 -0.38 0.24 -0.87 0.00 0.00 176.83 176.11 1r4w h MET 108 N 0.00 0.13 0.00 4.77 2.86 -0.53 -3.37 114.93 118.79 1r4w h MET 108 Ca -0.00 -0.22 -0.28 0.00 -2.06 0.00 0.00 59.70 57.14 1r4w h MET 108 Cb 0.60 0.08 -0.05 0.00 0.06 0.00 0.00 31.60 32.30 1r4w h MET 108 CO 0.04 1.10 -2.03 0.39 1.06 0.00 0.00 176.91 177.48 1r4w n GLU 109 N -4.39 0.66 -2.89 1.72 1.02 -0.01 -4.65 120.64 112.09 1r4w n GLU 109 Ca -0.12 0.08 -0.22 0.00 -0.02 0.00 0.00 57.16 56.88 1r4w n GLU 109 Cb 0.63 -1.63 -0.02 0.00 -0.02 0.00 0.00 31.44 30.40 1r4w n GLU 109 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1r4w n GLN 110 N -2.78 2.32 -0.34 3.49 1.13 0.46 -4.98 117.38 116.68 1r4w n GLN 110 Ca -0.22 -4.14 0.14 0.00 -1.94 0.00 0.00 57.00 50.84 1r4w n GLN 110 Cb 1.01 -1.95 0.35 0.00 0.11 0.00 0.00 30.24 29.77 1r4w n GLN 110 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1r4w h PRO 111 N 2.92 0.68 0.00 -1.09 0.13 -1.64 -0.85 132.00 132.14 1r4w h PRO 111 Ca 0.12 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1r4w h PRO 111 Cb 0.81 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1r4w h PRO 111 CO 0.69 0.45 0.00 0.39 -0.23 0.00 0.00 178.00 179.30 1r4w n GLU 112 N -4.74 0.13 0.00 0.86 1.02 -1.26 -1.68 120.64 114.97 1r4w n GLU 112 Ca 0.23 0.48 0.11 0.00 -0.02 0.00 0.00 57.16 57.96 1r4w n GLU 112 Cb 0.61 -1.81 0.10 0.00 -0.02 0.00 0.00 31.44 30.32 1r4w n GLU 112 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1r4w n MET 113 N -2.06 0.14 -0.21 3.49 2.81 -0.33 -4.49 117.12 116.48 1r4w n MET 113 Ca 0.01 -0.10 0.01 0.00 -1.81 0.00 0.00 57.70 55.81 1r4w n MET 113 Cb 0.13 -1.50 0.10 0.00 -0.71 0.00 0.00 33.22 31.25 1r4w n MET 113 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1r4w h LEU 114 N 0.25 -0.30 0.54 4.03 6.46 -1.29 -0.65 115.31 124.35 1r4w h LEU 114 Ca 0.00 0.16 -0.02 0.00 -0.12 0.00 0.00 57.88 57.90 1r4w h LEU 114 Cb 0.52 0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.72 1r4w h LEU 114 CO 0.00 -0.13 -0.37 -0.08 -0.62 0.00 0.00 178.44 177.24 1r4w h GLU 115 N 0.11 -0.85 -0.71 1.25 4.81 -1.80 -1.35 114.58 116.04 1r4w h GLU 115 Ca 0.33 0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.57 1r4w h GLU 115 Cb 0.53 0.19 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 1r4w h GLU 115 CO -0.55 -0.57 0.27 0.87 -0.73 0.00 0.00 179.01 178.31 1r4w h LYS 116 N -0.88 1.08 -0.55 1.92 1.57 -1.77 0.47 116.57 118.40 1r4w h LYS 116 Ca -0.06 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.47 1r4w h LYS 116 Cb 0.73 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 1r4w h LYS 116 CO 0.04 0.90 0.18 0.28 -0.57 0.00 0.00 179.45 180.28 1r4w h VAL 117 N 1.03 1.23 -0.17 0.50 2.07 -1.10 -0.55 116.25 119.26 1r4w h VAL 117 Ca 0.24 -0.78 0.02 0.00 0.82 0.00 0.00 66.70 66.99 1r4w h VAL 117 Cb 0.23 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1r4w h VAL 117 CO -0.02 0.29 0.06 0.28 0.02 0.00 0.00 177.57 178.20 1r4w h SER 118 N 0.77 0.07 -0.92 0.57 0.02 -0.72 -0.51 113.55 112.82 1r4w h SER 118 Ca 0.18 0.02 0.07 0.00 -0.84 0.00 0.00 61.79 61.22 1r4w h SER 118 Cb 0.27 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.75 1r4w h SER 118 CO -0.01 0.06 0.60 -0.09 -1.14 0.00 0.00 176.83 176.25 1r4w h ARG 119 N 0.14 1.00 -0.21 3.45 2.43 -0.52 -2.10 114.38 118.58 1r4w h ARG 119 Ca 0.07 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 59.05 1r4w h ARG 119 Cb 0.04 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1r4w h ARG 119 CO -0.07 0.66 -0.43 0.93 -1.51 0.00 0.00 179.97 179.55 1r4w h GLU 120 N 1.03 0.50 -0.23 0.20 4.39 0.21 -1.01 114.58 119.68 1r4w h GLU 120 Ca 0.40 -0.26 -0.07 0.00 0.34 0.00 0.00 59.36 59.77 1r4w h GLU 120 Cb 0.22 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1r4w h GLU 120 CO -0.15 0.84 -0.16 -0.07 -1.16 0.00 0.00 179.01 178.31 1r4w h LEU 121 N 0.41 0.37 -0.22 1.33 3.38 -0.54 -2.27 115.31 117.77 1r4w h LEU 121 Ca 0.03 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 1r4w h LEU 121 Cb 0.92 