#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ggm s ALA 2 N 0.00 3.29 -0.18 0.00 0.00 -0.79 -4.80 121.76 119.27 1ggm s ALA 2 Ca 0.00 0.77 -0.14 0.00 0.00 0.00 0.00 51.96 52.59 1ggm s ALA 2 Cb 0.00 -3.28 -0.21 0.00 0.00 0.00 0.00 23.12 19.62 1ggm s ALA 2 CO 0.00 -0.10 0.22 -1.13 0.00 0.00 0.00 175.76 174.75 1ggm n SER 3 N 0.81 1.98 -4.38 0.00 3.41 -1.26 -4.64 113.62 109.55 1ggm n SER 3 Ca 0.01 0.31 -0.33 0.00 -0.26 0.00 0.00 58.87 58.60 1ggm n SER 3 Cb 0.47 -0.89 -0.14 0.00 -0.26 0.00 0.00 64.21 63.38 1ggm n SER 3 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ggm s SER 4 N -6.97 3.97 0.36 4.04 1.04 -1.26 -4.82 113.70 110.06 1ggm s SER 4 Ca -0.27 -0.32 0.07 0.00 0.48 0.00 0.00 55.95 55.91 1ggm s SER 4 Cb 0.07 -1.48 0.77 0.00 0.10 0.00 0.00 66.02 65.48 1ggm s SER 4 CO 0.66 0.19 1.92 0.25 0.98 0.00 0.00 173.24 177.24 1ggm h LEU 5 N 6.48 0.67 -0.57 2.42 7.12 -1.90 -1.97 115.31 127.57 1ggm h LEU 5 Ca -0.29 0.02 0.11 0.00 0.13 0.00 0.00 57.88 57.86 1ggm h LEU 5 Cb 1.20 -0.12 -0.11 0.00 -0.53 0.00 0.00 40.66 41.10 1ggm h LEU 5 CO 0.54 0.39 -0.18 0.44 -0.13 0.00 0.00 178.44 179.51 1ggm h ASP 6 N 0.74 -0.65 -0.27 1.25 3.32 -1.99 0.29 116.42 119.12 1ggm h ASP 6 Ca 0.38 0.18 0.05 0.00 0.02 0.00 0.00 57.03 57.66 1ggm h ASP 6 Cb 0.47 0.40 -0.05 0.00 0.22 0.00 0.00 39.33 40.37 1ggm h ASP 6 CO -0.15 -0.22 -0.06 -0.33 -1.72 0.00 0.00 179.24 176.76 1ggm h GLU 7 N -0.04 0.01 -0.32 3.56 5.08 -1.77 0.17 114.58 121.26 1ggm h GLU 7 Ca 0.27 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.70 1ggm h GLU 7 Cb 0.46 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.63 1ggm h GLU 7 CO -0.61 0.00 -0.17 -0.07 -1.00 0.00 0.00 179.01 177.17 1ggm h LEU 8 N 0.01 -0.57 -0.86 1.33 -0.00 -0.53 0.25 115.31 114.94 1ggm h LEU 8 Ca 0.13 0.13 0.07 0.00 -0.00 0.00 0.00 57.88 58.21 1ggm h LEU 8 Cb 0.19 0.31 -0.06 0.00 -0.00 0.00 0.00 40.66 41.09 1ggm h LEU 8 CO -0.27 -0.20 0.53 0.58 -0.00 0.00 0.00 178.44 179.07 1ggm h VAL 9 N -0.12 1.01 -0.12 1.22 2.07 0.66 -1.39 116.25 119.58 1ggm h VAL 9 Ca 0.17 -0.32 -0.21 0.00 0.82 0.00 0.00 66.70 67.15 1ggm h VAL 9 Cb 0.38 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 1ggm h VAL 9 CO -0.40 0.17 -0.77 0.00 0.02 0.00 0.00 177.57 176.59 1ggm h ALA 10 N 1.42 0.42 -0.41 1.67 0.00 0.80 -2.83 119.26 120.33 1ggm h ALA 10 Ca 0.38 -0.61 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 1ggm h ALA 10 Cb 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ggm h ALA 10 CO -0.19 0.72 -0.19 1.25 0.00 0.00 0.00 179.25 180.84 1ggm h LEU 11 N 0.43 0.88 -0.66 0.00 6.46 -0.41 -1.42 115.31 120.59 1ggm h LEU 11 Ca -0.05 -0.40 0.10 0.00 -0.12 0.00 0.00 57.88 57.42 1ggm h LEU 11 Cb 1.38 -0.24 -0.08 0.00 -0.73 0.00 0.00 40.66 40.99 1ggm h LEU 11 CO 0.15 1.08 0.27 0.00 -0.62 0.00 0.00 178.44 179.32 1ggm h LYS 13 N 0.46 -0.12 0.00 0.00 3.64 -1.45 0.35 116.57 119.44 1ggm h LYS 13 Ca 0.34 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 1ggm h LYS 13 Cb 0.43 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1ggm h LYS 13 CO -0.32 0.41 0.11 -0.09 -2.27 0.00 0.00 179.45 177.30 1ggm h ARG 14 N -0.79 0.00 -0.00 1.90 2.43 -1.06 -2.31 114.38 114.56 1ggm h ARG 14 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1ggm h ARG 14 Cb 0.58 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1ggm h ARG 14 CO 0.02 0.00 -0.01 0.54 -1.51 0.00 0.00 179.97 179.01 1ggm n ARG 15 N -2.26 3.49 -1.54 0.20 5.12 -0.39 -5.01 116.66 116.25 1ggm n ARG 15 Ca -0.01 -0.23 0.00 0.00 -1.93 0.00 0.00 57.85 55.68 1ggm n ARG 15 Cb 0.14 -0.73 0.00 0.00 -1.16 0.00 0.00 32.46 30.71 1ggm n ARG 15 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ggm n GLY 16 N 0.59 0.80 0.02 -0.13 0.00 -0.87 -4.60 105.19 101.00 1ggm n GLY 16 Ca 0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 46.02 45.37 1ggm n GLY 16 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1ggm h PHE 17 N 0.00 0.00 -3.79 1.61 0.04 -0.57 -0.97 116.94 113.25 1ggm h PHE 17 Ca 0.00 0.00 -0.48 0.00 2.80 0.00 0.00 57.97 60.29 1ggm h PHE 17 Cb 0.75 0.00 -0.31 0.00 2.20 0.00 0.00 35.95 38.59 1ggm h PHE 17 CO 0.00 0.00 -0.81 0.42 -0.60 0.00 0.00 178.31 177.32 1ggm s ILE 18 N -1.25 1.04 0.22 -0.55 1.01 -1.00 0.95 121.20 121.62 1ggm s ILE 18 Ca -0.01 -0.49 0.10 0.00 0.00 0.00 0.00 60.65 60.24 1ggm s ILE 18 Cb 0.00 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.51 1ggm s ILE 18 CO 0.02 0.32 -0.12 -0.36 0.00 0.00 0.00 174.94 174.80 1ggm s PHE 19 N 0.21 2.53 0.02 3.97 0.08 0.48 -3.38 117.98 121.88 1ggm s PHE 19 Ca -0.05 -0.26 -0.30 0.00 0.12 0.00 0.00 56.93 56.43 1ggm s PHE 19 Cb -0.11 -1.18 -0.05 0.00 -0.57 0.00 0.00 43.02 41.11 1ggm s PHE 19 CO 0.01 0.58 1.30 -1.14 -0.10 0.00 0.00 175.22 175.87 1ggm s GLN 20 N -3.15 4.34 0.47 0.44 2.00 -1.26 -0.79 119.66 121.72 1ggm s GLN 20 Ca 0.27 1.86 -0.24 0.00 -2.00 0.00 0.00 55.36 55.24 1ggm s GLN 20 Cb -0.07 -3.47 -0.07 0.00 0.80 0.00 0.00 33.01 30.20 1ggm s GLN 20 CO 0.15 -0.44 1.41 0.45 -0.50 0.00 0.00 175.29 176.36 1ggm s SER 21 N 1.47 5.73 -1.39 6.67 0.15 -1.10 -2.61 113.70 122.62 1ggm s SER 21 Ca 0.61 2.88 -0.13 0.00 0.70 0.00 0.00 55.95 60.00 1ggm s SER 21 Cb -0.30 -2.65 0.11 0.00 -1.71 0.00 0.00 66.02 61.47 1ggm s SER 21 CO 0.27 -1.27 0.57 -1.20 1.20 0.00 0.00 173.24 172.80 1ggm n SER 22 N -0.40 -3.27 -0.11 5.45 7.64 -1.26 -3.24 113.62 118.42 1ggm n SER 22 Ca 0.06 -0.61 -0.05 0.00 1.01 0.00 0.00 58.87 59.29 1ggm n SER 22 Cb 0.43 -2.72 0.01 0.00 -1.01 0.00 0.00 64.21 60.92 1ggm n SER 22 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1ggm h GLU 23 N -1.08 -0.04 -0.66 1.43 4.81 -1.86 -1.25 114.58 115.92 1ggm h GLU 23 Ca -0.47 0.00 0.17 0.00 -0.13 0.00 0.00 59.36 58.94 1ggm h GLU 23 Cb 1.31 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.67 1ggm h GLU 23 CO 0.61 -0.03 0.47 -0.84 -0.73 0.00 0.00 179.01 178.49 1ggm h ILE 24 N -0.04 0.71 -0.62 2.32 3.07 -1.89 -0.98 117.51 120.08 1ggm h ILE 24 Ca 0.19 -0.04 -0.06 0.00 1.55 0.00 0.00 64.86 66.50 1ggm h ILE 24 Cb 0.33 0.59 -0.03 0.00 -0.27 0.00 0.00 36.82 37.43 1ggm h ILE 24 CO -0.42 0.02 0.07 -1.22 -1.05 0.00 0.00 178.15 175.55 1ggm n TYR 25 N -4.39 2.20 0.00 0.16 4.01 -1.00 -4.90 117.16 113.24 1ggm n TYR 25 Ca 0.13 -0.86 0.00 0.00 -0.16 0.00 0.00 57.90 57.01 1ggm n TYR 25 Cb 0.66 -0.56 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 1ggm n TYR 25 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ggm n GLY 26 N 0.41 2.84 0.00 2.72 0.00 -0.37 -4.98 105.19 105.81 1ggm n GLY 26 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1ggm n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggm n GLY 27 N -1.14 -2.14 3.30 -0.02 0.00 -0.51 -4.87 105.19 99.81 1ggm n GLY 27 Ca 0.00 -1.22 -0.46 0.00 0.00 0.00 0.00 46.02 44.34 1ggm n GLY 27 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ggm s LEU 28 N -1.60 6.48 0.05 0.99 2.96 -1.20 -5.00 118.68 121.37 1ggm s LEU 28 Ca 0.00 -2.49 -0.36 0.00 -0.22 0.00 0.00 54.13 51.06 1ggm s LEU 28 Cb 0.00 -2.17 -0.15 0.00 0.50 0.00 0.00 46.19 44.37 1ggm s LEU 28 CO 0.00 -0.62 1.52 0.00 -1.32 0.00 0.00 176.35 175.93 1ggm n GLN 29 N 4.23 1.60 -0.10 1.98 10.64 -1.26 -1.94 117.38 132.52 1ggm n GLN 29 Ca 0.07 0.58 0.00 0.00 -1.83 0.00 0.00 57.00 55.82 1ggm n GLN 29 Cb 0.45 -2.29 0.00 0.00 -0.86 0.00 0.00 30.24 27.53 1ggm n GLN 29 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ggm n GLY 30 N 3.21 0.66 2.79 2.61 0.00 -1.26 -4.92 105.19 108.29 1ggm n GLY 30 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.03 1ggm n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggm s VAL 31 N -2.15 0.13 0.39 1.61 0.11 -0.82 -0.62 120.40 119.05 1ggm s VAL 31 Ca 0.00 0.15 0.07 0.00 -2.93 0.00 0.00 61.98 59.28 1ggm s VAL 31 Cb 0.00 -0.26 -0.08 0.00 -1.53 0.00 0.00 36.38 34.51 1ggm s VAL 31 CO 0.00 0.15 -0.01 -0.31 -3.33 0.00 0.00 175.10 171.60 1ggm s TYR 32 N 1.28 2.46 0.00 1.54 1.51 -1.26 -2.72 117.35 120.17 1ggm s TYR 32 Ca -0.06 -0.65 0.08 0.00 -1.01 0.00 0.00 57.07 55.43 1ggm s TYR 32 Cb -0.13 -1.67 -0.02 0.00 -0.11 0.00 0.00 41.96 40.03 1ggm s TYR 32 CO -0.02 0.46 -0.24 -0.51 -1.11 0.00 0.00 175.55 174.13 1ggm s ASP 33 N -3.68 3.28 -0.35 2.29 1.01 0.03 -4.58 116.67 114.67 1ggm s ASP 33 Ca 0.34 -0.47 -0.17 0.00 0.71 0.00 0.00 52.55 52.97 1ggm s ASP 33 Cb 0.08 -0.41 -0.00 0.00 1.01 0.00 0.00 42.92 43.59 1ggm s ASP 33 CO 0.17 0.30 0.43 -0.31 0.21 0.00 0.00 175.17 175.97 1ggm s TYR 34 N -0.72 3.19 0.21 4.23 2.02 -1.26 -0.39 117.35 124.63 1ggm s TYR 34 Ca 0.11 0.01 -0.03 0.00 -0.37 0.00 0.00 57.07 56.79 1ggm s TYR 34 Cb -0.10 -2.79 0.05 0.00 -0.40 0.00 0.00 41.96 38.71 1ggm s TYR 34 CO 0.01 -0.51 0.24 0.41 -1.57 0.00 0.00 175.55 174.13 1ggm n GLY 35 N 4.91 -1.73 0.11 0.71 0.00 0.27 -4.53 105.19 104.93 1ggm n GLY 35 Ca -0.07 -1.59 -0.03 0.00 0.00 0.00 0.00 46.02 44.33 1ggm n GLY 35 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ggm h PRO 36 N 0.00 -0.01 0.00 1.61 0.11 -1.45 -0.55 132.00 131.71 1ggm h PRO 36 Ca -0.08 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.98 1ggm h PRO 36 Cb 0.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 1ggm h PRO 36 CO 0.06 -0.00 -0.22 -0.07 -0.21 0.00 0.00 178.00 177.55 1ggm h LEU 37 N -0.01 0.00 0.77 2.35 3.38 -1.63 -2.97 115.31 117.21 1ggm h LEU 37 Ca 0.04 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1ggm h LEU 37 Cb 0.11 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.86 1ggm h LEU 37 CO -0.23 0.22 -0.37 1.23 0.09 0.00 0.00 178.44 179.38 1ggm h GLY 38 N 1.31 -1.08 -0.54 0.83 0.00 -1.20 -2.47 103.07 99.92 1ggm h GLY 38 Ca -0.00 0.40 0.06 0.00 0.00 0.00 0.00 47.33 47.79 1ggm h GLY 38 CO 0.03 -0.39 -0.57 -2.08 0.00 0.00 0.00 176.54 173.53 1ggm h VAL 39 N -1.14 0.00 -0.49 4.60 2.07 -0.98 0.02 116.25 120.32 1ggm h VAL 39 Ca -0.11 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.51 1ggm h VAL 39 Cb 0.81 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.47 1ggm h VAL 39 CO 0.17 0.00 -0.30 -0.33 0.02 0.00 0.00 177.57 177.13 1ggm h GLU 40 N -0.31 -0.18 -0.23 1.57 4.39 -1.56 0.30 114.58 118.57 1ggm h GLU 40 Ca 0.09 0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.86 1ggm h GLU 40 Cb 0.55 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.19 1ggm h GLU 40 CO -0.67 -0.12 -0.13 1.25 -1.16 0.00 0.00 179.01 178.18 1ggm h LEU 41 N -0.18 -0.43 -0.24 1.33 5.85 -0.68 0.88 115.31 121.84 1ggm h LEU 41 Ca 0.21 0.10 0.04 0.00 0.84 0.00 0.00 57.88 59.07 1ggm h LEU 41 Cb 0.53 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 1ggm h LEU 41 CO -0.60 -0.17 0.02 0.50 -0.34 0.00 0.00 178.44 177.85 1ggm h LYS 42 N -0.11 0.09 -0.35 1.25 3.64 0.27 -0.68 116.57 120.69 1ggm h LYS 42 Ca 0.13 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1ggm h LYS 42 Cb 0.30 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1ggm h LYS 42 CO -0.30 0.06 0.22 -0.91 -2.27 0.00 0.00 179.45 176.25 1ggm h ASN 43 N 0.10 0.42 -0.66 4.20 -0.26 0.22 0.10 115.58 119.70 1ggm h ASN 43 Ca 0.11 -0.04 0.05 0.00 -0.56 0.00 0.00 56.30 55.86 1ggm h ASN 43 Cb 0.13 -0.11 -0.04 0.00 -1.06 0.00 0.00 38.32 37.25 1ggm h ASN 43 CO -0.17 0.33 0.44 0.78 -1.06 0.00 0.00 177.43 177.75 1ggm h ASN 44 N 0.47 0.63 -0.04 5.81 -0.26 -0.25 0.23 115.58 122.17 1ggm h ASN 44 Ca 0.13 -0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.85 1ggm h ASN 44 Cb -0.02 -0.14 -0.00 0.00 -1.06 0.00 0.00 38.32 37.10 1ggm h ASN 44 CO -0.03 0.42 -0.04 0.25 -1.06 0.00 0.00 177.43 176.98 1ggm h LEU 45 N 0.73 0.10 -0.10 1.61 5.85 -0.14 -2.63 115.31 120.73 1ggm h LEU 45 Ca 0.28 -0.50 0.04 0.00 0.84 0.00 0.00 57.88 58.54 1ggm h LEU 45 Cb 0.17 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 1ggm h LEU 45 CO -0.08 0.58 -0.22 0.11 -0.34 0.00 0.00 178.44 178.49 1ggm h LYS 46 N -0.37 -0.28 -0.33 1.25 1.57 0.27 -2.40 116.57 116.27 1ggm h LYS 46 Ca 0.01 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 1ggm h LYS 46 Cb 0.56 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.87 1ggm h LYS 46 CO 0.01 -0.19 -0.07 1.96 -0.57 0.00 0.00 179.45 180.59 1ggm h GLN 47 N -0.29 0.01 -0.23 3.15 4.20 -0.61 -1.87 115.11 119.46 1ggm h GLN 47 Ca 0.09 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1ggm h GLN 47 Cb 0.43 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 1ggm h GLN 47 CO -0.27 0.01 0.07 0.00 -0.67 0.00 0.00 178.83 177.96 1ggm h ALA 48 N 1.32 1.69 -0.34 3.87 0.00 -1.24 0.32 119.26 124.87 1ggm h ALA 48 Ca 0.16 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 1ggm h ALA 48 Cb 0.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1ggm h ALA 48 CO -0.33 0.25 -0.36 2.35 0.00 0.00 0.00 179.25 181.16 1ggm h TRP 49 N 0.33 0.92 -0.08 0.00 7.01 -0.88 -1.46 115.95 121.79 1ggm h TRP 49 Ca 0.08 -0.26 -0.23 0.00 2.11 0.00 0.00 58.89 60.60 1ggm h TRP 49 Cb 0.11 -0.20 0.01 0.00 -2.10 0.00 0.00 29.16 26.99 1ggm h TRP 49 CO 0.00 1.02 -0.83 2.35 -2.79 0.00 0.00 178.44 178.19 1ggm h TRP 50 N 0.65 0.99 0.16 2.65 2.91 -0.39 -0.13 115.95 122.78 1ggm h TRP 50 Ca 0.06 -0.48 0.00 0.00 1.13 0.00 0.00 58.89 59.60 1ggm h TRP 50 Cb 0.91 -0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 29.41 1ggm h TRP 50 CO 0.05 1.31 -0.15 -0.09 -1.03 0.00 0.00 178.44 178.53 1ggm h ARG 51 N 0.38 -0.33 0.71 2.65 2.43 -0.40 0.28 114.38 120.11 1ggm h ARG 51 Ca -0.08 0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 1ggm h ARG 51 Cb 1.48 0.07 0.01 0.00 -0.42 0.00 0.00 29.97 31.11 1ggm h ARG 51 CO 0.17 -0.22 -0.35 -0.09 -1.51 0.00 0.00 179.97 177.97 1ggm h ARG 52 N -0.34 -0.92 0.00 0.20 9.65 -1.27 -1.13 114.38 120.57 1ggm h ARG 52 Ca -0.00 0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 1ggm h ARG 52 Cb 0.32 0.21 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 1ggm h ARG 52 CO -0.03 -0.62 0.00 0.09 2.80 0.00 0.00 179.97 182.21 1ggm n ASN 53 N -4.59 0.00 0.06 -3.80 3.02 -0.06 -3.67 115.26 106.21 1ggm n ASN 53 Ca -0.12 -0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.06 1ggm n ASN 53 Cb 0.38 -0.18 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 1ggm n ASN 53 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1ggm n VAL 54 N -1.18 0.63 -0.06 2.41 0.31 0.08 -4.67 118.33 115.85 1ggm n VAL 54 Ca 0.15 0.21 -0.12 0.00 -0.01 0.00 0.00 64.34 64.56 1ggm n VAL 54 Cb 0.16 -1.23 -0.06 0.00 -0.91 0.00 0.00 33.84 31.80 1ggm n VAL 54 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 1ggm h TYR 55 N 0.00 0.42 0.00 3.52 -1.99 -1.33 -3.15 116.97 114.43 1ggm h TYR 55 Ca 0.00 -0.11 0.00 0.00 2.00 0.00 0.00 58.73 60.62 1ggm h TYR 55 Cb 0.18 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 38.81 1ggm h TYR 55 CO 0.00 0.68 0.00 0.93 -0.00 0.00 0.00 178.16 179.77 1ggm h GLU 56 N 0.04 0.00 -7.39 4.88 5.08 -1.32 -3.45 114.58 112.41 1ggm h GLU 56 Ca 0.04 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.94 1ggm h GLU 56 Cb 0.57 0.00 0.11 0.00 0.50 0.00 0.00 28.75 29.93 1ggm h GLU 56 CO 0.03 0.00 0.24 1.03 -1.00 0.00 0.00 179.01 179.30 1ggm s ARG 57 N -3.34 1.34 0.00 2.33 0.52 -1.19 -5.03 118.95 113.58 1ggm s ARG 57 Ca 0.06 -0.77 0.15 0.00 -0.52 0.00 0.00 55.73 54.64 1ggm s ARG 57 Cb 0.08 -2.14 0.24 0.00 0.52 0.00 0.00 34.95 33.66 1ggm s ARG 57 CO 0.58 -1.79 1.08 -0.25 0.02 0.00 0.00 175.30 174.95 1ggm n ASP 58 N -3.19 0.51 -0.76 0.23 8.00 -1.26 -4.82 116.55 115.26 1ggm n ASP 58 Ca 0.14 -1.96 -0.00 0.00 0.71 0.00 0.00 54.79 53.68 