#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g4r s VAL 8 N 0.00 -0.02 0.11 5.15 1.01 0.85 -4.81 120.40 122.69 1g4r s VAL 8 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.09 1g4r s VAL 8 Cb 0.00 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 1g4r s VAL 8 CO 0.00 0.03 0.18 -0.36 0.00 0.00 0.00 175.10 174.96 1g4r s PHE 9 N 0.62 3.35 0.04 5.22 0.40 -0.06 -0.13 117.98 127.41 1g4r s PHE 9 Ca -0.04 0.11 -0.18 0.00 -0.60 0.00 0.00 56.93 56.21 1g4r s PHE 9 Cb -0.06 -1.64 0.04 0.00 0.51 0.00 0.00 43.02 41.86 1g4r s PHE 9 CO -0.03 0.54 0.41 -1.59 0.70 0.00 0.00 175.22 175.25 1g4r s LYS 10 N -2.83 0.91 -0.12 0.44 -2.85 -0.90 -0.05 119.74 114.34 1g4r s LYS 10 Ca 0.33 -0.33 -0.11 0.00 -1.00 0.00 0.00 55.97 54.86 1g4r s LYS 10 Cb -0.12 0.40 0.03 0.00 -2.06 0.00 0.00 37.83 36.09 1g4r s LYS 10 CO 0.26 -0.31 0.32 0.21 0.10 0.00 0.00 175.35 175.93 1g4r s LYS 11 N -2.34 0.39 0.19 1.78 2.20 -0.10 -2.80 119.74 119.05 1g4r s LYS 11 Ca -0.06 0.43 0.10 0.00 -0.36 0.00 0.00 55.97 56.07 1g4r s LYS 11 Cb -0.01 0.19 -0.04 0.00 -1.51 0.00 0.00 37.83 36.45 1g4r s LYS 11 CO -0.01 -0.05 -0.14 0.00 -0.36 0.00 0.00 175.35 174.79 1g4r s ALA 12 N 0.12 2.83 1.04 3.13 0.00 -1.26 0.27 121.76 127.88 1g4r s ALA 12 Ca -0.00 -1.53 -0.13 0.00 0.00 0.00 0.00 51.96 50.30 1g4r s ALA 12 Cb -0.02 -0.61 0.21 0.00 0.00 0.00 0.00 23.12 22.69 1g4r s ALA 12 CO 0.01 0.45 1.09 -1.54 0.00 0.00 0.00 175.76 175.77 1g4r s SER 13 N -2.80 2.28 0.17 0.00 1.04 -0.53 -4.88 113.70 108.99 1g4r s SER 13 Ca 0.24 1.15 -0.19 0.00 0.48 0.00 0.00 55.95 57.62 1g4r s SER 13 Cb -0.08 -1.80 0.10 0.00 0.10 0.00 0.00 66.02 64.34 1g4r s SER 13 CO 0.14 -3.34 1.32 -2.65 0.98 0.00 0.00 173.24 169.68 1g4r n PRO 14 N -4.31 -0.27 -3.38 4.02 -0.02 -1.23 -3.80 135.00 126.02 1g4r n PRO 14 Ca 0.05 1.30 -0.38 0.00 -2.02 0.00 0.00 63.50 62.45 1g4r n PRO 14 Cb 0.57 -1.92 -0.07 0.00 -0.02 0.00 0.00 33.50 32.06 1g4r n PRO 14 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1g4r s ASN 15 N -5.35 6.54 0.00 2.55 2.20 -1.23 -4.94 114.94 114.71 1g4r s ASN 15 Ca -0.11 0.63 0.00 0.00 -0.94 0.00 0.00 52.86 52.44 1g4r s ASN 15 Cb 0.14 -2.25 0.00 0.00 -2.00 0.00 0.00 41.25 37.15 1g4r s ASN 15 CO 0.58 -0.03 0.22 0.61 -2.94 0.00 0.00 177.10 175.54 1g4r n GLY 16 N 3.59 -0.00 0.50 0.45 0.00 -1.25 -3.39 105.19 105.08 1g4r n GLY 16 Ca -0.08 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.25 1g4r n GLY 16 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g4r h LYS 17 N 0.00 0.00 -3.88 1.61 1.79 -1.91 -3.40 116.57 110.78 1g4r h LYS 17 Ca 0.00 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.13 1g4r h LYS 17 Cb 0.01 0.00 -0.33 0.00 -1.58 0.00 0.00 32.23 30.33 1g4r h LYS 17 CO 0.00 0.00 -0.75 -1.17 -1.08 0.00 0.00 179.45 176.45 1g4r s LEU 18 N -8.42 1.40 -0.01 2.94 2.96 -1.22 -3.90 118.68 112.43 1g4r s LEU 18 Ca -0.05 -0.06 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 1g4r s LEU 18 Cb 0.22 -0.26 0.01 0.00 0.50 0.00 0.00 46.19 46.66 1g4r s LEU 18 CO 0.78 -0.06 -0.01 0.42 -1.32 0.00 0.00 176.35 176.17 1g4r s THR 19 N 0.73 0.15 0.02 3.68 -4.23 -1.19 -1.45 115.64 113.35 1g4r s THR 19 Ca -0.08 -0.01 -0.00 0.00 -1.18 0.00 0.00 61.69 60.42 1g4r s THR 19 Cb -0.11 -0.18 -0.04 0.00 1.34 0.00 0.00 72.50 73.51 1g4r s THR 19 CO -0.01 0.08 0.12 -0.69 -0.54 0.00 0.00 174.62 173.58 1g4r s VAL 20 N 0.36 4.92 -0.07 2.29 1.01 0.14 -1.05 120.40 128.00 1g4r s VAL 20 Ca -0.03 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1g4r s VAL 20 Cb -0.06 -3.30 0.02 0.00 0.00 0.00 0.00 36.38 33.04 1g4r s VAL 20 CO -0.01 0.28 -0.11 -0.31 0.00 0.00 0.00 175.10 174.94 1g4r s TYR 21 N -1.30 1.45 0.02 5.22 1.51 0.15 -0.92 117.35 123.48 1g4r s TYR 21 Ca 0.26 -0.56 0.04 0.00 -1.01 0.00 0.00 57.07 55.80 1g4r s TYR 21 Cb -0.12 -1.09 -0.02 0.00 -0.11 0.00 0.00 41.96 40.62 1g4r s TYR 21 CO 0.18 -0.31 -0.11 -0.51 -1.11 0.00 0.00 175.55 173.69 1g4r s LEU 22 N 0.83 2.13 0.20 -1.29 1.43 0.93 -2.13 118.68 120.78 1g4r s LEU 22 Ca -0.11 -0.37 0.24 0.00 -1.03 0.00 0.00 54.13 52.86 1g4r s LEU 22 Cb -0.15 -0.47 0.90 0.00 0.03 0.00 0.00 46.19 46.51 1g4r s LEU 22 CO 0.02 0.02 1.74 0.61 0.23 0.00 0.00 176.35 178.96 1g4r n GLY 23 N 2.15 -1.46 3.58 -3.19 0.00 -1.26 -0.88 105.19 104.14 1g4r n GLY 23 Ca -0.17 0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.80 1g4r n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g4r s LYS 24 N -3.18 0.43 0.22 1.61 -2.85 -1.26 -4.77 119.74 109.93 1g4r s LYS 24 Ca 0.08 -0.05 0.17 0.00 -1.00 0.00 0.00 55.97 55.17 1g4r s LYS 24 Cb 0.11 0.20 0.02 0.00 -2.06 0.00 0.00 37.83 36.10 1g4r s LYS 24 CO 0.48 -0.17 1.22 0.00 0.10 0.00 0.00 175.35 176.98 1g4r h ARG 25 N 2.17 0.00 -5.25 1.78 3.08 -1.96 -3.46 114.38 110.75 1g4r h ARG 25 Ca -0.14 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.25 1g4r h ARG 25 Cb 1.18 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 30.94 1g4r h ARG 25 CO 0.26 0.33 -0.80 -0.51 -1.07 0.00 0.00 179.97 178.19 1g4r s ASP 26 N -6.09 3.74 -0.15 7.04 1.01 -1.26 -1.52 116.67 119.43 1g4r s ASP 26 Ca 0.02 -0.43 -0.02 0.00 0.71 0.00 0.00 52.55 52.82 1g4r s ASP 26 Cb 0.08 -1.57 -0.02 0.00 1.01 0.00 0.00 42.92 42.42 1g4r s ASP 26 CO 0.76 0.12 -0.07 -0.36 0.21 0.00 0.00 175.17 175.83 1g4r s PHE 27 N 0.62 2.94 -0.03 4.23 0.40 0.25 -4.98 117.98 121.41 1g4r s PHE 27 Ca -0.08 -0.48 -0.23 0.00 -0.60 0.00 0.00 56.93 55.53 1g4r s PHE 27 Cb -0.16 -1.93 -0.04 0.00 0.51 0.00 0.00 43.02 41.40 1g4r s PHE 27 CO 0.03 -0.15 0.70 0.08 0.70 0.00 0.00 175.22 176.58 1g4r s VAL 28 N 0.47 4.95 -0.24 -0.44 1.01 -1.26 -1.20 120.40 123.68 1g4r s VAL 28 Ca -0.06 1.45 -0.14 0.00 0.00 0.00 0.00 61.98 63.24 1g4r s VAL 28 Cb -0.15 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 1g4r s VAL 28 CO 0.03 0.31 0.33 -0.62 0.00 0.00 0.00 175.10 175.15 1g4r s ASP 29 N 0.43 6.27 -0.13 3.32 -1.08 0.14 -0.36 116.67 125.26 1g4r s ASP 29 Ca 0.37 0.31 0.17 0.00 -0.52 0.00 0.00 52.55 52.87 1g4r s ASP 29 Cb -0.18 -2.19 0.68 0.00 -1.46 0.00 0.00 42.92 39.76 1g4r s ASP 29 CO 0.19 -0.10 1.59 1.41 0.52 0.00 0.00 175.17 178.78 1g4r n HIS 30 N 4.87 1.42 0.00 -5.34 8.25 0.82 -1.33 115.22 123.91 1g4r n HIS 30 Ca -0.10 -0.66 0.00 0.00 -0.26 0.00 0.00 57.72 56.70 1g4r n HIS 30 Cb 0.51 -0.28 0.00 0.00 1.12 0.00 0.00 29.99 31.34 1g4r n HIS 30 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1g4r n ILE 31 N 0.77 0.00 0.03 1.59 5.41 -1.26 -4.37 119.36 121.53 1g4r n ILE 31 Ca 0.24 0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.85 1g4r n ILE 31 Cb 0.90 0.00 -0.14 0.00 -0.71 0.00 0.00 39.64 39.69 1g4r n ILE 31 CO 0.00 0.00 0.00 -2.24 0.00 0.00 0.00 176.55 174.31 1g4r h ASP 32 N 0.00 0.24 -5.23 4.38 2.03 -1.94 -3.47 116.42 112.44 1g4r h ASP 32 Ca 0.00 -0.39 -0.05 0.00 -0.73 0.00 0.00 57.03 55.86 1g4r h ASP 32 Cb 0.00 -0.08 -0.09 0.00 -0.83 0.00 0.00 39.33 38.34 1g4r h ASP 32 CO 0.00 1.33 -0.09 -1.48 -1.03 0.00 0.00 179.24 177.97 1g4r s LEU 33 N -6.70 0.29 -0.03 0.15 0.05 -1.26 -4.81 118.68 106.38 1g4r s LEU 33 Ca -0.09 -0.93 0.06 0.00 0.05 0.00 0.00 54.13 53.22 1g4r s LEU 33 Cb 0.07 1.84 -0.01 0.00 -2.05 0.00 0.00 46.19 46.05 1g4r s LEU 33 CO 0.83 -1.17 -0.20 -0.69 -0.55 0.00 0.00 176.35 174.57 1g4r s VAL 34 N -3.96 1.59 0.12 1.48 1.01 -1.26 -0.12 120.40 119.25 1g4r s VAL 34 Ca 0.22 -0.84 -0.35 0.00 0.00 0.00 0.00 61.98 61.00 1g4r s VAL 34 Cb -0.01 -1.34 -0.15 0.00 0.00 0.00 0.00 36.38 34.88 1g4r s VAL 34 CO 0.09 0.45 1.47 -0.62 0.00 0.00 0.00 175.10 176.49 1g4r n GLU 35 N 2.78 1.65 -2.02 2.72 1.02 0.52 -4.75 120.64 122.56 1g4r n GLU 35 Ca -0.16 0.60 -0.35 0.00 -0.02 0.00 0.00 57.16 57.22 1g4r n GLU 35 Cb 0.53 -2.31 0.03 0.00 -0.02 0.00 0.00 31.44 29.67 1g4r n GLU 35 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1g4r s PRO 36 N 0.78 3.00 -0.85 3.49 0.02 -1.26 -4.70 135.00 135.49 1g4r s PRO 36 Ca 0.82 1.74 -0.16 0.00 0.02 0.00 0.00 61.00 63.42 1g4r s PRO 36 Cb -0.82 -1.94 0.18 0.00 0.02 0.00 0.00 34.50 31.94 1g4r s PRO 36 CO 0.43 -1.16 0.88 0.08 -0.33 0.00 0.00 177.00 176.89 1g4r s VAL 37 N -1.71 5.29 -0.35 3.83 1.01 -0.61 -4.97 120.40 122.89 1g4r s VAL 37 Ca 0.75 -2.11 -0.11 0.00 0.00 0.00 0.00 61.98 60.52 1g4r s VAL 37 Cb -0.28 -4.57 0.01 0.00 0.00 0.00 0.00 36.38 31.54 1g4r s VAL 37 CO 0.33 -1.19 0.19 1.51 0.00 0.00 0.00 175.10 175.94 1g4r s ASP 38 N 2.72 5.68 0.10 3.32 -4.77 -1.26 -1.19 116.67 121.27 1g4r s ASP 38 Ca 0.22 -0.78 0.01 0.00 -3.30 0.00 0.00 52.55 48.71 1g4r s ASP 38 Cb -0.09 -2.02 -0.00 0.00 -1.09 0.00 0.00 42.92 39.71 1g4r s ASP 38 CO -0.08 -0.30 0.04 0.61 0.70 0.00 0.00 175.17 176.13 1g4r n GLY 39 N 5.00 3.89 3.12 2.12 0.00 0.12 -4.41 105.19 115.03 1g4r n GLY 39 Ca -0.13 -1.94 -0.12 0.00 0.00 0.00 0.00 46.02 43.83 1g4r n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g4r s VAL 40 N -1.93 0.07 0.04 1.61 1.01 -0.91 -1.27 120.40 119.01 1g4r s VAL 40 Ca 0.05 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 61.53 1g4r s VAL 40 Cb 0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 1g4r s VAL 40 CO 0.04 -0.32 -0.23 0.54 0.00 0.00 0.00 175.10 175.12 1g4r s VAL 41 N -1.21 1.86 -0.38 2.92 0.11 0.10 -0.67 120.40 123.13 1g4r s VAL 41 Ca -0.13 -1.24 -0.09 0.00 -2.93 0.00 0.00 61.98 57.59 1g4r s VAL 41 Cb -0.07 -1.60 0.05 0.00 -1.53 0.00 0.00 36.38 33.23 1g4r s VAL 41 CO 0.02 0.31 0.20 -0.22 -3.33 0.00 0.00 175.10 172.07 1g4r s LEU 42 N -1.11 4.76 0.05 2.54 2.96 -0.21 -0.80 118.68 126.87 1g4r s LEU 42 Ca 0.09 -1.19 0.00 0.00 -0.22 0.00 0.00 54.13 52.82 1g4r s LEU 42 Cb -0.09 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.58 1g4r s LEU 42 CO 0.01 -0.42 0.17 0.68 -1.32 0.00 0.00 176.35 175.48 1g4r s VAL 43 N 1.48 5.20 -0.68 1.68 -7.23 0.37 -3.15 120.40 118.06 1g4r s VAL 43 Ca 0.01 -0.43 -0.01 0.00 -1.81 0.00 0.00 61.98 59.74 1g4r s VAL 43 Cb -0.20 -3.51 0.17 0.00 0.56 0.00 0.00 36.38 33.40 1g4r s VAL 43 CO 0.04 0.17 0.50 1.51 -0.31 0.00 0.00 175.10 177.02 1g4r s ASP 44 N -2.37 5.26 0.38 4.85 3.84 -1.25 -4.71 116.67 122.67 1g4r s ASP 44 Ca 0.32 -3.17 0.29 0.00 -0.00 0.00 0.00 52.55 49.99 1g4r s ASP 44 Cb -0.13 -1.82 1.27 0.00 -1.38 0.00 0.00 42.92 40.86 1g4r s ASP 44 CO 0.25 -0.28 1.31 -2.65 -0.00 0.00 0.00 175.17 173.79 1g4r n PRO 45 N 3.03 -0.03 0.16 2.11 -0.02 -1.26 -0.95 135.00 138.05 1g4r n PRO 45 Ca 0.12 1.04 -0.12 0.00 -2.02 0.00 0.00 63.50 62.51 1g4r n PRO 45 Cb 0.37 -2.07 -0.07 0.00 -0.02 0.00 0.00 33.50 31.70 1g4r n PRO 45 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1g4r h GLU 46 N 0.00 -0.44 -0.71 -0.52 4.81 -1.95 0.15 114.58 115.92 1g4r h GLU 46 Ca 0.74 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 60.10 1g4r h GLU 46 Cb 2.46 0.10 -0.07 0.00 0.63 0.00 0.00 28.75 31.87 1g4r h GLU 46 CO -0.35 -0.12 0.34 -0.92 -0.73 0.00 0.00 179.01 177.23 1g4r h TYR 47 N -0.91 0.61 -0.09 0.92 3.20 -1.48 -2.27 116.97 116.96 1g4r h TYR 47 Ca -0.05 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 1g4r h TYR 47 Cb 0.53 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.63 1g4r h TYR 47 CO 0.03 0.20 0.02 -0.07 -1.64 0.00 0.00 178.16 176.71 1g4r h LEU 48 N 0.58 0.13 0.00 2.82 3.38 -1.40 -3.45 115.31 117.37 1g4r h LEU 48 Ca 0.36 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1g4r h LEU 48 Cb 0.40 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1g4r h LEU 48 CO -0.28 0.32 0.00 2.29 0.09 0.00 0.00 178.44 180.86 1g4r n LYS 49 N -4.89 0.00 0.20 1.13 2.85 0.52 -1.67 118.16 116.30 1g4r n LYS 49 Ca -0.06 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.10 1g4r n LYS 49 Cb 0.15 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.48 1g4r n LYS 49 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1g4r h GLU 50 N 0.00 -0.54 -6.52 -1.58 3.07 -1.87 -3.47 114.58 103.66 1g4r h GLU 50 Ca 0.00 0.04 -0.60 0.00 -0.50 0.00 0.00 59.36 58.30 1g4r h GLU 50 Cb 0.00 0.12 0.11 0.00 -0.84 0.00 0.00 28.75 28.15 1g4r h GLU 50 CO 0.00 -0.31 0.16 0.54 -1.40 0.00 0.00 179.01 178.01 1g4r n ARG 51 N -5.16 1.43 -3.88 2.33 1.74 -0.67 -4.78 116.66 107.67 1g4r n ARG 51 Ca -0.08 0.50 -0.25 0.00 -0.77 0.00 0.00 57.85 57.25 