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1r4w h LEU 121 CO 0.08 0.55 -0.42 -0.50 0.09 0.00 0.00 178.44 178.24 1r4w h TRP 122 N 0.35 0.85 -0.91 1.13 6.55 -1.13 -2.54 115.95 120.25 1r4w h TRP 122 Ca 0.07 -0.31 0.21 0.00 0.95 0.00 0.00 58.89 59.81 1r4w h TRP 122 Cb 0.49 -0.16 -0.06 0.00 -0.86 0.00 0.00 29.16 28.56 1r4w h TRP 122 CO 0.01 1.08 0.60 0.52 -1.05 0.00 0.00 178.44 179.60 1r4w h MET 123 N 0.38 0.36 0.01 0.49 2.86 -0.80 0.69 114.93 118.91 1r4w h MET 123 Ca 0.01 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1r4w h MET 123 Cb 1.03 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.60 1r4w h MET 123 CO 0.09 0.24 -0.01 0.00 1.06 0.00 0.00 176.91 178.29 1r4w h ARG 124 N 0.37 -0.02 -0.04 1.72 3.08 -1.17 -0.50 114.38 117.83 1r4w h ARG 124 Ca 0.47 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.52 1r4w h ARG 124 Cb 1.23 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.28 1r4w h ARG 124 CO -0.17 -0.01 0.01 0.97 -1.07 0.00 0.00 179.97 179.70 1r4w h ILE 125 N -0.03 1.19 -0.33 2.04 2.10 -1.16 -0.05 117.51 121.26 1r4w h ILE 125 Ca -0.00 -0.56 0.00 0.00 1.08 0.00 0.00 64.86 65.37 1r4w h ILE 125 Cb 0.01 1.50 0.00 0.00 -1.09 0.00 0.00 36.82 37.24 1r4w h ILE 125 CO 0.00 0.15 0.00 0.79 -1.08 0.00 0.00 178.15 178.02 1r4w n TRP 126 N -4.94 0.43 0.00 2.19 7.02 0.24 -3.21 117.44 119.16 1r4w n TRP 126 Ca -0.07 -0.21 0.00 0.00 -1.02 0.00 0.00 57.50 56.20 1r4w n TRP 126 Cb 0.14 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.03 1r4w n TRP 126 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1r4w n SER 127 N 0.94 3.25 -0.24 -0.99 2.88 -0.97 -1.48 113.62 117.00 1r4w n SER 127 Ca 0.18 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.74 1r4w n SER 127 Cb 0.46 0.11 0.06 0.00 -0.75 0.00 0.00 64.21 64.09 1r4w n SER 127 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1r4w n ARG 128 N -2.08 2.76 -2.04 -1.46 1.74 -0.23 -4.59 116.66 110.76 1r4w n ARG 128 Ca 0.00 -1.65 -0.11 0.00 -0.77 0.00 0.00 57.85 55.32 1r4w n ARG 128 Cb 0.38 -1.10 -0.02 0.00 -1.02 0.00 0.00 32.46 30.70 1r4w n ARG 128 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1r4w n ASP 129 N -0.10 -3.29 -4.57 0.55 2.03 -0.14 -4.95 116.55 106.08 1r4w n ASP 129 Ca 0.04 0.25 -0.28 0.00 0.52 0.00 0.00 54.79 55.32 1r4w n ASP 129 Cb 0.30 -2.93 0.13 0.00 -0.72 0.00 0.00 41.12 37.90 1r4w n ASP 129 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1r4w s GLU 130 N -4.27 1.45 0.28 -0.67 2.02 -0.55 -4.93 118.70 112.04 1r4w s GLU 130 Ca 0.00 -0.37 -0.09 0.00 0.02 0.00 0.00 54.97 54.53 1r4w s GLU 130 Cb 0.00 -2.02 -0.07 0.00 0.10 0.00 0.00 34.13 32.14 1r4w s GLU 130 CO 0.00 -1.81 0.60 0.34 0.02 0.00 0.00 175.26 174.41 1r4w s ASP 131 N -4.71 6.58 -0.18 -0.19 2.15 -1.26 -3.85 116.67 115.22 1r4w s ASP 131 Ca 0.67 0.94 0.22 0.00 0.43 0.00 0.00 52.55 54.81 1r4w s ASP 131 Cb -0.07 -2.24 0.46 0.00 -0.30 0.00 0.00 42.92 40.77 1r4w s ASP 131 CO 0.49 -0.16 1.16 2.30 -0.17 0.00 0.00 175.17 178.78 1r4w n ILE 132 N -0.51 0.75 0.10 4.11 -5.35 -1.26 -4.73 119.36 112.47 1r4w n ILE 132 Ca 0.01 -2.10 0.04 0.00 -0.27 0.00 0.00 62.75 60.42 1r4w n ILE 132 Cb 0.53 1.17 -0.06 0.00 -1.74 0.00 0.00 39.64 39.54 1r4w n ILE 132 CO 0.00 0.00 0.00 1.07 -1.76 0.00 0.00 176.55 175.86 1r4w n THR 133 N -0.32 0.00 -3.69 7.28 5.66 -1.26 -4.30 114.28 117.65 1r4w n THR 133 Ca 0.04 -0.22 -0.36 0.00 -3.05 0.00 0.00 64.05 60.45 1r4w n THR 133 Cb 0.91 0.51 -0.07 0.00 -1.55 0.00 0.00 70.33 70.13 1r4w n THR 133 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1r4w s GLU 134 N -2.31 3.94 0.20 1.09 2.02 -1.26 -4.93 118.70 117.45 1r4w s GLU 134 Ca -0.01 -0.01 -0.20 0.00 0.02 0.00 0.00 54.97 54.77 1r4w s GLU 134 Cb 0.05 -3.32 0.16 0.00 0.10 0.00 0.00 34.13 31.12 1r4w s GLU 134 CO 0.32 0.49 1.57 0.77 0.02 0.00 0.00 175.26 178.43 1r4w h SER 135 N 5.87 -1.30 0.11 -0.19 0.02 -1.99 0.17 113.55 116.24 1r4w h SER 135 Ca -0.47 0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1r4w h SER 135 Cb 1.19 0.66 0.00 0.00 