1ggm n ASP 58 Cb 0.60 -0.22 -0.01 0.00 -0.02 0.00 0.00 41.12 41.48 1ggm n ASP 58 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1ggm n ASP 59 N 0.28 0.06 -4.11 -2.24 5.75 -1.26 -5.09 116.55 109.95 1ggm n ASP 59 Ca 0.02 -1.73 -0.22 0.00 -0.01 0.00 0.00 54.79 52.85 1ggm n ASP 59 Cb 0.95 -0.10 -0.15 0.00 -1.03 0.00 0.00 41.12 40.79 1ggm n ASP 59 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 1ggm s MET 60 N 0.00 1.14 0.10 0.11 -1.94 -1.26 -1.06 119.30 116.39 1ggm s MET 60 Ca 0.07 -0.50 0.08 0.00 -1.71 0.00 0.00 55.69 53.63 1ggm s MET 60 Cb 0.07 -1.10 -0.04 0.00 2.01 0.00 0.00 34.83 35.78 1ggm s MET 60 CO -0.03 0.30 -0.18 -2.00 -0.01 0.00 0.00 175.02 173.10 1ggm s GLU 61 N -0.32 1.87 0.52 2.03 2.56 -0.25 -4.96 118.70 120.16 1ggm s GLU 61 Ca 0.05 -1.12 0.03 0.00 0.00 0.00 0.00 54.97 53.93 1ggm s GLU 61 Cb -0.05 -2.14 0.03 0.00 2.00 0.00 0.00 34.13 33.96 1ggm s GLU 61 CO -0.01 0.50 0.72 0.20 -0.56 0.00 0.00 175.26 176.12 1ggm s GLY 62 N -1.96 1.85 0.21 -1.50 0.00 -1.26 -0.34 107.32 104.33 1ggm s GLY 62 Ca 0.17 -1.41 -0.19 0.00 0.00 0.00 0.00 44.72 43.29 1ggm s GLY 62 CO 0.09 -1.15 0.58 -2.27 0.00 0.00 0.00 173.10 170.36 1ggm s LEU 63 N -4.66 -0.13 -0.40 0.66 2.96 -0.77 -4.74 118.68 111.60 1ggm s LEU 63 Ca 0.57 -0.43 0.07 0.00 -0.22 0.00 0.00 54.13 54.11 1ggm s LEU 63 Cb -0.10 2.36 0.17 0.00 0.50 0.00 0.00 46.19 49.13 1ggm s LEU 63 CO 0.37 -1.11 0.57 -0.62 -1.32 0.00 0.00 176.35 174.24 1ggm s ASP 64 N -2.87 -0.94 0.65 3.68 2.15 -1.26 -4.37 116.67 113.72 1ggm s ASP 64 Ca 0.08 -0.96 -0.04 0.00 0.43 0.00 0.00 52.55 52.07 1ggm s ASP 64 Cb -0.02 1.65 0.05 0.00 -0.30 0.00 0.00 42.92 44.30 1ggm s ASP 64 CO -0.02 -0.19 0.93 0.00 -0.17 0.00 0.00 175.17 175.72 1ggm s ALA 65 N 1.75 3.42 0.66 3.66 0.00 -1.26 -5.09 121.76 124.92 1ggm s ALA 65 Ca 0.16 -1.07 -0.09 0.00 0.00 0.00 0.00 51.96 50.96 1ggm s ALA 65 Cb -0.07 -2.41 0.02 0.00 0.00 0.00 0.00 23.12 20.66 1ggm s ALA 65 CO -0.06 -1.10 1.02 -1.54 0.00 0.00 0.00 175.76 174.08 1ggm s SER 66 N -4.48 5.43 0.12 0.00 1.04 -1.26 -4.99 113.70 109.56 1ggm s SER 66 Ca 0.59 0.92 -0.02 0.00 0.48 0.00 0.00 55.95 57.93 1ggm s SER 66 Cb -0.11 -1.78 -0.15 0.00 0.10 0.00 0.00 66.02 64.09 1ggm s SER 66 CO 0.42 -1.27 1.26 0.58 0.98 0.00 0.00 173.24 175.22 1ggm h VAL 67 N -0.48 1.49 -2.88 5.02 2.07 -1.96 -3.44 116.25 116.07 1ggm h VAL 67 Ca -0.45 -2.81 -0.56 0.00 0.82 0.00 0.00 66.70 63.70 1ggm h VAL 67 Cb 1.26 2.67 -0.02 0.00 -1.52 0.00 0.00 31.29 33.68 1ggm h VAL 67 CO 0.63 0.82 0.90 -0.76 0.02 0.00 0.00 177.57 179.18 1ggm s LEU 68 N -7.34 4.25 -0.13 2.57 1.43 -1.26 -1.81 118.68 116.39 1ggm s LEU 68 Ca -0.04 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.96 1ggm s LEU 68 Cb 0.09 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.75 1ggm s LEU 68 CO 0.86 -0.76 -0.14 -0.89 0.23 0.00 0.00 176.35 175.65 1ggm s THR 69 N 3.21 2.96 0.26 5.49 2.01 -0.34 -4.95 115.64 124.28 1ggm s THR 69 Ca 0.60 -0.69 -0.30 0.00 0.31 0.00 0.00 61.69 61.61 1ggm s THR 69 Cb -0.26 -2.24 -0.11 0.00 0.01 0.00 0.00 72.50 69.90 1ggm s THR 69 CO 0.21 0.53 1.56 -2.28 -0.69 0.00 0.00 174.62 173.95 1ggm s HIS 70 N 0.39 2.88 0.28 4.92 2.46 -1.26 -2.12 115.29 122.83 1ggm s HIS 70 Ca -0.11 0.78 0.09 0.00 0.47 0.00 0.00 55.06 56.29 1ggm s HIS 70 Cb -0.16 -3.99 0.88 0.00 -0.13 0.00 0.00 32.58 29.17 1ggm s HIS 70 CO 0.06 -3.40 1.32 -2.13 -2.47 0.00 0.00 174.74 168.12 1ggm n ARG 71 N 2.63 -0.06 -0.17 2.88 0.63 -1.24 -0.09 116.66 121.24 1ggm n ARG 71 Ca 0.09 1.21 -0.07 0.00 -0.92 0.00 0.00 57.85 58.16 1ggm n ARG 71 Cb 0.38 -2.03 0.02 0.00 0.45 0.00 0.00 32.46 31.27 1ggm n ARG 71 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1ggm h LEU 72 N 0.00 0.59 -0.54 6.15 3.38 -1.91 -2.94 115.31 120.04 1ggm h LEU 72 Ca 0.61 -0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.64 1ggm h LEU 72 Cb 1.45 -0.15 -0.11 0.00 0.09 0.00 0.00 40.66 41.94 1ggm h LEU 72 CO -0.72 0.45 -0.30 0.58 0.09 0.00 0.00 178.44 178.55 1ggm h VAL 73 N 0.67 0.23 0.00 1.22 2.07 -0.86 0.52 116.25 120.10 1ggm h VAL 73 Ca 0.18 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.70 1ggm h VAL 73 Cb -0.04 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 29.96 1ggm h VAL 73 CO -0.04 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.73 1ggm n LEU 74 N -5.43 0.00 -0.06 2.57 4.77 -1.21 -2.52 117.00 115.12 1ggm n LEU 74 Ca 0.04 0.46 -0.12 0.00 -0.03 0.00 0.00 56.01 56.36 1ggm n LEU 74 Cb 0.34 -0.46 -0.11 0.00 -2.33 0.00 0.00 43.42 40.86 1ggm n LEU 74 CO 0.04 -0.08 0.35 -0.74 -1.33 0.00 0.00 177.39 175.62 1ggm h HIS 75 N 0.00 -0.01 0.00 -1.77 2.76 0.18 0.59 115.15 116.90 1ggm h HIS 75 Ca 0.00 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.16 1ggm h HIS 75 Cb 0.38 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.34 1ggm h HIS 75 CO 0.00 0.81 -0.05 1.88 -1.30 0.00 0.00 177.93 179.27 1ggm h TYR 76 N -0.97 0.00 -0.00 5.26 0.05 -1.27 -1.38 116.97 118.66 1ggm h TYR 76 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ggm h TYR 76 Cb 0.82 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.56 1ggm h TYR 76 CO 0.23 0.05 -0.11 -1.13 -1.05 0.00 0.00 178.16 176.14 1ggm n SER 77 N -3.17 0.25 -0.06 3.88 3.41 -1.05 -4.75 113.62 112.12 1ggm n SER 77 Ca 0.00 -0.14 -0.01 0.00 -0.26 0.00 0.00 58.87 58.47 1ggm n SER 77 Cb 0.31 -0.19 -0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1ggm n SER 77 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ggm n GLY 78 N 1.37 0.48 0.23 5.00 0.00 -0.52 -4.91 105.19 106.85 1ggm n GLY 78 Ca 0.11 -0.53 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 1ggm n GLY 78 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1ggm h HIS 79 N 0.00 1.05 -0.11 1.61 3.86 -0.22 0.30 115.15 121.65 1ggm h HIS 79 Ca -0.02 -0.43 -0.00 0.00 -1.16 0.00 0.00 60.37 58.76 1ggm h HIS 79 Cb 0.09 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 28.38 1ggm h HIS 79 CO 0.05 1.26 0.06 1.49 0.86 0.00 0.00 177.93 181.64 1ggm h GLU 80 N 0.55 0.15 -0.27 2.45 4.81 -0.60 -1.79 114.58 119.88 1ggm h GLU 80 Ca -0.03 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.02 1ggm h GLU 80 Cb 1.30 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.64 1ggm h GLU 80 CO 0.14 0.20 -0.49 0.00 -0.73 0.00 0.00 179.01 178.13 1ggm h ALA 81 N 0.94 0.63 0.00 2.92 0.00 -1.77 -3.42 119.26 118.57 1ggm h ALA 81 Ca 0.04 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1ggm h ALA 81 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ggm h ALA 81 CO -0.01 0.68 -0.74 2.41 0.00 0.00 0.00 179.25 181.60 1ggm n THR 82 N -4.00 0.00 -1.64 0.00 -1.04 0.11 -4.95 114.28 102.75 1ggm n THR 82 Ca -0.03 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.83 1ggm n THR 82 Cb 0.58 -0.44 -0.07 0.00 -1.82 0.00 0.00 70.33 68.58 1ggm n THR 82 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1ggm s PHE 83 N -1.66 1.24 -0.09 -1.42 2.19 -0.67 -4.80 117.98 112.77 1ggm s PHE 83 Ca 0.00 1.81 -0.30 0.00 0.33 0.00 0.00 56.93 58.77 1ggm s PHE 83 Cb 0.00 -3.52 0.12 0.00 -1.31 0.00 0.00 43.02 38.31 1ggm s PHE 83 CO 0.00 -1.54 0.98 0.00 1.83 0.00 0.00 175.22 176.49 1ggm s ALA 84 N 14.25 -1.90 -0.08 11.12 0.00 -1.26 -3.34 121.76 140.55 1ggm s ALA 84 Ca 0.89 1.29 0.04 0.00 0.00 0.00 0.00 51.96 54.18 1ggm s ALA 84 Cb -0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 1ggm s ALA 84 CO 0.07 -0.56 -0.19 -0.51 0.00 0.00 0.00 175.76 174.58 1ggm s ASP 85 N -2.02 3.59 -0.63 0.00 1.11 -0.02 -4.78 116.67 113.92 1ggm s ASP 85 Ca 0.04 -0.38 -0.26 0.00 0.18 0.00 0.00 52.55 52.13 1ggm s ASP 85 Cb -0.01 -1.07 -0.10 0.00 1.07 0.00 0.00 42.92 42.81 1ggm s ASP 85 CO -0.05 0.25 2.41 -2.16 1.18 0.00 0.00 175.17 176.80 1ggm s PRO 86 N -0.16 1.86 0.13 8.23 0.04 -1.26 0.13 135.00 143.96 1ggm s PRO 86 Ca -0.02 1.00 -0.09 0.00 0.04 0.00 0.00 61.00 61.93 1ggm s PRO 86 Cb -0.14 -4.68 -0.06 0.00 0.04 0.00 0.00 34.50 29.67 1ggm s PRO 86 CO 0.04 -3.83 0.43 1.41 0.04 0.00 0.00 177.00 175.09 1ggm s MET 87 N 8.57 3.74 -0.06 4.56 1.75 0.44 -4.85 119.30 133.46 1ggm s MET 87 Ca 0.95 0.13 -0.21 0.00 -1.25 0.00 0.00 55.69 55.32 1ggm s MET 87 Cb -0.15 -2.89 0.04 0.00 2.84 0.00 0.00 34.83 34.67 1ggm s MET 87 CO 0.18 0.49 0.48 0.08 -0.65 0.00 0.00 175.02 175.60 1ggm s VAL 88 N -1.55 0.03 0.17 10.11 1.01 -1.23 -0.37 120.40 128.57 1ggm s VAL 88 Ca 0.38 -0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.21 1ggm s VAL 88 Cb -0.13 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 1ggm s VAL 88 CO 0.21 -0.12 -0.14 1.51 0.00 0.00 0.00 175.10 176.55 1ggm s ASP 89 N -1.02 2.32 0.00 3.32 1.47 -1.26 -0.32 116.67 121.19 1ggm s ASP 89 Ca -0.10 -0.97 0.00 0.00 1.18 0.00 0.00 52.55 52.66 1ggm s ASP 89 Cb -0.03 -0.10 0.00 0.00 -0.34 0.00 0.00 42.92 42.45 1ggm s ASP 89 CO 0.06 -0.18 0.00 0.59 0.68 0.00 0.00 175.17 176.31 1ggm n ASN 90 N -0.12 0.00 -0.11 2.11 3.02 -0.08 -2.08 115.26 118.00 1ggm n ASN 90 Ca -0.10 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.45 1ggm n ASN 90 Cb 0.59 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.77 1ggm n ASN 90 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ggm n ALA 91 N -3.00 1.45 -1.00 5.41 0.00 -1.26 -2.52 120.51 119.59 1ggm n ALA 91 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.62 1ggm n ALA 91 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.32 1ggm n ALA 91 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ggm n LYS 92 N -0.17 0.00 -4.72 0.00 4.01 -1.26 -5.16 118.16 110.86 1ggm n LYS 92 Ca 0.01 0.00 -0.32 0.00 -0.51 0.00 0.00 58.31 57.49 1ggm n LYS 92 Cb 0.51 0.00 -0.08 0.00 -0.51 0.00 0.00 35.03 34.94 1ggm n LYS 92 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ggm s ALA 93 N -1.69 3.85 0.21 7.82 0.00 -1.26 -5.08 121.76 125.60 1ggm s ALA 93 Ca 0.00 -0.85 -0.03 0.00 0.00 0.00 0.00 51.96 51.08 1ggm s ALA 93 Cb 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.16 1ggm s ALA 93 CO 0.00 -0.05 0.43 1.03 0.00 0.00 0.00 175.76 177.16 1ggm s ARG 94 N -3.83 3.57 0.00 0.00 1.81 -1.25 -0.91 118.95 118.34 1ggm s ARG 94 Ca 0.13 -0.19 0.00 0.00 -1.72 0.00 0.00 55.73 53.95 1ggm s ARG 94 Cb 0.04 -2.79 0.00 0.00 -0.45 0.00 0.00 34.95 31.74 1ggm s ARG 94 CO 0.07 0.37 0.00 0.66 -0.68 0.00 0.00 175.30 175.72 1ggm n TYR 95 N -0.54 -0.87 -3.45 -0.53 4.01 0.56 -4.94 117.16 111.42 1ggm n TYR 95 Ca -0.03 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.43 1ggm n TYR 95 Cb 0.53 0.45 -0.12 0.00 -0.31 0.00 0.00 39.34 39.90 1ggm n TYR 95 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1ggm s TRP 159 N -1.91 0.61 1.12 -0.72 0.52 -1.05 -3.54 118.94 113.97 1ggm s TRP 159 Ca 0.00 -1.55 -0.13 0.00 0.02 0.00 0.00 56.10 54.44 1ggm s TRP 159 Cb 0.00 -0.85 0.26 0.00 -1.15 0.00 0.00 33.47 31.73 1ggm s TRP 159 CO 0.00 -0.84 1.05 0.95 0.02 0.00 0.00 176.95 178.12 1ggm s THR 160 N 1.09 2.03 0.50 2.01 -4.23 -0.88 -4.90 115.64 111.24 1ggm s THR 160 Ca 0.18 0.01 -0.23 0.00 -1.18 0.00 0.00 61.69 60.47 1ggm s THR 160 Cb -0.22 -2.18 -0.06 0.00 1.34 0.00 0.00 72.50 71.38 1ggm s THR 160 CO 0.00 -0.01 1.35 -2.84 -0.54 0.00 0.00 174.62 172.58 1ggm s PRO 161 N -4.60 3.44 1.02 3.99 0.02 -1.26 -4.56 135.00 133.05 1ggm s PRO 161 Ca 0.68 2.24 -0.15 0.00 0.02 0.00 0.00 61.00 63.79 1ggm s PRO 161 Cb -0.23 -2.44 0.20 0.00 0.02 0.00 0.00 34.50 32.05 1ggm s PRO 161 CO 0.63 -0.95 1.14 -1.25 -0.33 0.00 0.00 177.00 176.24 1ggm s PRO 162 N -2.69 0.23 0.11 5.54 0.04 -1.26 -4.84 135.00 132.13 1ggm s PRO 162 Ca 0.66 0.14 -0.25 0.00 0.04 0.00 0.00 61.00 61.59 1ggm s PRO 162 Cb -0.40 -1.75 0.08 0.00 0.04 0.00 0.00 34.50 32.47 1ggm s PRO 162 CO 0.49 -2.78 0.70 -0.98 0.04 0.00 0.00 177.00 174.47 1ggm s ARG 163 N -5.33 1.13 -0.03 4.56 3.03 0.50 -4.98 118.95 117.83 1ggm s ARG 163 Ca 0.68 -0.42 -0.28 0.00 2.03 0.00 0.00 55.73 57.73 1ggm s ARG 163 Cb -0.13 0.52 -0.03 0.00 -1.03 0.00 0.00 34.95 34.28 1ggm s ARG 163 CO 0.55 -0.50 0.90 0.71 -1.13 0.00 0.00 175.30 175.84 1ggm s TYR 164 N -3.54 3.61 -0.36 5.89 1.51 -1.26 0.17 117.35 123.37 1ggm s TYR 164 Ca 0.03 1.56 -0.10 0.00 -1.01 0.00 0.00 57.07 57.54 1ggm s TYR 164 Cb -0.01 -3.04 0.03 0.00 -0.11 0.00 0.00 41.96 38.83 1ggm s TYR 164 CO -0.11 -0.02 0.18 0.12 -1.11 0.00 0.00 175.55 174.61 1ggm s PHE 165 N 1.10 3.25 0.37 2.71 5.36 0.35 -4.81 117.98 126.31 1ggm s PHE 165 Ca 0.47 -1.09 -0.27 0.00 -0.96 0.00 0.00 56.93 55.08 1ggm s PHE 165 Cb -0.20 -2.39 -0.09 0.00 -0.34 0.00 0.00 43.02 40.00 1ggm s PHE 165 CO 0.24 -0.67 1.28 1.21 -1.46 0.00 0.00 175.22 175.82 1ggm s ASN 166 N 1.51 6.58 0.00 6.13 3.84 -1.26 -0.84 114.94 130.89 1ggm s ASN 166 Ca 0.01 2.61 0.19 0.00 0.21 0.00 0.00 52.86 55.88 1ggm s ASN 166 Cb -0.19 -2.64 0.10 0.00 -0.55 0.00 0.00 41.25 37.97 1ggm s ASN 166 CO 0.06 -0.66 1.05 0.23 -2.79 0.00 0.00 177.10 174.98 1ggm n MET 167 N 0.45 1.62 -2.71 0.43 2.81 -1.21 -4.90 117.12 113.61 1ggm n MET 167 Ca 0.02 -1.39 -0.41 0.00 -1.81 0.00 0.00 57.70 54.11 1ggm n MET 167 Cb 0.43 -1.36 -0.04 0.00 -0.71 0.00 0.00 33.22 31.55 1ggm n MET 167 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1ggm s MET 168 N -1.74 4.64 0.57 0.03 -1.94 -1.26 0.65 119.30 120.25 1ggm s MET 168 Ca 0.20 1.46 -0.19 0.00 -1.71 0.00 0.00 55.69 55.44 1ggm s MET 168 Cb 0.15 -3.40 -0.04 0.00 2.01 0.00 0.00 34.83 33.55 1ggm s MET 168 CO 0.31 0.11 1.19 -0.06 -0.01 0.00 0.00 175.02 176.56 1ggm s PHE 169 N 0.37 2.48 0.05 -0.03 0.08 -1.26 -4.86 117.98 114.80 1ggm s PHE 169 Ca 0.49 1.52 0.08 0.00 0.12 0.00 0.00 56.93 59.14 1ggm s PHE 169 Cb -0.23 -3.44 -0.03 0.00 -0.57 0.00 0.00 43.02 38.75 1ggm s PHE 169 CO 0.29 -2.04 -0.24 -0.65 -0.10 0.00 0.00 175.22 172.49 1ggm s GLN 170 N -3.27 1.58 0.11 0.44 -0.21 -1.26 -2.33 119.66 114.71 1ggm s GLN 170 Ca 0.75 -1.04 -0.10 0.00 0.02 0.00 0.00 55.36 54.99 1ggm s GLN 170 Cb -0.29 -1.74 0.00 0.00 1.00 0.00 0.00 33.01 31.98 1ggm s GLN 170 CO 0.32 0.45 0.24 0.34 -2.12 0.00 0.00 175.29 174.52 1ggm s ASP 171 N -1.26 0.04 0.03 5.90 -1.08 0.51 -4.98 116.67 115.84 1ggm s ASP 171 Ca 0.10 -0.61 0.09 0.00 -0.52 0.00 0.00 52.55 51.60 1ggm s ASP 171 Cb -0.09 0.38 -0.03 0.00 -1.46 0.00 0.00 42.92 41.72 1ggm s ASP 171 CO 0.02 -0.78 -0.25 -0.76 0.52 0.00 0.00 175.17 173.93 1ggm s LEU 172 N -2.86 2.24 -1.29 -1.34 1.02 -1.26 -0.32 118.68 114.87 1ggm s LEU 172 Ca 0.06 -0.54 -0.18 0.00 0.02 0.00 0.00 54.13 53.50 1ggm s LEU 172 Cb 0.04 -1.34 0.08 0.00 0.02 0.00 0.00 46.19 44.99 1ggm s LEU 172 CO -0.10 0.27 1.71 -0.13 0.02 0.00 0.00 176.35 178.12 1ggm s ARG 173 N -1.18 3.99 2.43 1.70 3.00 0.11 -4.95 118.95 124.05 1ggm s ARG 173 Ca 0.12 -2.03 0.00 0.00 0.00 0.00 0.00 55.73 53.82 1ggm s ARG 173 Cb -0.10 -5.50 0.00 0.00 0.00 0.00 0.00 34.95 29.35 1ggm s ARG 173 CO 0.02 -2.22 0.00 0.41 0.00 0.00 0.00 175.30 173.51 1ggm n GLY 174 N 5.32 -0.49 1.94 -3.53 0.00 -1.26 -4.80 105.19 102.38 1ggm n GLY 174 Ca 0.48 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1ggm n GLY 174 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ggm n PRO 175 N 0.00 0.00 -4.20 1.61 -0.02 -1.26 -4.58 135.00 126.54 1ggm n PRO 175 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.36 1ggm n PRO 175 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 33.50 33.38 1ggm n PRO 175 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1ggm s ARG 176 N 0.00 1.09 -1.07 -0.52 1.70 -1.26 -5.07 118.95 113.82 1ggm s ARG 176 Ca 0.00 -1.55 -0.14 0.00 -0.47 0.00 0.00 