1g4r n ARG 51 Cb 0.25 -1.92 -0.03 0.00 -1.02 0.00 0.00 32.46 29.74 1g4r n ARG 51 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1g4r s ARG 52 N -1.66 3.46 -0.26 5.56 0.52 0.16 -4.78 118.95 121.95 1g4r s ARG 52 Ca 0.59 -0.57 -0.09 0.00 -0.52 0.00 0.00 55.73 55.14 1g4r s ARG 52 Cb -0.66 -2.92 -0.03 0.00 0.52 0.00 0.00 34.95 31.86 1g4r s ARG 52 CO 0.60 0.47 0.11 0.08 0.02 0.00 0.00 175.30 176.57 1g4r s VAL 53 N -1.84 4.62 0.21 3.52 1.01 0.25 -0.14 120.40 128.03 1g4r s VAL 53 Ca 0.35 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 62.32 1g4r s VAL 53 Cb -0.11 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 1g4r s VAL 53 CO 0.29 0.29 0.04 -0.31 0.00 0.00 0.00 175.10 175.41 1g4r s TYR 54 N 1.66 2.86 -0.08 5.22 1.51 0.34 -0.16 117.35 128.70 1g4r s TYR 54 Ca 0.06 -0.15 -0.03 0.00 -1.01 0.00 0.00 57.07 55.95 1g4r s TYR 54 Cb -0.15 -1.34 0.04 0.00 -0.11 0.00 0.00 41.96 40.39 1g4r s TYR 54 CO 0.06 0.55 0.05 0.08 -1.11 0.00 0.00 175.55 175.18 1g4r s VAL 55 N -1.96 0.03 -0.04 0.71 1.01 0.32 -0.25 120.40 120.21 1g4r s VAL 55 Ca 0.30 0.18 0.03 0.00 0.00 0.00 0.00 61.98 62.49 1g4r s VAL 55 Cb -0.08 -0.37 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 1g4r s VAL 55 CO 0.20 0.07 -0.13 -0.89 0.00 0.00 0.00 175.10 174.36 1g4r s THR 56 N 2.11 3.20 -0.22 3.92 2.01 0.11 -1.46 115.64 125.30 1g4r s THR 56 Ca 0.04 -0.71 -0.04 0.00 0.31 0.00 0.00 61.69 61.29 1g4r s THR 56 Cb -0.13 -2.28 -0.01 0.00 0.01 0.00 0.00 72.50 70.09 1g4r s THR 56 CO -0.05 0.56 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.19 1g4r s LEU 57 N -0.84 2.96 -0.08 4.42 2.96 0.13 -0.17 118.68 128.06 1g4r s LEU 57 Ca 0.12 -0.36 0.05 0.00 -0.22 0.00 0.00 54.13 53.72 1g4r s LEU 57 Cb -0.11 -1.76 -0.00 0.00 0.50 0.00 0.00 46.19 44.82 1g4r s LEU 57 CO 0.01 -0.02 -0.24 -0.89 -1.32 0.00 0.00 176.35 173.90 1g4r s THR 58 N 1.47 2.00 -0.20 3.68 2.01 0.10 -0.82 115.64 123.88 1g4r s THR 58 Ca 0.06 -1.01 -0.03 0.00 0.31 0.00 0.00 61.69 61.02 1g4r s THR 58 Cb -0.14 -1.71 -0.01 0.00 0.01 0.00 0.00 72.50 70.64 1g4r s THR 58 CO -0.02 0.55 -0.07 0.00 -0.69 0.00 0.00 174.62 174.39 1g4r s ALA 60 N 1.26 -0.49 -0.08 0.00 0.00 -0.75 -0.67 121.76 121.03 1g4r s ALA 60 Ca 0.03 -0.03 -0.14 0.00 0.00 0.00 0.00 51.96 51.82 1g4r s ALA 60 Cb -0.14 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.09 1g4r s ALA 60 CO -0.03 -0.28 0.34 0.12 0.00 0.00 0.00 175.76 175.92 1g4r s PHE 61 N -1.78 3.61 0.04 0.00 5.36 0.19 -1.75 117.98 123.64 1g4r s PHE 61 Ca -0.11 0.80 0.03 0.00 -0.96 0.00 0.00 56.93 56.69 1g4r s PHE 61 Cb -0.05 -2.28 -0.02 0.00 -0.34 0.00 0.00 43.02 40.33 1g4r s PHE 61 CO 0.01 0.48 -0.10 -0.98 -1.46 0.00 0.00 175.22 173.17 1g4r s ARG 62 N -0.41 0.64 -0.01 10.12 3.03 -0.08 -0.28 118.95 131.96 1g4r s ARG 62 Ca 0.21 -0.69 0.02 0.00 2.03 0.00 0.00 55.73 57.30 1g4r s ARG 62 Cb -0.15 -0.53 -0.00 0.00 -1.03 0.00 0.00 34.95 33.24 1g4r s ARG 62 CO 0.09 0.12 -0.06 -0.47 -1.13 0.00 0.00 175.30 173.84 1g4r s TYR 63 N -1.04 0.58 0.00 5.89 5.04 0.68 -1.73 117.35 126.77 1g4r s TYR 63 Ca -0.04 -0.11 0.00 0.00 -2.44 0.00 0.00 57.07 54.48 1g4r s TYR 63 Cb -0.08 -0.38 0.00 0.00 0.35 0.00 0.00 41.96 41.85 1g4r s TYR 63 CO 0.01 -0.02 0.00 0.41 -1.34 0.00 0.00 175.55 174.61 1g4r n GLY 64 N 2.98 2.06 3.22 8.97 0.00 0.15 -1.21 105.19 121.36 1g4r n GLY 64 Ca -0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 1g4r n GLY 64 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1g4r s ARG 65 N -0.18 0.95 0.00 1.61 3.52 -1.23 -4.57 118.95 119.05 1g4r s ARG 65 Ca 0.00 -1.23 0.06 0.00 -0.13 0.00 0.00 55.73 54.43 1g4r s ARG 65 Cb 0.00 0.30 0.32 0.00 -1.56 0.00 0.00 34.95 34.02 1g4r s ARG 65 CO 0.00 -0.30 1.22 -0.85 -0.81 0.00 0.00 175.30 174.56 1g4r n GLU 66 N -0.10 1.10 -3.95 5.12 0.28 -1.26 -4.39 120.64 117.43 1g4r n GLU 66 Ca -0.09 -0.15 -0.11 0.00 -0.16 0.00 0.00 57.16 56.65 1g4r n GLU 66 Cb 0.63 -1.11 -0.01 0.00 1.43 0.00 0.00 31.44 32.38 1g4r n GLU 66 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1g4r s ASP 67 N -1.16 0.40 0.00 -1.84 1.01 -1.26 -5.03 116.67 108.79 1g4r s ASP 67 Ca 0.10 -1.26 0.05 0.00 0.71 0.00 0.00 52.55 52.16 1g4r s ASP 67 Cb 0.05 0.74 0.25 0.00 1.01 0.00 0.00 42.92 44.97 1g4r s ASP 67 CO 0.08 -1.45 1.18 0.18 0.21 0.00 0.00 175.17 175.36 1g4r n LEU 68 N -0.53 0.37 -4.66 1.23 4.77 -1.26 -4.91 117.00 112.00 1g4r n LEU 68 Ca -0.03 -0.18 -0.30 0.00 -0.03 0.00 0.00 56.01 55.47 1g4r n LEU 68 Cb 0.61 -0.04 0.17 0.00 -2.33 0.00 0.00 43.42 41.82 1g4r n LEU 68 CO 0.27 0.09 0.64 1.51 -1.33 0.00 0.00 177.39 178.57 1g4r s ASP 69 N -1.11 2.89 -0.04 -1.43 3.84 -1.26 -5.03 116.67 114.53 1g4r s ASP 69 Ca 0.09 1.66 -0.14 0.00 -0.00 0.00 0.00 52.55 54.16 1g4r s ASP 69 Cb 0.05 -2.30 -0.08 0.00 -1.38 0.00 0.00 42.92 39.21 1g4r s ASP 69 CO 0.07 -3.03 0.58 0.58 -0.00 0.00 0.00 175.17 173.37 1g4r h VAL 70 N -1.82 0.00 -0.38 2.11 2.07 -1.95 -3.39 116.25 112.89 1g4r h VAL 70 Ca -0.50 -0.60 -0.78 0.00 0.82 0.00 0.00 66.70 65.64 1g4r h VAL 70 Cb 1.29 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1g4r h VAL 70 CO 0.51 0.00 1.18 -0.11 0.02 0.00 0.00 177.57 179.17 1g4r n LEU 71 N -4.99 1.05 0.00 2.57 7.94 -1.26 -0.65 117.00 121.66 1g4r n LEU 71 Ca -0.06 0.78 0.00 0.00 -1.11 0.00 0.00 56.01 55.61 1g4r n LEU 71 Cb 0.20 -0.94 0.00 0.00 0.53 0.00 0.00 43.42 43.20 1g4r n LEU 71 CO 0.15 -0.77 0.00 0.61 -1.11 0.00 0.00 177.39 176.27 1g4r n GLY 72 N 6.55 0.46 3.55 -3.96 0.00 -1.26 -4.85 105.19 105.68 1g4r n GLY 72 Ca 0.47 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.07 1g4r n GLY 72 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1g4r s LEU 73 N 0.00 3.77 0.10 0.99 2.96 0.18 -3.99 118.68 122.70 1g4r s LEU 73 Ca 0.00 -0.14 0.23 0.00 -0.22 0.00 0.00 54.13 54.00 1g4r s LEU 73 Cb 0.00 -2.98 0.02 0.00 0.50 0.00 0.00 46.19 43.73 1g4r s LEU 73 CO 0.00 -1.36 1.00 0.35 -1.32 0.00 0.00 176.35 175.02 1g4r n THR 74 N 6.42 0.34 -3.78 3.68 -2.24 -0.35 -4.92 114.28 113.43 1g4r n THR 74 Ca 0.05 -0.39 -0.13 0.00 -2.27 0.00 0.00 64.05 61.31 1g4r n THR 74 Cb 0.48 -0.06 -0.11 0.00 -2.10 0.00 0.00 70.33 68.54 1g4r n THR 74 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1g4r s PHE 75 N -3.30 -0.28 -0.10 4.78 5.36 -1.02 -5.00 117.98 118.42 1g4r s PHE 75 Ca 0.01 0.67 -0.05 0.00 -0.96 0.00 0.00 56.93 56.59 1g4r s PHE 75 Cb 0.12 0.10 0.04 0.00 -0.34 0.00 0.00 43.02 42.94 1g4r s PHE 75 CO 0.80 -0.16 0.24 0.50 -1.46 0.00 0.00 175.22 175.14 1g4r s ARG 76 N 0.00 0.21 -0.13 10.12 3.52 -1.26 -0.23 118.95 131.18 1g4r s ARG 76 Ca -0.01 0.50 0.00 0.00 -0.13 0.00 0.00 55.73 56.09 1g4r s ARG 76 Cb -0.02 -0.10 0.02 0.00 -1.56 0.00 0.00 34.95 33.29 1g4r s ARG 76 CO 0.01 -0.15 -0.12 0.21 -0.81 0.00 0.00 175.30 174.44 1g4r s LYS 77 N 1.15 2.02 0.00 5.12 2.20 0.61 -4.96 119.74 125.88 1g4r s LYS 77 Ca -0.08 -0.45 -0.30 0.00 -0.36 0.00 0.00 55.97 54.78 1g4r s LYS 77 Cb -0.10 -1.91 -0.04 0.00 -1.51 0.00 0.00 37.83 34.27 1g4r s LYS 77 CO -0.08 -0.24 1.19 -0.51 -0.36 0.00 0.00 175.35 175.35 1g4r s ASP 78 N 1.54 7.08 -0.15 1.43 1.01 -1.26 -0.64 116.67 125.68 1g4r s ASP 78 Ca 0.04 1.90 0.08 0.00 0.71 0.00 0.00 52.55 55.29 1g4r s ASP 78 Cb -0.13 -2.57 -0.15 0.00 1.01 0.00 0.00 42.92 41.08 1g4r s ASP 78 CO -0.09 -0.51 -0.03 0.18 0.21 0.00 0.00 175.17 174.93 1g4r n LEU 79 N 4.51 1.09 -3.65 1.23 4.77 0.16 -4.96 117.00 120.16 1g4r n LEU 79 Ca 0.10 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.92 1g4r n LEU 79 Cb 0.47 -0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.47 1g4r n LEU 79 CO 0.55 0.51 0.33 0.12 -1.33 0.00 0.00 177.39 177.57 1g4r s PHE 80 N -2.34 -0.79 -0.01 -1.77 5.36 -0.81 -4.98 117.98 112.64 1g4r s PHE 80 Ca -0.13 1.81 0.00 0.00 -0.96 0.00 0.00 56.93 57.65 1g4r s PHE 80 Cb 0.05 0.34 0.01 0.00 -0.34 0.00 0.00 43.02 43.08 1g4r s PHE 80 CO 0.50 -0.39 0.01 0.08 -1.46 0.00 0.00 175.22 173.97 1g4r s VAL 81 N 0.71 0.03 -0.02 3.12 1.01 -1.26 0.26 120.40 124.25 1g4r s VAL 81 Ca -0.03 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.04 1g4r s VAL 81 Cb -0.05 -0.09 0.01 0.00 0.00 0.00 0.00 36.38 36.25 1g4r s VAL 81 CO -0.05 0.06 -0.03 0.00 0.00 0.00 0.00 175.10 175.08 1g4r s ALA 82 N 0.53 0.38 -0.06 5.51 0.00 0.00 -4.98 121.76 123.14 1g4r s ALA 82 Ca -0.05 -0.06 0.01 0.00 0.00 0.00 0.00 51.96 51.87 1g4r s ALA 82 Cb -0.07 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 22.87 1g4r s ALA 82 CO -0.01 0.03 -0.07 1.21 0.00 0.00 0.00 175.76 176.91 1g4r s ASN 83 N 0.36 1.44 0.01 0.00 3.84 -1.26 0.22 114.94 119.54 1g4r s ASN 83 Ca -0.04 -0.21 0.05 0.00 0.21 0.00 0.00 52.86 52.87 1g4r s ASN 83 Cb -0.07 -0.64 -0.02 0.00 -0.55 0.00 0.00 41.25 39.98 1g4r s ASN 83 CO -0.01 -0.04 -0.15 0.68 -2.79 0.00 0.00 177.10 174.80 1g4r s VAL 84 N 0.97 1.17 -0.35 -5.21 -7.23 -0.54 -5.00 120.40 104.21 1g4r s VAL 84 Ca -0.10 -0.81 -0.16 0.00 -1.81 0.00 0.00 61.98 59.11 1g4r s VAL 84 Cb -0.15 -1.01 -0.01 0.00 0.56 0.00 0.00 36.38 35.78 1g4r s VAL 84 CO 0.00 0.19 0.41 -1.58 -0.31 0.00 0.00 175.10 173.81 1g4r s GLN 85 N -0.70 3.53 -0.06 4.82 0.74 -1.26 -0.52 119.66 126.20 1g4r s GLN 85 Ca 0.04 -0.39 -0.03 0.00 0.05 0.00 0.00 55.36 55.04 1g4r s GLN 85 Cb -0.07 -3.82 -0.27 0.00 1.10 0.00 0.00 33.01 29.95 1g4r s GLN 85 CO 0.00 -0.59 0.59 0.66 -0.55 0.00 0.00 175.29 175.41 1g4r h SER 86 N 8.49 0.36 -3.35 6.67 4.64 -0.86 -3.25 113.55 126.25 1g4r h SER 86 Ca -0.29 -0.66 -0.32 0.00 -0.47 0.00 0.00 61.79 60.05 1g4r h SER 86 Cb 1.14 -0.12 -0.36 0.00 -0.31 0.00 0.00 62.40 62.75 1g4r h SER 86 CO 0.72 1.58 -0.70 0.12 -0.87 0.00 0.00 176.83 177.68 1g4r s PHE 87 N -2.58 -0.02 0.57 4.77 2.19 -0.80 -2.79 117.98 119.32 1g4r s PHE 87 Ca -0.15 0.32 -0.18 0.00 0.33 0.00 0.00 56.93 57.25 1g4r s PHE 87 Cb 0.07 -0.32 -0.04 0.00 -1.31 0.00 0.00 43.02 41.42 1g4r s PHE 87 CO 0.81 -0.17 1.10 -2.14 1.83 0.00 0.00 175.22 176.65 1g4r s PRO 88 N 1.74 3.27 -0.28 10.12 0.02 -1.26 0.87 135.00 149.48 1g4r s PRO 88 Ca -0.01 1.43 -0.32 0.00 0.02 0.00 0.00 61.00 62.12 1g4r s PRO 88 Cb -0.12 -2.01 -0.09 0.00 0.02 0.00 0.00 34.50 32.30 1g4r s PRO 88 CO -0.04 -0.88 2.19 -2.30 -0.33 0.00 0.00 177.00 175.64 1g4r n PRO 89 N -1.68 1.51 -2.43 5.54 -0.02 -1.12 -4.91 135.00 131.89 1g4r n PRO 89 Ca 0.10 0.42 -0.42 0.00 -2.02 0.00 0.00 63.50 61.59 1g4r n PRO 89 Cb 0.52 -2.80 -0.03 0.00 -0.02 0.00 0.00 33.50 31.16 1g4r n PRO 89 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1g4r s ALA 90 N 7.59 3.40 0.08 3.55 0.00 -1.23 -4.97 121.76 130.17 1g4r s ALA 90 Ca 1.05 0.86 -0.30 0.00 0.00 0.00 0.00 51.96 53.57 1g4r s ALA 90 Cb -0.63 -3.42 -0.14 0.00 0.00 0.00 0.00 23.12 18.93 1g4r s ALA 90 CO 0.43 -0.38 1.48 -1.35 0.00 0.00 0.00 175.76 175.94 1g4r h PRO 91 N 6.21 -0.76 -0.87 0.00 0.11 -1.94 -3.00 132.00 131.75 1g4r h PRO 91 Ca -0.43 0.05 0.23 0.00 0.11 0.00 0.00 66.00 65.96 1g4r h PRO 91 Cb 1.21 0.17 -0.14 0.00 0.11 0.00 0.00 31.00 32.36 1g4r h PRO 91 CO 0.78 -0.50 0.25 0.93 -0.21 0.00 0.00 178.00 179.25 1g4r h GLU 92 N -0.78 0.23 -2.35 1.05 3.07 -2.01 -1.91 114.58 111.88 1g4r h GLU 92 Ca -0.03 -0.01 -0.19 0.00 -0.50 0.00 0.00 59.36 58.62 1g4r h GLU 92 Cb 0.72 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.53 1g4r h GLU 92 CO -0.13 0.15 0.21 -0.25 -1.40 0.00 0.00 179.01 177.59 1g4r n ASP 93 N -5.19 4.34 -4.56 1.42 8.00 -1.13 -4.91 116.55 114.51 1g4r n ASP 93 Ca 0.21 -2.27 -0.36 0.00 0.71 0.00 0.00 54.79 53.07 1g4r n ASP 93 Cb 0.66 -1.12 0.08 0.00 -0.02 0.00 0.00 41.12 40.72 1g4r n ASP 93 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1g4r n LYS 94 N 2.77 0.48 -3.15 -1.24 -0.00 -0.72 -4.87 118.16 111.43 1g4r n LYS 94 Ca 0.36 0.21 0.04 0.00 -0.00 0.00 0.00 58.31 58.92 1g4r n LYS 94 Cb 0.64 -2.06 -0.00 0.00 -0.00 0.00 0.00 35.03 33.61 1g4r n LYS 94 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1g4r s LYS 95 N -3.02 0.55 -0.99 -1.58 1.02 -1.26 -5.08 119.74 109.38 1g4r s LYS 95 Ca 0.71 0.58 -0.25 0.00 0.02 0.00 0.00 55.97 57.02 1g4r s LYS 95 Cb -0.36 0.27 -0.15 0.00 -0.52 0.00 0.00 37.83 37.08 1g4r s LYS 95 CO 0.52 -1.00 2.14 -2.14 -0.92 0.00 0.00 175.35 173.95 1g4r s PRO 96 N 2.83 1.77 