0.14 0.00 0.00 62.40 64.39 1r4w h SER 135 CO 0.68 -0.30 0.00 1.56 -1.14 0.00 0.00 176.83 177.63 1r4w h GLN 136 N -0.10 0.00 0.00 3.45 1.08 -1.98 0.50 115.11 118.07 1r4w h GLN 136 Ca 0.27 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.46 1r4w h GLN 136 Cb 0.57 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.00 1r4w h GLN 136 CO -0.81 0.00 -0.15 -0.91 -0.95 0.00 0.00 178.83 176.01 1r4w h ASN 137 N 0.00 0.00 -0.82 1.46 -0.26 -1.05 -2.12 115.58 112.79 1r4w h ASN 137 Ca 0.00 -0.41 0.16 0.00 -0.56 0.00 0.00 56.30 55.49 1r4w h ASN 137 Cb 0.05 0.00 -0.10 0.00 -1.06 0.00 0.00 38.32 37.21 1r4w h ASN 137 CO 0.00 0.79 0.37 0.40 -1.06 0.00 0.00 177.43 177.93 1r4w h ILE 138 N -1.00 0.64 -0.76 2.81 2.04 -0.65 0.47 117.51 121.06 1r4w h ILE 138 Ca -0.03 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 65.71 1r4w h ILE 138 Cb 0.53 0.10 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 1r4w h ILE 138 CO -0.02 0.09 0.46 0.25 0.00 0.00 0.00 178.15 178.93 1r4w h LEU 139 N 0.49 0.72 -0.67 1.44 5.85 -0.09 -0.86 115.31 122.19 1r4w h LEU 139 Ca 0.46 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.20 1r4w h LEU 139 Cb 0.74 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1r4w h LEU 139 CO -0.42 0.47 0.40 -1.28 -0.34 0.00 0.00 178.44 177.27 1r4w h SER 140 N 0.85 0.81 -0.05 1.25 0.87 0.59 -0.32 113.55 117.54 1r4w h SER 140 Ca 0.33 -0.07 0.02 0.00 -1.23 0.00 0.00 61.79 60.84 1r4w h SER 140 Cb 0.14 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 61.86 1r4w h SER 140 CO -0.16 0.64 -0.09 0.00 -0.53 0.00 0.00 176.83 176.69 1r4w h ALA 141 N 1.20 -0.05 -0.68 6.23 0.00 -0.30 -0.17 119.26 125.49 1r4w h ALA 141 Ca 0.24 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.20 1r4w h ALA 141 Cb -0.02 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1r4w h ALA 141 CO -0.04 -0.57 0.45 0.00 0.00 0.00 0.00 179.25 179.09 1r4w h ALA 142 N 0.90 1.59 -0.27 0.00 0.00 -0.77 -0.15 119.26 120.54 1r4w h ALA 142 Ca 0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1r4w h ALA 142 Cb 0.21 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1r4w h ALA 142 CO -0.13 0.35 -0.03 0.93 0.00 0.00 0.00 179.25 180.37 1r4w h GLU 143 N 0.85 0.51 0.00 0.00 5.08 -0.48 -0.90 114.58 119.64 1r4w h GLU 143 Ca 0.26 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1r4w h GLU 143 Cb 0.01 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 1r4w h GLU 143 CO -0.07 0.69 -0.09 0.87 -1.00 0.00 0.00 179.01 179.41 1r4w h LYS 144 N 0.27 0.00 0.00 2.33 1.57 -0.48 0.83 116.57 121.09 1r4w h LYS 144 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1r4w h LYS 144 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1r4w h LYS 144 CO 0.02 0.09 0.00 0.00 -0.57 0.00 0.00 179.45 178.99 1r4w n ALA 145 N -2.34 1.78 0.00 3.86 0.00 -0.12 -4.86 120.51 118.84 1r4w n ALA 145 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1r4w n ALA 145 Cb 0.18 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1r4w n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r4w n GLY 146 N 0.26 0.77 3.70 0.00 0.00 0.28 -4.84 105.19 105.36 1r4w n GLY 146 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1r4w n GLY 146 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1r4w s MET 147 N -0.62 4.46 0.30 1.61 -2.45 -0.40 -5.01 119.30 117.19 1r4w s MET 147 Ca 0.00 1.32 -0.30 0.00 -1.25 0.00 0.00 55.69 55.47 1r4w s MET 147 Cb 0.00 -3.51 -0.12 0.00 1.25 0.00 0.00 34.83 32.45 1r4w s MET 147 CO 0.00 -0.20 1.45 0.00 1.05 0.00 0.00 175.02 177.32 1r4w n ALA 148 N 4.57 1.81 -0.33 4.11 0.00 -1.26 -4.04 120.51 125.37 1r4w n ALA 148 Ca 0.07 0.38 0.13 0.00 0.00 0.00 0.00 53.44 54.02 1r4w n ALA 148 Cb 0.50 -2.35 0.36 0.00 0.00 0.00 0.00 19.45 17.95 1r4w n ALA 148 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1r4w h THR 149 N 3.01 0.74 0.15 0.00 2.02 -1.95 0.65 112.91 117.52 1r4w h THR 149 Ca -0.47 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 1r4w h THR 149 Cb 1.26 