55.73 53.58 1ggm s ARG 176 Cb 0.00 0.08 -0.08 0.00 -0.57 0.00 0.00 34.95 34.38 1ggm s ARG 176 CO 0.00 -0.27 2.19 0.41 -1.08 0.00 0.00 175.30 176.55 1ggm n GLY 177 N -0.21 3.34 3.91 3.88 0.00 -1.26 -4.78 105.19 110.07 1ggm n GLY 177 Ca -0.03 -1.24 -0.32 0.00 0.00 0.00 0.00 46.02 44.43 1ggm n GLY 177 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ggm s GLY 178 N 3.76 2.18 0.63 -0.02 0.00 -1.26 -4.96 107.32 107.64 1ggm s GLY 178 Ca 0.52 -0.79 0.35 0.00 0.00 0.00 0.00 44.72 44.79 1ggm s GLY 178 CO 0.00 -0.72 2.21 -0.09 0.00 0.00 0.00 173.10 174.51 1ggm h ARG 179 N 3.55 0.00 -0.09 2.90 9.65 -2.00 -0.34 114.38 128.05 1ggm h ARG 179 Ca -0.47 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.40 1ggm h ARG 179 Cb 1.18 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.75 1ggm h ARG 179 CO 0.71 0.00 0.05 0.78 2.80 0.00 0.00 179.97 184.31 1ggm h GLY 180 N 0.00 0.14 -6.72 2.80 0.00 -1.95 -3.29 103.07 94.05 1ggm h GLY 180 Ca 0.02 -0.07 -0.74 0.00 0.00 0.00 0.00 47.33 46.55 1ggm h GLY 180 CO -0.00 0.06 0.30 1.47 0.00 0.00 0.00 176.54 178.37 1ggm n LEU 181 N -4.96 5.46 -4.46 3.11 -0.00 -0.14 -5.00 117.00 111.02 1ggm n LEU 181 Ca -0.06 -5.28 -0.31 0.00 -0.00 0.00 0.00 56.01 50.36 1ggm n LEU 181 Cb 0.08 -1.08 -0.13 0.00 -0.00 0.00 0.00 43.42 42.30 1ggm n LEU 181 CO 0.34 1.80 -0.49 -0.22 -0.00 0.00 0.00 177.39 178.82 1ggm s LEU 182 N -2.60 2.62 -0.10 1.47 2.96 -1.24 0.09 118.68 121.88 1ggm s LEU 182 Ca 0.34 -0.42 -0.21 0.00 -0.22 0.00 0.00 54.13 53.62 1ggm s LEU 182 Cb 0.07 -1.52 0.05 0.00 0.50 0.00 0.00 46.19 45.29 1ggm s LEU 182 CO 0.05 0.26 0.49 0.00 -1.32 0.00 0.00 176.35 175.83 1ggm s ALA 183 N -0.93 -1.25 0.27 5.97 0.00 0.57 -3.58 121.76 122.80 1ggm s ALA 183 Ca 0.15 1.05 0.07 0.00 0.00 0.00 0.00 51.96 53.23 1ggm s ALA 183 Cb -0.10 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 1ggm s ALA 183 CO 0.05 -0.28 0.23 0.71 0.00 0.00 0.00 175.76 176.47 1ggm s TYR 184 N -0.66 3.08 -0.18 0.00 2.02 -0.90 -0.36 117.35 120.35 1ggm s TYR 184 Ca -0.07 -0.15 -0.15 0.00 -0.37 0.00 0.00 57.07 56.32 1ggm s TYR 184 Cb -0.03 -1.50 -0.04 0.00 -0.40 0.00 0.00 41.96 39.99 1ggm s TYR 184 CO 0.04 0.44 0.37 -0.51 -1.57 0.00 0.00 175.55 174.32 1ggm s LEU 185 N -3.89 4.20 -0.26 -1.29 1.43 -0.99 -1.20 118.68 116.69 1ggm s LEU 185 Ca 0.35 0.54 -0.40 0.00 -1.03 0.00 0.00 54.13 53.59 1ggm s LEU 185 Cb -0.07 -2.48 -0.16 0.00 0.03 0.00 0.00 46.19 43.51 1ggm s LEU 185 CO 0.25 -0.00 1.73 -2.11 0.23 0.00 0.00 176.35 176.45 1ggm n ARG 186 N 4.06 1.16 0.00 1.70 1.85 -0.75 -4.38 116.66 120.30 1ggm n ARG 186 Ca -0.10 0.43 0.10 0.00 -1.00 0.00 0.00 57.85 57.28 1ggm n ARG 186 Cb 0.51 -2.11 0.44 0.00 -1.05 0.00 0.00 32.46 30.26 1ggm n ARG 186 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1ggm n PRO 187 N 5.24 0.01 -3.51 2.89 -0.04 -1.24 -1.43 135.00 136.92 1ggm n PRO 187 Ca 0.26 0.15 -0.15 0.00 -0.04 0.00 0.00 63.50 63.72 1ggm n PRO 187 Cb 0.13 -1.51 -0.05 0.00 -0.04 0.00 0.00 33.50 32.03 1ggm n PRO 187 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1ggm s GLU 188 N -3.01 1.00 0.21 0.54 -1.05 -1.26 -4.52 118.70 110.61 1ggm s GLU 188 Ca 0.10 0.08 0.01 0.00 -0.15 0.00 0.00 54.97 55.01 1ggm s GLU 188 Cb 0.13 0.47 0.18 0.00 -0.44 0.00 0.00 34.13 34.47 1ggm s GLU 188 CO 0.38 -0.34 1.53 1.79 0.95 0.00 0.00 175.26 179.57 1ggm h THR 189 N 2.69 1.35 -0.52 1.83 1.35 -1.85 -3.36 112.91 114.39 1ggm h THR 189 Ca -0.26 -1.89 0.09 0.00 -0.55 0.00 0.00 66.41 63.80 1ggm h THR 189 Cb 1.18 1.89 -0.09 0.00 -1.73 0.00 0.00 68.15 69.40 1ggm h THR 189 CO 0.37 0.57 -0.17 0.00 -0.25 0.00 0.00 175.52 176.04 1ggm n ALA 190 N -2.50 0.03 -0.15 6.62 0.00 -1.26 -2.07 120.51 121.19 1ggm n ALA 190 Ca -0.03 0.55 -0.04 0.00 0.00 0.00 0.00 53.44 53.92 1ggm n ALA 190 Cb 0.61 -0.29 0.02 0.00 0.00 0.00 0.00 19.45 19.79 1ggm n ALA 190 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1ggm h GLN 191 N 0.00 -0.10 -0.51 0.00 1.08 -2.01 -0.81 115.11 112.76 1ggm h GLN 191 Ca 0.22 0.01 0.15 0.00 -1.45 0.00 0.00 58.65 57.57 1ggm h GLN 191 Cb 0.35 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.78 1ggm h GLN 191 CO -0.53 -0.06 0.63 0.78 -0.95 0.00 0.00 178.83 178.69 1ggm h GLY 192 N -0.10 0.00 0.18 3.46 0.00 -1.72 0.15 103.07 105.04 1ggm h GLY 192 Ca 0.22 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.47 1ggm h GLY 192 CO -0.54 0.00 -0.38 -2.22 0.00 0.00 0.00 176.54 173.40 1ggm h ILE 193 N 0.00 1.60 0.00 2.60 5.03 -1.29 -3.14 117.51 122.32 1ggm h ILE 193 Ca 0.24 -2.38 0.02 0.00 -0.12 0.00 0.00 64.86 62.63 1ggm h ILE 193 Cb 1.50 3.20 -0.03 0.00 -3.03 0.00 0.00 36.82 38.46 1ggm h ILE 193 CO -0.00 0.61 -0.13 -0.26 -0.68 0.00 0.00 178.15 177.69 1ggm h PHE 194 N -0.83 -0.33 0.00 1.37 0.04 -0.90 -0.90 116.94 115.39 1ggm h PHE 194 Ca -0.08 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.69 1ggm h PHE 194 Cb 1.21 0.15 -0.00 0.00 2.20 0.00 0.00 35.95 39.51 1ggm h PHE 194 CO 0.23 -0.19 -0.01 -0.24 -0.60 0.00 0.00 178.31 177.50 1ggm h VAL 195 N -0.22 0.64 -0.32 -0.55 3.04 -1.57 -0.73 116.25 116.54 1ggm h VAL 195 Ca 0.04 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 65.68 1ggm h VAL 195 Cb 0.27 1.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.59 1ggm h VAL 195 CO -0.12 0.01 0.00 0.59 -1.01 0.00 0.00 177.57 177.04 1ggm n ASN 196 N -3.98 2.87 -0.32 3.17 3.02 -0.75 -4.61 115.26 114.67 1ggm n ASN 196 Ca -0.03 -1.91 -0.12 0.00 -0.03 0.00 0.00 54.58 52.49 1ggm n ASN 196 Cb 0.10 -0.20 -0.10 0.00 -0.61 0.00 0.00 39.78 38.97 1ggm n ASN 196 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1ggm h PHE 197 N 3.73 -1.82 -0.43 3.10 3.04 0.23 0.58 116.94 125.37 1ggm h PHE 197 Ca 0.00 0.11 -0.00 0.00 3.98 0.00 0.00 57.97 62.06 1ggm h PHE 197 Cb 0.82 0.90 -0.02 0.00 2.56 0.00 0.00 35.95 40.21 1ggm h PHE 197 CO 0.20 -0.41 0.25 -0.22 -2.02 0.00 0.00 178.31 176.11 1ggm h LYS 198 N -0.14 0.59 -0.38 1.11 1.63 -1.81 -0.66 116.57 116.90 1ggm h LYS 198 Ca 0.13 -0.06 0.05 0.00 -0.85 0.00 0.00 60.65 59.92 1ggm h LYS 198 Cb 0.47 -0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 31.94 1ggm h LYS 198 CO -0.81 0.45 0.10 -0.91 -3.45 0.00 0.00 179.45 174.83 1ggm h ASN 199 N 0.56 0.06 -0.11 4.20 2.35 -1.61 0.23 115.58 121.26 1ggm h ASN 199 Ca 0.15 0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1ggm h ASN 199 Cb 0.02 0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.45 1ggm h ASN 199 CO -0.03 0.07 0.03 0.58 -1.65 0.00 0.00 177.43 176.43 1ggm h VAL 200 N 0.23 1.20 -0.91 2.81 2.07 -0.67 -2.55 116.25 118.44 1ggm h VAL 200 Ca 0.18 -0.62 0.14 0.00 0.82 0.00 0.00 66.70 67.22 1ggm h VAL 200 Cb 0.19 1.40 -0.09 0.00 -1.52 0.00 0.00 31.29 31.27 1ggm h VAL 200 CO -0.22 0.18 0.51 0.25 0.02 0.00 0.00 177.57 178.32 1ggm h LEU 201 N -0.02 0.67 0.57 2.57 5.85 -0.55 -0.72 115.31 123.67 1ggm h LEU 201 Ca 0.04 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 1ggm h LEU 201 Cb 0.26 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.26 1ggm h LEU 201 CO 0.00 0.30 -0.27 0.44 -0.34 0.00 0.00 178.44 178.57 1ggm h ASP 202 N 0.74 -0.65 0.54 1.25 3.32 -0.39 0.56 116.42 121.79 1ggm h ASP 202 Ca 0.48 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.50 1ggm h ASP 202 Cb 0.64 0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.36 1ggm h ASP 202 CO -0.34 -0.34 0.00 0.00 -1.72 0.00 0.00 179.24 176.84 1ggm h ALA 203 N -0.63 1.00 0.00 3.45 0.00 -1.02 -3.26 119.26 118.81 1ggm h ALA 203 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.50 1ggm h ALA 203 Cb 0.64 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 1ggm h ALA 203 CO 0.13 0.00 -2.12 0.25 0.00 0.00 0.00 179.25 177.51 1ggm n THR 204 N -3.03 1.11 -2.49 0.00 -2.24 -0.32 -5.05 114.28 102.26 1ggm n THR 204 Ca -0.01 -0.30 -0.06 0.00 -2.27 0.00 0.00 64.05 61.41 1ggm n THR 204 Cb 0.19 -1.68 0.03 0.00 -2.10 0.00 0.00 70.33 66.77 1ggm n THR 204 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ggm n SER 205 N -3.77 -2.01 -4.79 3.42 3.41 0.20 -5.03 113.62 105.04 1ggm n SER 205 Ca -0.39 -0.21 -0.36 0.00 -0.26 0.00 0.00 58.87 57.65 1ggm n SER 205 Cb 0.79 -2.07 -0.06 0.00 -0.26 0.00 0.00 64.21 62.61 1ggm n SER 205 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1ggm s ARG 206 N -4.46 4.37 0.59 4.33 0.52 -1.25 -5.08 118.95 117.97 1ggm s ARG 206 Ca 0.00 1.31 -0.04 0.00 -0.52 0.00 0.00 55.73 56.48 1ggm s ARG 206 Cb -0.00 -2.55 0.02 0.00 0.52 0.00 0.00 34.95 32.94 1ggm s ARG 206 CO 0.25 0.08 0.88 0.15 0.02 0.00 0.00 175.30 176.67 1ggm s LYS 207 N -2.49 2.75 0.03 3.54 3.01 -1.26 -5.06 119.74 120.25 1ggm s LYS 207 Ca 0.56 -0.22 -0.09 0.00 -1.01 0.00 0.00 55.97 55.20 1ggm s LYS 207 Cb -0.17 -2.32 -0.04 0.00 -1.01 0.00 0.00 37.83 34.29 1ggm s LYS 207 CO 0.22 -0.75 1.15 -0.07 0.51 0.00 0.00 175.35 176.40 1ggm h LEU 208 N -0.15 -0.41 -8.22 3.17 -0.00 -1.94 -3.37 115.31 104.38 1ggm h LEU 208 Ca -0.45 0.04 -0.33 0.00 -0.00 0.00 0.00 57.88 57.14 1ggm h LEU 208 Cb 1.27 0.15 -0.05 0.00 -0.00 0.00 0.00 40.66 42.03 1ggm h LEU 208 CO 0.59 -0.15 1.38 0.61 -0.00 0.00 0.00 178.44 180.87 1ggm n GLY 209 N -1.13 -0.26 3.58 0.83 0.00 -1.26 -4.63 105.19 102.31 1ggm n GLY 209 Ca -0.02 0.52 -0.10 0.00 0.00 0.00 0.00 46.02 46.42 1ggm n GLY 209 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ggm s PHE 210 N 8.77 -0.34 0.01 1.61 -0.12 -1.17 -4.89 117.98 121.86 1ggm s PHE 210 Ca 1.16 0.55 -0.05 0.00 -0.05 0.00 0.00 56.93 58.53 1ggm s PHE 210 Cb -0.62 0.46 -0.01 0.00 -0.63 0.00 0.00 43.02 42.22 1ggm s PHE 210 CO 0.36 -0.33 0.09 0.20 -0.05 0.00 0.00 175.22 175.49 1ggm s GLY 211 N -1.22 0.12 -0.11 1.99 0.00 -0.22 -0.38 107.32 107.50 1ggm s GLY 211 Ca -0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 44.72 44.35 1ggm s GLY 211 CO 0.00 -0.44 0.08 -0.42 0.00 0.00 0.00 173.10 172.32 1ggm s ILE 212 N -1.58 4.96 0.00 0.90 1.01 -1.15 -1.09 121.20 124.27 1ggm s ILE 212 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.52 1ggm s ILE 212 Cb -0.07 -3.13 -0.00 0.00 0.01 0.00 0.00 42.46 39.26 1ggm s ILE 212 CO 0.00 0.61 -0.01 0.00 0.00 0.00 0.00 174.94 175.54 1ggm s ALA 213 N -0.94 0.04 0.07 9.38 0.00 0.54 -1.53 121.76 129.32 1ggm s ALA 213 Ca 0.14 -0.14 -0.08 0.00 0.00 0.00 0.00 51.96 51.88 1ggm s ALA 213 Cb -0.12 0.03 -0.00 0.00 0.00 0.00 0.00 23.12 23.03 1ggm s ALA 213 CO 0.03 -0.03 0.17 1.14 0.00 0.00 0.00 175.76 177.07 1ggm s GLN 214 N -0.33 0.79 0.10 0.00 -2.07 -0.61 -1.85 119.66 115.68 1ggm s GLN 214 Ca -0.04 -0.91 0.06 0.00 -1.82 0.00 0.00 55.36 52.65 1ggm s GLN 214 Cb -0.02 0.32 -0.04 0.00 -1.09 0.00 0.00 33.01 32.17 1ggm s GLN 214 CO -0.00 -0.24 -0.07 0.42 -1.32 0.00 0.00 175.29 174.08 1ggm s ILE 215 N -3.58 3.58 -0.07 3.63 1.01 -1.26 -0.44 121.20 124.07 1ggm s ILE 215 Ca 0.03 -1.17 -0.32 0.00 0.00 0.00 0.00 60.65 59.19 1ggm s ILE 215 Cb 0.04 -2.68 0.14 0.00 0.01 0.00 0.00 42.46 39.97 1ggm s ILE 215 CO -0.09 0.12 1.39 -0.83 0.00 0.00 0.00 174.94 175.53 1ggm s GLY 216 N -2.22 -0.47 0.51 6.18 0.00 0.25 -4.90 107.32 106.67 1ggm s GLY 216 Ca 0.23 0.90 -0.18 0.00 0.00 0.00 0.00 44.72 45.67 1ggm s GLY 216 CO 0.15 0.17 0.99 1.25 0.00 0.00 0.00 173.10 175.66 1ggm s LYS 217 N -2.14 3.91 -0.18 2.90 2.47 -1.26 0.04 119.74 125.48 1ggm s LYS 217 Ca 0.15 1.06 -0.12 0.00 -1.56 0.00 0.00 55.97 55.49 1ggm s LYS 217 Cb 0.07 -2.13 0.05 0.00 -1.46 0.00 0.00 37.83 34.37 1ggm s LYS 217 CO -0.06 -0.31 0.44 0.00 0.16 0.00 0.00 175.35 175.58 1ggm s ALA 218 N -2.46 -1.13 -0.02 3.13 0.00 0.26 -4.52 121.76 117.02 1ggm s ALA 218 Ca 0.61 1.48 0.08 0.00 0.00 0.00 0.00 51.96 54.13 1ggm s ALA 218 Cb -0.11 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1ggm s ALA 218 CO 0.27 -0.25 -0.25 -0.06 0.00 0.00 0.00 175.76 175.47 1ggm s PHE 219 N 0.96 2.35 -0.10 0.00 0.40 -0.51 -1.21 117.98 119.86 1ggm s PHE 219 Ca -0.06 -0.42 -0.04 0.00 -0.60 0.00 0.00 56.93 55.81 1ggm s PHE 219 Cb -0.06 -1.50 0.05 0.00 0.51 0.00 0.00 43.02 42.02 1ggm s PHE 219 CO -0.08 -0.02 0.21 1.03 0.70 0.00 0.00 175.22 177.07 1ggm s ARG 220 N -0.66 0.10 0.00 0.44 0.52 -0.19 -3.71 118.95 115.45 1ggm s ARG 220 Ca 0.10 0.63 0.00 0.00 -0.52 0.00 0.00 55.73 55.94 1ggm s ARG 220 Cb -0.10 -0.15 0.00 0.00 0.52 0.00 0.00 34.95 35.22 1ggm s ARG 220 CO -0.01 -0.28 0.54 -1.71 0.02 0.00 0.00 175.30 173.86 1ggm n ASN 221 N 5.18 1.61 -2.14 0.23 5.15 0.21 -3.98 115.26 121.51 1ggm n ASN 221 Ca -0.08 -1.07 -0.30 0.00 -0.60 0.00 0.00 54.58 52.52 1ggm n ASN 221 Cb 0.50 -0.27 -0.06 0.00 -0.53 0.00 0.00 39.78 39.42 1ggm n ASN 221 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1ggm n GLU 222 N 0.76 0.00 -0.22 1.20 4.07 -1.26 -4.80 120.64 120.39 1ggm n GLU 222 Ca 0.00 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.09 1ggm n GLU 222 Cb 0.26 -0.75 0.06 0.00 -0.06 0.00 0.00 31.44 30.96 1ggm n GLU 222 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 1ggm h ILE 223 N 3.36 0.33 -3.38 6.31 1.08 -1.96 -3.35 117.51 119.90 1ggm h ILE 223 Ca -0.07 0.00 -0.58 0.00 -0.39 0.00 0.00 64.86 63.82 1ggm h ILE 223 Cb 0.70 0.33 -0.39 0.00 -3.07 0.00 0.00 36.82 34.39 1ggm h ILE 223 CO 0.54 0.00 -0.77 0.42 -0.69 0.00 0.00 178.15 177.65 1ggm s THR 224 N -6.22 1.07 0.01 -0.27 -4.23 -1.26 -5.04 115.64 99.70 1ggm s THR 224 Ca -0.14 -1.15 -0.30 0.00 -1.18 0.00 0.00 61.69 58.91 1ggm s THR 224 Cb 0.19 -1.58 -0.05 0.00 1.34 0.00 0.00 72.50 72.40 1ggm s THR 224 CO 0.73 -0.35 1.36 -2.84 -0.54 0.00 0.00 174.62 172.98 1ggm s PRO 225 N 1.57 4.31 0.00 3.99 0.02 -1.26 -4.99 135.00 138.64 1ggm s PRO 225 Ca 0.02 1.92 0.00 0.00 0.02 0.00 0.00 61.00 62.96 1ggm s PRO 225 Cb -0.18 -3.52 0.00 0.00 0.02 0.00 0.00 34.50 30.82 1ggm s PRO 225 CO -0.13 -0.52 0.00 0.54 -0.33 0.00 0.00 177.00 176.56 1ggm n ARG 226 N 5.08 0.00 -0.86 5.54 1.74 -1.08 -4.97 116.66 122.10 1ggm n ARG 226 Ca 0.12 0.01 -0.05 0.00 -0.77 0.00 0.00 57.85 57.16 1ggm n ARG 226 Cb 0.44 -0.14 0.03 0.00 -1.02 0.00 0.00 32.46 31.77 1ggm n ARG 226 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1ggm n ASN 227 N -1.56 0.21 0.00 0.55 4.13 -1.26 -4.88 115.26 112.45 1ggm n ASN 227 Ca 0.00 -1.20 0.00 0.00 1.68 0.00 0.00 54.58 55.06 1ggm n ASN 227 Cb 0.00 -0.16 0.00 0.00 -1.54 0.00 0.00 39.78 38.08 1ggm n ASN 227 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1ggm n PHE 228 N -1.87 0.00 1.10 3.10 7.35 -1.26 -3.98 117.46 121.90 1ggm n PHE 228 Ca 0.03 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 56.77 1ggm n PHE 228 Cb 0.12 0.00 0.25 0.00 0.35 0.00 0.00 39.48 40.20 1ggm n PHE 228 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1ggm n ILE 229 N 0.00 0.00 0.00 -2.13 -0.00 -1.26 -4.40 119.36 111.57 1ggm n ILE 229 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1ggm n ILE 229 Cb 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 39.64 39.18 1ggm n ILE 229 CO 0.00 0.00 0.00 0.33 -0.00 0.00 0.00 176.55 176.88 1ggm n PHE 230 N -0.74 0.00 -3.52 1.39 7.35 -1.26 -4.50 117.46 116.19 1ggm n PHE 230 Ca 0.06 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.34 1ggm n PHE 230 Cb 0.03 -0.13 -0.07 0.00 0.35 0.00 0.00 39.48 39.66 1ggm n PHE 230 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1ggm s ARG 231 N -1.27 2.78 0.27 -4.13 3.52 -1.26 -4.88 118.95 113.97 1ggm s ARG 231 Ca 0.00 -2.06 0.05 0.00 -0.13 0.00 0.00 55.73 53.59 1ggm s ARG 231 Cb 0.00 -4.03 -0.06 0.00 -1.56 0.00 0.00 34.95 29.30 1ggm s ARG 231 CO 0.00 -1.22 -0.03 0.14 -0.81 0.00 0.00 175.30 