#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3day s GLN 34 N 0.00 2.68 -0.37 3.23 -0.21 -1.26 -4.89 119.66 118.84 3day s GLN 34 Ca 0.00 -2.53 0.13 0.00 0.02 0.00 0.00 55.36 52.98 3day s GLN 34 Cb 0.00 -3.81 0.39 0.00 1.00 0.00 0.00 33.01 30.59 3day s GLN 34 CO 0.00 -1.19 0.95 -2.67 -2.12 0.00 0.00 175.29 170.26 3day n TRP 35 N 3.53 -0.36 -3.25 0.91 4.27 -1.26 -5.06 117.44 116.22 3day n TRP 35 Ca 0.08 -2.95 0.01 0.00 -3.89 0.00 0.00 57.50 50.76 3day n TRP 35 Cb 0.39 0.20 -0.00 0.00 -1.36 0.00 0.00 31.31 30.53 3day n TRP 35 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 3day n GLY 36 N 0.06 -1.88 3.26 -1.67 0.00 -1.23 -4.27 105.19 99.46 3day n GLY 36 Ca 0.13 -1.34 -0.14 0.00 0.00 0.00 0.00 46.02 44.67 3day n GLY 36 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3day s HIS 37 N -0.36 1.28 0.23 1.61 -3.43 -0.39 -4.72 115.29 109.51 3day s HIS 37 Ca 0.00 -1.05 0.07 0.00 -0.80 0.00 0.00 55.06 53.28 3day s HIS 37 Cb 0.00 -0.73 -0.04 0.00 -1.43 0.00 0.00 32.58 30.38 3day s HIS 37 CO 0.00 -0.23 0.12 -0.65 -2.00 0.00 0.00 174.74 171.97 3day s GLN 38 N -3.94 2.72 -0.60 -0.38 -0.21 -1.26 -0.66 119.66 115.33 3day s GLN 38 Ca 0.27 -1.11 -0.02 0.00 0.02 0.00 0.00 55.36 54.51 3day s GLN 38 Cb 0.06 -2.46 0.16 0.00 1.00 0.00 0.00 33.01 31.77 3day s GLN 38 CO 0.06 0.41 0.41 -1.21 -2.12 0.00 0.00 175.29 172.84 3day s GLU 39 N -3.58 2.48 0.05 2.91 2.02 -1.26 -5.02 118.70 116.31 3day s GLU 39 Ca 0.32 -2.49 0.01 0.00 0.02 0.00 0.00 54.97 52.82 3day s GLU 39 Cb -0.08 -3.69 -0.03 0.00 0.10 0.00 0.00 34.13 30.43 3day s GLU 39 CO 0.23 -1.16 -0.05 0.14 0.02 0.00 0.00 175.26 174.44 3day s VAL 40 N 0.00 0.40 0.67 2.63 -7.23 -1.26 -4.96 120.40 110.65 3day s VAL 40 Ca 0.16 -1.42 -0.17 0.00 -1.81 0.00 0.00 61.98 58.74 3day s VAL 40 Cb -0.21 -1.01 -0.02 0.00 0.56 0.00 0.00 36.38 35.71 3day s VAL 40 CO -0.03 -0.68 0.97 -0.81 -0.31 0.00 0.00 175.10 174.24 3day n PRO 41 N 0.80 0.69 -0.34 4.82 -0.04 -1.26 -4.93 135.00 134.75 3day n PRO 41 Ca -0.18 0.29 0.03 0.00 -0.04 0.00 0.00 63.50 63.59 3day n PRO 41 Cb 0.58 -2.20 0.20 0.00 -0.04 0.00 0.00 33.50 32.03 3day n PRO 41 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3day h ALA 42 N 0.08 1.44 -4.30 0.55 0.00 -2.00 -3.39 119.26 111.63 3day h ALA 42 Ca -0.48 -0.03 -0.68 0.00 0.00 0.00 0.00 54.91 53.72 3day h ALA 42 Cb 1.35 -0.30 -0.27 0.00 0.00 0.00 0.00 17.79 18.57 3day h ALA 42 CO 0.49 0.43 -0.88 0.15 0.00 0.00 0.00 179.25 179.44 3day s LYS 43 N -5.98 1.78 -0.09 0.00 -0.14 -1.26 -1.28 119.74 112.75 3day s LYS 43 Ca -0.12 -1.08 -0.22 0.00 -1.36 0.00 0.00 55.97 53.20 3day s LYS 43 Cb 0.20 -1.93 0.05 0.00 -1.68 0.00 0.00 37.83 34.47 3day s LYS 43 CO 0.81 0.50 0.52 0.12 -0.76 0.00 0.00 175.35 176.54 3day s PHE 44 N -0.79 -0.49 -0.23 3.18 5.36 -0.79 -4.64 117.98 119.58 3day s PHE 44 Ca 0.11 0.99 -0.09 0.00 -0.96 0.00 0.00 56.93 56.98 3day s PHE 44 Cb -0.10 0.24 0.10 0.00 -0.34 0.00 0.00 43.02 42.92 3day s PHE 44 CO 0.02 -0.43 0.51 1.21 -1.46 0.00 0.00 175.22 175.07 3day s ASN 45 N -0.71 -0.62 0.30 6.13 3.84 -1.26 -4.46 114.94 118.16 3day s ASN 45 Ca -0.08 1.20 -0.01 0.00 0.21 0.00 0.00 52.86 54.18 3day s ASN 45 Cb -0.03 1.53 0.45 0.00 -0.55 0.00 0.00 41.25 42.65 3day s ASN 45 CO 0.05 -0.22 1.89 0.15 -2.79 0.00 0.00 177.10 176.17 3day h PHE 46 N 7.83 0.88 0.17 0.43 3.57 -1.93 0.12 116.94 128.02 3day h PHE 46 Ca -0.21 