0.37 -1.68 0.02 -1.26 -4.90 135.00 132.15 1g4r s PRO 96 Ca 0.11 -0.28 -0.09 0.00 0.02 0.00 0.00 61.00 60.76 1g4r s PRO 96 Cb -0.10 -4.99 -0.08 0.00 0.02 0.00 0.00 34.50 29.35 1g4r s PRO 96 CO -0.26 -4.57 -0.21 1.28 -0.33 0.00 0.00 177.00 172.91 1g4r n LEU 97 N 17.49 -2.47 -4.69 -5.54 4.32 -1.26 -4.97 117.00 119.87 1g4r n LEU 97 Ca 0.43 0.25 -0.31 0.00 -0.02 0.00 0.00 56.01 56.37 1g4r n LEU 97 Cb 0.46 -0.44 -0.08 0.00 -1.62 0.00 0.00 43.42 41.74 1g4r n LEU 97 CO 0.59 -2.84 -0.32 0.42 -1.22 0.00 0.00 177.39 174.02 1g4r s THR 98 N -1.08 4.12 0.19 -5.08 -4.23 -1.26 -4.95 115.64 103.35 1g4r s THR 98 Ca 0.27 -0.81 -0.16 0.00 -1.18 0.00 0.00 61.69 59.81 1g4r s THR 98 Cb -0.20 -2.92 0.17 0.00 1.34 0.00 0.00 72.50 70.89 1g4r s THR 98 CO 0.39 0.22 1.30 0.54 -0.54 0.00 0.00 174.62 176.54 1g4r n ARG 99 N 0.89 -0.22 -0.05 3.99 1.74 -1.26 0.17 116.66 121.92 1g4r n ARG 99 Ca -0.12 1.29 0.16 0.00 -0.77 0.00 0.00 57.85 58.41 1g4r n ARG 99 Cb 0.52 -1.91 0.58 0.00 -1.02 0.00 0.00 32.46 30.63 1g4r n ARG 99 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1g4r h LEU 100 N 0.00 0.22 -0.07 0.55 5.85 -1.98 -0.39 115.31 119.49 1g4r h LEU 100 Ca 0.27 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.88 1g4r h LEU 100 Cb 0.48 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.48 1g4r h LEU 100 CO -0.83 0.12 -0.44 1.56 -0.34 0.00 0.00 178.44 178.52 1g4r h GLN 101 N 0.24 0.41 0.38 1.25 4.20 0.14 -2.38 115.11 119.35 1g4r h GLN 101 Ca 0.27 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1g4r h GLN 101 Cb 0.76 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.60 1g4r h GLN 101 CO -0.05 1.00 -0.36 0.93 -0.67 0.00 0.00 178.83 179.68 1g4r h GLU 102 N -0.06 -0.71 -1.21 1.46 5.08 -0.21 -0.43 114.58 118.51 1g4r h GLU 102 Ca -0.04 0.05 0.35 0.00 -1.00 0.00 0.00 59.36 58.72 1g4r h GLU 102 Cb 1.10 0.16 -0.09 0.00 0.50 0.00 0.00 28.75 30.42 1g4r h GLU 102 CO 0.09 -0.47 0.81 0.00 -1.00 0.00 0.00 179.01 178.44 1g4r h ARG 103 N -0.73 0.18 0.12 2.33 3.08 -1.21 -0.97 114.38 117.18 1g4r h ARG 103 Ca -0.05 -0.01 -0.28 0.00 0.07 0.00 0.00 59.98 59.71 1g4r h ARG 103 Cb 0.63 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.64 1g4r h ARG 103 CO -0.03 0.12 -1.31 1.25 -1.07 0.00 0.00 179.97 178.93 1g4r h LEU 104 N 0.19 0.40 -0.44 3.04 5.85 -0.79 -2.72 115.31 120.84 1g4r h LEU 104 Ca 0.67 -0.45 -0.15 0.00 0.84 0.00 0.00 57.88 58.79 1g4r h LEU 104 Cb 2.13 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 43.02 1g4r h LEU 104 CO -0.24 1.36 -0.33 0.40 -0.34 0.00 0.00 178.44 179.29 1g4r h ILE 105 N 0.07 1.27 0.93 4.05 2.04 0.20 -1.32 117.51 124.75 1g4r h ILE 105 Ca -0.16 -1.50 -0.04 0.00 1.00 0.00 0.00 64.86 64.16 1g4r h ILE 105 Cb 1.98 1.29 0.01 0.00 -0.74 0.00 0.00 36.82 39.35 1g4r h ILE 105 CO 0.19 0.51 -0.47 0.50 0.00 0.00 0.00 178.15 178.88 1g4r h LYS 106 N 0.79 -1.23 0.00 2.37 3.64 -1.42 0.23 116.57 120.96 1g4r h LYS 106 Ca 0.08 0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1g4r h LYS 106 Cb 0.92 0.28 -0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1g4r h LYS 106 CO 0.09 -0.82 -0.03 -0.22 -2.27 0.00 0.00 179.45 176.20 1g4r h LYS 107 N -1.28 0.00 0.02 1.90 3.64 -1.48 -3.15 116.57 116.22 1g4r h LYS 107 Ca -0.13 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 58.95 1g4r h LYS 107 Cb 0.99 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.76 1g4r h LYS 107 CO 0.20 0.03 -1.76 1.28 -2.27 0.00 0.00 179.45 176.92 1g4r n LEU 108 N -4.34 1.19 0.00 5.20 4.77 -0.50 -5.10 117.00 118.23 1g4r n LEU 108 Ca -0.03 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1g4r n LEU 108 Cb 0.12 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1g4r n LEU 108 CO 0.33 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1g4r n GLY 109 N 1.64 0.76 0.90 -0.72 0.00 0.06 -4.82 105.19 103.01 1g4r n GLY 109 Ca -0.20 -2.03 0.09 0.00 0.00 0.00 0.00 46.02 43.88 1g4r n GLY 109 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1g4r n GLU 110 N 0.00 2.15 -0.09 1.61 1.02 -1.26 -3.89 120.64 120.18 1g4r n GLU 110 Ca 0.00 -1.99 0.12 0.00 -0.02 0.00 0.00 57.16 55.26 1g4r n GLU 110 Cb 0.00 -1.40 0.33 0.00 -0.02 0.00 0.00 31.44 30.35 1g4r n GLU 110 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1g4r n HIS 111 N 1.12 0.23 -3.61 -0.32 8.25 -1.26 -4.79 115.22 114.83 1g4r n HIS 111 Ca 0.15 -0.11 -0.38 0.00 -0.26 0.00 0.00 57.72 57.11 1g4r n HIS 111 Cb 0.50 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.50 1g4r n HIS 111 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1g4r s ALA 112 N -1.77 3.44 0.09 -1.41 0.00 -1.25 -0.48 121.76 120.37 1g4r s ALA 112 Ca 0.34 -1.19 0.09 0.00 0.00 0.00 0.00 51.96 51.20 1g4r s ALA 112 Cb 0.19 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 20.83 1g4r s ALA 112 CO 0.29 -0.67 -0.22 0.71 0.00 0.00 0.00 175.76 175.88 1g4r s TYR 113 N 1.71 2.45 0.62 0.00 1.51 0.02 -4.85 117.35 118.82 1g4r s TYR 113 Ca 0.06 -0.31 -0.12 0.00 -1.01 0.00 0.00 57.07 55.69 1g4r s TYR 113 Cb -0.16 -1.36 -0.03 0.00 -0.11 0.00 0.00 41.96 40.29 1g4r s TYR 113 CO 0.09 0.30 1.03 -1.25 -1.11 0.00 0.00 175.55 174.61 1g4r s PRO 114 N -1.80 3.47 -0.12 -1.71 0.05 -1.26 0.00 135.00 133.63 1g4r s PRO 114 Ca 0.15 0.87 -0.08 0.00 0.05 0.00 0.00 61.00 61.99 1g4r s PRO 114 Cb -0.10 -2.06 0.04 0.00 0.05 0.00 0.00 34.50 32.42 1g4r s PRO 114 CO 0.07 -0.67 0.29 -0.59 0.05 0.00 0.00 177.00 176.15 1g4r s PHE 115 N -3.00 -0.36 -0.04 0.56 -0.12 -0.40 -4.79 117.98 109.83 1g4r s PHE 115 Ca 0.57 0.85 -0.03 0.00 -0.05 0.00 0.00 56.93 58.27 1g4r s PHE 115 Cb -0.12 0.11 0.02 0.00 -0.63 0.00 0.00 43.02 42.40 1g4r s PHE 115 CO 0.49 -0.21 0.10 0.99 -0.05 0.00 0.00 175.22 176.55 1g4r s THR 116 N 0.72 -0.02 0.04 -4.49 2.01 -1.26 -0.70 115.64 111.93 1g4r s THR 116 Ca -0.05 0.09 0.08 0.00 0.31 0.00 0.00 61.69 62.12 1g4r s THR 116 Cb -0.06 -0.17 -0.02 0.00 0.01 0.00 0.00 72.50 72.26 1g4r s THR 116 CO -0.05 0.04 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.34 1g4r s PHE 117 N 0.55 1.94 -0.38 4.92 0.40 -0.33 -4.99 117.98 120.09 1g4r s PHE 117 Ca -0.04 -0.38 -0.04 0.00 -0.60 0.00 0.00 56.93 55.87 1g4r s PHE 117 Cb -0.06 -1.17 0.09 0.00 0.51 0.00 0.00 43.02 42.39 1g4r s PHE 117 CO -0.02 0.08 0.15 -1.83 0.70 0.00 0.00 175.22 174.30 1g4r s GLU 118 N -1.10 2.21 -0.14 0.44 -1.05 -1.26 -1.57 118.70 116.24 1g4r s GLU 118 Ca 0.08 -1.60 -0.27 0.00 -0.15 0.00 0.00 54.97 53.04 1g4r s GLU 118 Cb -0.09 -3.50 -0.02 0.00 -0.44 0.00 0.00 34.13 30.09 1g4r s GLU 118 CO 0.01 -0.92 0.88 0.42 0.95 0.00 0.00 175.26 176.60 1g4r s ILE 119 N 1.22 4.86 0.61 1.83 1.01 -1.26 -5.01 121.20 124.45 1g4r s ILE 119 Ca 0.04 1.75 -0.19 0.00 0.00 0.00 0.00 60.65 62.25 1g4r s ILE 119 Cb -0.22 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.03 1g4r s ILE 119 CO -0.02 0.04 1.23 -2.65 0.00 0.00 0.00 174.94 173.54 1g4r n PRO 120 N 5.00 1.22 0.18 2.79 -0.02 -1.26 -4.40 135.00 138.51 1g4r n PRO 120 Ca 0.05 0.47 0.03 0.00 -2.02 0.00 0.00 63.50 62.02 1g4r n PRO 120 Cb 0.49 -2.45 0.37 0.00 -0.02 0.00 0.00 33.50 31.89 1g4r n PRO 120 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1g4r h PRO 121 N 0.78 0.03 -0.33 0.52 0.11 -1.90 -3.28 132.00 127.94 1g4r h PRO 121 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1g4r h PRO 121 Cb 1.34 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1g4r h PRO 121 CO 0.54 0.36 0.00 0.09 -0.21 0.00 0.00 178.00 178.78 1g4r n ASN 122 N -4.13 1.76 -4.82 -2.05 3.02 -1.26 -4.90 115.26 102.88 1g4r n ASN 122 Ca -0.02 -1.99 -0.33 0.00 -0.03 0.00 0.00 54.58 52.21 1g4r n ASN 122 Cb 0.38 -0.22 -0.02 0.00 -0.61 0.00 0.00 39.78 39.32 1g4r n ASN 122 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1g4r s LEU 123 N -1.01 3.61 0.61 3.41 1.43 -1.24 -5.02 118.68 120.47 1g4r s LEU 123 Ca 0.22 1.73 -0.16 0.00 -1.03 0.00 0.00 54.13 54.89 1g4r s LEU 123 Cb 0.12 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.78 1g4r s LEU 123 CO 0.15 -0.85 1.09 -2.16 0.23 0.00 0.00 176.35 174.81 1g4r s PRO 124 N -3.91 3.13 0.75 1.29 0.04 -1.26 -5.03 135.00 130.00 1g4r s PRO 124 Ca 0.62 1.34 -0.11 0.00 0.04 0.00 0.00 61.00 62.89 1g4r s PRO 124 Cb -0.13 -2.00 0.05 0.00 0.04 0.00 0.00 34.50 32.46 1g4r s PRO 124 CO 0.31 -0.98 1.12 0.00 0.04 0.00 0.00 177.00 177.49 1g4r s SER 126 N -4.49 6.52 -0.10 0.00 0.01 -0.76 -4.79 113.70 110.09 1g4r s SER 126 Ca 0.60 2.60 -0.15 0.00 1.31 0.00 0.00 55.95 60.31 1g4r s SER 126 Cb -0.11 -2.56 0.03 0.00 0.21 0.00 0.00 66.02 63.59 1g4r s SER 126 CO 0.49 -0.94 0.38 0.54 0.41 0.00 0.00 173.24 174.12 1g4r s VAL 127 N 2.81 0.02 0.06 3.43 0.11 -1.07 -4.47 120.40 121.30 1g4r s VAL 127 Ca 0.77 -0.15 -0.03 0.00 -2.93 0.00 0.00 61.98 59.65 1g4r s VAL 127 Cb -0.42 -0.59 -0.03 0.00 -1.53 0.00 0.00 36.38 33.80 1g4r s VAL 127 CO 0.34 -0.08 0.02 0.42 -3.33 0.00 0.00 175.10 172.47 1g4r s THR 128 N -0.34 0.19 -0.15 5.04 -4.23 0.46 0.58 115.64 117.18 1g4r s THR 128 Ca -0.05 -1.70 -0.11 0.00 -1.18 0.00 0.00 61.69 58.65 1g4r s THR 128 Cb -0.03 -1.53 0.05 0.00 1.34 0.00 0.00 72.50 72.32 1g4r s THR 128 CO 0.02 -0.89 0.39 -0.22 -0.54 0.00 0.00 174.62 173.39 1g4r s LEU 129 N -2.92 0.26 -0.25 4.79 0.20 0.15 -0.25 118.68 120.67 1g4r s LEU 129 Ca 0.08 0.81 -0.01 0.00 0.69 0.00 0.00 54.13 55.70 1g4r s LEU 129 Cb 0.07 1.31 0.03 0.00 -0.43 0.00 0.00 46.19 47.17 1g4r s LEU 129 CO -0.09 -0.16 -0.07 -1.58 -0.29 0.00 0.00 176.35 174.16 1g4r s GLN 130 N 0.74 2.84 0.61 1.98 2.00 -1.26 -2.20 119.66 124.37 1g4r s GLN 130 Ca -0.04 -0.97 -0.18 0.00 -2.00 0.00 0.00 55.36 52.16 1g4r s GLN 130 Cb -0.05 -2.97 -0.04 0.00 0.80 0.00 0.00 33.01 30.74 1g4r s GLN 130 CO -0.05 -0.39 1.04 -2.30 -0.50 0.00 0.00 175.29 173.08 1g4r n PRO 131 N 4.66 0.96 -1.61 1.67 -0.02 -1.26 -3.33 135.00 136.07 1g4r n PRO 131 Ca -0.17 0.37 -0.29 0.00 -2.02 0.00 0.00 63.50 61.40 1g4r n PRO 131 Cb 0.47 -2.25 0.12 0.00 -0.02 0.00 0.00 33.50 31.82 1g4r n PRO 131 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1g4r s GLY 132 N -1.27 1.59 0.27 -1.23 0.00 -1.25 -4.28 107.32 101.15 1g4r s GLY 132 Ca 0.77 -0.47 -0.00 0.00 0.00 0.00 0.00 44.72 45.02 1g4r s GLY 132 CO 0.46 0.04 1.76 -2.55 0.00 0.00 0.00 173.10 172.81 1g4r h PRO 133 N -1.31 0.60 -0.64 2.90 0.11 -1.95 -1.92 132.00 129.78 1g4r h PRO 133 Ca -0.49 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1g4r h PRO 133 Cb 1.32 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1g4r h PRO 133 CO 0.62 0.40 0.00 0.39 -0.21 0.00 0.00 178.00 179.20 1g4r n GLU 134 N -4.87 4.01 -3.86 1.05 4.71 -1.26 -4.91 120.64 115.51 1g4r n GLU 134 Ca 0.18 -2.85 -0.37 0.00 -0.01 0.00 0.00 57.16 54.11 1g4r n GLU 134 Cb 0.46 -2.00 -0.06 0.00 -1.01 0.00 0.00 31.44 28.83 1g4r n GLU 134 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1g4r s ASP 135 N -0.83 6.38 0.00 1.62 -0.00 -0.72 -5.01 116.67 118.11 1g4r s ASP 135 Ca 0.50 0.45 0.24 0.00 -0.00 0.00 0.00 52.55 53.75 1g4r s ASP 135 Cb 0.34 -2.08 0.38 0.00 -0.00 0.00 0.00 42.92 41.57 1g4r s ASP 135 CO 0.21 0.38 1.33 0.35 -0.00 0.00 0.00 175.17 177.44 1g4r n THR 136 N 2.15 0.00 -1.53 -1.27 -2.24 -1.26 -4.73 114.28 105.40 1g4r n THR 136 Ca -0.19 -0.16 -0.29 0.00 -2.27 0.00 0.00 64.05 61.13 1g4r n THR 136 Cb 0.55 0.75 0.17 0.00 -2.10 0.00 0.00 70.33 69.70 1g4r n THR 136 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1g4r s GLY 137 N -2.56 1.62 0.48 3.38 0.00 -1.26 -5.08 107.32 103.90 1g4r s GLY 137 Ca 0.20 -0.76 0.05 0.00 0.00 0.00 0.00 44.72 44.22 1g4r s GLY 137 CO 0.58 -0.09 0.25 0.54 0.00 0.00 0.00 173.10 174.38 1g4r s LYS 138 N -5.44 2.25 0.35 2.90 1.02 -1.26 -4.73 119.74 114.83 1g4r s LYS 138 Ca 0.67 -2.00 -0.28 0.00 0.02 0.00 0.00 55.97 54.38 1g4r s LYS 138 Cb -0.11 -1.97 -0.10 0.00 -0.52 0.00 0.00 37.83 35.13 1g4r s LYS 138 CO 0.54 -0.37 1.32 0.00 -0.92 0.00 0.00 175.35 175.92 1g4r s ALA 139 N -2.71 3.44 0.27 5.17 0.00 -1.26 -4.53 121.76 122.13 1g4r s ALA 139 Ca 0.32 1.27 -0.18 0.00 0.00 0.00 0.00 51.96 53.37 1g4r s ALA 139 Cb 0.01 -3.49 0.01 0.00 0.00 0.00 0.00 23.12 19.65 1g4r s ALA 139 CO 0.19 -0.71 0.63 0.00 0.00 0.00 0.00 175.76 175.86 1g4r n GLY 141 N -0.43 