173.38 1ggm s VAL 232 N 0.85 1.40 -0.29 7.11 -7.23 -1.26 -2.65 120.40 118.32 1ggm s VAL 232 Ca 0.10 -2.08 0.23 0.00 -1.81 0.00 0.00 61.98 58.42 1ggm s VAL 232 Cb -0.22 -2.45 0.29 0.00 0.56 0.00 0.00 36.38 34.55 1ggm s VAL 232 CO -0.03 -0.28 1.63 0.03 -0.31 0.00 0.00 175.10 176.15 1ggm h ARG 233 N 2.32 0.00 -3.74 4.82 3.08 -1.00 -3.43 114.38 116.44 1ggm h ARG 233 Ca -0.39 0.00 -0.40 0.00 0.07 0.00 0.00 59.98 59.26 1ggm h ARG 233 Cb 1.23 0.00 -0.36 0.00 0.08 0.00 0.00 29.97 30.92 1ggm h ARG 233 CO 0.67 0.11 -0.76 -2.00 -1.07 0.00 0.00 179.97 176.92 1ggm s GLU 234 N -3.24 0.50 0.38 0.04 2.12 -1.24 -1.02 118.70 116.24 1ggm s GLU 234 Ca 0.05 0.08 -0.11 0.00 0.36 0.00 0.00 54.97 55.36 1ggm s GLU 234 Cb 0.06 -0.76 0.04 0.00 0.26 0.00 0.00 34.13 33.73 1ggm s GLU 234 CO 0.67 -0.21 0.70 -0.59 -0.54 0.00 0.00 175.26 175.29 1ggm s PHE 235 N 1.50 0.45 0.07 5.30 -0.71 -0.35 -4.79 117.98 119.45 1ggm s PHE 235 Ca -0.03 -1.00 0.07 0.00 -1.04 0.00 0.00 56.93 54.94 1ggm s PHE 235 Cb -0.13 0.56 -0.03 0.00 -1.21 0.00 0.00 43.02 42.21 1ggm s PHE 235 CO -0.03 -1.47 -0.19 -1.21 -1.34 0.00 0.00 175.22 170.98 1ggm s GLU 236 N -2.41 1.18 0.11 1.99 2.02 -1.25 0.89 118.70 121.23 1ggm s GLU 236 Ca 0.21 -0.99 0.07 0.00 0.02 0.00 0.00 54.97 54.28 1ggm s GLU 236 Cb -0.04 -1.32 -0.04 0.00 0.10 0.00 0.00 34.13 32.84 1ggm s GLU 236 CO 0.15 0.32 -0.18 -0.65 0.02 0.00 0.00 175.26 174.92 1ggm s GLN 237 N -1.48 1.09 -0.37 1.61 -0.21 0.11 -1.62 119.66 118.79 1ggm s GLN 237 Ca 0.05 -1.19 -0.04 0.00 0.02 0.00 0.00 55.36 54.21 1ggm s GLN 237 Cb -0.09 -1.20 0.08 0.00 1.00 0.00 0.00 33.01 32.80 1ggm s GLN 237 CO 0.03 0.26 0.13 -1.64 -2.12 0.00 0.00 175.29 171.95 1ggm s MET 238 N -2.20 2.28 0.18 2.91 -1.94 -0.05 -0.58 119.30 119.89 1ggm s MET 238 Ca 0.07 -1.52 0.09 0.00 -1.71 0.00 0.00 55.69 52.62 1ggm s MET 238 Cb -0.08 -3.46 -0.04 0.00 2.01 0.00 0.00 34.83 33.26 1ggm s MET 238 CO 0.04 -0.86 -0.08 -1.21 -0.01 0.00 0.00 175.02 172.90 1ggm s GLU 239 N 1.24 2.10 0.04 2.03 2.02 0.42 -1.39 118.70 125.17 1ggm s GLU 239 Ca 0.02 -1.25 0.04 0.00 0.02 0.00 0.00 54.97 53.80 1ggm s GLU 239 Cb -0.21 -2.18 -0.02 0.00 0.10 0.00 0.00 34.13 31.81 1ggm s GLU 239 CO -0.02 0.44 -0.12 0.42 0.02 0.00 0.00 175.26 176.00 1ggm s ILE 240 N -1.71 0.91 -0.45 -1.63 1.01 -1.13 -1.58 121.20 116.62 1ggm s ILE 240 Ca 0.25 -0.99 0.02 0.00 0.00 0.00 0.00 60.65 59.93 1ggm s ILE 240 Cb -0.09 -0.86 0.15 0.00 0.01 0.00 0.00 42.46 41.67 1ggm s ILE 240 CO 0.16 -0.11 0.28 -1.61 0.00 0.00 0.00 174.94 173.65 1ggm s GLU 241 N -1.24 1.27 -0.48 2.79 0.41 -0.58 -3.47 118.70 117.40 1ggm s GLU 241 Ca -0.02 -2.09 -0.29 0.00 -0.41 0.00 0.00 54.97 52.17 1ggm s GLU 241 Cb -0.08 -2.19 0.02 0.00 -1.78 0.00 0.00 34.13 30.10 1ggm s GLU 241 CO 0.01 -1.22 1.31 -0.47 -0.49 0.00 0.00 175.26 174.40 1ggm s TYR 242 N 0.19 2.53 0.17 1.61 5.04 0.13 -2.92 117.35 124.11 1ggm s TYR 242 Ca 0.21 0.63 -0.30 0.00 -2.44 0.00 0.00 57.07 55.17 1ggm s TYR 242 Cb -0.17 -4.39 -0.07 0.00 0.35 0.00 0.00 41.96 37.67 1ggm s TYR 242 CO -0.05 -1.72 0.99 -0.06 -1.34 0.00 0.00 175.55 173.37 1ggm s PHE 243 N 5.20 3.81 0.05 4.97 0.08 0.48 -1.40 117.98 131.18 1ggm s PHE 243 Ca 0.54 1.79 -0.17 0.00 0.12 0.00 0.00 56.93 59.21 1ggm s PHE 243 Cb -0.10 -3.09 0.03 0.00 -0.57 0.00 0.00 43.02 39.29 1ggm s PHE 243 CO 0.31 0.08 0.38 0.54 -0.10 0.00 0.00 175.22 176.43 1ggm s VAL 244 N -0.44 0.06 0.13 -0.44 0.11 0.34 -3.03 120.40 117.14 1ggm s VAL 244 Ca 0.46 -0.53 -0.31 0.00 -2.93 0.00 0.00 61.98 58.66 1ggm s VAL 244 Cb -0.26 -0.98 -0.09 0.00 -1.53 0.00 0.00 36.38 33.52 1ggm s VAL 244 CO 0.32 -0.29 1.56 -0.13 -3.33 0.00 0.00 175.10 173.23 1ggm s ARG 245 N -2.66 4.23 0.13 1.54 0.52 -1.26 -0.85 118.95 120.59 1ggm s ARG 245 Ca -0.04 2.30 -0.03 0.00 -0.52 0.00 0.00 55.73 57.44 1ggm s ARG 245 Cb -0.00 -3.29 0.22 0.00 0.52 0.00 0.00 34.95 32.40 1ggm s ARG 245 CO -0.04 -0.61 0.70 -2.30 0.02 0.00 0.00 175.30 173.07 1ggm n PRO 246 N 4.40 -0.04 -0.08 3.54 -0.02 -1.26 -1.79 135.00 139.75 1ggm n PRO 246 Ca 0.14 0.70 -0.11 0.00 -2.02 0.00 0.00 63.50 62.21 1ggm n PRO 246 Cb 0.40 -1.05 0.03 0.00 -0.02 0.00 0.00 33.50 32.85 1ggm n PRO 246 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1ggm h GLY 247 N 0.00 0.89 1.76 -1.23 0.00 -2.01 -3.26 103.07 99.21 1ggm h GLY 247 Ca 0.22 -0.89 0.00 0.00 0.00 0.00 0.00 47.33 46.66 1ggm h GLY 247 CO -0.46 0.80 0.00 1.18 0.00 0.00 0.00 176.54 178.06 1ggm n GLU 248 N -4.05 0.14 -0.38 4.80 1.02 -0.74 -4.22 120.64 117.22 1ggm n GLU 248 Ca -0.02 0.15 0.30 0.00 -0.02 0.00 0.00 57.16 57.58 1ggm n GLU 248 Cb 0.53 -1.50 0.60 0.00 -0.02 0.00 0.00 31.44 31.05 1ggm n GLU 248 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 1ggm h ASP 249 N 0.00 0.30 0.19 1.62 3.04 -1.64 -0.76 116.42 119.17 1ggm h ASP 249 Ca 0.00 0.09 -0.01 0.00 -3.24 0.00 0.00 57.03 53.87 1ggm h ASP 249 Cb 0.23 0.05 0.00 0.00 -1.04 0.00 0.00 39.33 38.58 1ggm h ASP 249 CO 0.00 -0.03 -0.09 -0.08 -2.04 0.00 0.00 179.24 177.00 1ggm h GLU 250 N 0.22 -0.24 0.33 4.15 4.57 -1.88 -1.11 114.58 120.61 1ggm h GLU 250 Ca 0.69 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.88 1ggm h GLU 250 Cb 2.07 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 30.70 1ggm h GLU 250 CO -0.30 -0.08 -0.25 -0.92 -1.18 0.00 0.00 179.01 176.29 1ggm h TYR 251 N -0.36 -0.66 -0.79 0.92 3.20 -1.46 -2.76 116.97 115.07 1ggm h TYR 251 Ca -0.03 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.00 1ggm h TYR 251 Cb 0.28 0.24 -0.10 0.00 1.54 0.00 0.00 36.73 38.69 1ggm h TYR 251 CO -0.03 -0.37 0.34 -1.49 -1.64 0.00 0.00 178.16 174.96 1ggm h TRP 252 N -0.58 0.58 -0.97 -3.82 4.06 -1.44 0.17 115.95 113.94 1ggm h TRP 252 Ca -0.03 0.04 0.03 0.00 2.06 0.00 0.00 58.89 60.99 1ggm h TRP 252 Cb 0.50 -0.13 -0.06 0.00 -1.00 0.00 0.00 29.16 28.47 1ggm h TRP 252 CO -0.13 0.07 0.64 1.25 -3.56 0.00 0.00 178.44 176.71 1ggm h HIS 253 N 0.47 1.20 0.23 0.49 2.76 -0.95 -0.95 115.15 118.39 1ggm h HIS 253 Ca 0.44 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.63 1ggm h HIS 253 Cb 0.69 -0.40 0.00 0.00 1.55 0.00 0.00 27.41 29.25 1ggm h HIS 253 CO -0.15 0.70 -0.11 -0.09 -1.30 0.00 0.00 177.93 176.98 1ggm h ARG 254 N 1.24 -0.30 -0.61 5.26 2.43 -0.50 -2.43 114.38 119.48 1ggm h ARG 254 Ca 0.38 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.63 1ggm h ARG 254 Cb -0.02 0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 29.51 1ggm h ARG 254 CO -0.12 0.02 -0.49 -0.92 -1.51 0.00 0.00 179.97 176.95 1ggm h TYR 255 N -0.63 -1.54 -0.74 2.20 3.20 -0.59 -1.27 116.97 117.61 1ggm h TYR 255 Ca -0.03 0.09 0.08 0.00 3.14 0.00 0.00 58.73 62.01 1ggm h TYR 255 Cb 0.45 0.75 -0.05 0.00 1.54 0.00 0.00 36.73 39.42 1ggm h TYR 255 CO 0.02 -0.37 0.48 -1.49 -1.64 0.00 0.00 178.16 175.17 1ggm h TRP 256 N -0.17 0.75 -0.21 -3.82 4.06 -1.14 0.32 115.95 115.74 1ggm h TRP 256 Ca 0.10 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 61.04 1ggm h TRP 256 Cb 0.43 -0.25 -0.01 0.00 -1.00 0.00 0.00 29.16 28.33 1ggm h TRP 256 CO -0.87 0.38 0.01 0.28 -3.56 0.00 0.00 178.44 174.69 1ggm h VAL 257 N 0.73 1.24 -0.72 1.49 2.07 -0.84 -1.05 116.25 119.17 1ggm h VAL 257 Ca 0.33 -0.83 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 1ggm h VAL 257 Cb 0.33 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1ggm h VAL 257 CO -0.11 0.25 0.37 -0.33 0.02 0.00 0.00 177.57 177.77 1ggm h GLU 258 N 0.13 1.01 0.69 1.57 5.08 -0.49 -1.00 114.58 121.58 1ggm h GLU 258 Ca 0.06 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1ggm h GLU 258 Cb 0.37 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.43 1ggm h GLU 258 CO 0.01 0.76 -0.33 1.49 -1.00 0.00 0.00 179.01 179.93 1ggm h GLU 259 N 1.01 -0.90 -0.62 2.33 4.22 -0.81 -0.21 114.58 119.60 1ggm h GLU 259 Ca 0.25 0.06 0.18 0.00 0.08 0.00 0.00 59.36 59.93 1ggm h GLU 259 Cb 0.07 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1ggm h GLU 259 CO -0.04 -0.60 0.45 0.00 -2.18 0.00 0.00 179.01 176.65 1ggm h ARG 260 N -1.19 0.00 -0.03 1.92 2.47 -1.10 0.70 114.38 117.16 1ggm h ARG 260 Ca -0.10 0.00 -0.26 0.00 -1.26 0.00 0.00 59.98 58.36 1ggm h ARG 260 Cb 0.71 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 29.05 1ggm h ARG 260 CO 0.16 0.00 -1.00 1.25 0.56 0.00 0.00 179.97 180.94 1ggm h LEU 261 N 0.00 0.92 -0.97 3.04 6.46 -1.06 -2.52 115.31 121.18 1ggm h LEU 261 Ca 0.30 -0.71 0.02 0.00 -0.12 0.00 0.00 57.88 57.36 1ggm h LEU 261 Cb 1.19 -0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 40.79 1ggm h LEU 261 CO -0.00 1.51 0.64 0.11 -0.62 0.00 0.00 178.44 180.08 1ggm h LYS 262 N 0.42 1.24 0.51 1.25 1.57 0.22 -3.00 116.57 118.79 1ggm h LYS 262 Ca -0.12 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.56 1ggm h LYS 262 Cb 1.65 -0.28 0.01 0.00 0.08 0.00 0.00 32.23 33.68 1ggm h LYS 262 CO 0.20 0.82 -0.25 2.35 -0.57 0.00 0.00 179.45 182.00 1ggm h TRP 263 N 1.28 -0.64 0.00 -1.35 7.01 -0.90 -2.84 115.95 118.51 1ggm h TRP 263 Ca 0.37 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.35 1ggm h TRP 263 Cb -0.09 0.21 0.00 0.00 -2.10 0.00 0.00 29.16 27.18 1ggm h TRP 263 CO -0.00 -0.32 0.44 -1.49 -2.79 0.00 0.00 178.44 174.27 1ggm h TRP 264 N -0.92 0.00 0.00 2.65 4.06 -1.33 -0.17 115.95 120.25 1ggm h TRP 264 Ca -0.07 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.87 1ggm h TRP 264 Cb 0.61 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.77 1ggm h TRP 264 CO 0.00 0.00 -0.05 0.37 -3.56 0.00 0.00 178.44 175.20 1ggm h GLN 265 N 0.00 0.00 0.00 0.49 4.15 -1.38 -1.93 115.11 116.44 1ggm h GLN 265 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1ggm h GLN 265 Cb 0.87 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.56 1ggm h GLN 265 CO 0.00 0.35 0.05 0.93 -1.93 0.00 0.00 178.83 178.23 1ggm h GLU 266 N -1.00 0.00 -0.00 1.69 5.08 -0.87 0.25 114.58 119.73 1ggm h GLU 266 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1ggm h GLU 266 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1ggm h GLU 266 CO -0.00 0.00 -0.03 -1.33 -1.00 0.00 0.00 179.01 176.64 1ggm n MET 267 N -3.05 0.03 0.00 2.33 2.81 -0.46 -4.91 117.12 113.88 1ggm n MET 267 Ca -0.03 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 1ggm n MET 267 Cb 0.12 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.13 1ggm n MET 267 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ggm n GLY 268 N 1.49 1.86 3.66 3.03 0.00 0.88 -4.63 105.19 111.48 1ggm n GLY 268 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1ggm n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ggm s LEU 269 N 0.00 4.20 0.52 0.99 1.43 -0.73 -4.95 118.68 120.13 1ggm s LEU 269 Ca 0.00 1.83 -0.22 0.00 -1.03 0.00 0.00 54.13 54.72 1ggm s LEU 269 Cb 0.00 -3.54 -0.06 0.00 0.03 0.00 0.00 46.19 42.63 1ggm s LEU 269 CO 0.00 -0.85 1.26 -0.94 0.23 0.00 0.00 176.35 176.05 1ggm s SER 270 N 2.54 5.62 0.40 2.29 1.04 -1.26 -4.14 113.70 120.19 1ggm s SER 270 Ca 0.61 2.52 0.07 0.00 0.48 0.00 0.00 55.95 59.64 1ggm s SER 270 Cb -0.25 -2.62 0.83 0.00 0.10 0.00 0.00 66.02 64.08 1ggm s SER 270 CO 0.20 -1.31 2.02 -0.09 0.98 0.00 0.00 173.24 175.04 1ggm h ARG 271 N 1.61 0.48 -0.14 4.02 9.65 -1.93 -2.03 114.38 126.03 1ggm h ARG 271 Ca -0.50 -0.05 0.04 0.00 -1.10 0.00 0.00 59.98 58.37 1ggm h ARG 271 Cb 1.28 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.75 1ggm h ARG 271 CO 0.58 0.38 0.17 0.93 2.80 0.00 0.00 179.97 184.83 1ggm h GLU 272 N 0.49 0.00 -0.01 0.20 4.39 -2.03 -1.71 114.58 115.91 1ggm h GLU 272 Ca 0.12 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1ggm h GLU 272 Cb 0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1ggm h GLU 272 CO -0.02 0.00 -0.64 0.09 -1.16 0.00 0.00 179.01 177.28 1ggm n ASN 273 N -3.77 1.18 -4.78 1.42 3.02 -0.77 -4.94 115.26 106.62 1ggm n ASN 273 Ca 0.01 -1.09 -0.37 0.00 -0.03 0.00 0.00 54.58 53.09 1ggm n ASN 273 Cb 0.28 0.79 -0.06 0.00 -0.61 0.00 0.00 39.78 40.18 1ggm n ASN 273 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ggm s LEU 274 N -2.57 4.35 -0.13 3.41 1.43 -0.65 -1.89 118.68 122.64 1ggm s LEU 274 Ca 0.10 0.74 -0.04 0.00 -1.03 0.00 0.00 54.13 53.90 1ggm s LEU 274 Cb 0.14 -2.49 0.05 0.00 0.03 0.00 0.00 46.19 43.92 1ggm s LEU 274 CO 0.61 0.20 0.10 -0.69 0.23 0.00 0.00 176.35 176.79 1ggm s VAL 275 N -0.25 -0.13 0.49 -1.59 1.01 -0.30 -4.95 120.40 114.68 1ggm s VAL 275 Ca 0.21 0.07 -0.20 0.00 0.00 0.00 0.00 61.98 62.06 1ggm s VAL 275 Cb -0.15 -0.43 -0.09 0.00 0.00 0.00 0.00 36.38 35.72 1ggm s VAL 275 CO 0.09 -0.10 1.02 -2.16 0.00 0.00 0.00 175.10 173.94 1ggm s PRO 276 N 2.17 3.86 -0.15 2.72 0.04 -1.26 0.04 135.00 142.43 1ggm s PRO 276 Ca 0.03 1.26 -0.04 0.00 0.04 0.00 0.00 61.00 62.30 1ggm s PRO 276 Cb -0.14 -2.11 0.07 0.00 0.04 0.00 0.00 34.50 32.36 1ggm s PRO 276 CO -0.07 -0.37 0.24 -0.47 0.04 0.00 0.00 177.00 176.37 1ggm s TYR 277 N -2.11 -0.37 -0.34 0.56 6.14 0.14 -4.87 117.35 116.49 1ggm s TYR 277 Ca 0.65 0.71 -0.29 0.00 0.64 0.00 0.00 57.07 58.78 1ggm s TYR 277 Cb -0.14 -0.16 -0.00 0.00 0.42 0.00 0.00 41.96 42.08 1ggm s TYR 277 CO 0.21 -0.43 1.45 -1.14 0.64 0.00 0.00 175.55 176.28 1ggm s GLN 278 N 2.38 3.69 0.56 4.97 2.00 -1.26 -1.29 119.66 130.71 1ggm s GLN 278 Ca 0.04 1.20 -0.21 0.00 -2.00 0.00 0.00 55.36 54.38 1ggm s GLN 278 Cb -0.13 -4.00 -0.04 0.00 0.80 0.00 0.00 33.01 29.64 1ggm s GLN 278 CO -0.09 -1.41 1.33 -1.14 -0.50 0.00 0.00 175.29 173.47 1ggm s GLN 279 N 4.73 3.09 0.19 1.67 0.74 -1.01 -4.98 119.66 124.08 1ggm s GLN 279 Ca 0.63 2.16 0.03 0.00 0.05 0.00 0.00 55.36 58.23 1ggm s GLN 279 Cb -0.17 -2.19 -0.03 0.00 1.10 0.00 0.00 33.01 31.71 1ggm s GLN 279 CO 0.29 -1.21 0.32 -1.25 -0.55 0.00 0.00 175.29 172.90 1ggm s PRO 280 N -2.98 3.45 0.10 1.67 0.04 -1.26 -4.74 135.00 131.28 1ggm s PRO 280 Ca 0.73 -0.61 0.02 0.00 0.04 0.00 0.00 61.00 61.17 1ggm s PRO 280 Cb -0.39 -2.92 0.26 0.00 0.04 0.00 0.00 34.50 31.49 1ggm s PRO 280 CO 0.45 0.47 0.47 -0.35 0.04 0.00 0.00 177.00 178.09 1ggm n PRO 281 N -0.84 -0.02 0.20 0.56 -0.04 -1.26 0.25 135.00 133.84 1ggm n PRO 281 Ca -0.07 0.45 -0.15 0.00 -0.04 0.00 0.00 63.50 63.69 1ggm n PRO 281 Cb 0.55 -0.72 -0.08 0.00 -0.04 0.00 0.00 33.50 33.21 1ggm n PRO 281 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1ggm h GLU 282 N 0.00 -0.46 0.00 0.54 3.07 -2.02 -3.09 114.58 112.61 1ggm h GLU 282 Ca 0.19 0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 59.06 1ggm h GLU 282 Cb 0.43 0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.44 1ggm h GLU 282 CO -0.27 -0.31 -0.13 0.77 -1.40 0.00 0.00 179.01 177.67 1ggm h SER 283 N -0.48 0.00 -0.28 1.42 0.02 0.29 -3.43 113.55 111.09 1ggm h SER 283 Ca -0.03 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1ggm h SER 283 Cb 0.39 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 1ggm h SER 283 CO 0.04 0.13 0.10 -0.24 -1.14 0.00 0.00 176.83 175.72 1ggm n SER 284 N -3.17 1.56 -4.46 3.07 2.88 -0.66 -4.89 113.62 107.95 1ggm n SER 284 Ca 0.02 -1.60 -0.37 0.00 -1.33 0.00 0.00 58.87 55.59 1ggm n SER 284 Cb 0.49 -1.62 0.06 0.00 -0.75 0.00 0.00 64.21 62.39 1ggm n SER 284 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ggm n ALA 285 N 18.29 -1.47 -0.04 -1.46 0.00 -1.26 -4.81 120.51 129.76 1ggm n ALA 285 Ca 0.47 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1ggm n ALA 285 Cb 0.42 -1.83 0.00 0.00 0.00 0.00 0.00 19.45 18.04 1ggm n ALA 285 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1ggm n