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.24 3day h PHE 46 Cb 1.13 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.60 3day h PHE 46 CO 0.22 0.67 -0.08 0.00 -2.23 0.00 0.00 178.31 176.88 3day h ALA 47 N 1.42 -0.23 -0.14 2.41 0.00 -1.93 -0.76 119.26 120.03 3day h ALA 47 Ca 0.21 -0.15 -0.23 0.00 0.00 0.00 0.00 54.91 54.74 3day h ALA 47 Cb 0.14 0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.03 3day h ALA 47 CO -0.02 -0.50 -0.81 0.66 0.00 0.00 0.00 179.25 178.58 3day h SER 48 N -0.49 0.94 1.04 0.00 4.64 -1.94 0.17 113.55 117.91 3day h SER 48 Ca -0.02 -0.63 -0.06 0.00 -0.47 0.00 0.00 61.79 60.61 3day h SER 48 Cb 0.38 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 3day h SER 48 CO 0.04 1.43 -1.00 0.44 -0.87 0.00 0.00 176.83 176.87 3day h ASP 49 N 0.52 0.00 0.00 4.97 3.32 -0.83 -3.37 116.42 121.03 3day h ASP 49 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 3day h ASP 49 Cb 1.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.99 3day h ASP 49 CO 0.17 0.21 -0.02 0.52 -1.72 0.00 0.00 179.24 178.40 3day n VAL 50 N -2.82 0.97 -0.09 -1.35 0.31 -0.40 -4.72 118.33 110.23 3day n VAL 50 Ca -0.02 0.32 -0.10 0.00 -0.01 0.00 0.00 64.34 64.53 3day n VAL 50 Cb 0.65 -1.38 -0.03 0.00 -0.91 0.00 0.00 33.84 32.18 3day n VAL 50 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3day h LEU 51 N 0.00 0.42 -1.27 7.52 5.85 -1.13 -2.85 115.31 123.84 3day h LEU 51 Ca 0.00 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.54 3day h LEU 51 Cb 0.02 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.94 3day h LEU 51 CO 0.00 0.48 0.00 0.44 -0.34 0.00 0.00 178.44 179.02 3day h ASP 52 N 0.33 0.00 -0.37 1.25 3.32 -0.82 -2.19 116.42 117.94 3day h ASP 52 Ca 0.10 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.21 3day h ASP 52 Cb 0.20 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.70 3day h ASP 52 CO -0.01 0.00 0.05 -0.74 -1.72 0.00 0.00 179.24 176.82 3day h HIS 53 N 0.00 0.08 -0.45 4.55 -0.00 -1.68 -1.33 115.15 116.31 3day h HIS 53 Ca 0.00 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.34 3day h HIS 53 Cb 0.52 0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.94 3day h HIS 53 CO 0.00 -0.01 0.08 -1.49 -0.00 0.00 0.00 177.93 176.50 3day h TRP 54 N 0.17 0.80 -0.31 5.26 4.06 -1.42 -1.71 115.95 122.79 3day h TRP 54 Ca 0.18 -0.11 0.06 0.00 2.06 0.00 0.00 58.89 61.07 3day h TRP 54 Cb 0.22 -0.22 -0.05 0.00 -1.00 0.00 0.00 29.16 28.11 3day h TRP 54 CO -0.21 0.75 -0.01 0.00 -3.56 0.00 0.00 178.44 175.41 3day h ALA 55 N 0.95 0.27 -0.78 1.49 0.00 -1.49 -2.74 119.26 116.95 3day h ALA 55 Ca 0.14 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3day h ALA 55 Cb 0.38 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3day h ALA 55 CO 0.01 -0.42 0.46 -0.44 0.00 0.00 0.00 179.25 178.87 3day h ASP 56 N 0.07 0.94 -1.00 0.00 3.32 -0.98 -0.96 116.42 117.82 3day h ASP 56 Ca 0.15 -0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.17 3day h ASP 56 Cb 0.21 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.47 3day h ASP 56 CO -0.27 0.73 0.66 0.24 -1.72 0.00 0.00 179.24 178.88 3day h MET 57 N 1.08 1.27 -0.15 3.56 2.86 -1.17 0.23 114.93 122.61 3day h MET 57 Ca 0.28 -0.08 -0.06 0.00 -2.06 0.00 0.00 59.70 57.78 3day h MET 57 Cb -0.03 -0.29 -0.00 0.00 0.06 0.00 0.00 31.60 31.34 3day h MET 57 CO -0.05 0.84 -0.14 0.93 1.06 0.00 0.00 176.91 179.54 