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1r4w h THR 149 CO 0.72 0.13 -0.07 0.00 0.37 0.00 0.00 175.52 176.67 1r4w h ALA 150 N 1.62 -0.20 -0.26 6.16 0.00 -1.99 0.00 119.26 124.59 1r4w h ALA 150 Ca 0.54 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.35 1r4w h ALA 150 Cb 0.90 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1r4w h ALA 150 CO -0.31 -0.50 0.04 0.37 0.00 0.00 0.00 179.25 178.85 1r4w h GLN 151 N -0.43 0.13 -0.62 0.00 5.75 -1.72 0.16 115.11 118.38 1r4w h GLN 151 Ca -0.02 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.51 1r4w h GLN 151 Cb 0.34 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.81 1r4w h GLN 151 CO 0.03 0.09 0.37 0.00 -2.65 0.00 0.00 178.83 176.67 1r4w h ALA 152 N 1.20 0.82 -0.36 3.38 0.00 -0.88 -0.88 119.26 122.54 1r4w h ALA 152 Ca 0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1r4w h ALA 152 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1r4w h ALA 152 CO -0.17 0.09 0.11 0.37 0.00 0.00 0.00 179.25 179.65 1r4w h GLN 153 N 0.72 0.56 -0.36 0.00 5.75 -0.45 -0.22 115.11 121.11 1r4w h GLN 153 Ca 0.26 -0.12 0.08 0.00 -0.15 0.00 0.00 58.65 58.71 1r4w h GLN 153 Cb 0.07 -0.08 -0.08 0.00 1.07 0.00 0.00 27.48 28.46 1r4w h GLN 153 CO -0.12 0.59 -0.19 1.25 -2.65 0.00 0.00 178.83 177.70 1r4w h HIS 154 N 0.43 -0.49 -0.72 3.99 2.76 -0.13 0.46 115.15 121.45 1r4w h HIS 154 Ca 0.11 0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.28 1r4w h HIS 154 Cb 0.27 0.27 -0.03 0.00 1.55 0.00 0.00 27.41 29.47 1r4w h HIS 154 CO 0.01 -0.27 0.27 -0.07 -1.30 0.00 0.00 177.93 176.57 1r4w h LEU 155 N -0.14 1.01 -1.46 0.26 3.38 -0.99 -1.84 115.31 115.53 1r4w h LEU 155 Ca 0.18 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 58.01 1r4w h LEU 155 Cb 0.42 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1r4w h LEU 155 CO -0.44 0.92 0.42 -0.07 0.09 0.00 0.00 178.44 179.35 1r4w h LEU 156 N 1.04 0.60 -0.33 1.67 3.38 -0.12 -0.60 115.31 120.96 1r4w h LEU 156 Ca 0.24 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1r4w h LEU 156 Cb 0.24 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1r4w h LEU 156 CO -0.02 0.40 0.00 0.59 0.09 0.00 0.00 178.44 179.51 1r4w n ASN 157 N -4.47 0.29 0.01 -0.43 3.02 0.07 -2.39 115.26 111.35 1r4w n ASN 157 Ca 0.08 0.58 0.11 0.00 -0.03 0.00 0.00 54.58 55.32 1r4w n ASN 157 Cb 0.18 -0.63 -0.04 0.00 -0.61 0.00 0.00 39.78 38.68 1r4w n ASN 157 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1r4w n LYS 158 N -1.82 0.16 0.01 3.52 5.02 -0.24 -4.33 118.16 120.48 1r4w n LYS 158 Ca 0.03 -0.03 0.01 0.00 -2.02 0.00 0.00 58.31 56.30 1r4w n LYS 158 Cb 0.18 -1.53 0.04 0.00 -0.02 0.00 0.00 35.03 33.71 1r4w n LYS 158 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1r4w n ILE 159 N -1.72 1.65 0.07 -0.18 -5.35 -1.01 -0.14 119.36 112.69 1r4w n ILE 159 Ca 0.03 0.52 0.11 0.00 -0.27 0.00 0.00 62.75 63.14 1r4w n ILE 159 Cb 0.39 -1.52 -0.09 0.00 -1.74 0.00 0.00 39.64 36.68 1r4w n ILE 159 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1r4w n SER 160 N -1.49 0.37 -4.27 7.28 3.41 -1.26 -4.58 113.62 113.08 1r4w n SER 160 Ca -0.00 0.11 -0.34 0.00 -0.26 0.00 0.00 58.87 58.38 1r4w n SER 160 Cb 0.08 1.33 0.11 0.00 -0.26 0.00 0.00 64.21 65.46 1r4w n SER 160 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1r4w n THR 161 N -2.40 0.00 0.09 6.66 -1.04 0.81 -4.86 114.28 113.54 1r4w n THR 161 Ca -0.02 -0.27 -0.18 0.00 -2.04 0.00 0.00 64.05 61.54 1r4w n THR 161 Cb 0.55 -0.43 -0.14 0.00 -1.82 0.00 0.00 70.33 68.48 1r4w n THR 161 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1r4w h GLU 162 N -1.50 0.31 0.19 -2.82 4.39 -1.94 -2.98 114.58 110.24 1r4w h GLU 162 Ca -0.45 -0.54 0.01 0.00 0.34 0.00 0.00 59.36 58.72 1r4w h GLU 162 Cb 1.31 0.20 -0.04 0.00 -0.10 0.00 0.00 28.75 30.12 1r4w h GLU 162 CO 0.32 1.21 -0.40 -0.07 -1.16 0.00 0.00 179.01 178.90 1r4w h LEU 163 N 0.09 -1.17 0.18 1.33 4.07 -1.92 -0.51 115.31 117.38 1r4w h LEU 163 Ca -0.23 0.12 -0.01 0.00 0.08 0.00 0.00 57.88 57.85 1r4w h LEU 