HIS 286 N -2.14 0.00 0.16 0.00 1.44 -1.26 -0.82 115.22 112.60 1ggm n HIS 286 Ca 0.10 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.88 1ggm n HIS 286 Cb 0.49 -0.10 0.57 0.00 0.12 0.00 0.00 29.99 31.07 1ggm n HIS 286 CO 0.00 0.00 0.00 0.10 -2.81 0.00 0.00 176.34 173.63 1ggm h TYR 287 N 0.00 0.18 -3.37 -1.40 -0.00 -1.95 -3.41 116.97 107.02 1ggm h TYR 287 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 58.73 58.17 1ggm h TYR 287 Cb 0.00 -0.06 -0.06 0.00 -0.00 0.00 0.00 36.73 36.61 1ggm h TYR 287 CO -0.18 0.11 0.96 0.00 -0.00 0.00 0.00 178.16 179.05 1ggm s ALA 288 N -5.22 3.25 0.19 0.10 0.00 -0.00 -3.36 121.76 116.72 1ggm s ALA 288 Ca -0.06 -0.15 0.19 0.00 0.00 0.00 0.00 51.96 51.94 1ggm s ALA 288 Cb 0.17 -3.84 0.75 0.00 0.00 0.00 0.00 23.12 20.21 1ggm s ALA 288 CO 0.69 -2.02 1.77 -0.22 0.00 0.00 0.00 175.76 175.98 1ggm h LYS 289 N 9.44 0.00 -2.30 0.00 3.64 -1.54 -3.41 116.57 122.40 1ggm h LYS 289 Ca -0.25 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.24 1ggm h LYS 289 Cb 1.08 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.76 1ggm h LYS 289 CO 1.07 0.35 0.49 0.00 -2.27 0.00 0.00 179.45 179.09 1ggm s ALA 290 N -3.68 -1.81 -0.05 5.00 0.00 -1.24 -5.05 121.76 114.93 1ggm s ALA 290 Ca -0.00 0.95 -0.29 0.00 0.00 0.00 0.00 51.96 52.62 1ggm s ALA 290 Cb 0.11 0.44 0.07 0.00 0.00 0.00 0.00 23.12 23.74 1ggm s ALA 290 CO 0.68 -0.71 0.64 0.95 0.00 0.00 0.00 175.76 177.32 1ggm s THR 291 N -3.14 0.01 -0.06 0.00 -4.23 -1.26 -1.31 115.64 105.64 1ggm s THR 291 Ca 0.05 -0.05 0.02 0.00 -1.18 0.00 0.00 61.69 60.53 1ggm s THR 291 Cb -0.01 -0.96 0.02 0.00 1.34 0.00 0.00 72.50 72.89 1ggm s THR 291 CO -0.08 -0.03 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.19 1ggm s VAL 292 N -1.20 0.90 0.07 2.29 1.01 -0.40 -2.40 120.40 120.68 1ggm s VAL 292 Ca -0.11 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.55 1ggm s VAL 292 Cb -0.01 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 1ggm s VAL 292 CO 0.09 0.31 0.15 -1.81 0.00 0.00 0.00 175.10 173.84 1ggm s ASP 293 N 0.81 5.95 -0.42 3.32 1.01 -0.41 -0.45 116.67 126.48 1ggm s ASP 293 Ca -0.12 0.13 -0.06 0.00 0.71 0.00 0.00 52.55 53.21 1ggm s ASP 293 Cb -0.15 -1.73 0.10 0.00 1.01 0.00 0.00 42.92 42.16 1ggm s ASP 293 CO 0.02 0.17 0.24 -0.63 0.21 0.00 0.00 175.17 175.18 1ggm s ILE 294 N -1.46 3.71 0.53 0.77 1.01 -0.70 0.25 121.20 125.30 1ggm s ILE 294 Ca 0.32 -1.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.05 1ggm s ILE 294 Cb -0.13 -3.43 -0.06 0.00 0.01 0.00 0.00 42.46 38.86 1ggm s ILE 294 CO 0.25 -0.64 0.93 -0.76 0.00 0.00 0.00 174.94 174.72 1ggm s LEU 295 N 1.27 3.53 0.03 2.97 1.43 0.11 -2.01 118.68 125.99 1ggm s LEU 295 Ca 0.06 1.34 0.06 0.00 -1.03 0.00 0.00 54.13 54.56 1ggm s LEU 295 Cb -0.24 -4.31 -0.02 0.00 0.03 0.00 0.00 46.19 41.65 1ggm s LEU 295 CO -0.02 -0.65 -0.19 -0.47 0.23 0.00 0.00 176.35 175.26 1ggm s TYR 296 N -2.79 1.64 -1.31 0.29 5.04 0.54 -1.14 117.35 119.61 1ggm s TYR 296 Ca 0.54 -0.35 -0.13 0.00 -2.44 0.00 0.00 57.07 54.69 1ggm s TYR 296 Cb -0.10 -0.99 -0.04 0.00 0.35 0.00 0.00 41.96 41.18 1ggm s TYR 296 CO 0.41 0.06 2.35 0.54 -1.34 0.00 0.00 175.55 177.57 1ggm n ARG 297 N 2.01 2.73 -2.11 4.97 1.74 -0.79 -1.58 116.66 123.64 1ggm n ARG 297 Ca -0.17 -2.22 -0.39 0.00 -0.77 0.00 0.00 57.85 54.30 1ggm n ARG 297 Cb 0.54 -3.00 -0.00 0.00 -1.02 0.00 0.00 32.46 28.98 1ggm n ARG 297 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1ggm s PHE 298 N 3.29 2.83 0.29 -1.55 0.08 -1.23 -4.90 117.98 116.79 1ggm s PHE 298 Ca 0.54 1.45 -0.02 0.00 0.12 0.00 0.00 56.93 59.03 1ggm s PHE 298 Cb 0.15 -3.58 0.64 0.00 -0.57 0.00 0.00 43.02 39.65 1ggm s PHE 298 CO -0.04 -1.93 1.58 -1.35 -0.10 0.00 0.00 175.22 173.39 1ggm h PRO 299 N 2.46 0.03 0.00 0.24 0.11 -1.87 0.55 132.00 133.52 1ggm h PRO 299 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1ggm h PRO 299 Cb 1.25 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ggm h PRO 299 CO 0.62 0.02 0.00 -2.39 -0.21 0.00 0.00 178.00 176.03 1ggm n HIS 300 N -5.48 0.00 0.00 0.65 1.44 -1.26 -4.87 115.22 105.69 1ggm n HIS 300 Ca 0.20 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.91 1ggm n HIS 300 Cb 0.66 -0.19 0.00 0.00 0.12 0.00 0.00 29.99 30.57 1ggm n HIS 300 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1ggm n GLY 301 N 0.84 4.67 3.50 -1.39 0.00 0.19 -5.04 105.19 107.97 1ggm n GLY 301 Ca 0.15 -1.22 -0.48 0.00 0.00 0.00 0.00 46.02 44.46 1ggm n GLY 301 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ggm n SER 302 N 0.00 2.49 -4.20 1.61 2.88 -1.26 -3.49 113.62 111.65 1ggm n SER 302 Ca 0.00 0.37 -0.12 0.00 -1.33 0.00 0.00 58.87 57.80 1ggm n SER 302 Cb 0.00 -1.35 -0.10 0.00 -0.75 0.00 0.00 64.21 62.01 1ggm n SER 302 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1ggm s LEU 303 N 7.48 1.90 0.26 2.46 1.43 -0.62 -4.89 118.68 126.71 1ggm s LEU 303 Ca 1.07 -1.21 -0.31 0.00 -1.03 0.00 0.00 54.13 52.65 1ggm s LEU 303 Cb -0.70 0.14 -0.12 0.00 0.03 0.00 0.00 46.19 45.53 1ggm s LEU 303 CO 0.45 -0.66 1.57 1.21 0.23 0.00 0.00 176.35 179.15 1ggm n GLU 304 N -0.18 2.50 0.02 1.70 2.13 -1.26 -0.34 120.64 125.22 1ggm n GLU 304 Ca -0.06 0.89 -0.01 0.00 0.66 0.00 0.00 57.16 58.65 1ggm n GLU 304 Cb 0.64 -2.65 -0.00 0.00 0.27 0.00 0.00 31.44 29.69 1ggm n GLU 304 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1ggm n LEU 305 N 2.54 0.76 -4.26 4.31 0.00 -0.85 -4.83 117.00 114.68 1ggm n LEU 305 Ca 0.11 0.10 -0.18 0.00 0.00 0.00 0.00 56.01 56.04 1ggm n LEU 305 Cb 0.34 -0.24 -0.11 0.00 0.00 0.00 0.00 43.42 43.41 1ggm n LEU 305 CO 0.64 -0.43 -0.45 -0.70 0.00 0.00 0.00 177.39 176.45 1ggm s GLU 306 N -2.05 1.07 -0.27 1.96 2.12 -1.20 -2.63 118.70 117.70 1ggm s GLU 306 Ca -0.02 -1.28 -0.01 0.00 0.36 0.00 0.00 54.97 54.02 1ggm s GLU 306 Cb 0.01 -0.96 0.08 0.00 0.26 0.00 0.00 34.13 33.52 1ggm s GLU 306 CO 0.03 0.18 0.05 0.20 -0.54 0.00 0.00 175.26 175.19 1ggm s GLY 307 N -2.53 1.09 -1.01 -1.50 0.00 0.78 -1.73 107.32 102.43 1ggm s GLY 307 Ca 0.10 -1.46 -0.16 0.00 0.00 0.00 0.00 44.72 43.20 1ggm s GLY 307 CO 0.03 1.40 1.18 -0.42 0.00 0.00 0.00 173.10 175.29 1ggm s ILE 308 N 1.58 4.99 0.71 0.90 1.09 0.40 -0.95 121.20 129.92 1ggm s ILE 308 Ca 0.05 -2.10 -0.11 0.00 -1.10 0.00 0.00 60.65 57.39 1ggm s ILE 308 Cb -0.18 -4.77 0.16 0.00 -1.06 0.00 0.00 42.46 36.61 1ggm s ILE 308 CO -0.17 -1.47 0.96 0.00 -0.10 0.00 0.00 174.94 174.17 1ggm n ALA 309 N 5.76 -0.98 -2.90 9.38 0.00 0.13 -1.27 120.51 130.63 1ggm n ALA 309 Ca 0.27 -1.32 -0.13 0.00 0.00 0.00 0.00 53.44 52.26 1ggm n ALA 309 Cb 0.46 -0.03 0.02 0.00 0.00 0.00 0.00 19.45 19.91 1ggm n ALA 309 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1ggm n GLN 310 N -3.01 0.83 -1.12 0.00 -0.06 -0.43 -2.12 117.38 111.47 1ggm n GLN 310 Ca 0.12 -2.31 -0.31 0.00 -2.00 0.00 0.00 57.00 52.51 1ggm n GLN 310 Cb 0.43 -1.35 0.11 0.00 -4.06 0.00 0.00 30.24 25.38 1ggm n GLN 310 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 1ggm s ARG 311 N -0.17 1.93 -0.34 3.69 0.52 -1.20 -1.61 118.95 121.77 1ggm s ARG 311 Ca 0.32 1.29 -0.01 0.00 -0.52 0.00 0.00 55.73 56.81 1ggm s ARG 311 Cb 0.24 -1.85 0.13 0.00 0.52 0.00 0.00 34.95 33.98 1ggm s ARG 311 CO -0.16 -1.91 0.18 0.95 0.02 0.00 0.00 175.30 174.38 1ggm s THR 312 N -2.80 0.20 0.00 0.02 -4.23 -1.21 -2.85 115.64 104.77 1ggm s THR 312 Ca 0.63 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1ggm s THR 312 Cb -0.19 -1.16 0.00 0.00 1.34 0.00 0.00 72.50 72.49 1ggm s THR 312 CO 0.56 -0.89 0.00 -0.90 -0.54 0.00 0.00 174.62 172.85 1ggm n ASP 313 N 4.40 -4.98 -0.01 3.99 5.75 -1.18 -4.50 116.55 120.02 1ggm n ASP 313 Ca 0.06 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.67 1ggm n ASP 313 Cb 0.39 -3.02 -0.12 0.00 -1.03 0.00 0.00 41.12 37.34 1ggm n ASP 313 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 1ggm h PHE 314 N 0.00 0.43 0.52 2.11 3.57 -1.89 0.13 116.94 121.81 1ggm h PHE 314 Ca 0.00 -0.24 -0.03 0.00 3.53 0.00 0.00 57.97 61.23 1ggm h PHE 314 Cb 0.83 -0.05 0.01 0.00 2.79 0.00 0.00 35.95 39.53 1ggm h PHE 314 CO 0.52 1.07 -0.25 -0.44 -2.23 0.00 0.00 178.31 176.98 1ggm h ASP 315 N -0.33 -0.59 -0.72 0.41 3.32 -1.93 0.80 116.42 117.38 1ggm h ASP 315 Ca -0.06 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 1ggm h ASP 315 Cb 1.20 0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.87 1ggm h ASP 315 CO 0.09 -0.33 0.45 -0.07 -1.72 0.00 0.00 179.24 177.66 1ggm h LEU 316 N -0.83 0.86 -0.28 1.55 3.38 -1.90 -2.40 115.31 115.69 1ggm h LEU 316 Ca -0.07 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.88 1ggm h LEU 316 Cb 0.59 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1ggm h LEU 316 CO 0.12 0.65 0.14 1.23 0.09 0.00 0.00 178.44 180.67 1ggm h GLY 317 N 1.02 0.37 2.00 0.83 0.00 -0.24 -1.47 103.07 105.58 1ggm h GLY 317 Ca 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.49 1ggm h GLY 317 CO -0.05 0.08 0.00 1.76 0.00 0.00 0.00 176.54 178.33 1ggm h SER 318 N 0.29 0.00 -0.21 0.19 0.02 0.11 -3.22 113.55 110.74 1ggm h SER 318 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1ggm h SER 318 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 1ggm h SER 318 CO -0.08 0.00 0.00 1.41 -1.14 0.00 0.00 176.83 177.02 1ggm n HIS 319 N -2.37 0.27 -4.20 3.45 -0.00 -0.62 -4.73 115.22 107.01 1ggm n HIS 319 Ca 0.02 -0.40 -0.31 0.00 -0.00 0.00 0.00 57.72 57.03 1ggm n HIS 319 Cb 0.23 -0.03 -0.09 0.00 -0.00 0.00 0.00 29.99 30.11 1ggm n HIS 319 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 1ggm s THR 320 N -0.93 3.93 0.71 1.59 -1.32 -0.79 -4.78 115.64 114.03 1ggm s THR 320 Ca 0.16 -0.93 -0.11 0.00 -1.21 0.00 0.00 61.69 59.60 1ggm s THR 320 Cb 0.08 -2.83 0.02 0.00 -1.51 0.00 0.00 72.50 68.26 1ggm s THR 320 CO 0.11 0.19 1.07 -0.75 -2.21 0.00 0.00 174.62 173.04 1ggm s LYS 321 N -2.06 2.82 -1.87 7.08 2.20 0.10 -3.73 119.74 124.29 1ggm s LYS 321 Ca 0.23 0.71 0.00 0.00 -0.36 0.00 0.00 55.97 56.55 1ggm s LYS 321 Cb -0.12 -2.00 0.00 0.00 -1.51 0.00 0.00 37.83 34.21 1ggm s LYS 321 CO 0.15 -1.12 0.00 -0.25 -0.36 0.00 0.00 175.35 173.77 1ggm n ASP 322 N -3.11 -5.31 -0.30 1.43 9.92 -1.26 -4.62 116.55 113.31 1ggm n ASP 322 Ca 0.07 0.31 0.12 0.00 -0.53 0.00 0.00 54.79 54.76 1ggm n ASP 322 Cb 0.55 -4.43 0.23 0.00 -0.64 0.00 0.00 41.12 36.84 1ggm n ASP 322 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 1ggm n GLN 323 N -2.56 -0.07 -0.37 -1.24 7.27 -1.24 -0.29 117.38 118.88 1ggm n GLN 323 Ca -0.20 1.28 0.01 0.00 0.07 0.00 0.00 57.00 58.17 1ggm n GLN 323 Cb 0.63 -2.02 0.16 0.00 2.41 0.00 0.00 30.24 31.42 1ggm n GLN 323 CO 0.00 0.00 0.00 1.05 0.07 0.00 0.00 177.06 178.18 1ggm h GLU 324 N 0.00 1.19 0.05 3.69 9.09 -1.93 -3.32 114.58 123.35 1ggm h GLU 324 Ca 0.50 -0.07 -0.00 0.00 0.05 0.00 0.00 59.36 59.84 1ggm h GLU 324 Cb 1.00 -0.27 0.00 0.00 -1.65 0.00 0.00 28.75 27.84 1ggm h GLU 324 CO -0.81 0.79 -0.02 0.00 0.05 0.00 0.00 179.01 179.01 1ggm h ALA 325 N 1.43 -0.71 -1.95 1.06 0.00 -1.03 -3.42 119.26 114.66 1ggm h ALA 325 Ca 0.41 -0.01 -0.57 0.00 0.00 0.00 0.00 54.91 54.73 1ggm h ALA 325 Cb 0.07 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1ggm h ALA 325 CO -0.14 -0.70 1.27 -0.48 0.00 0.00 0.00 179.25 179.19 1ggm s LEU 326 N -4.39 3.63 -0.89 0.00 0.05 -1.22 -4.88 118.68 110.98 1ggm s LEU 326 Ca -0.01 1.53 -0.25 0.00 0.05 0.00 0.00 54.13 55.45 1ggm s LEU 326 Cb 0.00 -3.53 -0.18 0.00 -2.05 0.00 0.00 46.19 40.44 1ggm s LEU 326 CO 0.03 -1.60 2.27 0.61 -0.55 0.00 0.00 176.35 177.10 1ggm n GLY 327 N 5.25 -0.28 3.75 -3.48 0.00 -1.26 -4.86 105.19 104.31 1ggm n GLY 327 Ca 0.23 0.21 -0.31 0.00 0.00 0.00 0.00 46.02 46.15 1ggm n GLY 327 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ggm s ILE 328 N 14.87 3.07 0.00 -0.61 1.09 -1.26 -4.82 121.20 133.54 1ggm s ILE 328 Ca 0.88 0.36 0.00 0.00 -1.10 0.00 0.00 60.65 60.79 1ggm s ILE 328 Cb -0.13 -2.76 0.00 0.00 -1.06 0.00 0.00 42.46 38.51 1ggm s ILE 328 CO 0.14 -0.44 0.00 0.35 -0.10 0.00 0.00 174.94 174.89 1ggm n THR 329 N -3.57 0.00 -0.71 2.92 -2.24 -1.26 -5.06 114.28 104.36 1ggm n THR 329 Ca 0.10 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.58 1ggm n THR 329 Cb 0.53 -0.65 0.20 0.00 -2.10 0.00 0.00 70.33 68.31 1ggm n THR 329 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ggm s ALA 330 N -4.04 0.53 0.44 6.98 0.00 -1.26 -4.97 121.76 119.44 1ggm s ALA 330 Ca 0.00 0.14 -0.23 0.00 0.00 0.00 0.00 51.96 51.87 1ggm s ALA 330 Cb 0.00 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.71 1ggm s ALA 330 CO 0.00 -3.23 0.93 2.89 0.00 0.00 0.00 175.76 176.35 1ggm n ARG 331 N -4.52 1.17 -3.81 0.00 -4.01 -1.26 -4.86 116.66 99.37 1ggm n ARG 331 Ca 0.07 0.43 -0.06 0.00 -1.04 0.00 0.00 57.85 57.24 1ggm n ARG 331 Cb 0.54 -1.98 -0.02 0.00 -3.04 0.00 0.00 32.46 27.96 1ggm n ARG 331 CO 0.00 0.00 0.00 0.14 -3.04 0.00 0.00 177.63 174.73 1ggm s VAL 332 N -1.34 0.00 0.02 8.89 -7.23 -1.26 -4.79 120.40 114.69 1ggm s VAL 332 Ca 0.65 -0.86 -0.01 0.00 -1.81 0.00 0.00 61.98 59.94 1ggm s VAL 332 Cb -0.54 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 1ggm s VAL 332 CO 0.56 0.00 0.17 -0.76 -0.31 0.00 0.00 175.10 174.76 1ggm s LEU 333 N -2.91 4.27 -0.13 1.32 1.43 -1.26 -4.99 118.68 116.40 1ggm s LEU 333 Ca 0.11 0.27 -0.29 0.00 -1.03 0.00 0.00 54.13 53.19 1ggm s LEU 333 Cb -0.05 -2.68 -0.06 0.00 0.03 0.00 0.00 46.19 43.44 1ggm s LEU 333 CO 0.05 0.23 2.03 -0.60 0.23 0.00 0.00 176.35 178.28 1ggm s ARG 334 N -2.14 3.59 -0.35 1.70 6.06 -1.26 -4.84 118.95 121.71 1ggm s ARG 334 Ca 0.29 2.16 -0.27 0.00 -2.50 0.00 0.00 55.73 55.41 1ggm s ARG 334 Cb -0.13 -4.24 0.02 0.00 0.06 0.00 0.00 34.95 30.66 1ggm s ARG 334 CO 0.21 -1.58 1.00 1.21 -2.50 0.00 0.00 175.30 173.64 1ggm s ASN 335 N 6.27 6.79 0.00 -2.12 3.84 -1.26 -4.90 114.94 123.55 1ggm s ASN 335 Ca 0.91 0.79 0.22 0.00 0.21 0.00 0.00 52.86 55.00 1ggm s ASN 335 Cb -0.35 -2.50 -0.03 0.00 -0.55 0.00 0.00 41.25 37.82 1ggm s ASN 335 CO 0.36 -0.87 1.03 -0.62 -2.79 0.00 0.00 177.10 174.21 1ggm n GLU 336 N 6.84 0.04 -0.08 0.43 1.02 -1.26 -4.60 120.64 123.02 1ggm n GLU 336 Ca 0.09 -0.01 -0.09 0.00 -0.02 0.00 0.00 57.16 57.14 1ggm n GLU 336 Cb 0.48 -1.51 -0.10 0.00 -0.02 0.00 0.00 31.44 30.29 1ggm n GLU 336 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1ggm n HIS 337 N -1.55 0.00 -1.57 -0.32 8.25 -1.26 -5.02 115.22 113.75 1ggm n HIS 337 Ca 0.04 0.00 -0.59 0.00 -0.26 0.00 0.00 57.72 56.91 1ggm n HIS 337 Cb 0.34 -0.70 -0.09 0.00 1.12 0.00 0.00 29.99 30.67 1ggm n HIS 337 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1ggm n SER 338 N -2.68 1.74 0.16 0.41 2.88 -1.26 -4.84 113.62 110.03 1ggm n SER 338 Ca -0.26 0.88 0.01 0.00 -1.33 0.00 0.00 58.87 58.17 1ggm n SER 338 Cb 0.92 -1.06 0.25 0.00 -0.75 0.00 0.00 64.21 63.58 1ggm n SER 338 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1ggm h THR 339 N 5.95 1.34 -2.96 2.46 1.35 -1.95 -3.39 112.91 115.69 1ggm h THR 339 Ca -0.34 -1.78 -0.61 0.00 -0.55 0.00 0.00 66.41 63.13 1ggm h THR 339 Cb 1.35 1.97 -0.04 0.00 -1.73 0.00 0.00 68.15 69.70 1ggm h THR 339 CO 1.01 0.50 -0.46 -1.10 -0.25 0.00 0.00 175.52 175.22 1ggm s GLN 340 N -3.81 3.48 -0.92 4.72 -0.21 -1.26 -4.90 119.66 116.75 1ggm s GLN 340 Ca -0.02 -0.36 -0.01 0.00 0.02 0.00 0.00 55.36 54.99 1ggm s GLN 340 Cb 0.13 -3.00 0.28 0.00 1.00 0.00 0.00 33.01 31.42 1ggm s GLN 340 CO 0.74 0.58 1.15 -2.13 -2.12 0.00 0.00 175.29 173.52 