0.09 3.33 0.00 0.00 -0.70 -0.68 105.19 106.80 1g4r n GLY 141 Ca -0.03 -1.11 -0.34 0.00 0.00 0.00 0.00 46.02 44.54 1g4r n GLY 141 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g4r s VAL 142 N -2.00 3.19 0.12 1.61 1.01 0.20 -0.90 120.40 123.63 1g4r s VAL 142 Ca 0.00 -0.58 0.09 0.00 0.00 0.00 0.00 61.98 61.50 1g4r s VAL 142 Cb 0.00 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1g4r s VAL 142 CO 0.00 0.47 -0.23 -1.81 0.00 0.00 0.00 175.10 173.53 1g4r s ASP 143 N 1.01 2.87 -0.25 3.32 1.01 -0.72 -2.61 116.67 121.30 1g4r s ASP 143 Ca -0.01 -0.72 -0.01 0.00 0.71 0.00 0.00 52.55 52.52 1g4r s ASP 143 Cb -0.15 -0.17 0.03 0.00 1.01 0.00 0.00 42.92 43.64 1g4r s ASP 143 CO -0.01 0.11 -0.06 -0.31 0.21 0.00 0.00 175.17 175.11 1g4r s TYR 144 N -1.15 3.09 -0.12 4.23 1.51 -1.25 -1.81 117.35 121.84 1g4r s TYR 144 Ca 0.10 -1.62 0.01 0.00 -1.01 0.00 0.00 57.07 54.55 1g4r s TYR 144 Cb -0.10 -2.06 -0.01 0.00 -0.11 0.00 0.00 41.96 39.68 1g4r s TYR 144 CO 0.05 -0.74 -0.16 -2.00 -1.11 0.00 0.00 175.55 171.59 1g4r s GLU 145 N 1.31 3.30 -0.26 -0.62 2.12 0.23 -1.66 118.70 123.13 1g4r s GLU 145 Ca -0.01 -0.73 -0.11 0.00 0.36 0.00 0.00 54.97 54.48 1g4r s GLU 145 Cb -0.17 -2.55 -0.05 0.00 0.26 0.00 0.00 34.13 31.62 1g4r s GLU 145 CO -0.04 0.21 0.18 0.08 -0.54 0.00 0.00 175.26 175.15 1g4r s VAL 146 N 0.35 5.33 -0.17 3.70 1.01 0.39 0.03 120.40 131.04 1g4r s VAL 146 Ca -0.13 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.05 1g4r s VAL 146 Cb -0.16 -3.52 0.03 0.00 0.00 0.00 0.00 36.38 32.72 1g4r s VAL 146 CO 0.07 0.29 -0.12 -0.75 0.00 0.00 0.00 175.10 174.58 1g4r s LYS 147 N 1.45 2.17 -0.22 2.72 2.20 0.76 -0.24 119.74 128.58 1g4r s LYS 147 Ca 0.08 -0.65 -0.09 0.00 -0.36 0.00 0.00 55.97 54.95 1g4r s LYS 147 Cb -0.15 -2.20 -0.04 0.00 -1.51 0.00 0.00 37.83 33.92 1g4r s LYS 147 CO 0.08 -0.31 0.11 0.00 -0.36 0.00 0.00 175.35 174.87 1g4r s ALA 148 N 1.46 3.44 0.21 3.13 0.00 0.58 0.06 121.76 130.64 1g4r s ALA 148 Ca 0.03 -0.90 -0.09 0.00 0.00 0.00 0.00 51.96 50.99 1g4r s ALA 148 Cb -0.14 -2.13 -0.01 0.00 0.00 0.00 0.00 23.12 20.83 1g4r s ALA 148 CO -0.10 -0.14 0.35 -0.59 0.00 0.00 0.00 175.76 175.29 1g4r s PHE 149 N 0.96 0.52 -0.00 0.00 -0.12 0.65 0.40 117.98 120.38 1g4r s PHE 149 Ca 0.05 -0.85 0.03 0.00 -0.05 0.00 0.00 56.93 56.12 1g4r s PHE 149 Cb -0.14 -0.03 -0.01 0.00 -0.63 0.00 0.00 43.02 42.22 1g4r s PHE 149 CO 0.03 -0.84 -0.11 0.00 -0.05 0.00 0.00 175.22 174.25 1g4r s ALA 151 N -0.32 -1.91 0.07 0.00 0.00 0.80 -4.79 121.76 115.61 1g4r s ALA 151 Ca 0.04 1.31 -0.27 0.00 0.00 0.00 0.00 51.96 53.03 1g4r s ALA 151 Cb -0.05 -0.04 -0.13 0.00 0.00 0.00 0.00 23.12 22.91 1g4r s ALA 151 CO -0.00 -0.56 1.43 0.93 0.00 0.00 0.00 175.76 177.56 1g4r h GLU 152 N 2.15 -0.69 -4.99 0.00 5.08 -1.86 0.49 114.58 114.76 1g4r h GLU 152 Ca -0.18 0.05 -0.41 0.00 -1.00 0.00 0.00 59.36 57.82 1g4r h GLU 152 Cb 1.20 0.16 -0.14 0.00 0.50 0.00 0.00 28.75 30.47 1g4r h GLU 152 CO 0.29 -0.46 -0.60 0.54 -1.00 0.00 0.00 179.01 177.78 1g4r s ASN 153 N -3.97 1.67 0.51 1.42 4.22 -1.26 -4.28 114.94 113.25 1g4r s ASN 153 Ca -0.13 -1.43 0.34 0.00 -2.14 0.00 0.00 52.86 49.50 1g4r s ASN 153 Cb 0.04 0.15 1.51 0.00 1.28 0.00 0.00 41.25 44.23 1g4r s ASN 153 CO 0.47 -0.73 2.00 -0.07 -2.04 0.00 0.00 177.10 176.72 1g4r h LEU 154 N 2.24 0.00 -0.11 3.54 3.38 -2.00 -2.96 115.31 119.40 1g4r h LEU 154 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1g4r h LEU 154 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1g4r h LEU 154 CO 0.62 0.00 -0.02 -0.62 0.09 0.00 0.00 178.44 178.50 1g4r n GLU 155 N -2.90 0.78 -3.99 1.13 1.02 -1.26 -4.88 120.64 110.54 1g4r n GLU 155 Ca -0.00 -0.11 -0.29 0.00 -0.02 0.00 0.00 57.16 56.74 1g4r n GLU 155 Cb 0.23 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.10 1g4r n GLU 155 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1g4r s GLU 156 N -2.29 3.18 0.30 3.49 -1.05 -1.12 -5.07 118.70 116.13 1g4r s GLU 156 Ca 0.37 -0.61 -0.30 0.00 -0.15 0.00 0.00 54.97 54.28 1g4r s GLU 156 Cb 0.21 -2.87 -0.13 0.00 -0.44 0.00 0.00 34.13 30.91 1g4r s GLU 156 CO 0.42 0.56 1.38 1.63 0.95 0.00 0.00 175.26 180.21 1g4r n LYS 157 N 0.10 2.18 -4.70 -4.83 5.02 -1.26 -4.96 118.16 109.71 1g4r n LYS 157 Ca -0.07 0.77 -0.32 0.00 -2.02 0.00 0.00 58.31 56.67 1g4r n LYS 157 Cb 0.52 -2.41 -0.12 0.00 -0.02 0.00 0.00 35.03 33.00 1g4r n LYS 157 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1g4r s ILE 158 N -0.54 3.07 -0.10 -0.18 -4.36 -1.26 -4.96 121.20 112.88 1g4r s ILE 158 Ca 0.62 -0.94 -0.04 0.00 -0.26 0.00 0.00 60.65 60.02 1g4r s ILE 158 Cb -0.59 -2.27 -0.04 0.00 1.25 0.00 0.00 42.46 40.81 1g4r s ILE 158 CO 0.55 0.44 0.08 -1.00 0.24 0.00 0.00 174.94 175.25 1g4r s HIS 159 N -0.88 3.40 0.57 1.37 3.76 -1.26 -4.99 115.29 117.27 1g4r s HIS 159 Ca 0.14 0.37 0.29 0.00 -0.15 0.00 0.00 55.06 55.71 1g4r s HIS 159 Cb -0.11 -1.86 1.48 0.00 1.11 0.00 0.00 32.58 33.20 1g4r s HIS 159 CO 0.04 0.62 1.91 -0.22 -0.85 0.00 0.00 174.74 176.24 1g4r h LYS 160 N 4.97 0.00 0.00 1.40 3.64 -2.00 -2.42 116.57 122.17 1g4r h LYS 160 Ca -0.53 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 1g4r h LYS 160 Cb 1.21 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1g4r h LYS 160 CO 0.57 0.00 -0.21 -0.09 -2.27 0.00 0.00 179.45 177.45 1g4r h ARG 161 N 0.00 0.00 -0.41 1.90 2.43 -1.99 -3.06 114.38 113.25 1g4r h ARG 161 Ca 0.25 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.39 1g4r h ARG 161 Cb 1.22 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 1g4r h ARG 161 CO -0.00 0.21 0.02 0.09 -1.51 0.00 0.00 179.97 178.78 1g4r n ASN 162 N -4.12 4.51 -4.13 -3.80 3.02 -0.91 -3.49 115.26 106.35 1g4r n ASN 162 Ca -0.02 -3.05 -0.16 0.00 -0.03 0.00 0.00 54.58 51.31 1g4r n ASN 162 Cb 0.28 -0.62 -0.12 0.00 -0.61 0.00 0.00 39.78 38.72 1g4r n ASN 162 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1g4r s SER 163 N -1.52 1.33 -0.12 6.41 1.04 -1.16 -3.83 113.70 115.86 1g4r s SER 163 Ca 0.48 -0.60 0.03 0.00 0.48 0.00 0.00 55.95 56.34 1g4r s SER 163 Cb 0.38 -0.01 0.01 0.00 0.10 0.00 0.00 66.02 66.50 1g4r s SER 163 CO 0.11 -0.13 -0.21 -0.69 0.98 0.00 0.00 173.24 173.29 1g4r s VAL 164 N -1.36 1.95 -0.20 5.02 1.01 0.16 -4.39 120.40 122.58 1g4r s VAL 164 Ca -0.05 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 60.98 1g4r s VAL 164 Cb -0.10 -1.72 -0.00 0.00 0.00 0.00 0.00 36.38 34.57 1g4r s VAL 164 CO 0.01 0.53 -0.09 -0.13 0.00 0.00 0.00 175.10 175.42 1g4r s ARG 165 N 0.69 3.26 0.10 2.72 0.52 -1.26 -0.31 118.95 124.68 1g4r s ARG 165 Ca -0.11 -0.69 0.10 0.00 -0.52 0.00 0.00 55.73 54.51 1g4r s ARG 165 Cb -0.16 -2.86 -0.04 0.00 0.52 0.00 0.00 34.95 32.41 1g4r s ARG 165 CO 0.02 -0.18 -0.23 -0.51 0.02 0.00 0.00 175.30 174.41 1g4r s LEU 166 N 1.37 2.46 -0.32 2.53 1.43 0.66 -4.98 118.68 121.84 1g4r s LEU 166 Ca 0.05 -0.62 -0.05 0.00 -1.03 0.00 0.00 54.13 52.47 1g4r s LEU 166 Cb -0.14 -1.38 0.03 0.00 0.03 0.00 0.00 46.19 44.74 1g4r s LEU 166 CO -0.06 0.20 0.07 -0.69 0.23 0.00 0.00 176.35 176.10 1g4r s VAL 167 N -1.03 3.63 0.34 -1.59 1.01 -1.26 -0.46 120.40 121.03 1g4r s VAL 167 Ca 0.15 -1.08 0.05 0.00 0.00 0.00 0.00 61.98 61.10 1g4r s VAL 167 Cb -0.10 -3.01 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 1g4r s VAL 167 CO 0.07 -0.09 0.49 0.27 0.00 0.00 0.00 175.10 175.84 1g4r s ILE 168 N 1.39 4.24 -0.04 2.22 -4.36 -0.66 -5.01 121.20 118.98 1g4r s ILE 168 Ca -0.01 -0.90 0.05 0.00 -0.26 0.00 0.00 60.65 59.53 1g4r s ILE 168 Cb -0.19 -3.49 -0.02 0.00 1.25 0.00 0.00 42.46 40.01 1g4r s ILE 168 CO 0.02 -0.22 -0.20 -0.13 0.24 0.00 0.00 174.94 174.65 1g4r s ARG 169 N -4.22 2.38 -0.24 0.37 0.52 -0.58 -3.94 118.95 113.25 1g4r s ARG 169 Ca 0.44 -0.80 -0.06 0.00 -0.52 0.00 0.00 55.73 54.79 1g4r s ARG 169 Cb -0.10 -2.24 -0.02 0.00 0.52 0.00 0.00 34.95 33.12 1g4r s ARG 169 CO 0.32 0.57 0.02 0.21 0.02 0.00 0.00 175.30 176.44 1g4r s LYS 170 N -0.61 3.50 0.07 3.54 2.36 -1.26 -0.58 119.74 126.77 1g4r s LYS 170 Ca 0.09 -0.56 0.05 0.00 -2.55 0.00 0.00 55.97 53.00 1g4r s LYS 170 Cb -0.11 -3.17 -0.04 0.00 -1.05 0.00 0.00 37.83 33.46 1g4r s LYS 170 CO 0.00 -0.20 -0.04 0.14 1.55 0.00 0.00 175.35 176.80 1g4r s VAL 171 N 1.55 3.76 -0.17 4.02 -7.23 -0.34 -1.83 120.40 120.16 1g4r s VAL 171 Ca 0.06 -1.02 -0.08 0.00 -1.81 0.00 0.00 61.98 59.13 1g4r s VAL 171 Cb -0.15 -2.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.00 1g4r s VAL 171 CO 0.00 0.18 0.10 -1.58 -0.31 0.00 0.00 175.10 173.49 1g4r s GLN 172 N -2.09 3.90 0.16 4.82 2.00 -1.26 0.27 119.66 127.46 1g4r s GLN 172 Ca 0.23 -0.25 0.08 0.00 -2.00 0.00 0.00 55.36 53.41 1g4r s GLN 172 Cb -0.11 -3.27 -0.04 0.00 0.80 0.00 0.00 33.01 30.38 1g4r s GLN 172 CO 0.15 0.41 -0.17 -0.47 -0.50 0.00 0.00 175.29 174.71 1g4r s TYR 173 N 0.02 1.68 -0.08 1.67 5.04 -0.45 -1.12 117.35 124.12 1g4r s TYR 173 Ca 0.08 -0.51 -0.21 0.00 -2.44 0.00 0.00 57.07 53.99 1g4r s TYR 173 Cb -0.12 -0.84 0.05 0.00 0.35 0.00 0.00 41.96 41.40 1g4r s TYR 173 CO 0.00 0.28 0.49 0.00 -1.34 0.00 0.00 175.55 174.98 1g4r s ALA 174 N -2.18 -1.25 0.35 3.97 0.00 -1.26 -4.46 121.76 116.92 1g4r s ALA 174 Ca 0.14 0.99 -0.16 0.00 0.00 0.00 0.00 51.96 52.93 1g4r s ALA 174 Cb -0.05 -0.22 -0.09 0.00 0.00 0.00 0.00 23.12 22.75 1g4r s ALA 174 CO 0.05 -0.29 0.79 -2.14 0.00 0.00 0.00 175.76 174.17 1g4r s PRO 175 N -0.81 4.06 0.55 0.00 0.02 -1.26 -5.01 135.00 132.55 1g4r s PRO 175 Ca -0.09 0.78 -0.21 0.00 0.02 0.00 0.00 61.00 61.51 1g4r s PRO 175 Cb -0.03 -2.38 -0.05 0.00 0.02 0.00 0.00 34.50 32.06 1g4r s PRO 175 CO 0.05 0.12 1.19 0.39 -0.33 0.00 0.00 177.00 178.41 1g4r n GLU 176 N -0.41 1.37 -3.98 5.54 1.02 -1.26 -4.98 120.64 117.94 1g4r n GLU 176 Ca 0.04 0.51 -0.25 0.00 -0.02 0.00 0.00 57.16 57.44 1g4r n GLU 176 Cb 0.53 -2.37 -0.04 0.00 -0.02 0.00 0.00 31.44 29.54 1g4r n GLU 176 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1g4r s ARG 177 N -2.75 2.29 0.19 3.49 0.52 -1.26 -5.10 118.95 116.33 1g4r s ARG 177 Ca 0.72 -1.90 0.03 0.00 -0.52 0.00 0.00 55.73 54.06 1g4r s ARG 177 Cb -0.43 -2.06 -0.03 0.00 0.52 0.00 0.00 34.95 32.94 1g4r s ARG 177 CO 0.49 -0.35 0.33 -1.25 0.02 0.00 0.00 175.30 174.54 1g4r s PRO 178 N -4.09 3.45 0.00 3.54 0.04 -1.26 -4.98 135.00 131.70 1g4r s PRO 178 Ca 0.37 -0.60 0.00 0.00 0.04 0.00 0.00 61.00 60.81 1g4r s PRO 178 Cb 0.00 -2.91 0.00 0.00 0.04 0.00 0.00 34.50 31.63 1g4r s PRO 178 CO 0.21 0.46 0.00 0.41 0.04 0.00 0.00 177.00 178.13 1g4r n GLY 179 N -0.87 2.52 3.75 0.56 0.00 -1.26 -5.06 105.19 104.83 1g4r n GLY 179 Ca -0.07 -2.12 -0.38 0.00 0.00 0.00 0.00 46.02 43.45 1g4r n GLY 179 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1g4r s PRO 180 N -1.94 3.22 0.76 1.61 0.04 -1.26 -5.00 135.00 132.43 1g4r s PRO 180 Ca 0.00 2.24 -0.11 0.00 0.04 0.00 0.00 61.00 63.17 1g4r s PRO 180 Cb 0.00 -2.30 0.05 0.00 0.04 0.00 0.00 34.50 32.28 1g4r s PRO 180 CO 0.00 -1.13 1.09 -0.65 0.04 0.00 0.00 177.00 176.34 1g4r s GLN 181 N -2.85 2.36 0.13 4.56 -0.21 -1.26 -4.96 119.66 117.43 1g4r s GLN 181 Ca 0.70 0.72 -0.31 0.00 0.02 0.00 0.00 55.36 56.49 1g4r s GLN 181 Cb -0.40 -1.94 -0.10 0.00 1.00 0.00 0.00 33.01 31.56 1g4r s GLN 181 CO 0.48 -1.44 1.81 -2.14 -2.12 0.00 0.00 175.29 171.88 1g4r s PRO 182 N -5.13 4.14 0.02 2.91 0.02 -1.26 -4.90 135.00 130.81 1g4r s PRO 182 Ca 0.60 2.59 0.00 0.00 0.02 0.00 0.00 61.00 64.21 1g4r s PRO 182 Cb -0.14 -3.52 -0.02 0.00 0.02 0.00 0.00 34.50 30.83 1g4r s PRO 182 CO 0.54 -0.83 -0.04 -0.08 -0.33 0.00 0.00 177.00 176.27 1g4r s THR 183 N 2.52 0.18 0.03 0.99 -1.32 -1.26 -1.42 115.64 115.37 1g4r s THR 183 Ca 0.80 -0.89 -0.23 0.00 -1.21 0.00 0.00 61.69 60.16 1g4r s THR 183 Cb -0.46 -0.31 0.05 0.00 -1.51 0.00 0.00 72.50 70.27 1g4r s THR 183 CO 0.36 -0.45 0.52 0.00 -2.21 0.00 0.00 174.62 172.84 1g4r s ALA 184 N -1.36 -1.34 0.18 11.08 0.00 -0.18 -4.99 121.76 125.15 1g4r s ALA 184 Ca -0.14 0.68 -0.17 0.00 0.00 0.00 0.00 51.96 52.33 1g4r s ALA 184 Cb -0.09 0.29 0.03 0.00 0.00 0.00 0.00 23.12 23.35 1g4r s ALA 184 CO -0.01 -0.46 0.49 -1.83 0.00 0.00 0.00 175.76 173.96 1g4r s GLU 185 N -2.14 1.32 0.05 0.00 -1.05 -1.26 -0.89 