163 Cb 2.04 0.43 -0.00 0.00 1.08 0.00 0.00 40.66 44.20 1r4w h LEU 163 CO 0.19 -0.50 -0.10 0.58 -1.08 0.00 0.00 178.44 177.54 1r4w h VAL 164 N -0.68 0.79 -0.65 1.22 2.07 -1.83 -1.48 116.25 115.69 1r4w h VAL 164 Ca 0.01 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.62 1r4w h VAL 164 Cb 0.68 0.79 -0.07 0.00 -1.52 0.00 0.00 31.29 31.17 1r4w h VAL 164 CO -0.19 0.00 0.29 0.11 0.02 0.00 0.00 177.57 177.79 1r4w h LYS 165 N -0.27 0.49 0.00 1.57 1.57 -1.35 -1.33 116.57 117.25 1r4w h LYS 165 Ca -0.02 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 1r4w h LYS 165 Cb 0.21 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1r4w h LYS 165 CO 0.03 0.32 -0.59 0.66 -0.57 0.00 0.00 179.45 179.30 1r4w h SER 166 N 0.50 0.00 -0.83 0.86 4.64 -1.01 -2.46 113.55 115.25 1r4w h SER 166 Ca 0.33 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.63 1r4w h SER 166 Cb 0.37 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.42 1r4w h SER 166 CO -0.28 0.59 0.48 0.50 -0.87 0.00 0.00 176.83 177.24 1r4w h LYS 167 N 0.00 1.15 -0.14 4.77 1.63 -0.37 0.53 116.57 124.14 1r4w h LYS 167 Ca -0.01 -0.12 -0.05 0.00 -0.85 0.00 0.00 60.65 59.62 1r4w h LYS 167 Cb 1.34 -0.23 -0.00 0.00 -0.60 0.00 0.00 32.23 32.73 1r4w h LYS 167 CO 0.08 0.83 -0.11 1.25 -3.45 0.00 0.00 179.45 178.05 1r4w h LEU 168 N 1.16 0.34 -0.93 5.20 5.85 -1.09 -0.50 115.31 125.35 1r4w h LEU 168 Ca 0.30 -0.45 0.02 0.00 0.84 0.00 0.00 57.88 58.58 1r4w h LEU 168 Cb -0.00 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 1r4w h LEU 168 CO -0.05 0.72 0.61 0.03 -0.34 0.00 0.00 178.44 179.41 1r4w h ARG 169 N -0.03 1.19 -0.20 1.25 3.08 -0.96 -1.07 114.38 117.63 1r4w h ARG 169 Ca 0.03 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 1r4w h ARG 169 Cb 0.61 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1r4w h ARG 169 CO 0.03 0.79 0.01 1.49 -1.07 0.00 0.00 179.97 181.21 1r4w h GLU 170 N 1.23 0.35 -0.75 0.04 4.81 0.22 -0.91 114.58 119.56 1r4w h GLU 170 Ca 0.35 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1r4w h GLU 170 Cb -0.09 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 1r4w h GLU 170 CO -0.09 0.54 0.38 1.15 -0.73 0.00 0.00 179.01 180.26 1r4w h THR 171 N 0.12 1.23 0.00 0.32 2.02 -0.88 0.17 112.91 115.88 1r4w h THR 171 Ca 0.06 -0.62 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 1r4w h THR 171 Cb 0.37 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1r4w h THR 171 CO 0.01 0.27 -0.01 0.00 0.37 0.00 0.00 175.52 176.16 1r4w h THR 172 N 1.06 0.02 -0.00 3.16 1.03 -1.08 -2.88 112.91 114.21 1r4w h THR 172 Ca 0.26 -0.98 -0.25 0.00 -0.01 0.00 0.00 66.41 65.44 1r4w h THR 172 Cb 0.08 1.96 0.01 0.00 -1.07 0.00 0.00 68.15 69.13 1r4w h THR 172 CO -0.04 0.01 -0.99 1.23 -0.01 0.00 0.00 175.52 175.72 1r4w h GLY 173 N 3.80 0.62 0.93 2.99 0.00 -0.23 -2.79 103.07 108.39 1r4w h GLY 173 Ca -0.00 -1.09 0.04 0.00 0.00 0.00 0.00 47.33 46.28 1r4w h GLY 173 CO 0.00 0.96 0.63 0.00 0.00 0.00 0.00 176.54 178.13 1r4w h ALA 174 N 0.58 1.39 0.29 3.60 0.00 -0.56 0.17 119.26 124.73 1r4w h ALA 174 Ca -0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1r4w h ALA 174 Cb 1.63 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1r4w h ALA 174 CO 0.18 0.52 -0.21 0.00 0.00 0.00 0.00 179.25 179.74 1r4w h ALA 175 N 1.44 -0.48 -0.88 0.00 0.00 -1.33 -1.67 119.26 116.34 1r4w h ALA 175 Ca 0.38 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.32 1r4w h ALA 175 Cb 0.02 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.00 1r4w h ALA 175 CO -0.12 -0.79 0.51 0.00 0.00 0.00 0.00 179.25 178.85 1r4w h LYS 177 N 0.80 0.00 -0.00 0.00 1.57 -0.15 0.17 116.57 118.97 1r4w h LYS 177 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 1r4w h LYS 177 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1r4w h LYS 177 CO -0.28 0.03 -0.11 0.66 -0.57 0.00 0.00 179.45 179.18 1r4w n TYR 178 N -3.72 0.00 0.00 -1.35 4.01 0.64 -4.88 117.16 111.86 1r4w n TYR 178 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1r4w