1ggm n ARG 341 N 0.27 3.60 -1.66 2.91 0.00 -1.26 0.03 116.66 120.56 1ggm n ARG 341 Ca -0.05 -4.58 -0.24 0.00 -0.00 0.00 0.00 57.85 52.98 1ggm n ARG 341 Cb 0.51 -2.42 -0.05 0.00 0.00 0.00 0.00 32.46 30.50 1ggm n ARG 341 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1ggm s LEU 342 N -2.45 3.11 0.11 6.15 1.43 -1.26 -4.87 118.68 120.90 1ggm s LEU 342 Ca 0.33 0.34 -0.19 0.00 -1.03 0.00 0.00 54.13 53.58 1ggm s LEU 342 Cb 0.06 -2.53 0.05 0.00 0.03 0.00 0.00 46.19 43.79 1ggm s LEU 342 CO 0.03 -3.31 0.47 0.00 0.23 0.00 0.00 176.35 173.77 1ggm s ALA 343 N 12.98 -1.17 -0.17 4.21 0.00 -1.26 -4.89 121.76 131.46 1ggm s ALA 343 Ca 0.90 0.23 -0.05 0.00 0.00 0.00 0.00 51.96 53.04 1ggm s ALA 343 Cb -0.14 0.65 -0.03 0.00 0.00 0.00 0.00 23.12 23.61 1ggm s ALA 343 CO 0.14 -0.63 0.00 -0.47 0.00 0.00 0.00 175.76 174.80 1ggm s TYR 344 N -3.42 3.10 -0.30 0.00 5.04 -0.85 -4.96 117.35 115.95 1ggm s TYR 344 Ca 0.00 -0.21 0.23 0.00 -2.44 0.00 0.00 57.07 54.65 1ggm s TYR 344 Cb 0.01 -2.02 -0.06 0.00 0.35 0.00 0.00 41.96 40.23 1ggm s TYR 344 CO -0.10 -0.02 0.91 2.89 -1.34 0.00 0.00 175.55 177.90 1ggm n ARG 345 N 3.69 0.52 -3.78 4.97 1.85 -1.26 -2.17 116.66 120.48 1ggm n ARG 345 Ca -0.17 0.01 -0.37 0.00 -1.00 0.00 0.00 57.85 56.32 1ggm n ARG 345 Cb 0.52 -1.69 -0.12 0.00 -1.05 0.00 0.00 32.46 30.13 1ggm n ARG 345 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1ggm s ASP 346 N -4.73 5.23 0.00 2.89 2.15 -1.26 -3.76 116.67 117.19 1ggm s ASP 346 Ca -0.01 -1.66 0.00 0.00 0.43 0.00 0.00 52.55 51.32 1ggm s ASP 346 Cb 0.12 -1.83 0.00 0.00 -0.30 0.00 0.00 42.92 40.91 1ggm s ASP 346 CO 0.82 -0.45 0.00 -0.81 -0.17 0.00 0.00 175.17 174.56 1ggm n PRO 347 N 4.68 3.88 0.22 4.34 -0.04 -1.26 -4.87 135.00 141.94 1ggm n PRO 347 Ca -0.07 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.54 1ggm n PRO 347 Cb 0.42 0.00 0.66 0.00 -0.04 0.00 0.00 33.50 34.54 1ggm n PRO 347 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1ggm h GLU 348 N 0.00 0.00 0.00 0.54 5.08 -1.97 -3.42 114.58 114.80 1ggm h GLU 348 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ggm h GLU 348 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1ggm h GLU 348 CO 0.00 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 178.26 1ggm n THR 349 N -2.68 0.00 -1.76 1.13 -2.24 -1.26 -5.06 114.28 102.41 1ggm n THR 349 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1ggm n THR 349 Cb 0.23 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 1ggm n THR 349 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ggm n GLY 350 N 5.00 -0.21 3.65 3.38 0.00 -1.26 -4.86 105.19 110.89 1ggm n GLY 350 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1ggm n GLY 350 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggm s LYS 351 N 0.00 4.16 0.11 1.61 3.01 -1.25 -4.88 119.74 122.50 1ggm s LYS 351 Ca 0.00 1.20 -0.31 0.00 -1.01 0.00 0.00 55.97 55.85 1ggm s LYS 351 Cb 0.00 -3.69 -0.09 0.00 -1.01 0.00 0.00 37.83 33.04 1ggm s LYS 351 CO 0.00 -0.76 1.71 -1.58 0.51 0.00 0.00 175.35 175.23 1ggm s TRP 352 N 3.41 2.44 0.19 3.18 0.51 -1.26 -4.55 118.94 122.86 1ggm s TRP 352 Ca 0.44 0.24 0.00 0.00 -2.12 0.00 0.00 56.10 54.66 1ggm s TRP 352 Cb -0.14 -4.04 -0.04 0.00 -0.81 0.00 0.00 33.47 28.44 1ggm s TRP 352 CO 0.11 -4.19 0.08 -0.59 -0.51 0.00 0.00 176.95 171.85 1ggm s PHE 353 N 2.40 1.19 -0.29 -1.98 -0.71 -0.92 -4.64 117.98 113.03 1ggm s PHE 353 Ca 0.76 -1.22 -0.03 0.00 -1.04 0.00 0.00 56.93 55.40 1ggm s PHE 353 Cb -0.43 -0.65 0.04 0.00 -1.21 0.00 0.00 43.02 40.77 1ggm s PHE 353 CO 0.34 -0.45 -0.00 0.08 -1.34 0.00 0.00 175.22 173.85 1ggm s VAL 354 N -3.93 3.11 0.65 -2.49 1.01 -1.26 -2.01 120.40 115.47 1ggm s VAL 354 Ca 0.32 -1.20 -0.17 0.00 0.00 0.00 0.00 61.98 60.92 1ggm s VAL 354 Cb 0.07 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 1ggm s VAL 354 CO 0.08 -0.01 0.72 -2.65 0.00 0.00 0.00 175.10 173.25 1ggm n PRO 355 N 4.67 0.56 -3.69 2.72 -0.02 -1.26 -4.76 135.00 133.22 1ggm n PRO 355 Ca -0.14 0.23 -0.21 0.00 -2.02 0.00 0.00 63.50 61.36 1ggm n PRO 355 Cb 0.45 -1.96 -0.01 0.00 -0.02 0.00 0.00 33.50 31.96 1ggm n PRO 355 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1ggm s TYR 356 N -1.73 3.36 0.07 6.00 1.51 -0.03 -3.12 117.35 123.41 1ggm s TYR 356 Ca 0.71 0.00 0.03 0.00 -1.01 0.00 0.00 57.07 56.80 1ggm s TYR 356 Cb -0.39 -1.77 -0.03 0.00 -0.11 0.00 0.00 41.96 39.65 1ggm s TYR 356 CO 0.52 0.23 -0.10 0.14 -1.11 0.00 0.00 175.55 175.23 1ggm s VAL 357 N -2.12 0.81 -0.12 0.71 -7.23 -1.13 -0.50 120.40 110.82 1ggm s VAL 357 Ca 0.39 -1.39 0.00 0.00 -1.81 0.00 0.00 61.98 59.17 1ggm s VAL 357 Cb -0.09 -1.05 -0.02 0.00 0.56 0.00 0.00 36.38 35.78 1ggm s VAL 357 CO 0.31 -0.45 -0.13 -0.63 -0.31 0.00 0.00 175.10 173.89 1ggm s ILE 358 N -1.90 3.05 -0.17 -0.62 -1.09 -0.49 -3.26 121.20 116.72 1ggm s ILE 358 Ca -0.01 -0.67 0.00 0.00 -2.23 0.00 0.00 60.65 57.74 1ggm s ILE 358 Cb -0.06 -2.27 0.03 0.00 -1.58 0.00 0.00 42.46 38.58 1ggm s ILE 358 CO 0.00 0.53 -0.10 -0.70 -1.23 0.00 0.00 174.94 173.44 1ggm s GLU 359 N 0.23 1.95 -0.50 2.79 2.12 -0.90 -0.69 118.70 123.71 1ggm s GLU 359 Ca -0.09 -0.64 -0.16 0.00 0.36 0.00 0.00 54.97 54.45 1ggm s GLU 359 Cb -0.15 -2.16 0.09 0.00 0.26 0.00 0.00 34.13 32.16 1ggm s GLU 359 CO 0.05 -0.35 0.45 -2.14 -0.54 0.00 0.00 175.26 172.73 1ggm s PRO 360 N 1.50 2.99 -0.34 4.30 0.02 -1.23 0.21 135.00 142.46 1ggm s PRO 360 Ca 0.02 -1.44 -0.10 0.00 0.02 0.00 0.00 61.00 59.49 1ggm s PRO 360 Cb -0.15 -4.19 0.01 0.00 0.02 0.00 0.00 34.50 30.20 1ggm s PRO 360 CO -0.09 -1.15 0.17 0.45 -0.33 0.00 0.00 177.00 176.06 1ggm s SER 361 N 2.95 5.61 -0.08 2.53 0.15 -0.12 -2.83 113.70 121.90 1ggm s SER 361 Ca 0.04 -0.76 -0.02 0.00 0.70 0.00 0.00 55.95 55.92 1ggm s SER 361 Cb -0.26 -2.00 -0.03 0.00 -1.71 0.00 0.00 66.02 62.02 1ggm s SER 361 CO 0.06 -0.28 -0.00 0.00 1.20 0.00 0.00 173.24 174.21 1ggm s ALA 362 N 1.58 3.26 -0.42 5.45 0.00 -0.48 -0.15 121.76 130.98 1ggm s ALA 362 Ca 0.03 -0.81 -0.22 0.00 0.00 0.00 0.00 51.96 50.96 1ggm s ALA 362 Cb -0.18 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.50 1ggm s ALA 362 CO 0.06 0.59 0.73 0.20 0.00 0.00 0.00 175.76 177.34 1ggm s GLY 363 N -0.88 1.66 0.14 0.00 0.00 -1.08 -0.87 107.32 106.29 1ggm s GLY 363 Ca 0.13 -0.97 -0.18 0.00 0.00 0.00 0.00 44.72 43.70 1ggm s GLY 363 CO 0.02 1.68 1.77 -2.08 0.00 0.00 0.00 173.10 174.49 1ggm h VAL 364 N 5.88 0.99 -0.79 1.40 2.07 -1.65 0.34 116.25 124.48 1ggm h VAL 364 Ca -0.25 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.24 1ggm h VAL 364 Cb 1.09 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.47 1ggm h VAL 364 CO 0.92 0.05 0.46 0.44 0.02 0.00 0.00 177.57 179.46 1ggm h ASP 365 N 0.29 0.69 0.18 0.57 5.19 -1.91 -1.16 116.42 120.27 1ggm h ASP 365 Ca 0.12 0.03 -0.17 0.00 -0.62 0.00 0.00 57.03 56.39 1ggm h ASP 365 Cb 0.04 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.44 1ggm h ASP 365 CO -0.08 0.42 -0.63 0.03 -3.12 0.00 0.00 179.24 175.85 1ggm h ARG 366 N 0.81 0.44 -0.90 3.56 3.08 -1.56 -2.24 114.38 117.57 1ggm h ARG 366 Ca 0.36 -0.31 0.10 0.00 0.07 0.00 0.00 59.98 60.20 1ggm h ARG 366 Cb 0.25 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.29 1ggm h ARG 366 CO -0.21 0.93 0.58 0.78 -1.07 0.00 0.00 179.97 180.98 1ggm h GLY 367 N 1.21 1.31 0.66 0.04 0.00 0.58 0.17 103.07 107.04 1ggm h GLY 367 Ca -0.01 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 1ggm h GLY 367 CO 0.11 0.21 -0.01 -2.08 0.00 0.00 0.00 176.54 174.77 1ggm h VAL 368 N 0.90 1.30 -0.89 4.60 2.07 -0.94 -0.49 116.25 122.80 1ggm h VAL 368 Ca 0.42 -0.91 0.09 0.00 0.82 0.00 0.00 66.70 67.12 1ggm h VAL 368 Cb 0.41 1.82 -0.07 0.00 -1.52 0.00 0.00 31.29 31.93 1ggm h VAL 368 CO -0.18 0.24 0.53 -0.07 0.02 0.00 0.00 177.57 178.12 1ggm h LEU 369 N -0.28 0.79 0.00 2.57 3.38 -0.75 0.12 115.31 121.15 1ggm h LEU 369 Ca 0.01 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ggm h LEU 369 Cb 0.40 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1ggm h LEU 369 CO 0.00 0.46 0.00 0.00 0.09 0.00 0.00 178.44 178.99 1ggm n ALA 370 N -2.37 -0.46 -0.33 1.53 0.00 0.50 -0.58 120.51 118.80 1ggm n ALA 370 Ca 0.15 0.00 0.28 0.00 0.00 0.00 0.00 53.44 53.86 1ggm n ALA 370 Cb 0.27 0.02 0.53 0.00 0.00 0.00 0.00 19.45 20.27 1ggm n ALA 370 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ggm h LEU 371 N 0.00 0.43 0.29 0.00 3.38 -0.72 0.18 115.31 118.87 1ggm h LEU 371 Ca 0.00 0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1ggm h LEU 371 Cb 0.00 0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1ggm h LEU 371 CO 0.00 -0.25 -0.14 -0.07 0.09 0.00 0.00 178.44 178.07 1ggm h LEU 372 N 0.19 -0.32 -0.03 1.67 3.38 -0.69 -1.79 115.31 117.72 1ggm h LEU 372 Ca 0.78 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 58.59 1ggm h LEU 372 Cb 1.94 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 42.72 1ggm h LEU 372 CO -0.66 0.15 -0.51 0.00 0.09 0.00 0.00 178.44 177.52 1ggm h ALA 373 N -0.58 -0.86 -0.75 1.53 0.00 0.96 0.22 119.26 119.78 1ggm h ALA 373 Ca -0.04 -0.07 0.16 0.00 0.00 0.00 0.00 54.91 54.96 1ggm h ALA 373 Cb 0.50 0.91 -0.11 0.00 0.00 0.00 0.00 17.79 19.08 1ggm h ALA 373 CO 0.06 -1.07 0.21 1.49 0.00 0.00 0.00 179.25 179.95 1ggm h GLU 374 N -0.63 0.29 0.02 0.00 4.57 -0.81 -2.01 114.58 116.01 1ggm h GLU 374 Ca 0.03 -0.02 -0.21 0.00 -1.18 0.00 0.00 59.36 57.98 1ggm h GLU 374 Cb 0.70 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.21 1ggm h GLU 374 CO -0.37 0.19 -0.98 0.00 -1.18 0.00 0.00 179.01 176.68 1ggm h ALA 375 N 1.61 0.40 -1.31 2.92 0.00 -0.48 -3.30 119.26 119.09 1ggm h ALA 375 Ca 0.42 -0.84 -0.35 0.00 0.00 0.00 0.00 54.91 54.15 1ggm h ALA 375 Cb 0.72 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.41 1ggm h ALA 375 CO -0.50 1.09 1.26 0.12 0.00 0.00 0.00 179.25 181.22 1ggm s PHE 376 N -2.89 1.08 0.24 0.00 2.19 0.70 -1.49 117.98 117.81 1ggm s PHE 376 Ca -0.01 1.68 0.09 0.00 0.33 0.00 0.00 56.93 59.02 1ggm s PHE 376 Cb 0.10 -3.54 -0.04 0.00 -1.31 0.00 0.00 43.02 38.23 1ggm s PHE 376 CO 0.83 -2.30 -0.01 0.95 1.83 0.00 0.00 175.22 176.52 1ggm s THR 377 N 12.88 3.51 -0.38 0.12 -4.23 -0.91 -2.07 115.64 124.56 1ggm s THR 377 Ca 0.97 -1.76 0.12 0.00 -1.18 0.00 0.00 61.69 59.84 1ggm s THR 377 Cb -0.16 -2.84 0.43 0.00 1.34 0.00 0.00 72.50 71.27 1ggm s THR 377 CO 0.22 -0.29 0.97 -1.14 -0.54 0.00 0.00 174.62 173.84 1ggm n ARG 378 N -0.63 1.97 -1.14 3.99 0.63 -1.26 -0.38 116.66 119.84 1ggm n ARG 378 Ca -0.08 -3.77 -0.34 0.00 -0.92 0.00 0.00 57.85 52.74 1ggm n ARG 378 Cb 0.58 -1.68 0.11 0.00 0.45 0.00 0.00 32.46 31.91 1ggm n ARG 378 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1ggm n GLU 379 N -0.16 0.19 -3.92 -0.14 0.28 -1.21 -4.73 120.64 110.95 1ggm n GLU 379 Ca 0.22 0.13 -0.26 0.00 -0.16 0.00 0.00 57.16 57.09 1ggm n GLU 379 Cb 0.72 -2.18 -0.03 0.00 1.43 0.00 0.00 31.44 31.38 1ggm n GLU 379 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1ggm s GLU 380 N -3.61 3.45 -0.00 3.44 -6.30 -1.26 -2.49 118.70 111.92 1ggm s GLU 380 Ca 0.69 -0.58 0.03 0.00 -2.50 0.00 0.00 54.97 52.61 1ggm s GLU 380 Cb -0.30 -2.95 -0.01 0.00 0.00 0.00 0.00 34.13 30.87 1ggm s GLU 380 CO 0.55 0.51 -0.10 -0.48 0.02 0.00 0.00 175.26 175.75 1ggm s LEU 381 N -3.27 2.03 0.42 2.70 0.05 0.25 -4.92 118.68 115.95 1ggm s LEU 381 Ca 0.35 -0.21 0.02 0.00 0.05 0.00 0.00 54.13 54.34 1ggm s LEU 381 Cb -0.11 -0.52 0.08 0.00 -2.05 0.00 0.00 46.19 43.59 1ggm s LEU 381 CO 0.29 0.11 0.67 -0.81 -0.55 0.00 0.00 176.35 176.06 1ggm n PRO 382 N 2.75 0.02 0.00 1.48 -0.04 -1.26 0.18 135.00 138.12 1ggm n PRO 382 Ca -0.14 0.62 0.01 0.00 -0.04 0.00 0.00 63.50 63.95 1ggm n PRO 382 Cb 0.56 -1.66 0.03 0.00 -0.04 0.00 0.00 33.50 32.40 1ggm n PRO 382 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ggm n ASN 383 N -1.90 0.00 0.00 3.54 4.13 -1.26 -4.73 115.26 115.04 1ggm n ASN 383 Ca 0.02 -1.41 0.00 0.00 1.68 0.00 0.00 54.58 54.87 1ggm n ASN 383 Cb 0.70 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.94 1ggm n ASN 383 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ggm n GLY 384 N 0.23 0.20 2.74 7.41 0.00 0.47 -4.95 105.19 111.29 1ggm n GLY 384 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 1ggm n GLY 384 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ggm n GLU 385 N -0.60 0.91 -4.21 1.61 -0.58 -0.61 -4.90 120.64 112.28 1ggm n GLU 385 Ca 0.00 -2.49 -0.16 0.00 -0.42 0.00 0.00 57.16 54.09 1ggm n GLU 385 Cb 0.28 0.29 -0.11 0.00 -0.57 0.00 0.00 31.44 31.33 1ggm n GLU 385 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 1ggm s GLU 386 N -3.61 0.92 -0.01 3.49 -1.05 -1.26 0.88 118.70 118.07 1ggm s GLU 386 Ca 0.21 -1.18 0.02 0.00 -0.15 0.00 0.00 54.97 53.88 1ggm s GLU 386 Cb -0.02 -0.72 -0.01 0.00 -0.44 0.00 0.00 34.13 32.95 1ggm s GLU 386 CO 0.14 0.13 -0.08 -0.98 0.95 0.00 0.00 175.26 175.42 1ggm s ARG 387 N -2.67 0.65 -0.07 -4.83 1.70 -1.04 -4.93 118.95 107.78 1ggm s ARG 387 Ca 0.06 -0.28 -0.15 0.00 -0.47 0.00 0.00 55.73 54.89 1ggm s ARG 387 Cb -0.04 -0.63 -0.05 0.00 -0.57 0.00 0.00 34.95 33.66 1ggm s ARG 387 CO 0.02 0.16 0.39 0.42 -1.08 0.00 0.00 175.30 175.21 1ggm s ILE 388 N -0.15 5.15 -0.24 4.99 1.09 -1.26 -3.35 121.20 127.42 1ggm s ILE 388 Ca 0.03 0.78 -0.02 0.00 -1.10 0.00 0.00 60.65 60.33 1ggm s ILE 388 Cb -0.03 -3.71 0.07 0.00 -1.06 0.00 0.00 42.46 37.73 1ggm s ILE 388 CO -0.00 0.48 0.05 -0.69 -0.10 0.00 0.00 174.94 174.68 1ggm s VAL 389 N -0.34 0.74 -0.13 2.92 1.01 0.48 -4.10 120.40 121.00 1ggm s VAL 389 Ca 0.22 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 1ggm s VAL 389 Cb -0.15 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 1ggm s VAL 389 CO 0.10 -0.37 1.45 -0.76 0.00 0.00 0.00 175.10 175.52 1ggm s LEU 390 N 1.73 4.21 -0.84 3.92 1.43 -0.34 -2.14 118.68 126.64 1ggm s LEU 390 Ca 0.02 1.90 0.01 0.00 -1.03 0.00 0.00 54.13 55.04 1ggm s LEU 390 Cb -0.17 -3.54 0.32 0.00 0.03 0.00 0.00 46.19 42.83 1ggm s LEU 390 CO -0.15 -0.87 1.36 0.29 0.23 0.00 0.00 176.35 177.21 1ggm n LYS 391 N 6.91 4.24 -1.77 1.70 5.02 -0.56 -3.85 118.16 129.86 1ggm n LYS 391 Ca 0.16 -4.72 -0.33 0.00 -2.02 0.00 0.00 58.31 51.39 1ggm n LYS 391 Cb 0.44 -2.37 0.05 0.00 -0.02 0.00 0.00 35.03 33.12 1ggm n LYS 391 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ggm s LEU 392 N -3.61 3.40 -0.14 -0.35 1.43 -1.26 -4.75 118.68 113.40 1ggm s LEU 392 Ca 0.41 2.02 -0.29 0.00 -1.03 0.00 0.00 54.13 55.25 1ggm s LEU 392 Cb 0.20 -4.55 -0.06 0.00 0.03 0.00 0.00 46.19 41.80 1ggm s LEU 392 CO -0.08 -1.63 1.99 -0.75 0.23 0.00 0.00 176.35 176.10 1ggm s LYS 393 N -4.05 3.61 0.11 1.70 2.20 -1.26 -4.79 119.74 117.26 1ggm s LYS 393 Ca 0.67 2.12 -0.09 0.00 -0.36 0.00 0.00 55.97 58.32 1ggm s LYS 393 Cb -0.21 -4.23 0.11 0.00 -1.51 0.00 0.00 37.83 31.99 1ggm s LYS 393 CO 0.41 -1.55 0.75 -0.35 -0.36 0.00 0.00 175.35 174.25 1ggm n PRO 394 N 8.11 -0.12 0.09 4.03 -0.04 -1.26 0.11 135.00 145.92 1ggm n PRO 394 Ca 0.24 0.74 0.05 0.00 -0.04 0.00 0.00 63.50 64.49 1ggm n PRO 394 Cb 0.44 -1.10 0.24 0.00 -0.04 0.00 0.00 33.50 33.04 1ggm n PRO 394 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1ggm n GLN 395 N -4.70 0.06 -0.00 0.54 3.00 -1.26 -0.39 117.38 114.62 1ggm n GLN 395 Ca 0.05 0.49 0.02 0.00 -0.01 0.00 0.00 57.00 57.56 1ggm n GLN 395 Cb 0.19 -1.85 0.02 0.00 0.00 0.00 0.00 30.24 28.60 1ggm n GLN 395 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1ggm