118.70 114.73 1g4r s GLU 185 Ca -0.07 -0.85 -0.27 0.00 -0.15 0.00 0.00 54.97 53.63 1g4r s GLU 185 Cb -0.01 0.51 0.07 0.00 -0.44 0.00 0.00 34.13 34.26 1g4r s GLU 185 CO 0.01 -0.55 0.64 -0.08 0.95 0.00 0.00 175.26 176.22 1g4r s THR 186 N -3.86 0.00 0.02 1.83 -1.32 -0.21 -4.99 115.64 107.10 1g4r s THR 186 Ca 0.08 -0.01 0.04 0.00 -1.21 0.00 0.00 61.69 60.60 1g4r s THR 186 Cb -0.00 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.97 1g4r s THR 186 CO -0.04 -0.00 -0.13 0.42 -2.21 0.00 0.00 174.62 172.66 1g4r s THR 187 N -2.41 0.99 -0.03 5.08 -4.23 -1.26 -0.81 115.64 112.96 1g4r s THR 187 Ca -0.05 -0.78 0.05 0.00 -1.18 0.00 0.00 61.69 59.73 1g4r s THR 187 Cb -0.00 -0.87 -0.01 0.00 1.34 0.00 0.00 72.50 72.95 1g4r s THR 187 CO -0.01 0.09 -0.20 -0.60 -0.54 0.00 0.00 174.62 173.36 1g4r s ARG 188 N -0.78 1.86 -0.18 3.99 6.06 0.15 -4.93 118.95 125.12 1g4r s ARG 188 Ca 0.02 -0.71 0.00 0.00 -2.50 0.00 0.00 55.73 52.54 1g4r s ARG 188 Cb -0.06 -1.68 0.01 0.00 0.06 0.00 0.00 34.95 33.28 1g4r s ARG 188 CO 0.00 0.35 -0.17 -0.65 -2.50 0.00 0.00 175.30 172.33 1g4r s GLN 189 N -0.22 3.08 0.82 5.12 -0.21 -1.26 -1.33 119.66 125.66 1g4r s GLN 189 Ca 0.01 -0.79 -0.07 0.00 0.02 0.00 0.00 55.36 54.53 1g4r s GLN 189 Cb -0.10 -2.63 0.16 0.00 1.00 0.00 0.00 33.01 31.44 1g4r s GLN 189 CO 0.01 -0.15 1.13 -0.06 -2.12 0.00 0.00 175.29 174.10 1g4r s PHE 190 N 1.19 1.58 0.54 0.91 0.40 -1.26 -5.04 117.98 116.30 1g4r s PHE 190 Ca 0.02 -0.04 -0.22 0.00 -0.60 0.00 0.00 56.93 56.09 1g4r s PHE 190 Cb -0.14 -3.44 -0.05 0.00 0.51 0.00 0.00 43.02 39.90 1g4r s PHE 190 CO -0.08 -2.09 1.34 -0.51 0.70 0.00 0.00 175.22 174.57 1g4r s LEU 191 N -5.45 3.86 -1.61 -0.37 1.43 -1.26 -3.43 118.68 111.87 1g4r s LEU 191 Ca 0.69 2.73 -0.02 0.00 -1.03 0.00 0.00 54.13 56.50 1g4r s LEU 191 Cb -0.05 -4.27 0.00 0.00 0.03 0.00 0.00 46.19 41.90 1g4r s LEU 191 CO 0.48 -1.52 0.28 0.23 0.23 0.00 0.00 176.35 176.05 1g4r n MET 192 N -0.98 -3.07 -3.58 1.70 2.81 -1.26 -4.96 117.12 107.78 1g4r n MET 192 Ca 0.10 0.92 -0.11 0.00 -1.81 0.00 0.00 57.70 56.80 1g4r n MET 192 Cb 0.45 -5.61 -0.05 0.00 -0.71 0.00 0.00 33.22 27.30 1g4r n MET 192 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1g4r s SER 193 N -2.39 -0.41 -0.00 7.83 0.15 -1.22 -5.01 113.70 112.63 1g4r s SER 193 Ca 0.14 0.51 0.06 0.00 0.70 0.00 0.00 55.95 57.36 1g4r s SER 193 Cb -0.06 0.42 0.18 0.00 -1.71 0.00 0.00 66.02 64.85 1g4r s SER 193 CO 0.17 -0.34 1.15 -0.90 1.20 0.00 0.00 173.24 174.52 1g4r n ASP 194 N 0.97 2.55 -4.72 5.45 5.75 -1.26 -4.42 116.55 120.87 1g4r n ASP 194 Ca -0.11 -2.03 -0.41 0.00 -0.01 0.00 0.00 54.79 52.23 1g4r n ASP 194 Cb 0.57 -0.14 -0.04 0.00 -1.03 0.00 0.00 41.12 40.48 1g4r n ASP 194 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1g4r s LYS 195 N -1.05 4.55 0.14 0.11 1.02 -1.26 -5.00 119.74 118.25 1g4r s LYS 195 Ca 0.14 1.27 -0.17 0.00 0.02 0.00 0.00 55.97 57.23 1g4r s LYS 195 Cb 0.08 -3.43 -0.07 0.00 -0.52 0.00 0.00 37.83 33.88 1g4r s LYS 195 CO 0.09 0.06 0.59 -1.25 -0.92 0.00 0.00 175.35 173.93 1g4r s PRO 196 N 0.65 4.10 -0.22 -1.68 0.04 -1.26 -4.45 135.00 132.18 1g4r s PRO 196 Ca 0.46 0.64 -0.02 0.00 0.04 0.00 0.00 61.00 62.12 1g4r s PRO 196 Cb -0.21 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.33 1g4r s PRO 196 CO 0.26 0.50 -0.08 -1.17 0.04 0.00 0.00 177.00 176.55 1g4r s LEU 197 N -1.74 2.77 -0.12 -3.56 2.96 -0.44 -2.10 118.68 116.46 1g4r s LEU 197 Ca 0.37 -0.52 0.00 0.00 -0.22 0.00 0.00 54.13 53.76 1g4r s LEU 197 Cb -0.17 -1.67 -0.01 0.00 0.50 0.00 0.00 46.19 44.84 1g4r s LEU 197 CO 0.20 -0.03 -0.14 -2.28 -1.32 0.00 0.00 176.35 172.77 1g4r s HIS 198 N 1.42 2.79 -0.07 5.38 5.65 -0.48 0.30 115.29 130.28 1g4r s HIS 198 Ca 0.05 -0.65 0.05 0.00 0.25 0.00 0.00 55.06 54.76 1g4r s HIS 198 Cb -0.14 -1.83 -0.01 0.00 -1.18 0.00 0.00 32.58 29.43 1g4r s HIS 198 CO -0.06 -0.21 -0.23 -1.17 -0.65 0.00 0.00 174.74 172.43 1g4r s LEU 199 N 0.30 2.03 -0.01 8.88 2.96 0.01 -1.19 118.68 131.67 1g4r s LEU 199 Ca -0.11 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.32 1g4r s LEU 199 Cb -0.16 -1.29 0.01 0.00 0.50 0.00 0.00 46.19 45.25 1g4r s LEU 199 CO 0.06 0.20 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.57 1g4r s GLU 200 N 0.03 0.21 0.11 1.98 2.12 -0.00 -1.05 118.70 122.10 1g4r s GLU 200 Ca -0.08 -0.02 -0.08 0.00 0.36 0.00 0.00 54.97 55.15 1g4r s GLU 200 Cb -0.14 -0.28 -0.01 0.00 0.26 0.00 0.00 34.13 33.95 1g4r s GLU 200 CO 0.05 -0.02 0.20 0.00 -0.54 0.00 0.00 175.26 174.94 1g4r s ALA 201 N 0.34 -0.03 0.15 6.30 0.00 -0.07 0.12 121.76 128.57 1g4r s ALA 201 Ca -0.03 -0.80 -0.23 0.00 0.00 0.00 0.00 51.96 50.89 1g4r s ALA 201 Cb -0.06 0.62 0.07 0.00 0.00 0.00 0.00 23.12 23.75 1g4r s ALA 201 CO -0.01 -0.54 0.63 -1.54 0.00 0.00 0.00 175.76 174.30 1g4r s SER 202 N -2.91 -0.54 0.19 0.00 1.04 -0.66 -1.02 113.70 109.80 1g4r s SER 202 Ca 0.10 -0.02 0.06 0.00 0.48 0.00 0.00 55.95 56.58 1g4r s SER 202 Cb 0.05 0.58 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 1g4r s SER 202 CO -0.07 -0.95 0.11 -0.76 0.98 0.00 0.00 173.24 172.55 1g4r s LEU 203 N -2.73 3.65 0.47 2.42 1.43 -0.50 -0.33 118.68 123.09 1g4r s LEU 203 Ca 0.02 -0.25 0.27 0.00 -1.03 0.00 0.00 54.13 53.14 1g4r s LEU 203 Cb -0.01 -2.25 1.02 0.00 0.03 0.00 0.00 46.19 44.98 1g4r s LEU 203 CO -0.12 0.05 1.86 -2.24 0.23 0.00 0.00 176.35 176.13 1g4r h ASP 204 N 2.29 0.00 -5.58 2.29 2.03 -1.85 -3.36 116.42 112.24 1g4r h ASP 204 Ca -0.47 0.00 -0.27 0.00 -0.73 0.00 0.00 57.03 55.55 1g4r h ASP 204 Cb 1.21 0.00 -0.11 0.00 -0.83 0.00 0.00 39.33 39.60 1g4r h ASP 204 CO 0.61 0.14 -0.38 -0.54 -1.03 0.00 0.00 179.24 178.05 1g4r s LYS 205 N -3.62 1.60 -0.22 4.15 1.02 -1.26 -4.90 119.74 116.50 1g4r s LYS 205 Ca 0.01 -1.69 0.10 0.00 0.02 0.00 0.00 55.97 54.41 1g4r s LYS 205 Cb 0.09 0.37 -0.20 0.00 -0.52 0.00 0.00 37.83 37.57 1g4r s LYS 205 CO 0.61 -0.61 -0.07 -1.91 -0.92 0.00 0.00 175.35 172.45 1g4r n GLU 206 N -0.46 0.74 -4.36 1.68 2.13 -1.26 -4.49 120.64 114.63 1g4r n GLU 206 Ca 0.02 0.06 -0.34 0.00 0.66 0.00 0.00 57.16 57.57 1g4r n GLU 206 Cb 0.63 -1.49 -0.13 0.00 0.27 0.00 0.00 31.44 30.71 1g4r n GLU 206 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1g4r s ILE 207 N -2.48 3.48 0.20 6.31 1.01 -1.26 -1.01 121.20 127.46 1g4r s ILE 207 Ca -0.21 -0.49 0.09 0.00 0.00 0.00 0.00 60.65 60.05 1g4r s ILE 207 Cb 0.07 -2.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1g4r s ILE 207 CO 0.68 0.48 -0.19 -0.31 0.00 0.00 0.00 174.94 175.61 1g4r s TYR 208 N 0.72 1.97 0.23 3.97 1.51 -0.15 -4.91 117.35 120.68 1g4r s TYR 208 Ca -0.03 -0.45 0.10 0.00 -1.01 0.00 0.00 57.07 55.68 1g4r s TYR 208 Cb -0.15 -0.93 -0.04 0.00 -0.11 0.00 0.00 41.96 40.73 1g4r s TYR 208 CO 0.02 0.45 -0.09 0.71 -1.11 0.00 0.00 175.55 175.53 1g4r s TYR 209 N -2.30 2.58 0.27 2.71 1.51 -1.26 -0.43 117.35 120.43 1g4r s TYR 209 Ca 0.21 -0.25 -0.29 0.00 -1.01 0.00 0.00 57.07 55.74 1g4r s TYR 209 Cb -0.05 -1.19 -0.14 0.00 -0.11 0.00 0.00 41.96 40.47 1g4r s TYR 209 CO 0.09 0.59 1.05 0.72 -1.11 0.00 0.00 175.55 176.88 1g4r n HIS 210 N -0.40 1.32 0.00 2.71 8.25 -0.76 -0.68 115.22 125.66 1g4r n HIS 210 Ca -0.08 0.69 0.00 0.00 -0.26 0.00 0.00 57.72 58.07 1g4r n HIS 210 Cb 0.58 -2.26 0.00 0.00 1.12 0.00 0.00 29.99 29.42 1g4r n HIS 210 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1g4r n GLY 211 N 1.35 3.07 3.73 -1.41 0.00 -1.26 -4.83 105.19 105.83 1g4r n GLY 211 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1g4r n GLY 211 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1g4r s GLU 212 N -0.14 4.68 0.43 1.61 2.12 0.15 -5.02 118.70 122.53 1g4r s GLU 212 Ca 0.00 1.51 -0.23 0.00 0.36 0.00 0.00 54.97 56.60 1g4r s GLU 212 Cb 0.00 -3.35 -0.08 0.00 0.26 0.00 0.00 34.13 30.95 1g4r s GLU 212 CO 0.00 0.19 1.10 -1.25 -0.54 0.00 0.00 175.26 174.76 1g4r s PRO 213 N -0.09 3.96 -0.21 4.30 0.04 -1.26 -4.66 135.00 137.07 1g4r s PRO 213 Ca 0.47 1.62 -0.05 0.00 0.04 0.00 0.00 61.00 63.09 1g4r s PRO 213 Cb -0.25 -2.46 -0.02 0.00 0.04 0.00 0.00 34.50 31.81 1g4r s PRO 213 CO 0.31 -0.34 0.01 0.42 0.04 0.00 0.00 177.00 177.43 1g4r s ILE 214 N -1.62 3.93 -0.22 0.56 1.01 0.58 -4.95 121.20 120.48 1g4r s ILE 214 Ca 0.61 -0.31 -0.12 0.00 0.00 0.00 0.00 60.65 60.82 1g4r s ILE 214 Cb -0.25 -2.79 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 1g4r s ILE 214 CO 0.30 0.41 0.23 -0.44 0.00 0.00 0.00 174.94 175.44 1g4r s SER 215 N 1.21 6.23 -0.21 3.58 0.01 -1.26 -1.49 113.70 121.78 1g4r s SER 215 Ca 0.03 0.26 -0.02 0.00 1.31 0.00 0.00 55.95 57.53 1g4r s SER 215 Cb -0.15 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 63.94 1g4r s SER 215 CO 0.01 0.04 -0.10 -0.69 0.41 0.00 0.00 173.24 172.92 1g4r s VAL 216 N 1.01 2.91 -0.25 3.43 1.01 0.23 -2.65 120.40 126.09 1g4r s VAL 216 Ca 0.11 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.29 1g4r s VAL 216 Cb -0.13 -2.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1g4r s VAL 216 CO 0.05 0.46 0.39 0.21 0.00 0.00 0.00 175.10 176.21 1g4r s ASN 217 N 1.41 6.31 -0.12 3.32 3.84 0.55 -0.27 114.94 129.97 1g4r s ASN 217 Ca 0.05 0.35 0.02 0.00 0.21 0.00 0.00 52.86 53.50 1g4r s ASN 217 Cb -0.14 -2.22 -0.01 0.00 -0.55 0.00 0.00 41.25 38.34 1g4r s ASN 217 CO -0.07 -0.17 -0.18 -0.69 -2.79 0.00 0.00 177.10 173.21 1g4r s VAL 218 N 1.91 2.59 -0.06 -5.21 1.01 -0.17 -1.66 120.40 118.81 1g4r s VAL 218 Ca 0.16 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.34 1g4r s VAL 218 Cb -0.15 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.19 1g4r s VAL 218 CO 0.09 0.54 -0.11 -2.28 0.00 0.00 0.00 175.10 173.34 1g4r s HIS 219 N 0.42 1.35 -0.08 5.22 2.46 0.12 -1.27 115.29 123.51 1g4r s HIS 219 Ca -0.13 -0.49 0.03 0.00 0.47 0.00 0.00 55.06 54.93 1g4r s HIS 219 Cb -0.17 -1.01 0.01 0.00 -0.13 0.00 0.00 32.58 31.28 1g4r s HIS 219 CO 0.06 -0.28 -0.16 0.08 -2.47 0.00 0.00 174.74 171.97 1g4r s VAL 220 N 0.76 1.47 -0.37 0.89 1.01 0.12 -0.82 120.40 123.45 1g4r s VAL 220 Ca -0.13 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 1g4r s VAL 220 Cb -0.15 -1.30 0.09 0.00 0.00 0.00 0.00 36.38 35.02 1g4r s VAL 220 CO 0.03 0.43 0.12 -0.89 0.00 0.00 0.00 175.10 174.78 1g4r s THR 221 N 0.54 2.99 -0.64 3.92 2.01 -0.33 -0.79 115.64 123.34 1g4r s THR 221 Ca -0.16 -1.95 -0.14 0.00 0.31 0.00 0.00 61.69 59.75 1g4r s THR 221 Cb -0.17 -3.00 0.16 0.00 0.01 0.00 0.00 72.50 69.51 1g4r s THR 221 CO 0.06 -0.52 0.58 0.21 -0.69 0.00 0.00 174.62 174.25 1g4r s ASN 222 N 1.49 6.32 -0.23 3.53 2.47 -0.19 -1.39 114.94 126.93 1g4r s ASN 222 Ca 0.05 -2.15 0.09 0.00 0.42 0.00 0.00 52.86 51.28 1g4r s ASN 222 Cb -0.21 -2.18 0.63 0.00 -1.45 0.00 0.00 41.25 38.04 1g4r s ASN 222 CO -0.04 -0.73 1.56 0.59 -3.72 0.00 0.00 177.10 174.76 1g4r n ASN 223 N 4.72 4.51 -4.95 -4.21 3.02 -0.89 -0.02 115.26 117.44 1g4r n ASN 223 Ca -0.03 -2.89 -0.19 0.00 -0.03 0.00 0.00 54.58 51.44 1g4r n ASN 223 Cb 0.42 -0.68 -0.00 0.00 -0.61 0.00 0.00 39.78 38.91 1g4r n ASN 223 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1g4r s THR 224 N -2.47 2.68 -2.23 3.41 2.01 -1.26 -4.57 115.64 113.22 1g4r s THR 224 Ca 0.44 -1.16 0.27 0.00 0.31 0.00 0.00 61.69 61.55 1g4r s THR 224 Cb 0.35 -2.85 0.36 0.00 0.01 0.00 0.00 72.50 70.37 1g4r s THR 224 CO 0.12 0.00 1.58 -0.46 -0.69 0.00 0.00 174.62 175.16 1g4r n ASN 225 N -1.78 1.51 -4.89 3.53 6.94 -1.26 -2.30 115.26 117.01 1g4r n ASN 225 Ca 0.07 -1.32 -0.29 0.00 -0.02 0.00 0.00 54.58 53.02 1g4r n ASN 225 Cb 0.61 0.09 0.02 0.00 -2.36 0.00 0.00 39.78 38.14 1g4r n ASN 225 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1g4r s LYS 226 N -2.23 3.21 -0.04 -3.83 1.02 -1.26 -4.72 119.74 111.89 1g4r s LYS 226 Ca 0.30 0.35 0.06 0.00 0.02 0.00 0.00 55.97 56.71 1g4r s LYS 226 Cb 0.20 -2.18 -0.02 0.00 -0.52 0.00 0.00 37.83 35.31 1g4r s LYS 226 CO 0.42 -0.65 -0.24 0.99 -0.92 0.00 0.00 175.35 174.96 1g4r s THR 227 N -3.08 2.22 -0.31 2.17 2.01 -1.26 -3.60 115.64 113.79 1g4r s THR 227 Ca 0.54 -1.03 -0.26 0.00 0.31 0.00 0.00 61.69 61.26 1g4r s THR 227 Cb -0.11 -1.80 0.01 0.00 0.01 0.00 0.00 72.50 70.61 1g4r s THR 227 CO 0.49 0.58 0.90 -0.69 -0.69 0.00 0.00 174.62 175.20 1g4r s VAL 228 N -0.40 4.69 -0.08 3.82 1.01 -0.11 -0.38 120.40 128.96 1g4r s VAL 228 Ca 0.04 1.42 -0.25 0.00 0.00 0.00 0.00 61.98 63.19 1g4r s VAL 228 Cb -0.12 -4.24 -0.29 0.00 0.00 0.00 0.00 36.38 31.73 1g4r s VAL 228 CO 0.01 -0.32 0.85 0.11 0.00 0.00 0.00 175.10 175.76 1g4r h LYS 229 N 8.07 0.18 -3.63 2.72 1.79 -0.78 -2.05 116.57 122.87 1g4r h LYS 229 Ca -0.23 -0.31 -0.07 0.00 -2.18 0.00 0.00 60.65 57.86 1g4r h LYS 229 Cb 1.08 0.12 -0.11 0.00 -1.58 0.00 0.00 32.23 31.74 1g4r h LYS 229 CO 0.94 1.15 -0.17 -1.59 -1.08 0.00 0.00 179.45 178.70 1g4r s LYS 230 N -2.36 1.27 -0.08 3.15 -2.85 -1.20 -4.35 119.74 113.32 1g4r s LYS 230 Ca -0.16 -1.05 0.01 0.00 -1.00 0.00 0.00 55.97 53.77 1g4r s LYS 230 Cb -0.01 0.44 0.02 0.00 -2.06 0.00 0.00 37.83 36.22 1g4r s LYS 230 CO 0.78 -0.50 -0.10 0.42 0.10 0.00 0.00 175.35 176.05 1g4r s ILE 231 N -3.93 1.01 -0.13 3.79 1.01 -0.81 -1.00 121.20 121.14 1g4r s ILE 231 Ca 0.14 -0.36 -0.00 0.00 0.00 0.00 0.00 60.65 60.43 1g4r s ILE 231 Cb 0.01 -0.97 -0.01 0.00 0.01 0.00 0.00 42.46 41.50 1g4r s ILE 231 CO -0.01 0.34 -0.13 -0.54 0.00 0.00 0.00 174.94 174.60 1g4r s LYS 232 N 1.03 3.36 -0.08 2.79 1.02 -0.14 -1.03 119.74 126.70 1g4r s LYS 232 Ca -0.08 -0.69 0.04 0.00 0.02 0.00 0.00 55.97 55.26 1g4r s LYS 232 Cb -0.15 -2.63 -0.01 0.00 -0.52 0.00 0.00 37.83 34.52 1g4r s LYS 232 CO -0.01 0.19 -0.22 0.42 -0.92 0.00 0.00 175.35 174.82 1g4r s ILE 233 N 0.41 2.32 0.10 2.17 -1.09 0.12 -0.73 121.20 124.50 1g4r s ILE 233 Ca -0.10 -0.95 -0.07 0.00 -2.23 0.00 0.00 60.65 57.29 1g4r s ILE 233 Cb -0.16 -1.89 -0.01 0.00 -1.58 0.00 0.00 42.46 38.82 1g4r s ILE 233 CO 0.05 0.56 0.17 -0.94 -1.23 0.00 0.00 174.94 173.55 1g4r s SER 234 N 0.02 0.16 -0.07 3.58 1.04 -0.63 -0.35 113.70 117.46 1g4r s SER 234 Ca -0.08 -0.75 0.05 0.00 0.48 0.00 0.00 55.95 55.65 1g4r s SER 234 Cb -0.15 0.34 -0.00 0.00 0.10 0.00 0.00 66.02 66.30 1g4r s SER 234 CO 0.05 -0.74 -0.23 -0.69 0.98 0.00 0.00 173.24 172.61 1g4r s VAL 235 N -3.89 1.97 0.03 5.02 1.01 0.38 -0.69 120.40 124.23 1g4r s VAL 235 Ca 0.08 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.12 1g4r s VAL 235 Cb 0.05 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 1g4r s VAL 235 CO -0.09 0.54 -0.16 -0.13 0.00 0.00 0.00 175.10 175.27 1g4r s ARG 236 N 0.10 1.06 -0.06 2.72 0.52 0.18 -1.31 118.95 122.15 1g4r s ARG 236 Ca -0.11 -0.77 -0.03 0.00 -0.52 0.00 0.00 55.73 54.30 1g4r s ARG 236 Cb -0.15 -1.08 -0.04 0.00 0.52 0.00 0.00 34.95 34.19 1g4r s ARG 236 CO 0.06 0.27 0.08 -1.14 0.02 0.00 0.00 175.30 174.60 1g4r s GLN 237 N -1.06 3.19 -0.09 3.54 0.74 0.03 -1.14 119.66 124.87 1g4r s GLN 237 Ca 0.03 -0.34 0.03 0.00 0.05 0.00 0.00 55.36 55.14 1g4r s GLN 237 Cb -0.08 -2.96 0.01 0.00 1.10 0.00 0.00 33.01 31.08 1g4r s GLN 237 CO 0.01 0.71 -0.19 0.71 -0.55 0.00 0.00 175.29 175.97 1g4r s TYR 238 N -1.06 2.18 -0.07 1.67 1.51 0.00 -1.29 117.35 120.30 1g4r s TYR 238 Ca 0.18 -0.91 -0.01 0.00 -1.01 0.00 0.00 57.07 55.32 1g4r s TYR 238 Cb -0.12 -1.50 0.03 0.00 -0.11 0.00 0.00 41.96 40.26 1g4r s TYR 238 CO 0.08 -0.40 0.01 0.00 -1.11 0.00 0.00 175.55 174.13 1g4r s ALA 239 N 0.54 0.63 -0.16 3.71 0.00 -0.48 -1.40 121.76 124.60 1g4r s ALA 239 Ca -0.15 -0.09 -0.04 0.00 0.00 0.00 0.00 51.96 51.68 1g4r s ALA 239 Cb -0.17 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 1g4r s ALA 239 CO 0.06 -0.47 -0.03 -0.51 0.00 0.00 0.00 175.76 174.81 1g4r s ASP 240 N 2.00 4.86 -0.11 0.00 1.01 -0.25 -0.58 116.67 123.60 1g4r s ASP 240 Ca 0.05 -0.13 -0.23 0.00 0.71 0.00 0.00 52.55 52.96 1g4r s ASP 240 Cb -0.12 -1.80 -0.03 0.00 1.01 0.00 0.00 42.92 41.97 1g4r s ASP 240 CO -0.05 0.15 0.68 -0.63 0.21 0.00 0.00 175.17 175.54 1g4r s ILE 241 N 0.45 5.04 -1.45 0.77 -1.09 0.64 -0.85 121.20 124.72 1g4r s ILE 241 Ca -0.03 1.37 0.13 0.00 -2.23 0.00 0.00 60.65 59.90 1g4r s ILE 241 Cb -0.14 -4.01 0.06 0.00 -1.58 0.00 0.00 42.46 36.79 1g4r s ILE 241 CO 0.03 0.21 0.84 0.00 -1.23 0.00 0.00 174.94 174.78 1g4r s LEU 243 N -1.39 2.19 0.00 0.00 1.43 -1.26 -4.83 118.68 114.83 1g4r s LEU 243 Ca 0.13 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1g4r s LEU 243 Cb 0.11 -0.88 0.00 0.00 0.03 0.00 0.00 46.19 45.44 1g4r s LEU 243 CO 0.23 0.12 0.00 0.33 0.23 0.00 0.00 176.35 177.25 1g4r n PHE 244 N 1.72 0.00 -3.65 0.29 7.35 -1.26 -4.12 117.46 117.79 1g4r n PHE 244 Ca -0.18 0.00 -0.27 0.00 -0.76 0.00 0.00 57.45 56.24 1g4r n PHE 244 Cb 0.54 0.00 -0.11 0.00 0.35 0.00 0.00 39.48 40.26 1g4r n PHE 244 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1g4r n ASN 245 N 0.38 1.34 -4.51 -2.13 4.05 -1.26 -5.11 115.26 108.02 1g4r n ASN 245 Ca 0.00 -2.81 -0.48 0.00 0.45 0.00 0.00 54.58 51.73 1g4r n ASN 245 Cb 0.00 -0.66 -0.03 0.00 1.23 0.00 0.00 39.78 40.32 1g4r n ASN 245 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 177.26 174.62 1g4r n THR 246 N 2.35 1.53 -3.53 -0.44 -1.04 -1.26 -4.90 114.28 106.99 1g4r n THR 246 Ca 0.25 -0.38 -0.09 0.00 -2.04 0.00 0.00 64.05 61.79 1g4r n THR 246 Cb 0.41 -0.50 -0.03 0.00 -1.82 0.00 0.00 70.33 68.39 1g4r n THR 246 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1g4r s ALA 247 N -0.72 -1.87 -0.16 2.41 0.00 -1.15 -4.96 121.76 115.31 1g4r s ALA 247 Ca 0.67 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.88 1g4r s ALA 247 Cb -0.88 0.00 0.03 0.00 0.00 0.00 0.00 23.12 22.28 1g4r s ALA 247 CO 0.56 -0.55 -0.09 -0.65 0.00 0.00 0.00 175.76 175.03 1g4r s GLN 248 N -2.36 1.80 0.15 0.00 1.11 -1.26 -0.26 119.66 118.84 1g4r s GLN 248 Ca 0.03 -0.53 0.06 0.00 0.01 0.00 0.00 55.36 54.92 1g4r s GLN 248 Cb -0.01 -2.01 -0.04 0.00 -1.01 0.00 0.00 33.01 29.94 1g4r s GLN 248 CO -0.05 -0.34 0.07 0.71 0.01 0.00 0.00 175.29 175.69 1g4r s TYR 249 N 1.57 3.02 -0.08 0.91 1.51 0.26 -4.98 117.35 119.56 1g4r s TYR 249 Ca 0.02 -0.06 -0.04 0.00 -1.01 0.00 0.00 57.07 55.99 1g4r s TYR 249 Cb -0.14 -1.47 0.04 0.00 -0.11 0.00 0.00 41.96 40.28 1g4r s TYR 249 CO -0.09 0.51 0.18 0.15 -1.11 0.00 0.00 175.55 175.20 1g4r s LYS 250 N -2.90 0.14 -0.17 -0.62 3.01 -1.26 -1.38 119.74 116.55 1g4r s LYS 250 Ca 0.29 0.42 -0.12 0.00 -1.01 0.00 0.00 55.97 55.56 1g4r s LYS 250 Cb -0.10 -0.15 0.05 0.00 -1.01 0.00 0.00 37.83 36.62 1g4r s LYS 250 CO 0.21 -0.16 0.43 0.00 0.51 0.00 0.00 175.35 176.34 1g4r s PRO 252 N 0.97 4.47 0.00 0.00 0.02 -1.26 -0.79 135.00 138.41 1g4r s PRO 252 Ca -0.06 1.95 0.00 0.00 0.02 0.00 0.00 61.00 62.91 1g4r s PRO 252 Cb -0.06 -3.21 0.00 0.00 0.02 0.00 0.00 34.50 31.25 1g4r s PRO 252 CO -0.08 -0.11 0.85 1.33 -0.33 0.00 0.00 177.00 178.67 1g4r n VAL 253 N 2.24 0.73 -3.65 3.83 0.24 -0.43 -4.91 118.33 116.38 1g4r n VAL 253 Ca 0.04 -0.78 -0.04 0.00 -2.04 0.00 0.00 64.34 61.51 1g4r n VAL 253 Cb 0.44 0.66 -0.07 0.00 -1.47 0.00 0.00 33.84 33.40 1g4r n VAL 253 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1g4r s ALA 254 N -0.73 -2.19 -0.05 2.33 0.00 -1.23 -2.05 121.76 117.84 1g4r s ALA 254 Ca 0.00 1.79 -0.19 0.00 0.00 0.00 0.00 51.96 53.56 1g4r s ALA 254 Cb 0.00 -1.70 0.04 0.00 0.00 0.00 0.00 23.12 21.46 1g4r s ALA 254 CO 0.00 -0.17 0.43 -1.64 0.00 0.00 0.00 175.76 174.38 1g4r s MET 255 N 0.25 0.74 -0.22 0.00 -1.94 -1.26 -0.47 119.30 116.41 1g4r s MET 255 Ca 0.04 0.06 -0.05 0.00 -1.71 0.00 0.00 55.69 54.03 1g4r s MET 255 Cb -0.05 0.34 0.11 0.00 2.01 0.00 0.00 34.83 37.24 1g4r s MET 255 CO -0.12 -0.20 0.42 -2.00 -0.01 0.00 0.00 175.02 173.10 1g4r s GLU 256 N -1.02 0.34 -0.28 2.03 2.12 0.53 -4.99 118.70 117.42 1g4r s GLU 256 Ca -0.11 0.89 -0.08 0.00 0.36 0.00 0.00 54.97 56.04 1g4r s GLU 256 Cb -0.04 0.11 -0.01 0.00 0.26 0.00 0.00 34.13 34.45 1g4r s GLU 256 CO 0.05 -0.38 0.10 -1.21 -0.54 0.00 0.00 175.26 173.28 1g4r s GLU 257 N 2.61 3.38 0.01 4.30 2.02 -1.26 -0.71 118.70 129.05 1g4r s GLU 257 Ca 0.03 -0.67 0.06 0.00 0.02 0.00 0.00 54.97 54.42 1g4r s GLU 257 Cb -0.13 -3.41 -0.03 0.00 0.10 0.00 0.00 34.13 30.66 1g4r s GLU 257 CO -0.14 -0.33 -0.17 0.00 0.02 0.00 0.00 175.26 174.64 1g4r s ALA 258 N 1.58 2.60 -0.22 5.21 0.00 -0.20 -5.01 121.76 125.73 1g4r s ALA 258 Ca 0.05 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 50.87 1g4r s ALA 258 Cb -0.16 -0.81 0.06 0.00 0.00 0.00 0.00 23.12 22.21 1g4r s ALA 258 CO 0.04 0.57 2.40 -0.25 0.00 0.00 0.00 175.76 178.51 1g4r n ASP 259 N 1.85 6.02 -4.78 0.00 10.43 -1.26 -1.91 116.55 126.89 1g4r n ASP 259 Ca -0.16 -2.85 -0.39 0.00 2.57 0.00 0.00 54.79 53.96 1g4r n ASP 259 Cb 0.52 -1.16 -0.06 0.00 1.84 0.00 0.00 41.12 42.26 1g4r n ASP 259 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 1g4r s ASP 260 N 0.92 7.30 0.18 -2.24 1.01 -1.26 -4.94 116.67 117.63 1g4r s ASP 260 Ca 0.34 1.54 0.11 0.00 0.71 0.00 0.00 52.55 55.25 1g4r s ASP 260 Cb 0.22 -2.46 -0.04 0.00 1.01 0.00 0.00 42.92 41.65 1g4r s ASP 260 CO -0.04 0.22 -0.23 0.42 0.21 0.00 0.00 175.17 175.74 1g4r s THR 261 N -1.10 2.41 -0.20 -1.27 -4.23 -1.26 -3.80 115.64 106.19 1g4r s THR 261 Ca 0.34 -1.94 -0.01 0.00 -1.18 0.00 0.00 61.69 58.90 1g4r s THR 261 Cb -0.22 -2.14 0.05 0.00 1.34 0.00 0.00 72.50 71.53 1g4r s THR 261 CO 0.24 -0.07 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.53 1g4r s VAL 262 N -1.55 1.15 0.71 2.29 1.01 -0.77 -4.95 120.40 118.29 1g4r s VAL 262 Ca 0.20 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.18 1g4r s VAL 262 Cb -0.08 -1.45 0.02 0.00 0.00 0.00 0.00 36.38 34.86 1g4r s VAL 262 CO 0.10 -0.07 1.07 0.00 0.00 0.00 0.00 175.10 176.20 1g4r s ALA 263 N 1.58 2.70 0.27 5.51 0.00 -1.26 -0.93 121.76 129.63 1g4r s ALA 263 Ca -0.03 -0.12 -0.28 0.00 0.00 0.00 0.00 51.96 51.52 1g4r s ALA 263 Cb -0.17 -3.10 -0.14 0.00 0.00 0.00 0.00 23.12 19.70 1g4r s ALA 263 CO -0.07 -1.23 1.00 -2.30 0.00 0.00 0.00 175.76 173.16 1g4r n PRO 264 N -3.11 1.26 -3.83 0.00 -0.02 -1.24 -2.95 135.00 125.11 1g4r n PRO 264 Ca 0.07 0.44 -0.27 0.00 -2.02 0.00 0.00 63.50 61.72 1g4r n PRO 264 Cb 0.55 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 1g4r n PRO 264 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1g4r n SER 265 N 1.35 -4.77 -3.84 2.55 3.41 0.97 -4.96 113.62 108.33 1g4r n SER 265 Ca 0.11 -1.01 -0.09 0.00 -0.26 0.00 0.00 58.87 57.61 1g4r n SER 265 Cb 0.31 -1.70 -0.05 0.00 -0.26 0.00 0.00 64.21 62.51 1g4r n SER 265 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1g4r s SER 266 N -3.07 -0.16 0.18 4.04 1.04 -0.41 -4.97 113.70 110.36 1g4r s SER 266 Ca 0.07 -0.65 0.11 0.00 0.48 0.00 0.00 55.95 55.96 1g4r s SER 266 Cb -0.04 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.59 1g4r s SER 266 CO 0.91 -1.03 -0.21 -0.89 0.98 0.00 0.00 173.24 172.99 1g4r s THR 267 N -3.92 2.53 -0.09 2.02 2.01 -1.26 -1.03 115.64 115.90 1g4r s THR 267 Ca 0.13 -1.90 -0.18 0.00 0.31 0.00 0.00 61.69 60.05 1g4r s THR 267 Cb -0.00 -2.21 0.04 0.00 0.01 0.00 0.00 72.50 70.34 1g4r s THR 267 CO -0.00 -0.08 0.44 0.12 -0.69 0.00 0.00 174.62 174.41 1g4r s PHE 268 N -1.59 -0.41 0.07 4.92 5.36 0.03 -4.99 117.98 121.37 1g4r s PHE 268 Ca 0.21 0.84 -0.16 0.00 -0.96 0.00 0.00 56.93 56.86 1g4r s PHE 268 Cb -0.08 0.18 0.03 0.00 -0.34 0.00 0.00 43.02 42.81 1g4r s PHE 268 CO 0.10 -0.36 0.38 0.00 -1.46 0.00 0.00 175.22 173.89 1g4r s LYS 270 N -3.02 0.49 -0.21 0.00 2.20 -0.39 -4.99 119.74 113.83 1g4r s LYS 270 Ca -0.02 0.04 -0.07 0.00 -0.36 0.00 0.00 55.97 55.56 1g4r s LYS 270 Cb 0.00 0.23 -0.04 0.00 -1.51 0.00 0.00 37.83 36.52 1g4r s LYS 270 CO -0.06 -0.17 0.06 0.08 -0.36 0.00 0.00 175.35 174.89 1g4r s VAL 271 N -1.50 4.53 -0.04 4.02 1.01 -1.26 -1.00 120.40 126.17 1g4r s VAL 271 Ca 0.02 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1g4r s VAL 271 Cb -0.01 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 1g4r s VAL 271 CO -0.02 0.41 -0.05 -0.31 0.00 0.00 0.00 175.10 175.13 1g4r s TYR 272 N 0.88 2.98 -0.11 5.22 1.51 0.62 -4.90 117.35 123.55 1g4r s TYR 272 Ca 0.03 0.04 0.02 0.00 -1.01 0.00 0.00 57.07 56.15 1g4r s TYR 272 Cb -0.14 -1.68 0.01 0.00 -0.11 0.00 0.00 41.96 40.04 1g4r s TYR 272 CO 0.02 0.39 -0.17 0.99 -1.11 0.00 0.00 175.55 175.67 1g4r s THR 273 N -0.93 1.64 0.05 -0.71 2.01 -1.26 0.75 115.64 117.20 1g4r s THR 273 Ca 0.15 -0.73 -0.02 0.00 