n TYR 178 Cb 0.12 -0.40 0.00 0.00 -0.31 0.00 0.00 39.34 38.75 1r4w n TYR 178 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1r4w n GLY 179 N 1.46 0.97 3.67 2.72 0.00 0.61 -4.92 105.19 109.70 1r4w n GLY 179 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1r4w n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r4w n ALA 180 N -1.02 0.96 -0.26 4.61 0.00 -0.74 -4.88 120.51 119.18 1r4w n ALA 180 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1r4w n ALA 180 Cb 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.24 1r4w n ALA 180 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1r4w n PHE 181 N -0.34 0.00 -3.02 0.00 1.16 -1.26 -4.58 117.46 109.42 1r4w n PHE 181 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.66 1r4w n PHE 181 Cb 0.40 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.27 1r4w n PHE 181 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1r4w n GLY 182 N 0.24 1.85 3.01 4.97 0.00 -1.26 -4.71 105.19 109.28 1r4w n GLY 182 Ca 0.00 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 1r4w n GLY 182 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r4w s LEU 183 N 0.00 2.28 0.48 0.99 1.43 -1.26 -4.26 118.68 118.33 1r4w s LEU 183 Ca 0.00 -0.57 -0.21 0.00 -1.03 0.00 0.00 54.13 52.32 1r4w s LEU 183 Cb 0.00 0.05 -0.08 0.00 0.03 0.00 0.00 46.19 46.19 1r4w s LEU 183 CO 0.00 -0.31 1.05 -2.16 0.23 0.00 0.00 176.35 175.16 1r4w s PRO 184 N -1.79 3.80 -0.09 1.29 0.04 -1.26 -4.58 135.00 132.40 1r4w s PRO 184 Ca -0.12 1.41 0.03 0.00 0.04 0.00 0.00 61.00 62.36 1r4w s PRO 184 Cb -0.08 -2.14 0.01 0.00 0.04 0.00 0.00 34.50 32.33 1r4w s PRO 184 CO -0.02 -0.44 -0.17 0.99 0.04 0.00 0.00 177.00 177.40 1r4w s THR 185 N -1.92 1.56 -0.10 1.26 2.01 -1.10 -0.71 115.64 116.65 1r4w s THR 185 Ca 0.67 -0.72 0.02 0.00 0.31 0.00 0.00 61.69 61.97 1r4w s THR 185 Cb -0.18 -1.39 -0.01 0.00 0.01 0.00 0.00 72.50 70.93 1r4w s THR 185 CO 0.22 0.45 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.54 1r4w s THR 186 N 0.59 2.76 -0.19 -0.82 2.01 -0.20 -0.58 115.64 119.21 1r4w s THR 186 Ca -0.15 -0.79 -0.01 0.00 0.31 0.00 0.00 61.69 61.05 1r4w s THR 186 Cb -0.16 -2.11 0.01 0.00 0.01 0.00 0.00 72.50 70.24 1r4w s THR 186 CO 0.05 0.55 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.71 1r4w s VAL 187 N 0.03 2.66 -0.16 3.82 1.01 0.14 -0.33 120.40 127.56 1r4w s VAL 187 Ca -0.06 -0.74 -0.06 0.00 0.00 0.00 0.00 61.98 61.12 1r4w s VAL 187 Cb -0.15 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1r4w s VAL 187 CO 0.05 0.49 0.03 0.00 0.00 0.00 0.00 175.10 175.67 1r4w s ALA 188 N 1.28 3.30 -0.36 5.51 0.00 -0.00 -0.21 121.76 131.28 1r4w s ALA 188 Ca 0.04 -0.77 -0.06 0.00 0.00 0.00 0.00 51.96 51.17 1r4w s ALA 188 Cb -0.14 -1.78 0.06 0.00 0.00 0.00 0.00 23.12 21.26 1r4w s ALA 188 CO -0.07 0.25 0.14 -1.01 0.00 0.00 0.00 175.76 175.07 1r4w s HIS 189 N 0.17 3.31 -0.04 0.00 3.76 -0.86 -0.75 115.29 120.88 1r4w s HIS 189 Ca 0.03 -1.60 0.03 0.00 -0.15 0.00 0.00 55.06 53.36 1r4w s HIS 189 Cb -0.13 -2.53 0.00 0.00 1.11 0.00 0.00 32.58 31.03 1r4w s HIS 189 CO 0.01 -0.79 -0.11 0.08 -0.85 0.00 0.00 174.74 173.08 1r4w s VAL 190 N 1.37 0.99 -0.89 -0.90 1.01 -0.91 -3.99 120.40 117.08 1r4w s VAL 190 Ca 0.00 -0.45 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 1r4w s VAL 190 Cb -0.21 -0.88 0.02 0.00 0.00 0.00 0.00 36.38 35.31 1r4w s VAL 190 CO 0.02 0.31 0.24 0.47 0.00 0.00 0.00 175.10 176.13 1r4w n ASP 191 N 3.39 -1.14 0.00 3.32 8.00 -1.26 0.50 116.55 129.36 1r4w n ASP 191 Ca -0.19 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.46 1r4w n ASP 191 Cb 0.53 -1.03 0.00 0.00 -0.02 0.00 0.00 41.12 40.60 1r4w n ASP 191 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r4w n GLY 192 N -1.85 2.27 3.98 0.44 0.00 -1.26 -4.99 105.19 103.77 1r4w n GLY 192 Ca -0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 1r4w n GLY 192 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r4w s LYS 193 N -0.02 3.29 -0.08 1.61 1.02 0.18 -5.12 119.74 