n LEU 396 N -1.78 1.42 -4.75 1.08 4.77 0.30 -5.04 117.00 113.00 1ggm n LEU 396 Ca -0.01 -1.01 -0.38 0.00 -0.03 0.00 0.00 56.01 54.59 1ggm n LEU 396 Cb 0.17 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.29 1ggm n LEU 396 CO 0.04 0.30 0.93 0.00 -1.33 0.00 0.00 177.39 177.33 1ggm s ALA 397 N -0.42 2.78 0.30 -1.18 0.00 0.47 -4.66 121.76 119.04 1ggm s ALA 397 Ca 0.06 1.21 0.02 0.00 0.00 0.00 0.00 51.96 53.25 1ggm s ALA 397 Cb 0.04 -3.52 0.58 0.00 0.00 0.00 0.00 23.12 20.22 1ggm s ALA 397 CO 0.06 -1.23 1.86 -1.35 0.00 0.00 0.00 175.76 175.10 1ggm h PRO 398 N 1.43 0.94 -4.87 0.00 0.11 -1.85 -3.40 132.00 124.36 1ggm h PRO 398 Ca -0.51 -0.06 -0.57 0.00 0.11 0.00 0.00 66.00 64.98 1ggm h PRO 398 Cb 1.29 -0.21 -0.33 0.00 0.11 0.00 0.00 31.00 31.86 1ggm h PRO 398 CO 0.57 0.62 -0.84 0.42 -0.21 0.00 0.00 178.00 178.57 1ggm s ILE 399 N -5.91 1.43 -0.04 4.15 1.01 -1.26 -4.78 121.20 115.81 1ggm s ILE 399 Ca -0.12 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 59.84 1ggm s ILE 399 Cb 0.22 -1.27 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 1ggm s ILE 399 CO 0.80 0.42 0.22 0.11 0.00 0.00 0.00 174.94 176.50 1ggm h LYS 400 N 6.80 -0.12 -6.52 2.79 6.56 -1.34 -3.33 116.57 121.42 1ggm h LYS 400 Ca -0.28 0.01 -0.69 0.00 -1.06 0.00 0.00 60.65 58.63 1ggm h LYS 400 Cb 1.20 0.03 -0.26 0.00 -0.57 0.00 0.00 32.23 32.63 1ggm h LYS 400 CO 0.47 -0.08 -0.83 0.08 -2.06 0.00 0.00 179.45 177.03 1ggm s VAL 401 N -1.86 2.53 -0.25 0.50 1.01 -1.21 -1.86 120.40 119.26 1ggm s VAL 401 Ca -0.02 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 60.96 1ggm s VAL 401 Cb 0.00 -1.96 0.06 0.00 0.00 0.00 0.00 36.38 34.48 1ggm s VAL 401 CO 0.05 0.52 -0.08 0.00 0.00 0.00 0.00 175.10 175.60 1ggm s ALA 402 N -0.72 2.25 -0.31 5.51 0.00 0.21 -0.31 121.76 128.38 1ggm s ALA 402 Ca 0.11 -1.55 -0.28 0.00 0.00 0.00 0.00 51.96 50.24 1ggm s ALA 402 Cb -0.10 -1.51 0.01 0.00 0.00 0.00 0.00 23.12 21.52 1ggm s ALA 402 CO 0.01 -1.20 1.02 0.08 0.00 0.00 0.00 175.76 175.67 1ggm s VAL 403 N 1.25 4.57 -0.18 0.00 1.01 0.86 -1.51 120.40 126.41 1ggm s VAL 403 Ca -0.07 1.65 0.00 0.00 0.00 0.00 0.00 61.98 63.56 1ggm s VAL 403 Cb -0.19 -4.36 0.01 0.00 0.00 0.00 0.00 36.38 31.84 1ggm s VAL 403 CO -0.06 -0.42 -0.17 -0.63 0.00 0.00 0.00 175.10 173.82 1ggm s ILE 404 N 3.50 2.33 0.16 2.22 1.01 0.31 -1.61 121.20 129.11 1ggm s ILE 404 Ca 0.43 -0.86 -0.30 0.00 0.00 0.00 0.00 60.65 59.92 1ggm s ILE 404 Cb -0.13 -1.99 -0.07 0.00 0.01 0.00 0.00 42.46 40.28 1ggm s ILE 404 CO 0.14 0.52 0.99 -2.16 0.00 0.00 0.00 174.94 174.43 1ggm s PRO 405 N 1.23 4.71 0.12 2.79 0.04 -1.26 0.48 135.00 143.11 1ggm s PRO 405 Ca 0.03 1.53 -0.13 0.00 0.04 0.00 0.00 61.00 62.47 1ggm s PRO 405 Cb -0.14 -3.33 -0.08 0.00 0.04 0.00 0.00 34.50 30.99 1ggm s PRO 405 CO -0.09 0.26 1.42 1.25 0.04 0.00 0.00 177.00 179.88 1ggm h LEU 406 N 5.10 0.92 -8.30 -3.56 5.85 -0.21 -3.42 115.31 111.68 1ggm h LEU 406 Ca -0.44 -0.50 -0.67 0.00 0.84 0.00 0.00 57.88 57.11 1ggm h LEU 406 Cb 1.21 -0.26 -0.32 0.00 0.37 0.00 0.00 40.66 41.66 1ggm h LEU 406 CO 0.71 1.24 -0.82 -0.69 -0.34 0.00 0.00 178.44 178.54 1ggm s VAL 407 N -4.24 2.47 -1.16 1.05 1.01 -1.26 -4.88 120.40 113.39 1ggm s VAL 407 Ca -0.11 -0.83 0.21 0.00 0.00 0.00 0.00 61.98 61.25 1ggm s VAL 407 Cb 0.10 -2.03 0.25 0.00 0.00 0.00 0.00 36.38 34.70 1ggm s VAL 407 CO 0.87 0.52 1.69 0.29 0.00 0.00 0.00 175.10 178.47 1ggm n LYS 408 N 4.13 0.12 0.00 2.72 4.01 -1.26 -4.03 118.16 123.84 1ggm n LYS 408 Ca -0.19 0.11 0.00 0.00 -0.51 0.00 0.00 58.31 57.72 1ggm n LYS 408 Cb 0.51 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.53 1ggm n LYS 408 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1ggm n ASN 409 N -1.42 0.00 -4.51 4.39 6.94 -1.26 -4.72 115.26 114.68 1ggm n ASN 409 Ca 0.07 0.61 -0.37 0.00 -0.02 0.00 0.00 54.58 54.87 1ggm n ASN 409 Cb 0.22 -0.42 -0.13 0.00 -2.36 0.00 0.00 39.78 37.09 1ggm n ASN 409 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1ggm n ARG 410 N -1.75 0.25 0.29 -3.83 5.12 -1.26 -4.78 116.66 110.70 1ggm n ARG 410 Ca 0.00 -0.03 0.16 0.00 -1.93 0.00 0.00 57.85 56.05 1ggm n ARG 410 Cb 0.00 -1.95 0.91 0.00 -1.16 0.00 0.00 32.46 30.26 1ggm n ARG 410 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1ggm h PRO 411 N 13.59 0.00 -0.01 5.56 0.13 -1.91 -0.56 132.00 148.81 1ggm h PRO 411 Ca -0.08 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.93 1ggm h PRO 411 Cb 1.27 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 1ggm h PRO 411 CO 1.35 0.04 -0.58 0.93 -0.23 0.00 0.00 178.00 179.51 1ggm h GLU 412 N 0.00 0.02 0.24 0.86 3.07 -1.99 -1.79 114.58 115.00 1ggm h GLU 412 Ca -0.00 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.83 1ggm h GLU 412 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1ggm h GLU 412 CO 0.01 0.59 -0.12 0.82 -1.40 0.00 0.00 179.01 178.91 1ggm h ILE 413 N 0.02 0.00 -0.73 3.13 2.04 -1.49 -2.97 117.51 117.50 1ggm h ILE 413 Ca -0.01 -0.44 0.16 0.00 1.00 0.00 0.00 64.86 65.58 1ggm h ILE 413 Cb 1.03 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.99 1ggm h ILE 413 CO 0.08 0.00 0.10 0.71 0.00 0.00 0.00 178.15 179.04 1ggm h THR 414 N -0.76 0.44 -0.47 -0.27 1.35 -1.42 0.42 112.91 112.20 1ggm h THR 414 Ca -0.03 -0.06 0.06 0.00 -0.55 0.00 0.00 66.41 65.82 1ggm h THR 414 Cb 0.25 0.24 -0.05 0.00 -1.73 0.00 0.00 68.15 66.85 1ggm h THR 414 CO 0.06 0.03 0.18 -0.08 -0.25 0.00 0.00 175.52 175.45 1ggm h GLU 415 N 0.19 0.34 -0.48 4.72 4.22 -1.45 0.36 114.58 122.48 1ggm h GLU 415 Ca 0.41 -0.02 0.05 0.00 0.08 0.00 0.00 59.36 59.88 1ggm h GLU 415 Cb 0.72 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.84 1ggm h GLU 415 CO -0.57 0.23 0.21 -0.92 -2.18 0.00 0.00 179.01 175.77 1ggm h TYR 416 N 0.35 0.37 0.22 0.92 5.03 -0.11 0.15 116.97 123.90 1ggm h TYR 416 Ca 0.22 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.55 1ggm h TYR 416 Cb 0.22 -0.10 -0.00 0.00 1.55 0.00 0.00 36.73 38.40 1ggm h TYR 416 CO -0.15 0.16 -0.17 0.00 -1.32 0.00 0.00 178.16 176.68 1ggm h ALA 417 N 1.29 -0.95 -1.14 1.82 0.00 0.16 -0.05 119.26 120.39 1ggm h ALA 417 Ca 0.22 -0.07 0.32 0.00 0.00 0.00 0.00 54.91 55.37 1ggm h ALA 417 Cb 0.18 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.25 1ggm h ALA 417 CO -0.19 -0.95 0.78 0.87 0.00 0.00 0.00 179.25 179.76 1ggm h LYS 418 N -0.37 0.15 -0.35 0.00 1.57 -0.20 0.54 116.57 117.91 1ggm h LYS 418 Ca -0.03 -0.01 -0.17 0.00 -1.87 0.00 0.00 60.65 58.57 1ggm h LYS 418 Cb 0.31 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1ggm h LYS 418 CO 0.01 0.10 -0.43 -0.09 -0.57 0.00 0.00 179.45 178.46 1ggm h ARG 419 N 0.15 0.92 -0.17 3.15 2.43 -0.22 -3.15 114.38 117.49 1ggm h ARG 419 Ca 0.59 -0.51 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1ggm h ARG 419 Cb 1.99 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.57 1ggm h ARG 419 CO -0.14 1.16 -0.03 1.25 -1.51 0.00 0.00 179.97 180.70 1ggm h LEU 420 N 0.72 0.32 -0.88 3.80 5.85 0.20 -2.94 115.31 122.38 1ggm h LEU 420 Ca 0.05 -0.36 0.23 0.00 0.84 0.00 0.00 57.88 58.63 1ggm h LEU 420 Cb 1.04 -0.09 -0.16 0.00 0.37 0.00 0.00 40.66 41.82 1ggm h LEU 420 CO 0.10 0.61 0.07 0.50 -0.34 0.00 0.00 178.44 179.38 1ggm h LYS 421 N 0.04 0.09 0.43 1.25 3.64 -1.29 0.25 116.57 120.97 1ggm h LYS 421 Ca 0.04 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1ggm h LYS 421 Cb 0.46 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1ggm h LYS 421 CO 0.02 0.06 -0.38 0.00 -2.27 0.00 0.00 179.45 176.87 1ggm h ALA 422 N 1.84 -0.85 -0.96 5.00 0.00 -1.47 0.09 119.26 122.91 1ggm h ALA 422 Ca 0.53 -0.14 0.19 0.00 0.00 0.00 0.00 54.91 55.48 1ggm h ALA 422 Cb 1.03 0.53 -0.11 0.00 0.00 0.00 0.00 17.79 19.25 1ggm h ALA 422 CO -0.77 -1.01 0.55 -0.09 0.00 0.00 0.00 179.25 177.93 1ggm h ARG 423 N -0.81 0.67 -0.11 0.00 2.43 -0.95 -1.17 114.38 114.45 1ggm h ARG 423 Ca -0.04 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 58.97 1ggm h ARG 423 Cb 0.71 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 1ggm h ARG 423 CO -0.04 0.44 -0.41 -0.07 -1.51 0.00 0.00 179.97 178.38 1ggm h LEU 424 N 0.69 0.55 -1.26 3.80 3.38 -0.90 -3.05 115.31 118.52 1ggm h LEU 424 Ca 0.56 -0.63 0.11 0.00 0.09 0.00 0.00 57.88 58.01 1ggm h LEU 424 Cb 0.88 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.41 1ggm h LEU 424 CO -0.40 1.08 0.56 0.25 0.09 0.00 0.00 178.44 180.02 1ggm h LEU 425 N 0.05 0.72 -1.79 1.67 5.85 -0.14 -0.48 115.31 121.20 1ggm h LEU 425 Ca -0.02 0.03 0.16 0.00 0.84 0.00 0.00 57.88 58.89 1ggm h LEU 425 Cb 1.05 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 1ggm h LEU 425 CO 0.09 0.41 0.47 0.00 -0.34 0.00 0.00 178.44 179.07 1ggm h ALA 426 N 1.58 2.34 0.00 1.25 0.00 -1.13 0.83 119.26 124.13 1ggm h ALA 426 Ca 0.41 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 1ggm h ALA 426 Cb 0.52 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ggm h ALA 426 CO -0.18 -0.53 -0.03 -0.07 0.00 0.00 0.00 179.25 178.44 1ggm h LEU 427 N 0.21 0.00 0.29 0.00 3.38 -1.12 -3.45 115.31 114.62 1ggm h LEU 427 Ca 0.33 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.05 1ggm h LEU 427 Cb 1.00 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.80 1ggm h LEU 427 CO -0.06 0.03 -0.38 0.61 0.09 0.00 0.00 178.44 178.73 1ggm n GLY 428 N -0.80 -0.06 0.02 0.83 0.00 0.29 -4.88 105.19 100.60 1ggm n GLY 428 Ca -0.02 -0.20 0.13 0.00 0.00 0.00 0.00 46.02 45.92 1ggm n GLY 428 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ggm n LEU 429 N -2.67 0.45 0.00 0.99 4.77 -1.26 -5.01 117.00 114.27 1ggm n LEU 429 Ca -0.06 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1ggm n LEU 429 Cb 0.57 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1ggm n LEU 429 CO 0.30 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1ggm n GLY 430 N 1.44 1.59 3.70 -0.72 0.00 -1.26 -4.83 105.19 105.11 1ggm n GLY 430 Ca 0.05 -1.90 -0.43 0.00 0.00 0.00 0.00 46.02 43.73 1ggm n GLY 430 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ggm n ARG 431 N -1.97 2.28 -4.32 1.61 0.63 -1.26 -4.76 116.66 108.88 1ggm n ARG 431 Ca 0.00 0.81 -0.29 0.00 -0.92 0.00 0.00 57.85 57.45 1ggm n ARG 431 Cb 0.00 -2.51 -0.11 0.00 0.45 0.00 0.00 32.46 30.29 1ggm n ARG 431 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1ggm s VAL 432 N -0.13 2.79 -0.03 5.15 1.01 -1.26 -1.10 120.40 126.83 1ggm s VAL 432 Ca 0.66 -1.57 0.04 0.00 0.00 0.00 0.00 61.98 61.11 1ggm s VAL 432 Cb -0.59 -2.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 1ggm s VAL 432 CO 0.50 0.07 -0.16 -0.22 0.00 0.00 0.00 175.10 175.29 1ggm s LEU 433 N -2.23 1.96 -1.15 3.92 2.96 0.58 -4.96 118.68 119.76 1ggm s LEU 433 Ca 0.18 -0.31 -0.12 0.00 -0.22 0.00 0.00 54.13 53.67 1ggm s LEU 433 Cb -0.10 -0.86 0.22 0.00 0.50 0.00 0.00 46.19 45.95 1ggm s LEU 433 CO 0.10 0.17 1.26 -0.47 -1.32 0.00 0.00 176.35 176.09 1ggm s TYR 434 N -0.15 3.88 -0.13 5.38 5.04 -1.26 -0.10 117.35 130.01 1ggm s TYR 434 Ca 0.01 -2.40 -0.29 0.00 -2.44 0.00 0.00 57.07 51.95 1ggm s TYR 434 Cb -0.09 -4.08 -0.02 0.00 0.35 0.00 0.00 41.96 38.12 1ggm s TYR 434 CO 0.01 -1.17 1.31 -2.00 -1.34 0.00 0.00 175.55 172.36 1ggm s GLU 435 N 0.18 4.24 -0.06 4.97 2.56 -0.63 -4.89 118.70 125.07 1ggm s GLU 435 Ca 0.36 1.75 0.09 0.00 0.00 0.00 0.00 54.97 57.17 1ggm s GLU 435 Cb -0.06 -3.76 0.21 0.00 2.00 0.00 0.00 34.13 32.51 1ggm s GLU 435 CO -0.04 -0.69 1.14 -0.40 -0.56 0.00 0.00 175.26 174.71 1ggm n ASP 436 N 6.47 2.52 -4.68 -1.70 5.68 -1.26 -4.09 116.55 119.49 1ggm n ASP 436 Ca 0.14 -2.42 -0.43 0.00 -0.50 0.00 0.00 54.79 51.58 1ggm n ASP 436 Cb 0.45 -0.23 -0.02 0.00 -1.14 0.00 0.00 41.12 40.17 1ggm n ASP 436 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1ggm s THR 437 N -1.74 4.52 0.00 2.12 2.01 -1.26 -4.98 115.64 116.31 1ggm s THR 437 Ca 0.18 1.82 0.00 0.00 0.31 0.00 0.00 61.69 64.01 1ggm s THR 437 Cb 0.14 -4.17 0.00 0.00 0.01 0.00 0.00 72.50 68.48 1ggm s THR 437 CO 0.05 -0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.52 1ggm n GLY 438 N 3.32 0.00 3.68 4.40 0.00 -1.26 -4.36 105.19 110.97 1ggm n GLY 438 Ca 0.11 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.60 1ggm n GLY 438 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ggm n ASN 439 N 0.00 2.73 0.16 1.61 2.85 -1.26 -4.82 115.26 116.54 1ggm n ASN 439 Ca 0.00 1.04 0.06 0.00 -0.11 0.00 0.00 54.58 55.57 1ggm n ASN 439 Cb 0.00 -1.25 0.52 0.00 1.24 0.00 0.00 39.78 40.29 1ggm n ASN 439 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 1ggm h ILE 440 N 4.98 1.08 -0.47 -1.44 6.09 -1.90 0.58 117.51 126.43 1ggm h ILE 440 Ca -0.47 -0.27 -0.07 0.00 -1.37 0.00 0.00 64.86 62.68 1ggm h ILE 440 Cb 1.30 0.95 -0.02 0.00 0.47 0.00 0.00 36.82 39.52 1ggm h ILE 440 CO 0.93 0.09 0.02 1.23 -3.07 0.00 0.00 178.15 177.35 1ggm h GLY 441 N 0.34 0.82 0.86 8.18 0.00 -1.93 0.49 103.07 111.83 1ggm h GLY 441 Ca 0.05 -0.53 -0.13 0.00 0.00 0.00 0.00 47.33 46.72 1ggm h GLY 441 CO -0.00 0.49 -0.41 1.70 0.00 0.00 0.00 176.54 178.31 1ggm h LYS 442 N 0.72 0.51 0.61 4.80 3.11 -0.83 -2.35 116.57 123.13 1ggm h LYS 442 Ca 0.14 -0.38 -0.02 0.00 -2.81 0.00 0.00 60.65 57.59 1ggm h LYS 442 Cb 0.41 0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.69 1ggm h LYS 442 CO 0.02 1.00 -0.45 0.00 -2.81 0.00 0.00 179.45 177.20 1ggm h ALA 443 N 0.52 -1.08 -0.67 5.00 0.00 0.69 0.99 119.26 124.71 1ggm h ALA 443 Ca -0.01 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 54.80 1ggm h ALA 443 Cb 1.04 0.59 -0.12 0.00 0.00 0.00 0.00 17.79 19.30 1ggm h ALA 443 CO 0.09 -1.13 -0.41 1.88 0.00 0.00 0.00 179.25 179.67 1ggm h TYR 444 N -1.02 -1.20 0.33 0.00 0.05 -0.08 -1.85 116.97 113.21 1ggm h TYR 444 Ca -0.07 0.09 -0.00 0.00 0.05 0.00 0.00 58.73 58.79 1ggm h TYR 444 Cb 0.85 0.62 -0.03 0.00 1.01 0.00 0.00 36.73 39.18 1ggm h TYR 444 CO -0.16 -0.41 -0.46 -0.09 -1.05 0.00 0.00 178.16 175.99 1ggm h ARG 445 N -0.17 -0.79 -0.93 4.88 9.65 -0.97 -2.28 114.38 123.77 1ggm h ARG 445 Ca 0.22 0.05 0.26 0.00 -1.10 0.00 0.00 59.98 59.41 1ggm h ARG 445 Cb 0.56 0.18 -0.17 0.00 -1.39 0.00 0.00 29.97 29.15 1ggm h ARG 445 CO -0.75 -0.53 0.05 -2.13 2.80 0.00 0.00 179.97 179.41 1ggm n ARG 446 N -5.17 -0.07 -0.17 0.20 0.63 0.30 -0.39 116.66 111.99 1ggm n ARG 446 Ca -0.10 1.39 -0.06 0.00 -0.92 0.00 0.00 57.85 58.16 1ggm n ARG 446 Cb 0.40 -2.22 0.10 0.00 0.45 0.00 0.00 32.46 31.18 1ggm n ARG 446 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1ggm h HIS 447 N 0.00 1.02 -0.03 -0.14 3.86 -0.79 -2.44 115.15 116.63 1ggm h HIS 447 Ca 0.58 -0.15 -0.13 0.00 -1.16 0.00 0.00 60.37 59.51 1ggm h HIS 447 Cb 1.22 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 29.40 1ggm h HIS 447 CO -0.44 0.90 -0.59 -0.44 0.86 0.00 0.00 177.93 178.22 1ggm h ASP 448 N 0.89 0.11 0.55 2.45 3.32 -0.44 -0.67 116.42 122.62 1ggm h ASP 448 Ca 0.17 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.12 1ggm h ASP 448 Cb 0.47 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1ggm h ASP 448 CO 0.02 0.67 -0.21 -0.33 -1.72 0.00 0.00 179.24 177.67 1ggm h GLU 449 N 0.07 0.00 -0.44 3.56 5.08 -0.96 -0.68 114.58 121.21 1ggm h GLU 449 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1ggm h GLU 449 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1ggm h GLU 449 CO 0.08 0.21 0.00 1.33 -1.00 0.00 0.00 179.01 179.63 1ggm n VAL 450 N -3.64 2.15 -4.15 3.13 0.24 -0.81 -4.35 118.33 110.89 1ggm n VAL 450 Ca -0.01 -1.49 -0.32 0.00 -2.04 0.00 0.00 64.34 60.47 1ggm n VAL 450 Cb 0.34 -0.08 -0.03 0.00 -1.47 0.00 0.00 33.84 32.60 1ggm n VAL 450 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ggm n GLY 451 N 0.29 -0.35 3.72 7.63 0.00 -0.33 -4.45 105.19 111.71 1ggm n GLY 451 Ca 0.23 0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.99 1ggm n GLY 451 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ggm s THR 452 N -3.60 4.95 0.34 2.61 -4.23 -0.79 -4.49 115.64 110.43 1ggm s THR 452 Ca 0.44 1.66 0.02 0.00 -1.18 0.00 0.00 61.69 62.64 1ggm s THR 452 Cb -0.24 -4.14 0.22 0.00 1.34 0.00 0.00 72.50 69.68 1ggm s THR 452 CO 0.92 0.24 1.95 1.55 -0.54 0.00 0.00 174.62 178.74 1ggm h PRO 453 N 6.63 0.76 -3.49 3.99 0.13 -1.65 -3.43 132.00 134.94 1ggm h PRO 453 Ca -0.41 -0.09 -0.30 0.00 -0.87 0.00 0.00 66.00 64.33 1ggm h PRO 453 Cb 1.21 -0.15 -0.34 0.00 0.13 0.00 0.00 31.00 31.85 1ggm h PRO 453 CO 0.75 0.59 -0.72 -0.06 -0.23 0.00 0.00 178.00 178.32 1ggm s PHE 454 N -5.46 0.02 -0.40 1.56 0.08 -0.78 -2.89 117.98 110.11 1ggm s PHE 454 Ca -0.09 0.17 -0.04 0.00 0.12 0.00 0.00 56.93 57.08 1ggm s PHE 454 Cb 0.17 -0.24 0.10 0.00 -0.57 0.00 0.00 43.02 42.47 1ggm s PHE 454 CO 0.77 -0.10 0.20 0.00 -0.10 0.00 0.00 175.22 175.98 1ggm s ALA 455 N 1.15 3.15 -0.24 5.36 0.00 -1.03 -0.62 121.76 129.54 1ggm s ALA 455 Ca -0.08 -2.34 -0.20 0.00 0.00 0.00 0.00 51.96 49.34 1ggm s ALA 455 Cb -0.13 -2.