0.31 0.00 0.00 61.69 61.40 1g4r s THR 273 Cb -0.11 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 70.88 1g4r s THR 273 CO 0.05 0.47 0.00 -1.48 -0.69 0.00 0.00 174.62 172.97 1g4r s LEU 274 N 0.89 2.33 -0.15 4.42 0.05 -0.55 -4.94 118.68 120.73 1g4r s LEU 274 Ca -0.08 -0.93 -0.01 0.00 0.05 0.00 0.00 54.13 53.16 1g4r s LEU 274 Cb -0.15 0.31 0.04 0.00 -2.05 0.00 0.00 46.19 44.34 1g4r s LEU 274 CO -0.01 -0.61 -0.05 -0.89 -0.55 0.00 0.00 176.35 174.25 1g4r s THR 275 N -3.82 1.02 0.24 5.48 2.01 -1.26 -0.31 115.64 119.00 1g4r s THR 275 Ca 0.06 -0.52 -0.31 0.00 0.31 0.00 0.00 61.69 61.22 1g4r s THR 275 Cb 0.07 -1.19 -0.12 0.00 0.01 0.00 0.00 72.50 71.27 1g4r s THR 275 CO -0.10 0.16 1.59 -2.65 -0.69 0.00 0.00 174.62 172.93 1g4r n PRO 276 N 4.91 2.49 -3.81 4.92 -0.02 -1.26 -4.74 135.00 137.49 1g4r n PRO 276 Ca -0.12 0.89 -0.12 0.00 -2.02 0.00 0.00 63.50 62.13 1g4r n PRO 276 Cb 0.48 -2.66 -0.10 0.00 -0.02 0.00 0.00 33.50 31.20 1g4r n PRO 276 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1g4r s PHE 277 N 0.45 -0.12 -0.25 6.00 -0.12 -0.87 -4.53 117.98 118.54 1g4r s PHE 277 Ca 0.70 0.21 -0.20 0.00 -0.05 0.00 0.00 56.93 57.59 1g4r s PHE 277 Cb -0.56 0.04 -0.02 0.00 -0.63 0.00 0.00 43.02 41.85 1g4r s PHE 277 CO 0.43 -0.28 0.63 -1.17 -0.05 0.00 0.00 175.22 174.78 1g4r s LEU 278 N -0.96 4.07 0.02 -1.99 2.96 -1.26 -4.85 118.68 116.67 1g4r s LEU 278 Ca -0.10 0.73 -0.35 0.00 -0.22 0.00 0.00 54.13 54.18 1g4r s LEU 278 Cb -0.05 -2.86 -0.14 0.00 0.50 0.00 0.00 46.19 43.63 1g4r s LEU 278 CO 0.02 -0.36 1.62 0.00 -1.32 0.00 0.00 176.35 176.31 1g4r n ALA 279 N 5.65 0.52 -0.29 5.97 0.00 -1.26 -4.81 120.51 126.29 1g4r n ALA 279 Ca -0.01 0.41 0.29 0.00 0.00 0.00 0.00 53.44 54.14 1g4r n ALA 279 Cb 0.49 -2.31 0.66 0.00 0.00 0.00 0.00 19.45 18.29 1g4r n ALA 279 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1g4r h ASN 280 N 6.62 0.15 -3.58 0.00 2.35 -2.02 -3.29 115.58 115.82 1g4r h ASN 280 Ca -0.47 0.03 -0.61 0.00 -0.55 0.00 0.00 56.30 54.70 1g4r h ASN 280 Cb 1.28 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 39.55 1g4r h ASN 280 CO 0.89 0.03 0.47 0.21 -1.65 0.00 0.00 177.43 177.39 1g4r s ASN 281 N -5.32 6.53 -0.86 5.81 3.04 -1.26 -4.99 114.94 117.89 1g4r s ASN 281 Ca -0.06 0.23 -0.23 0.00 0.04 0.00 0.00 52.86 52.85 1g4r s ASN 281 Cb 0.23 -2.42 0.07 0.00 -1.54 0.00 0.00 41.25 37.59 1g4r s ASN 281 CO 0.79 -0.89 1.22 -0.13 -3.04 0.00 0.00 177.10 175.06 1g4r s ARG 282 N 3.40 3.41 0.04 0.43 1.81 -1.24 -5.01 118.95 121.79 1g4r s ARG 282 Ca 0.34 -1.06 -0.00 0.00 -1.72 0.00 0.00 55.73 53.29 1g4r s ARG 282 Cb -0.12 -4.75 -0.04 0.00 -0.45 0.00 0.00 34.95 29.59 1g4r s ARG 282 CO 0.21 -1.99 0.19 -1.83 -0.68 0.00 0.00 175.30 171.20 1g4r s GLU 283 N 4.29 3.38 -0.73 3.54 1.03 -1.26 -5.02 118.70 123.93 1g4r s GLU 283 Ca 0.35 -0.44 -0.26 0.00 0.03 0.00 0.00 54.97 54.65 1g4r s GLU 283 Cb -0.07 -3.02 0.01 0.00 -0.80 0.00 0.00 34.13 30.25 1g4r s GLU 283 CO -0.00 0.62 1.50 0.15 -1.33 0.00 0.00 175.26 176.20 1g4r s LYS 284 N -2.35 3.02 0.14 -4.83 1.02 -1.26 -4.95 119.74 110.52 1g4r s LYS 284 Ca 0.33 -0.04 0.11 0.00 0.02 0.00 0.00 55.97 56.38 1g4r s LYS 284 Cb -0.13 -4.37 -0.04 0.00 -0.52 0.00 0.00 37.83 32.78 1g4r s LYS 284 CO 0.25 -2.39 -0.26 1.03 -0.92 0.00 0.00 175.35 173.07 1g4r s ARG 285 N 6.15 1.38 -0.38 1.68 0.52 -1.23 -3.77 118.95 123.29 1g4r s ARG 285 Ca 0.47 -1.35 -0.03 0.00 -0.52 0.00 0.00 55.73 54.30 1g4r s ARG 285 Cb -0.09 -1.81 -0.04 0.00 0.52 0.00 0.00 34.95 33.52 1g4r s ARG 285 CO 0.14 0.42 1.60 0.41 0.02 0.00 0.00 175.30 177.89 1g4r n GLY 286 N 0.83 2.26 3.63 -3.53 0.00 -1.21 -4.34 105.19 102.83 1g4r n GLY 286 Ca -0.17 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.05 1g4r n GLY 286 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1g4r s LEU 287 N 0.04 3.78 0.01 0.99 2.96 -1.26 -4.59 118.68 120.61 1g4r s LEU 287 Ca 0.22 0.08 -0.27 0.00 -0.22 0.00 0.00 54.13 53.94 1g4r s LEU 287 Cb 0.07 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1g4r s LEU 287 CO -0.01 0.19 0.86 0.00 -1.32 0.00 0.00 176.35 176.06 1g4r s ALA 288 N 0.26 3.26 0.37 5.97 0.00 -1.26 -4.02 121.76 126.35 1g4r s ALA 288 Ca 0.03 0.38 0.05 0.00 0.00 0.00 0.00 51.96 52.42 1g4r s ALA 288 Cb -0.12 -3.15 -0.07 0.00 0.00 0.00 0.00 23.12 19.77 1g4r s ALA 288 CO 0.00 -0.11 0.04 -0.51 0.00 0.00 0.00 175.76 175.19 1g4r s LEU 289 N 0.59 2.49 0.00 0.00 1.43 0.65 -1.64 118.68 122.21 1g4r s LEU 289 Ca 0.45 -1.39 0.23 0.00 -1.03 0.00 0.00 54.13 52.38 1g4r s LEU 289 Cb -0.20 -0.62 0.49 0.00 0.03 0.00 0.00 46.19 45.89 1g4r s LEU 289 CO 0.24 -0.56 1.43 -0.90 0.23 0.00 0.00 176.35 176.80 1g4r n ASP 290 N -0.86 2.98 -2.72 2.29 5.68 -0.49 -0.41 116.55 123.03 1g4r n ASP 290 Ca -0.04 -1.93 -0.05 0.00 -0.50 0.00 0.00 54.79 52.28 1g4r n ASP 290 Cb 0.67 -0.20 0.02 0.00 -1.14 0.00 0.00 41.12 40.47 1g4r n ASP 290 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1g4r n GLY 291 N 1.40 0.90 3.77 6.12 0.00 -1.26 -4.54 105.19 111.58 1g4r n GLY 291 Ca 0.18 -1.16 -0.40 0.00 0.00 0.00 0.00 46.02 44.64 1g4r n GLY 291 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g4r s LYS 292 N -2.06 4.20 0.52 1.61 1.02 -1.26 -4.74 119.74 119.03 1g4r s LYS 292 Ca 0.17 2.22 0.23 0.00 0.02 0.00 0.00 55.97 58.60 1g4r s LYS 292 Cb -0.03 -2.95 1.39 0.00 -0.52 0.00 0.00 37.83 35.71 1g4r s LYS 292 CO 0.07 -0.32 2.10 1.37 -0.92 0.00 0.00 175.35 177.65 1g4r h LEU 293 N 3.11 0.00 -1.14 3.17 -0.00 -1.98 -2.08 115.31 116.39 1g4r h LEU 293 Ca -0.49 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.37 1g4r h LEU 293 Cb 1.23 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.86 1g4r h LEU 293 CO 0.64 0.10 0.39 0.50 -0.00 0.00 0.00 178.44 180.07 1g4r h LYS 294 N 0.00 0.98 -6.88 0.17 3.64 -1.96 -3.44 116.57 109.09 1g4r h LYS 294 Ca -0.00 -0.11 -0.51 0.00 -1.27 0.00 0.00 60.65 58.77 1g4r h LYS 294 Cb 0.21 -0.20 0.04 0.00 -0.41 0.00 0.00 32.23 31.87 1g4r h LYS 294 CO 0.01 0.72 0.51 -1.01 -2.27 0.00 0.00 179.45 177.41 1g4r s HIS 295 N -5.66 3.27 0.05 1.91 3.76 -0.78 -4.97 115.29 112.88 1g4r s HIS 295 Ca -0.11 1.59 -0.24 0.00 -0.15 0.00 0.00 55.06 56.16 1g4r s HIS 295 Cb 0.17 -3.37 -0.16 0.00 1.11 0.00 0.00 32.58 30.32 1g4r s HIS 295 CO 0.79 -1.05 1.58 0.93 -0.85 0.00 0.00 174.74 176.14 1g4r h GLU 296 N 3.17 0.03 0.00 1.40 5.08 -1.84 -3.04 114.58 119.38 1g4r h GLU 296 Ca -0.48 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1g4r h GLU 296 Cb 1.22 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1g4r h GLU 296 CO 0.65 0.19 0.00 -0.40 -1.00 0.00 0.00 179.01 178.44 1g4r n ASP 297 N -4.99 0.00 -4.74 1.42 5.75 -1.26 -4.81 116.55 107.92 1g4r n ASP 297 Ca -0.07 -0.40 -0.41 0.00 -0.01 0.00 0.00 54.79 53.89 1g4r n ASP 297 Cb 0.11 -0.04 -0.03 0.00 -1.03 0.00 0.00 41.12 40.13 1g4r n ASP 297 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1g4r s THR 298 N -2.07 3.20 0.52 2.12 2.01 -1.15 -4.99 115.64 115.28 1g4r s THR 298 Ca 0.21 1.00 0.02 0.00 0.31 0.00 0.00 61.69 63.24 1g4r s THR 298 Cb 0.10 -3.64 -0.00 0.00 0.01 0.00 0.00 72.50 68.97 1g4r s THR 298 CO 0.18 0.16 0.11 0.20 -0.69 0.00 0.00 174.62 174.57 1g4r s ASN 299 N 0.27 4.26 0.42 3.53 0.01 -1.26 -4.97 114.94 117.20 1g4r s ASN 299 Ca 0.56 -1.54 -0.25 0.00 -0.71 0.00 0.00 52.86 50.92 1g4r s ASN 299 Cb -0.36 0.47 -0.08 0.00 0.41 0.00 0.00 41.25 41.68 1g4r s ASN 299 CO 0.39 -0.90 1.20 -0.76 -1.51 0.00 0.00 177.10 175.52 1g4r s LEU 300 N -3.98 4.15 0.64 0.60 1.43 -1.26 -1.39 118.68 118.87 1g4r s LEU 300 Ca 0.14 2.41 -0.18 0.00 -1.03 0.00 0.00 54.13 55.48 1g4r s LEU 300 Cb 0.01 -4.05 -0.03 0.00 0.03 0.00 0.00 46.19 42.15 1g4r s LEU 300 CO 0.08 -0.79 1.02 0.00 0.23 0.00 0.00 176.35 176.89 1g4r n ALA 301 N -0.07 0.26 -2.14 4.21 0.00 -0.65 -4.40 120.51 117.73 1g4r n ALA 301 Ca 0.05 -0.05 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1g4r n ALA 301 Cb 0.46 -2.15 0.01 0.00 0.00 0.00 0.00 19.45 17.77 1g4r n ALA 301 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1g4r s SER 302 N -1.38 6.12 0.40 0.00 1.04 -1.26 -4.92 113.70 113.69 1g4r s SER 302 Ca 0.77 1.01 -0.27 0.00 0.48 0.00 0.00 55.95 57.94 1g4r s SER 302 Cb -0.39 -2.20 -0.10 0.00 0.10 0.00 0.00 66.02 63.43 1g4r s SER 302 CO 0.46 -0.75 1.40 -0.44 0.98 0.00 0.00 173.24 174.89 1g4r s SER 303 N -4.16 6.27 0.00 7.02 0.01 0.21 -4.72 113.70 118.32 1g4r s SER 303 Ca 0.50 2.87 -0.30 0.00 1.31 0.00 0.00 55.95 60.33 1g4r s SER 303 Cb -0.10 -2.65 -0.04 0.00 0.21 0.00 0.00 66.02 63.43 1g4r s SER 303 CO 0.47 -0.90 1.10 -0.89 0.41 0.00 0.00 173.24 173.43 1g4r s THR 304 N -1.18 4.44 -0.27 1.44 2.01 0.70 -4.91 115.64 117.87 1g4r s THR 304 Ca 0.55 1.75 -0.21 0.00 0.31 0.00 0.00 61.69 64.10 1g4r s THR 304 Cb -0.43 -4.12 -0.02 0.00 0.01 0.00 0.00 72.50 67.95 1g4r s THR 304 CO 0.56 0.10 0.65 -0.76 -0.69 0.00 0.00 174.62 174.48 1g4r s LEU 305 N 1.34 4.08 -0.49 4.42 1.43 -1.26 -4.84 118.68 123.35 1g4r s LEU 305 Ca 0.55 0.65 -0.14 0.00 -1.03 0.00 0.00 54.13 54.16 1g4r s LEU 305 Cb -0.25 -2.87 0.11 0.00 0.03 0.00 0.00 46.19 43.21 1g4r s LEU 305 CO 0.26 -0.41 0.42 -0.76 0.23 0.00 0.00 176.35 176.08 1g4r s LEU 306 N 2.57 5.82 0.60 1.79 1.43 -1.26 -5.07 118.68 124.56 1g4r s LEU 306 Ca 0.27 -1.64 -0.18 0.00 -1.03 0.00 0.00 54.13 51.55 1g4r s LEU 306 Cb -0.15 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 43.89 1g4r s LEU 306 CO 0.09 -0.73 1.14 -0.13 0.23 0.00 0.00 176.35 176.95 1g4r s ARG 307 N 1.55 3.05 0.14 1.70 0.52 -1.26 -4.90 118.95 119.75 1g4r s ARG 307 Ca 0.04 1.58 -0.33 0.00 -0.52 0.00 0.00 55.73 56.49 1g4r s ARG 307 Cb -0.27 -1.97 -0.13 0.00 0.52 0.00 0.00 34.95 33.10 1g4r s ARG 307 CO 0.03 -1.08 1.65 0.39 0.02 0.00 0.00 175.30 176.31 1g4r n GLU 308 N -1.78 2.29 -1.04 3.54 4.71 -1.26 -1.95 120.64 125.15 1g4r n GLU 308 Ca 0.12 0.83 -0.01 0.00 -0.01 0.00 0.00 57.16 58.08 1g4r n GLU 308 Cb 0.51 -2.63 -0.01 0.00 -1.01 0.00 0.00 31.44 28.31 1g4r n GLU 308 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1g4r n GLY 309 N 3.67 0.22 3.79 0.62 0.00 -1.26 -4.98 105.19 107.25 1g4r n GLY 309 Ca 0.18 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1g4r n GLY 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g4r s ALA 310 N -1.30 2.86 -0.18 4.61 0.00 -0.82 -4.95 121.76 121.97 1g4r s ALA 310 Ca 0.00 0.71 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 1g4r s ALA 310 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 1g4r s ALA 310 CO 0.00 -0.45 1.70 1.21 0.00 0.00 0.00 175.76 178.22 1g4r s ASN 311 N -1.82 6.34 0.13 0.00 3.84 -1.26 -4.90 114.94 117.27 1g4r s ASN 311 Ca 0.67 1.80 -0.06 0.00 0.21 0.00 0.00 52.86 55.49 1g4r s ASN 311 Cb -0.20 -2.53 -0.08 0.00 -0.55 0.00 0.00 41.25 37.89 1g4r s ASN 311 CO 0.24 -1.26 1.33 -0.09 -2.79 0.00 0.00 177.10 174.52 1g4r h ARG 312 N 10.96 0.51 -0.00 0.43 2.43 -1.98 -3.35 114.38 123.39 1g4r h ARG 312 Ca -0.36 -0.48 0.01 0.00 -0.81 0.00 0.00 59.98 58.33 1g4r h ARG 312 Cb 1.17 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.83 1g4r h ARG 312 CO 0.99 1.12 -0.04 0.93 -1.51 0.00 0.00 179.97 181.46 1g4r h GLU 313 N 0.32 -0.07 0.00 0.20 5.08 -1.90 -2.89 114.58 115.32 1g4r h GLU 313 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1g4r h GLU 313 Cb 1.48 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.74 1g4r h GLU 313 CO 0.16 -0.04 0.00 0.44 -1.00 0.00 0.00 179.01 178.56 1g4r n ILE 314 N -5.15 0.00 0.67 3.13 -5.35 -1.26 -0.84 119.36 110.57 1g4r n ILE 314 Ca -0.06 0.00 0.11 0.00 -0.27 0.00 0.00 62.75 62.53 1g4r n ILE 314 Cb 0.08 -0.53 0.04 0.00 -1.74 0.00 0.00 39.64 37.49 1g4r n ILE 314 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1g4r n LEU 315 N -0.71 0.63 0.00 7.28 4.77 -1.09 -4.70 117.00 123.19 1g4r n LEU 315 Ca 0.03 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1g4r n LEU 315 Cb 0.02 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1g4r n LEU 315 CO 0.03 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.77 1g4r n GLY 316 N 1.40 1.21 2.86 -0.72 0.00 -0.02 -4.75 105.19 105.17 1g4r n GLY 316 Ca 0.03 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1g4r n