120.63 1r4w s LYS 193 Ca 0.00 -0.83 -0.01 0.00 0.02 0.00 0.00 55.97 55.15 1r4w s LYS 193 Cb 0.00 -2.83 0.03 0.00 -0.52 0.00 0.00 37.83 34.50 1r4w s LYS 193 CO 0.00 0.23 -0.03 0.99 -0.92 0.00 0.00 175.35 175.61 1r4w s THR 194 N -2.11 0.61 -0.06 2.17 2.01 -1.26 -2.13 115.64 114.87 1r4w s THR 194 Ca 0.40 -0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.35 1r4w s THR 194 Cb -0.09 -0.70 -0.03 0.00 0.01 0.00 0.00 72.50 71.69 1r4w s THR 194 CO 0.31 0.29 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.14 1r4w s TYR 195 N 1.66 2.91 -0.19 4.92 2.02 0.07 -4.95 117.35 123.79 1r4w s TYR 195 Ca 0.01 -0.00 0.01 0.00 -0.37 0.00 0.00 57.07 56.73 1r4w s TYR 195 Cb -0.13 -1.70 0.02 0.00 -0.40 0.00 0.00 41.96 39.76 1r4w s TYR 195 CO -0.05 0.32 -0.19 1.41 -1.57 0.00 0.00 175.55 175.47 1r4w s MET 196 N -0.81 2.91 -0.08 -0.62 -2.45 -1.26 -0.82 119.30 116.16 1r4w s MET 196 Ca 0.12 -0.88 0.05 0.00 -1.25 0.00 0.00 55.69 53.73 1r4w s MET 196 Cb -0.11 -2.60 -0.01 0.00 1.25 0.00 0.00 34.83 33.37 1r4w s MET 196 CO 0.01 -0.25 -0.23 -0.51 1.05 0.00 0.00 175.02 175.10 1r4w s LEU 197 N 1.27 2.16 -0.08 4.11 1.43 0.56 -4.98 118.68 123.15 1r4w s LEU 197 Ca 0.04 -0.50 -0.03 0.00 -1.03 0.00 0.00 54.13 52.61 1r4w s LEU 197 Cb -0.14 -1.42 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 1r4w s LEU 197 CO -0.12 0.21 0.05 0.12 0.23 0.00 0.00 176.35 176.84 1r4w s PHE 198 N 0.06 3.31 0.00 0.29 5.36 -1.26 -1.03 117.98 124.70 1r4w s PHE 198 Ca -0.10 0.29 0.00 0.00 -0.96 0.00 0.00 56.93 56.16 1r4w s PHE 198 Cb -0.16 -1.82 0.00 0.00 -0.34 0.00 0.00 43.02 40.70 1r4w s PHE 198 CO 0.06 0.56 0.00 0.41 -1.46 0.00 0.00 175.22 174.79 1r4w n GLY 199 N 1.92 1.21 0.64 13.12 0.00 0.11 -4.51 105.19 117.68 1r4w n GLY 199 Ca -0.18 -1.88 0.12 0.00 0.00 0.00 0.00 46.02 44.08 1r4w n GLY 199 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1r4w n SER 200 N -0.33 1.94 -1.39 1.61 3.41 -1.26 -3.87 113.62 113.73 1r4w n SER 200 Ca 0.00 -1.70 -0.07 0.00 -0.26 0.00 0.00 58.87 56.84 1r4w n SER 200 Cb 0.00 -0.08 0.21 0.00 -0.26 0.00 0.00 64.21 64.08 1r4w n SER 200 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1r4w n ASP 201 N 0.50 3.04 -0.12 4.04 5.68 -1.26 -4.36 116.55 124.07 1r4w n ASP 201 Ca 0.17 -3.62 0.01 0.00 -0.50 0.00 0.00 54.79 50.85 1r4w n ASP 201 Cb 0.39 -0.67 0.03 0.00 -1.14 0.00 0.00 41.12 39.73 1r4w n ASP 201 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1r4w n ARG 202 N -1.00 2.87 0.11 0.11 5.12 -1.25 -4.70 116.66 117.92 1r4w n ARG 202 Ca 0.38 -1.58 -0.01 0.00 -1.93 0.00 0.00 57.85 54.71 1r4w n ARG 202 Cb 1.17 -1.05 0.26 0.00 -1.16 0.00 0.00 32.46 31.68 1r4w n ARG 202 CO 0.00 0.00 0.00 0.52 -1.93 0.00 0.00 177.63 176.22 1r4w h MET 203 N 0.39 0.20 -0.22 5.56 2.86 -1.84 0.15 114.93 122.02 1r4w h MET 203 Ca 0.00 -0.08 -0.10 0.00 -2.06 0.00 0.00 59.70 57.45 1r4w h MET 203 Cb 0.53 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 1r4w h MET 203 CO 0.00 0.55 -0.31 1.49 1.06 0.00 0.00 176.91 179.70 1r4w h GLU 204 N 0.17 0.44 -0.11 1.72 4.81 -1.92 -1.50 114.58 118.19 1r4w h GLU 204 Ca 0.02 -0.18 -0.21 0.00 -0.13 0.00 0.00 59.36 58.85 1r4w h GLU 204 Cb 0.75 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.12 1r4w h GLU 204 CO 0.06 0.71 -0.79 1.25 -0.73 0.00 0.00 179.01 179.50 1r4w h LEU 205 N 0.38 0.75 -1.34 1.64 5.85 -1.68 -3.00 115.31 117.92 1r4w h LEU 205 Ca 0.05 -0.51 0.04 0.00 0.84 0.00 0.00 57.88 58.30 1r4w h LEU 205 Cb 0.74 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 1r4w h LEU 205 CO 0.06 1.29 0.48 0.25 -0.34 0.00 0.00 178.44 180.17 1r4w h LEU 206 N 0.42 0.74 -0.76 2.25 5.85 -0.56 -0.08 115.31 123.16 1r4w h LEU 206 Ca -0.05 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.58 1r4w h LEU 206 Cb 1.40 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 1r4w h LEU 206 CO 0.15 0.51 0.02 0.00 -0.34 0.00 0.00 178.44 178.77 1r4w h ALA 207 N 1.58 0.96 -0.14 1.25 0.00 -1.21 -1.14 119.26 120.57 1r4w h ALA 207 Ca 0.29 