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.54 1ggm s ALA 455 CO -0.03 -1.70 0.60 0.08 0.00 0.00 0.00 175.76 174.70 1ggm s VAL 456 N 1.23 5.02 -0.10 0.00 1.01 -0.57 -1.64 120.40 125.35 1ggm s VAL 456 Ca 0.05 1.07 -0.02 0.00 0.00 0.00 0.00 61.98 63.08 1ggm s VAL 456 Cb -0.23 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 1ggm s VAL 456 CO -0.02 0.06 -0.02 0.28 0.00 0.00 0.00 175.10 175.41 1ggm s THR 457 N 2.30 4.15 -0.23 3.92 -1.32 0.34 -0.53 115.64 124.27 1ggm s THR 457 Ca 0.25 -0.30 -0.05 0.00 -1.21 0.00 0.00 61.69 60.38 1ggm s THR 457 Cb -0.16 -2.76 -0.02 0.00 -1.51 0.00 0.00 72.50 68.06 1ggm s THR 457 CO 0.09 0.58 0.01 -0.69 -2.21 0.00 0.00 174.62 172.39 1ggm s VAL 458 N -0.58 3.78 0.20 5.08 1.01 0.18 -3.09 120.40 126.98 1ggm s VAL 458 Ca 0.09 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.73 1ggm s VAL 458 Cb -0.12 -2.74 0.02 0.00 0.00 0.00 0.00 36.38 33.53 1ggm s VAL 458 CO 0.02 0.38 0.13 -0.90 0.00 0.00 0.00 175.10 174.73 1ggm n ASP 459 N 4.85 1.75 0.36 3.32 5.68 -1.26 0.60 116.55 131.85 1ggm n ASP 459 Ca -0.17 -1.71 -0.18 0.00 -0.50 0.00 0.00 54.79 52.23 1ggm n ASP 459 Cb 0.51 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.41 1ggm n ASP 459 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 1ggm h TYR 460 N 0.63 -0.83 -0.89 2.11 0.05 -1.99 -2.88 116.97 113.17 1ggm h TYR 460 Ca -0.13 -0.02 0.35 0.00 0.05 0.00 0.00 58.73 58.98 1ggm h TYR 460 Cb 0.47 0.27 -0.16 0.00 1.01 0.00 0.00 36.73 38.32 1ggm h TYR 460 CO 0.00 -0.50 0.39 -0.25 -1.05 0.00 0.00 178.16 176.74 1ggm n ASP 461 N -5.46 0.23 -0.03 3.88 8.00 -1.25 0.36 116.55 122.28 1ggm n ASP 461 Ca -0.13 1.48 -0.09 0.00 0.71 0.00 0.00 54.79 56.76 1ggm n ASP 461 Cb 0.37 -0.69 -0.03 0.00 -0.02 0.00 0.00 41.12 40.75 1ggm n ASP 461 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1ggm h THR 462 N 0.00 0.86 0.17 -3.53 2.02 -1.69 -3.21 112.91 107.53 1ggm h THR 462 Ca 0.71 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.87 1ggm h THR 462 Cb 1.82 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 1ggm h THR 462 CO -0.72 0.01 -0.08 0.16 0.37 0.00 0.00 175.52 175.26 1ggm h ILE 463 N 0.04 0.94 0.00 3.11 3.07 -0.17 0.47 117.51 124.98 1ggm h ILE 463 Ca 0.08 -0.65 0.00 0.00 1.55 0.00 0.00 64.86 65.84 1ggm h ILE 463 Cb 0.11 1.33 0.00 0.00 -0.27 0.00 0.00 36.82 37.99 1ggm h ILE 463 CO -0.15 0.15 0.00 0.61 -1.05 0.00 0.00 178.15 177.71 1ggm n GLY 464 N -0.30 -0.20 2.85 0.16 0.00 -1.06 -4.84 105.19 101.81 1ggm n GLY 464 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 1ggm n GLY 464 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1ggm n GLN 465 N 0.00 1.87 -3.82 1.61 7.27 -1.24 -5.04 117.38 118.04 1ggm n GLN 465 Ca 0.00 -4.49 -0.36 0.00 0.07 0.00 0.00 57.00 52.22 1ggm n GLN 465 Cb 0.00 -2.28 -0.13 0.00 2.41 0.00 0.00 30.24 30.25 1ggm n GLN 465 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 1ggm s SER 466 N -1.54 5.02 0.32 1.69 1.04 -1.26 -3.76 113.70 115.21 1ggm s SER 466 Ca 0.26 -0.22 0.09 0.00 0.48 0.00 0.00 55.95 56.57 1ggm s SER 466 Cb -0.02 -1.89 0.92 0.00 0.10 0.00 0.00 66.02 65.12 1ggm s SER 466 CO -0.16 -0.01 1.66 0.07 0.98 0.00 0.00 173.24 175.78 1ggm h LYS 467 N 8.08 0.29 -0.40 4.02 -0.00 -1.96 0.80 116.57 127.40 1ggm h LYS 467 Ca -0.38 -0.02 0.00 0.00 -0.00 0.00 0.00 60.65 60.25 1ggm h LYS 467 Cb 1.17 -0.07 0.00 0.00 -0.00 0.00 0.00 32.23 33.34 1ggm h LYS 467 CO 0.59 0.19 0.00 -0.40 -0.00 0.00 0.00 179.45 179.83 1ggm n ASP 468 N -5.11 0.40 0.00 7.07 5.75 -1.26 -4.88 116.55 118.52 1ggm n ASP 468 Ca 0.27 -1.76 0.00 0.00 -0.01 0.00 0.00 54.79 53.29 1ggm n ASP 468 Cb 0.84 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.73 1ggm n ASP 468 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ggm n GLY 469 N 0.23 0.45 3.61 6.12 0.00 0.28 -4.92 105.19 110.96 1ggm n GLY 469 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.46 1ggm n GLY 469 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ggm n THR 470 N 0.00 0.07 -0.98 2.61 -2.24 -1.26 -4.73 114.28 107.74 1ggm n THR 470 Ca 0.00 -0.01 -0.16 0.00 -2.27 0.00 0.00 64.05 61.61 1ggm n THR 470 Cb 0.00 -0.72 -0.01 0.00 -2.10 0.00 0.00 70.33 67.50 1ggm n THR 470 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ggm n THR 471 N 2.88 2.81 0.00 4.28 -2.24 -1.26 -4.44 114.28 116.32 1ggm n THR 471 Ca 0.21 -1.78 -0.12 0.00 -2.27 0.00 0.00 64.05 60.10 1ggm n THR 471 Cb 0.14 -1.49 0.00 0.00 -2.10 0.00 0.00 70.33 66.88 1ggm n THR 471 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1ggm h ARG 472 N 1.91 0.60 -0.16 -0.78 1.12 -1.94 -3.28 114.38 111.86 1ggm h ARG 472 Ca 0.26 -0.44 -0.04 0.00 -1.11 0.00 0.00 59.98 58.65 1ggm h ARG 472 Cb 0.94 0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 30.95 1ggm h ARG 472 CO 0.62 1.06 -0.09 1.28 -3.11 0.00 0.00 179.97 179.73 1ggm n LEU 473 N -3.92 3.27 -4.70 3.80 4.77 -1.26 -5.02 117.00 113.94 1ggm n LEU 473 Ca -0.05 -3.34 -0.42 0.00 -0.03 0.00 0.00 56.01 52.17 1ggm n LEU 473 Cb 0.68 -0.53 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1ggm n LEU 473 CO 0.49 0.92 1.32 -0.75 -1.33 0.00 0.00 177.39 178.04 1ggm s LYS 474 N -3.00 4.19 -0.32 3.23 2.20 -1.24 -2.35 119.74 122.45 1ggm s LYS 474 Ca 0.39 2.39 0.00 0.00 -0.36 0.00 0.00 55.97 58.39 1ggm s LYS 474 Cb 0.34 -3.43 0.00 0.00 -1.51 0.00 0.00 37.83 33.23 1ggm s LYS 474 CO 0.03 -0.71 0.00 -0.25 -0.36 0.00 0.00 175.35 174.06 1ggm n ASP 475 N 5.01 -2.38 -4.18 1.43 8.00 0.15 -4.98 116.55 119.61 1ggm n ASP 475 Ca 0.15 0.03 -0.30 0.00 0.71 0.00 0.00 54.79 55.38 1ggm n ASP 475 Cb 0.39 -1.23 -0.17 0.00 -0.02 0.00 0.00 41.12 40.09 1ggm n ASP 475 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1ggm s THR 476 N -2.16 1.85 0.34 -3.53 -4.23 -0.99 0.16 115.64 107.07 1ggm s THR 476 Ca 0.00 -0.90 0.10 0.00 -1.18 0.00 0.00 61.69 59.70 1ggm s THR 476 Cb 0.00 -1.61 -0.06 0.00 1.34 0.00 0.00 72.50 72.17 1ggm s THR 476 CO 0.00 0.51 -0.10 0.68 -0.54 0.00 0.00 174.62 175.17 1ggm s VAL 477 N 0.35 2.28 -0.27 2.29 -7.23 0.23 -4.45 120.40 113.60 1ggm s VAL 477 Ca -0.16 -2.22 -0.13 0.00 -1.81 0.00 0.00 61.98 57.66 1ggm s VAL 477 Cb -0.17 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 1ggm s VAL 477 CO 0.07 -0.22 0.27 0.42 -0.31 0.00 0.00 175.10 175.33 1ggm s THR 478 N -2.59 5.25 -0.43 5.32 -4.23 -1.18 -0.64 115.64 117.13 1ggm s THR 478 Ca 0.32 0.36 -0.05 0.00 -1.18 0.00 0.00 61.69 61.14 1ggm s THR 478 Cb 0.01 -3.61 0.11 0.00 1.34 0.00 0.00 72.50 70.36 1ggm s THR 478 CO 0.16 0.22 0.26 0.54 -0.54 0.00 0.00 174.62 175.27 1ggm s VAL 479 N 1.81 3.67 -0.12 2.29 0.11 -0.51 -0.50 120.40 127.14 1ggm s VAL 479 Ca 0.11 -1.95 -0.27 0.00 -2.93 0.00 0.00 61.98 56.94 1ggm s VAL 479 Cb -0.16 -3.47 -0.02 0.00 -1.53 0.00 0.00 36.38 31.21 1ggm s VAL 479 CO 0.10 -0.73 0.89 -0.60 -3.33 0.00 0.00 175.10 171.43 1ggm s ARG 480 N 1.23 4.38 -0.08 1.54 3.52 -0.65 -3.16 118.95 125.73 1ggm s ARG 480 Ca 0.07 1.16 -0.23 0.00 -0.13 0.00 0.00 55.73 56.60 1ggm s ARG 480 Cb -0.24 -3.54 -0.04 0.00 -1.56 0.00 0.00 34.95 29.57 1ggm s ARG 480 CO -0.03 -0.26 0.68 0.34 -0.81 0.00 0.00 175.30 175.22 1ggm s ASP 481 N 1.08 6.95 0.00 -2.12 -1.08 -0.05 -2.46 116.67 119.00 1ggm s ASP 481 Ca 0.43 1.14 0.00 0.00 -0.52 0.00 0.00 52.55 53.60 1ggm s ASP 481 Cb -0.18 -2.40 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 1ggm s ASP 481 CO 0.16 -0.12 0.86 -1.14 0.52 0.00 0.00 175.17 175.45 1ggm n ARG 482 N 3.85 0.00 0.09 4.34 0.63 -1.14 0.76 116.66 125.20 1ggm n ARG 482 Ca -0.02 0.71 -0.12 0.00 -0.92 0.00 0.00 57.85 57.51 1ggm n ARG 482 Cb 0.51 -1.36 -0.05 0.00 0.45 0.00 0.00 32.46 32.01 1ggm n ARG 482 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1ggm h ASP 483 N 0.00 -0.49 0.87 6.15 3.32 -1.94 -3.06 116.42 121.27 1ggm h ASP 483 Ca 0.00 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1ggm h ASP 483 Cb 0.00 0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1ggm h ASP 483 CO 0.00 -0.25 -0.19 0.35 -1.72 0.00 0.00 179.24 177.43 1ggm n THR 484 N -5.30 0.05 -1.06 0.35 -2.24 -1.21 -4.89 114.28 99.98 1ggm n THR 484 Ca -0.06 -0.03 -0.05 0.00 -2.27 0.00 0.00 64.05 61.63 1ggm n THR 484 Cb 0.22 -0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.18 1ggm n THR 484 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1ggm n MET 485 N -1.58 -1.82 -2.28 -0.78 2.81 0.23 -4.91 117.12 108.80 1ggm n MET 485 Ca 0.06 0.62 -0.37 0.00 -1.81 0.00 0.00 57.70 56.20 1ggm n MET 485 Cb 0.35 -4.87 -0.01 0.00 -0.71 0.00 0.00 33.22 27.98 1ggm n MET 485 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1ggm s GLU 486 N -2.26 3.75 -0.32 0.03 2.02 -1.24 -4.71 118.70 115.97 1ggm s GLU 486 Ca 0.00 1.74 0.02 0.00 0.02 0.00 0.00 54.97 56.75 1ggm s GLU 486 Cb 0.00 -2.38 0.10 0.00 0.10 0.00 0.00 34.13 31.95 1ggm s GLU 486 CO 0.00 -0.55 0.06 -0.65 0.02 0.00 0.00 175.26 174.15 1ggm s GLN 487 N -2.74 1.18 0.57 1.61 -0.21 -1.26 -0.87 119.66 117.94 1ggm s GLN 487 Ca 0.64 -1.52 -0.02 0.00 0.02 0.00 0.00 55.36 54.48 1ggm s GLN 487 Cb -0.28 -2.69 0.03 0.00 1.00 0.00 0.00 33.01 31.07 1ggm s GLN 487 CO 0.33 -0.94 0.84 0.42 -2.12 0.00 0.00 175.29 173.82 1ggm s ILE 488 N 1.21 3.12 -0.30 1.08 1.09 -1.19 -4.91 121.20 121.30 1ggm s ILE 488 Ca 0.10 -0.37 -0.01 0.00 -1.10 0.00 0.00 60.65 59.26 1ggm s ILE 488 Cb -0.18 -3.22 0.10 0.00 -1.06 0.00 0.00 42.46 38.10 1ggm s ILE 488 CO -0.15 -0.19 0.10 -0.60 -0.10 0.00 0.00 174.94 174.00 1ggm s ARG 489 N -4.88 0.66 0.24 2.79 3.52 -1.26 -1.43 118.95 118.59 1ggm s ARG 489 Ca 0.55 -0.97 0.11 0.00 -0.13 0.00 0.00 55.73 55.29 1ggm s ARG 489 Cb -0.10 -1.91 -0.05 0.00 -1.56 0.00 0.00 34.95 31.33 1ggm s ARG 489 CO 0.41 -0.97 -0.14 -0.48 -0.81 0.00 0.00 175.30 173.32 1ggm s LEU 490 N 1.68 2.78 0.21 -0.88 0.05 0.19 -4.87 118.68 117.84 1ggm s LEU 490 Ca 0.09 -0.81 -0.30 0.00 0.05 0.00 0.00 54.13 53.16 1ggm s LEU 490 Cb -0.17 -1.37 -0.08 0.00 -2.05 0.00 0.00 46.19 42.51 1ggm s LEU 490 CO -0.25 0.06 1.12 -2.28 -0.55 0.00 0.00 176.35 174.45 1ggm s HIS 491 N -2.13 3.55 0.10 3.48 5.65 -1.26 0.74 115.29 125.42 1ggm s HIS 491 Ca 0.27 1.59 -0.11 0.00 0.25 0.00 0.00 55.06 57.06 1ggm s HIS 491 Cb -0.07 -3.32 0.07 0.00 -1.18 0.00 0.00 32.58 28.08 1ggm s HIS 491 CO 0.15 -0.73 0.78 0.28 -0.65 0.00 0.00 174.74 174.57 1ggm n VAL 492 N 2.05 -0.29 0.32 0.89 0.31 0.12 0.58 118.33 122.30 1ggm n VAL 492 Ca 0.02 1.20 0.19 0.00 -0.01 0.00 0.00 64.34 65.74 1ggm n VAL 492 Cb 0.45 -1.55 1.06 0.00 -0.91 0.00 0.00 33.84 32.90 1ggm n VAL 492 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1ggm h ASP 493 N 0.00 0.00 0.92 4.52 3.32 -1.92 0.21 116.42 123.46 1ggm h ASP 493 Ca 0.14 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.99 1ggm h ASP 493 Cb 0.27 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.79 1ggm h ASP 493 CO -0.49 0.01 -1.15 -0.08 -1.72 0.00 0.00 179.24 175.80 1ggm h GLU 494 N 0.00 0.00 -0.05 3.56 4.57 -0.23 -3.32 114.58 119.11 1ggm h GLU 494 Ca -0.00 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1ggm h GLU 494 Cb 0.03 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1ggm h GLU 494 CO 0.00 0.67 0.05 1.25 -1.18 0.00 0.00 179.01 179.80 1ggm h LEU 495 N 0.00 0.00 0.31 1.64 5.85 -0.82 0.44 115.31 122.73 1ggm h LEU 495 Ca -0.10 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1ggm h LEU 495 Cb 1.73 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.77 1ggm h LEU 495 CO 0.09 0.00 -0.15 -0.33 -0.34 0.00 0.00 178.44 177.72 1ggm h GLU 496 N 0.00 -0.40 -0.97 1.25 5.08 -1.65 -2.68 114.58 115.21 1ggm h GLU 496 Ca 0.02 0.03 0.22 0.00 -1.00 0.00 0.00 59.36 58.63 1ggm h GLU 496 Cb 0.13 0.09 -0.12 0.00 0.50 0.00 0.00 28.75 29.35 1ggm h GLU 496 CO -0.00 -0.26 0.55 0.78 -1.00 0.00 0.00 179.01 179.08 1ggm h GLY 497 N -0.66 1.77 0.18 -3.84 0.00 -1.60 0.31 103.07 99.24 1ggm h GLY 497 Ca -0.04 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 1ggm h GLY 497 CO 0.07 -0.19 -0.29 -2.75 0.00 0.00 0.00 176.54 173.38 1ggm h PHE 498 N 0.60 -0.82 -0.56 5.60 3.04 -0.97 -1.50 116.94 122.32 1ggm h PHE 498 Ca 0.60 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.54 1ggm h PHE 498 Cb 1.07 0.33 -0.03 0.00 2.56 0.00 0.00 35.95 39.88 1ggm h PHE 498 CO -0.04 -0.36 0.24 -0.07 -2.02 0.00 0.00 178.31 176.07 1ggm h LEU 499 N -0.50 0.73 -1.48 0.59 3.38 -1.01 -0.23 115.31 116.80 1ggm h LEU 499 Ca -0.02 -0.08 0.15 0.00 0.09 0.00 0.00 57.88 58.02 1ggm h LEU 499 Cb 0.46 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1ggm h LEU 499 CO -0.09 0.64 0.53 0.03 0.09 0.00 0.00 178.44 179.64 1ggm h ARG 500 N 0.80 0.49 -0.18 1.13 3.08 -0.52 0.44 114.38 119.62 1ggm h ARG 500 Ca 0.19 -0.03 -0.19 0.00 0.07 0.00 0.00 59.98 60.02 1ggm h ARG 500 Cb 0.13 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1ggm h ARG 500 CO -0.02 0.33 -0.66 0.93 -1.07 0.00 0.00 179.97 179.47 1ggm h GLU 501 N 0.51 0.68 0.00 0.04 5.08 -0.01 -3.30 114.58 117.58 1ggm h GLU 501 Ca 0.40 -0.49 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1ggm h GLU 501 Cb 0.82 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1ggm h GLU 501 CO -0.15 1.11 -0.15 0.00 -1.00 0.00 0.00 179.01 178.82 1ggm h ARG 502 N 0.49 0.00 0.00 2.33 -0.00 0.15 -3.40 114.38 113.95 1ggm h ARG 502 Ca -0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.46 1ggm h ARG 502 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.22 1ggm h ARG 502 CO 0.13 0.00 0.00 1.28 0.00 0.00 0.00 179.97 181.38 1ggm n LEU 503 N -3.94 0.00 -4.74 3.04 7.99 -0.16 -4.79 117.00 114.40 1ggm n LEU 503 Ca -0.02 0.24 -0.40 0.00 -0.01 0.00 0.00 56.01 55.83 1ggm n LEU 503 Cb 0.08 -0.24 -0.05 0.00 -0.11 0.00 0.00 43.42 43.10 1ggm n LEU 503 CO 0.03 -0.14 0.45 -0.60 -1.51 0.00 0.00 177.39 175.62 1ggm s ARG 504 N -2.49 4.48 0.00 3.23 6.06 -1.24 -4.70 118.95 124.29 1ggm s ARG 504 Ca 0.13 1.03 0.00 0.00 -2.50 0.00 0.00 55.73 54.39 1ggm s ARG 504 Cb 0.09 -3.37 0.00 0.00 0.06 0.00 0.00 34.95 31.73 1ggm s ARG 504 CO 0.19 0.27 0.49 0.91 -2.50 0.00 0.00 175.30 174.66