GLY 316 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g4r s ILE 317 N 0.00 0.87 -0.19 -0.61 1.01 -1.26 -0.26 121.20 120.76 1g4r s ILE 317 Ca 0.00 -0.32 -0.17 0.00 0.00 0.00 0.00 60.65 60.17 1g4r s ILE 317 Cb 0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1g4r s ILE 317 CO 0.00 0.23 0.44 -0.63 0.00 0.00 0.00 174.94 174.98 1g4r s ILE 318 N 1.76 5.17 -0.07 2.92 -1.09 -0.03 -4.90 121.20 124.96 1g4r s ILE 318 Ca 0.03 0.81 0.06 0.00 -2.23 0.00 0.00 60.65 59.32 1g4r s ILE 318 Cb -0.14 -3.77 -0.01 0.00 -1.58 0.00 0.00 42.46 36.96 1g4r s ILE 318 CO -0.07 0.24 -0.25 -0.69 -1.23 0.00 0.00 174.94 172.94 1g4r s VAL 319 N 1.30 2.06 0.12 2.92 1.01 -1.26 -1.09 120.40 125.44 1g4r s VAL 319 Ca 0.21 -1.06 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 1g4r s VAL 319 Cb -0.15 -1.75 -0.00 0.00 0.00 0.00 0.00 36.38 34.48 1g4r s VAL 319 CO 0.09 0.57 0.22 -0.94 0.00 0.00 0.00 175.10 175.04 1g4r s SER 320 N -0.05 0.09 0.12 3.32 1.04 -0.49 -0.21 113.70 117.51 1g4r s SER 320 Ca -0.07 -0.73 0.05 0.00 0.48 0.00 0.00 55.95 55.68 1g4r s SER 320 Cb -0.15 0.37 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1g4r s SER 320 CO 0.05 -0.79 -0.12 -0.31 0.98 0.00 0.00 173.24 173.06 1g4r s TYR 321 N -3.90 1.24 -0.09 5.02 1.51 -1.26 -0.82 117.35 119.05 1g4r s TYR 321 Ca 0.09 -0.63 -0.14 0.00 -1.01 0.00 0.00 57.07 55.38 1g4r s TYR 321 Cb 0.04 -0.65 0.03 0.00 -0.11 0.00 0.00 41.96 41.27 1g4r s TYR 321 CO -0.07 0.08 0.36 0.15 -1.11 0.00 0.00 175.55 174.96 1g4r s LYS 322 N -2.92 0.55 -0.07 -0.62 1.02 -0.29 -3.19 119.74 114.22 1g4r s LYS 322 Ca 0.09 0.26 -0.07 0.00 0.02 0.00 0.00 55.97 56.26 1g4r s LYS 322 Cb -0.03 0.26 -0.04 0.00 -0.52 0.00 0.00 37.83 37.49 1g4r s LYS 322 CO 0.01 -0.11 0.20 0.08 -0.92 0.00 0.00 175.35 174.62 1g4r s VAL 323 N -0.40 5.40 -0.04 3.17 1.01 0.80 -0.65 120.40 129.69 1g4r s VAL 323 Ca -0.05 0.25 0.05 0.00 0.00 0.00 0.00 61.98 62.23 1g4r s VAL 323 Cb -0.03 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 1g4r s VAL 323 CO 0.02 0.54 -0.20 -0.75 0.00 0.00 0.00 175.10 174.71 1g4r s LYS 324 N -1.27 1.96 -0.14 2.72 2.20 0.13 -0.30 119.74 125.04 1g4r s LYS 324 Ca 0.20 -0.72 0.01 0.00 -0.36 0.00 0.00 55.97 55.10 1g4r s LYS 324 Cb -0.13 -1.73 0.00 0.00 -1.51 0.00 0.00 37.83 34.46 1g4r s LYS 324 CO 0.09 0.32 -0.18 0.08 -0.36 0.00 0.00 175.35 175.31 1g4r s VAL 325 N -0.13 2.46 -0.06 4.02 1.01 0.09 -1.60 120.40 126.19 1g4r s VAL 325 Ca -0.01 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.14 1g4r s VAL 325 Cb -0.11 -2.02 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1g4r s VAL 325 CO 0.02 0.53 -0.11 -0.75 0.00 0.00 0.00 175.10 174.79 1g4r s LYS 326 N 0.75 1.50 -0.18 2.72 2.20 0.10 -1.30 119.74 125.52 1g4r s LYS 326 Ca -0.07 -0.35 -0.09 0.00 -0.36 0.00 0.00 55.97 55.11 1g4r s LYS 326 Cb -0.16 -1.27 -0.05 0.00 -1.51 0.00 0.00 37.83 34.85 1g4r s LYS 326 CO 0.00 0.01 0.10 -0.51 -0.36 0.00 0.00 175.35 174.60 1g4r s LEU 327 N 0.69 4.08 -0.29 5.43 1.43 0.11 -0.97 118.68 129.16 1g4r s LEU 327 Ca -0.14 0.20 -0.10 0.00 -1.03 0.00 0.00 54.13 53.07 1g4r s LEU 327 Cb -0.15 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1g4r s LEU 327 CO 0.03 0.21 0.15 -0.69 0.23 0.00 0.00 176.35 176.28 1g4r s VAL 328 N 0.17 4.81 0.04 -1.59 1.01 -0.17 -2.13 120.40 122.54 1g4r s VAL 328 Ca 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1g4r s VAL 328 Cb -0.12 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 1g4r s VAL 328 CO -0.01 0.18 0.22 -0.69 0.00 0.00 0.00 175.10 174.80 1g4r s VAL 329 N 1.67 5.38 0.00 2.92 1.01 -0.69 -0.13 120.40 130.56 1g4r s VAL 329 Ca 0.06 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1g4r s VAL 329 Cb -0.16 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.62 1g4r s VAL 329 CO 0.07 0.20 0.00 -1.54 0.00 0.00 0.00 175.10 173.83 1g4r n SER 330 N 0.51 0.00 0.00 3.32 3.41 0.49 -3.83 113.62 117.51 1g4r n SER 330 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1g4r n SER 330 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1g4r n SER 330 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1g4r n ASP 337 N 0.00 -0.03 -1.13 4.04 5.68 -1.26 -4.72 116.55 119.12 1g4r n ASP 337 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1g4r n ASP 337 Cb 0.00 0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.23 1g4r n ASP 337 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1g4r n LEU 338 N -0.35 0.00 -4.81 -2.12 -0.00 -1.26 -4.96 117.00 103.50 1g4r n LEU 338 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 56.01 55.67 1g4r n LEU 338 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.35 1g4r n LEU 338 CO 0.00 0.00 0.66 0.00 -0.00 0.00 0.00 177.39 178.05 1g4r s ALA 339 N -2.40 3.07 0.04 1.47 0.00 -1.26 -4.96 121.76 117.71 1g4r s ALA 339 Ca 0.00 0.44 -0.38 0.00 0.00 0.00 0.00 51.96 52.02 1g4r s ALA 339 Cb 0.00 -3.16 -0.18 0.00 0.00 0.00 0.00 23.12 19.78 1g4r s ALA 339 CO 0.00 0.11 1.29 0.43 0.00 0.00 0.00 175.76 177.59 1g4r n SER 340 N -0.40 1.22 -4.88 0.00 7.64 -1.26 -4.95 113.62 110.99 1g4r n SER 340 Ca 0.06 1.13 -0.30 0.00 1.01 0.00 0.00 58.87 60.77 1g4r n SER 340 Cb 0.53 -1.11 -0.03 0.00 -1.01 0.00 0.00 64.21 62.59 1g4r n SER 340 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1g4r s SER 341 N 0.51 6.47 -0.06 6.43 0.01 -1.25 -4.91 113.70 120.90 1g4r s SER 341 Ca 0.87 1.11 0.01 0.00 1.31 0.00 0.00 55.95 59.26 1g4r s SER 341 Cb -1.05 -2.32 0.02 0.00 0.21 0.00 0.00 66.02 62.88 1g4r s SER 341 CO 0.51 -0.44 -0.08 -1.81 0.41 0.00 0.00 173.24 171.82 1g4r s ASP 342 N -3.33 1.50 -0.19 2.44 1.11 -1.26 -1.70 116.67 115.24 1g4r s ASP 342 Ca 0.51 -0.23 -0.03 0.00 0.18 0.00 0.00 52.55 52.98 1g4r s ASP 342 Cb -0.10 -0.67 -0.01 0.00 1.07 0.00 0.00 42.92 43.20 1g4r s ASP 342 CO 0.34 -0.03 -0.07 -0.69 1.18 0.00 0.00 175.17 175.91 1g4r s VAL 343 N 0.93 3.33 0.11 -1.27 1.01 -0.90 -4.96 120.40 118.64 1g4r s VAL 343 Ca -0.10 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1g4r s VAL 343 Cb -0.15 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 1g4r s VAL 343 CO 0.01 0.46 0.07 0.00 0.00 0.00 0.00 175.10 175.64 1g4r s ALA 344 N 1.07 0.59 -0.00 5.51 0.00 -1.26 0.05 121.76 127.71 1g4r s ALA 344 Ca 0.01 -1.28 -0.09 0.00 0.00 0.00 0.00 51.96 50.60 1g4r s ALA 344 Cb -0.15 0.69 0.01 0.00 0.00 0.00 0.00 23.12 23.67 1g4r s ALA 344 CO -0.01 -0.48 0.17 0.54 0.00 0.00 0.00 175.76 175.99 1g4r s VAL 345 N -3.99 0.07 0.11 0.00 0.11 -0.42 -4.88 120.40 111.40 1g4r s VAL 345 Ca 0.18 -0.61 0.10 0.00 -2.93 0.00 0.00 61.98 58.71 1g4r s VAL 345 Cb 0.07 -0.46 -0.04 0.00 -1.53 0.00 0.00 36.38 34.42 1g4r s VAL 345 CO -0.02 -0.34 -0.24 -1.61 -3.33 0.00 0.00 175.10 169.56 1g4r s GLU 346 N -1.29 1.28 -0.09 1.54 2.02 -1.26 -0.73 118.70 120.17 1g4r s GLU 346 Ca -0.14 -1.25 -0.02 0.00 0.02 0.00 0.00 54.97 53.58 1g4r s GLU 346 Cb -0.07 -1.67 0.03 0.00 0.10 0.00 0.00 34.13 32.53 1g4r s GLU 346 CO 0.02 0.39 0.01 -0.51 0.02 0.00 0.00 175.26 175.19 1g4r s LEU 347 N -1.96 0.68 0.56 1.80 1.43 0.59 -4.83 118.68 116.95 1g4r s LEU 347 Ca 0.10 -0.20 -0.15 0.00 -1.03 0.00 0.00 54.13 52.85 1g4r s LEU 347 Cb -0.10 -0.47 -0.06 0.00 0.03 0.00 0.00 46.19 45.60 1g4r s LEU 347 CO 0.05 -0.21 1.02 -2.84 0.23 0.00 0.00 176.35 174.60 1g4r s PRO 348 N 1.95 3.67 0.25 1.29 0.02 -1.26 -0.14 135.00 140.78 1g4r s PRO 348 Ca 0.04 0.99 -0.16 0.00 0.02 0.00 0.00 61.00 61.89 1g4r s PRO 348 Cb -0.13 -2.09 0.01 0.00 0.02 0.00 0.00 34.50 32.31 1g4r s PRO 348 CO -0.06 -0.51 0.56 -0.59 -0.33 0.00 0.00 177.00 176.08 1g4r s PHE 349 N -2.68 0.10 -0.04 6.54 -0.12 -1.19 -4.89 117.98 115.69 1g4r s PHE 349 Ca 0.60 -0.49 0.07 0.00 -0.05 0.00 0.00 56.93 57.06 1g4r s PHE 349 Cb -0.12 0.39 -0.02 0.00 -0.63 0.00 0.00 43.02 42.65 1g4r s PHE 349 CO 0.37 -1.06 -0.24 0.95 -0.05 0.00 0.00 175.22 175.20 1g4r s THR 350 N -3.96 2.16 -0.17 -4.49 -4.23 -0.18 -4.23 115.64 100.54 1g4r s THR 350 Ca 0.16 -1.05 -0.04 0.00 -1.18 0.00 0.00 61.69 59.58 1g4r s THR 350 Cb -0.02 -1.77 -0.03 0.00 1.34 0.00 0.00 72.50 72.02 1g4r s THR 350 CO 0.06 0.58 -0.02 -0.22 -0.54 0.00 0.00 174.62 174.48 1g4r s LEU 351 N -0.41 3.31 0.32 4.79 2.96 -1.26 -0.98 118.68 127.42 1g4r s LEU 351 Ca 0.04 -0.13 0.03 0.00 -0.22 0.00 0.00 54.13 53.85 1g4r s LEU 351 Cb -0.12 -1.81 -0.06 0.00 0.50 0.00 0.00 46.19 44.70 1g4r s LEU 351 CO 0.01 0.14 0.07 -0.04 -1.32 0.00 0.00 176.35 175.21 1g4r s MET 352 N 0.57 1.65 0.11 1.98 -1.94 0.43 -0.62 119.30 121.47 1g4r s MET 352 Ca -0.02 -1.92 -0.23 0.00 -1.71 0.00 0.00 55.69 51.81 1g4r s MET 352 Cb -0.14 -0.79 -0.07 0.00 2.01 0.00 0.00 34.83 35.84 1g4r s MET 352 CO 0.02 -0.22 0.70 -1.58 -0.01 0.00 0.00 175.02 173.94 1g4r s HIS 353 N -3.34 3.84 1.02 -0.03 2.46 -0.27 -1.83 115.29 117.15 1g4r s HIS 353 Ca 0.36 1.48 -0.15 0.00 0.47 0.00 0.00 55.06 57.22 1g4r s HIS 353 Cb 0.08 -2.69 0.08 0.00 -0.13 0.00 0.00 32.58 29.92 1g4r s HIS 353 CO 0.15 0.49 0.31 -2.30 -2.47 0.00 0.00 174.74 170.92 1g4r n PRO 354 N 1.90 -0.90 -2.31 2.88 -0.02 -1.26 -4.51 135.00 130.77 1g4r n PRO 354 Ca -0.07 -0.23 -0.38 0.00 -2.02 0.00 0.00 63.50 60.80 1g4r n PRO 354 Cb 0.50 -1.83 -0.02 0.00 -0.02 0.00 0.00 33.50 32.12 1g4r n PRO 354 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1g4r s LYS 355 N -3.64 4.05 0.00 -0.52 2.20 -1.26 -4.94 119.74 115.63 1g4r s LYS 355 Ca 0.57 1.81 0.00 0.00 -0.36 0.00 0.00 55.97 58.00 1g4r s LYS 355 Cb -0.18 -2.65 0.00 0.00 -1.51 0.00 0.00 37.83 33.49 1g4r s LYS 355 CO 0.66 -0.32 0.00 -2.30 -0.36 0.00 0.00 175.35 173.04 1g4r n PRO 356 N 0.04 2.11 0.00 4.03 -0.02 -1.26 -5.23 135.00 134.67 1g4r n PRO 356 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1g4r n PRO 356 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.95 1g4r n PRO 356 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1g4r n ASP 385 N -0.21 0.00 -3.25 2.55 -0.08 -1.26 -5.27 116.55 109.04 1g4r n ASP 385 Ca 0.00 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 53.25 1g4r n ASP 385 Cb 0.00 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.42 1g4r n ASP 385 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1g4r s ILE 386 N -1.34 -0.80 -0.16 5.18 -1.09 -1.26 -4.95 121.20 116.78 1g4r s ILE 386 Ca 0.00 -0.04 -0.05 0.00 -2.23 0.00 0.00 60.65 58.33 1g4r s ILE 386 Cb 0.00 -0.91 -0.03 0.00 -1.58 0.00 0.00 42.46 39.93 1g4r s ILE 386 CO 0.00 -0.07 0.00 -0.69 -1.23 0.00 0.00 174.94 172.95 1g4r s VAL 387 N 2.70 4.25 -0.00 2.92 1.01 -1.26 -4.99 120.40 125.02 1g4r s VAL 387 Ca 0.16 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.76 1g4r s VAL 387 Cb -0.15 -2.87 -0.06 0.00 0.00 0.00 0.00 36.38 33.30 1g4r s VAL 387 CO -0.19 0.50 0.42 -0.36 0.00 0.00 0.00 175.10 175.47 1g4r s PHE 388 N 0.21 3.72 0.01 5.22 2.99 -1.26 -0.11 117.98 128.77 1g4r s PHE 388 Ca 0.00 1.01 -0.09 0.00 0.00 0.00 0.00 56.93 57.85 1g4r s PHE 388 Cb -0.13 -2.32 0.00 0.00 0.00 0.00 0.00 43.02 40.57 1g4r s PHE 388 CO 0.02 0.61 0.17 -1.21 -0.00 0.00 0.00 175.22 174.81 1g4r s GLU 389 N -0.98 0.58 0.75 0.44 0.41 0.81 -4.91 118.70 115.79 1g4r s GLU 389 Ca 0.24 -0.48 -0.15 0.00 -0.41 0.00 0.00 54.97 54.17 1g4r s GLU 389 Cb -0.17 0.24 0.04 0.00 -1.78 0.00 0.00 34.13 32.46 1g4r s GLU 389 CO 0.14 -0.15 1.11 -0.25 -0.49 0.00 0.00 175.26 175.61 1g4r n ASP 390 N 1.14 0.90 -0.08 -0.19 8.00 -1.26 -2.12 116.55 122.94 1g4r n ASP 390 Ca -0.21 0.65 -0.18 0.00 0.71 0.00 0.00 54.79 55.76 1g4r n ASP 390 Cb 0.57 -1.47 -0.12 0.00 -0.02 0.00 0.00 41.12 40.07 1g4r n ASP 390 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1g4r h PHE 391 N -0.45 0.04 -0.14 1.24 3.57 -1.87 -3.42 116.94 115.91 1g4r h PHE 391 Ca -0.47 -0.03 -0.56 0.00 3.53 0.00 0.00 57.97 60.44 1g4r h PHE 391 Cb 1.32 -0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.99 1g4r h PHE 391 CO 0.43 1.24 1.64 0.00 -2.23 0.00 0.00 178.31 179.39 1g4r n ALA 392 N -2.96 0.33 1.78 2.41 0.00 -1.26 -5.03 120.51 115.78 1g4r n ALA 392 Ca -0.20 -0.21 0.14 0.00 0.00 0.00 0.00 53.44 53.17 1g4r n ALA 392 Cb 0.59 -2.30 0.85 0.00 0.00 0.00 0.00 19.45 18.59 1g4r n ALA 392 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39