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1r4w h ALA 207 Cb 0.09 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1r4w h ALA 207 CO -0.09 0.63 -0.06 -0.92 0.00 0.00 0.00 179.25 178.81 1r4w h TYR 208 N 0.89 0.34 -0.32 0.00 3.20 -1.12 0.83 116.97 120.79 1r4w h TYR 208 Ca 0.17 -0.08 0.01 0.00 3.14 0.00 0.00 58.73 61.96 1r4w h TYR 208 Cb 0.50 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 1r4w h TYR 208 CO 0.03 0.62 0.21 -0.07 -1.64 0.00 0.00 178.16 177.31 1r4w h LEU 209 N -0.04 0.36 0.00 2.82 3.38 -0.89 -2.42 115.31 118.53 1r4w h LEU 209 Ca 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1r4w h LEU 209 Cb 0.52 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1r4w h LEU 209 CO 0.02 0.26 -0.25 0.18 0.09 0.00 0.00 178.44 178.74 1r4w n LEU 210 N -4.49 0.74 0.00 1.67 4.77 -0.44 -4.92 117.00 114.33 1r4w n LEU 210 Ca 0.02 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1r4w n LEU 210 Cb 0.07 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1r4w n LEU 210 CO 0.35 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1r4w n GLY 211 N 1.33 0.64 3.96 -0.72 0.00 -0.50 -5.04 105.19 104.86 1r4w n GLY 211 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 1r4w n GLY 211 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r4w s GLU 212 N -0.22 2.78 -0.17 1.61 0.41 0.17 -5.01 118.70 118.27 1r4w s GLU 212 Ca 0.00 -0.54 -0.16 0.00 -0.41 0.00 0.00 54.97 53.86 1r4w s GLU 212 Cb 0.00 -2.47 -0.04 0.00 -1.78 0.00 0.00 34.13 29.83 1r4w s GLU 212 CO 0.00 -0.56 0.38 0.21 -0.49 0.00 0.00 175.26 174.80 1r4w s LYS 213 N -4.73 4.23 -0.14 1.61 2.20 -1.26 -4.32 119.74 117.33 1r4w s LYS 213 Ca 0.53 0.22 -0.18 0.00 -0.36 0.00 0.00 55.97 56.18 1r4w s LYS 213 Cb -0.10 -3.48 -0.04 0.00 -1.51 0.00 0.00 37.83 32.69 1r4w s LYS 213 CO 0.39 0.08 0.50 -0.46 -0.36 0.00 0.00 175.35 175.50 1r4w s TRP 214 N 0.92 3.48 -0.20 4.03 -0.11 -1.26 -4.96 118.94 120.84 1r4w s TRP 214 Ca 0.20 0.87 0.18 0.00 1.22 0.00 0.00 56.10 58.57 1r4w s TRP 214 Cb -0.14 -2.59 0.47 0.00 -1.50 0.00 0.00 33.47 29.70 1r4w s TRP 214 CO 0.07 0.10 1.16 -1.33 -4.62 0.00 0.00 176.95 172.33 1r4w n MET 215 N 3.96 1.78 0.00 5.86 2.81 -1.26 -5.11 117.12 125.17 1r4w n MET 215 Ca -0.06 -3.30 0.00 0.00 -1.81 0.00 0.00 57.70 52.53 1r4w n MET 215 Cb 0.51 -1.41 0.00 0.00 -0.71 0.00 0.00 33.22 31.61 1r4w n MET 215 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1r4w n GLY 216 N -0.46 -1.09 0.11 3.03 0.00 -1.26 -3.87 105.19 101.65 1r4w n GLY 216 Ca 0.18 -1.63 0.10 0.00 0.00 0.00 0.00 46.02 44.67 1r4w n GLY 216 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1r4w n PRO 217 N -1.30 0.15 -3.33 1.61 -0.02 -1.26 -3.68 135.00 127.16 1r4w n PRO 217 Ca 0.00 0.45 -0.26 0.00 -2.02 0.00 0.00 63.50 61.67 1r4w n PRO 217 Cb 0.00 -1.82 -0.08 0.00 -0.02 0.00 0.00 33.50 31.58 1r4w n PRO 217 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1r4w n VAL 218 N -2.11 0.73 -1.07 -1.45 0.31 -1.26 -4.65 118.33 108.83 1r4w n VAL 218 Ca 0.01 -4.56 -0.33 0.00 -0.01 0.00 0.00 64.34 59.45 1r4w n VAL 218 Cb 0.17 -2.02 0.13 0.00 -0.91 0.00 0.00 33.84 31.21 1r4w n VAL 218 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1r4w n PRO 219 N 1.25 0.13 -2.11 5.55 -0.04 -1.24 -4.88 135.00 133.66 1r4w n PRO 219 Ca 0.25 0.12 -0.40 0.00 -0.04 0.00 0.00 63.50 63.43 1r4w n PRO 219 Cb 0.47 -2.42 -0.03 0.00 -0.04 0.00 0.00 33.50 31.48 1r4w n PRO 219 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1r4w s PRO 220 N -4.12 2.98 0.29 0.54 0.04 -1.26 -4.86 135.00 128.60 1r4w s PRO 220 Ca 0.73 0.80 0.13 0.00 0.04 0.00 0.00 61.00 62.70 1r4w s PRO 220 Cb -0.29 -4.27 0.73 0.00 0.04 0.00 0.00 34.50 30.71 1r4w s PRO 220 CO 0.52 -2.31 1.32 -2.37 0.04 0.00 0.00 177.00 174.20 1r4w n THR 221 N 7.19 0.78 1.88 1.26 5.66 -1.26 -5.09 114.28 124.69 1r4w n THR 221 Ca 0.19 0.72 0.16 0.00 -3.05 0.00 0.00 64.05 62.06 1r4w n THR 221 Cb 0.50 -1.72 0.85 0.00 -1.55 0.00 0.00 70.33 68.41 1r4w n THR 221 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91