3day h GLU 58 N 1.31 0.35 -0.63 1.72 5.08 -1.10 0.54 114.58 121.85 3day h GLU 58 Ca 0.38 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 3day h GLU 58 Cb -0.08 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 3day h GLU 58 CO -0.10 0.74 0.17 0.87 -1.00 0.00 0.00 179.01 179.69 3day h LYS 59 N -0.02 0.97 -0.01 2.33 1.57 -0.83 -1.64 116.57 118.95 3day h LYS 59 Ca 0.02 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3day h LYS 59 Cb 0.67 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3day h LYS 59 CO 0.04 0.85 0.00 0.00 -0.57 0.00 0.00 179.45 179.77 3day n ALA 60 N -2.46 2.58 -1.35 3.86 0.00 0.79 -4.88 120.51 119.05 3day n ALA 60 Ca 0.05 -0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.27 3day n ALA 60 Cb 0.23 -1.21 -0.05 0.00 0.00 0.00 0.00 19.45 18.42 3day n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3day n GLY 61 N 0.73 1.25 0.10 0.00 0.00 -0.62 -4.87 105.19 101.79 3day n GLY 61 Ca 0.10 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 45.99 3day n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3day h LYS 62 N 0.06 0.00 -3.63 1.61 1.57 -0.16 -3.45 116.57 112.57 3day h LYS 62 Ca -0.24 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.36 3day h LYS 62 Cb 0.92 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.00 3day h LYS 62 CO 0.36 0.00 -0.60 0.50 -0.57 0.00 0.00 179.45 179.14 3day s ARG 63 N -3.20 0.27 0.72 3.15 3.52 -0.90 -4.98 118.95 117.54 3day s ARG 63 Ca 0.06 -0.21 -0.14 0.00 -0.13 0.00 0.00 55.73 55.31 3day s ARG 63 Cb 0.11 0.11 0.04 0.00 -1.56 0.00 0.00 34.95 33.65 3day s ARG 63 CO 0.70 -0.05 1.14 -2.14 -0.81 0.00 0.00 175.30 174.14 3day s PRO 64 N -0.75 2.33 -0.20 5.12 0.02 -1.26 -4.08 135.00 136.18 3day s PRO 64 Ca -0.08 1.48 -0.33 0.00 0.02 0.00 0.00 61.00 62.09 3day s PRO 64 Cb -0.05 -1.88 -0.09 0.00 0.02 0.00 0.00 34.50 32.49 3day s PRO 64 CO 0.00 -1.63 2.08 -2.30 -0.33 0.00 0.00 177.00 174.83 3day n PRO 65 N -2.87 1.81 -4.89 5.54 -0.02 -1.26 -4.86 135.00 128.44 3day n PRO 65 Ca 0.11 0.57 -0.33 0.00 -2.02 0.00 0.00 63.50 61.84 3day n PRO 65 Cb 0.52 -2.78 -0.13 0.00 -0.02 0.00 0.00 33.50 31.08 3day n PRO 65 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3day s SER 66 N 6.36 4.01 0.31 2.55 0.01 -1.26 -5.02 113.70 120.67 3day s SER 66 Ca 1.00 -0.21 -0.29 0.00 1.31 0.00 0.00 55.95 57.76 3day s SER 66 Cb -0.63 -0.92 -0.10 0.00 0.21 0.00 0.00 66.02 64.58 3day s SER 66 CO 0.46 0.33 1.43 -2.16 0.41 0.00 0.00 173.24 173.71 3day s PRO 67 N -0.62 4.24 -0.08 12.44 0.04 -1.26 -2.57 135.00 147.19 3day s PRO 67 Ca 0.09 2.37 -0.01 0.00 0.04 0.00 0.00 61.00 63.49 3day s PRO 67 Cb -0.11 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.33 3day s PRO 67 CO 0.01 -0.40 -0.08 0.00 0.04 0.00 0.00 177.00 176.57 3day n ALA 68 N 1.47 2.06 -3.71 8.56 0.00 0.71 -3.59 120.51 126.01 3day n ALA 68 Ca 0.04 -0.32 -0.20 0.00 0.00 0.00 0.00 53.44 52.96 3day n ALA 68 Cb 0.40 0.35 -0.17 0.00 0.00 0.00 0.00 19.45 20.03 3day n ALA 68 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3day s LEU 69 N -5.78 0.50 -0.19 0.00 2.96 -0.89 -1.04 118.68 114.25 3day s LEU 69 Ca -0.10 0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.84 3day s LEU 69 Cb 0.03 -0.21 0.03 0.00 0.50 0.00 0.00 46.19 46.54 3day s LEU 69 CO 0.16 -0.20 -0.13 0.86 -1.32 0.00 0.00 176.35 175.72 3day s TRP 70 N 1.83 2.48 -0.03 5.38 -0.11 -0.26 -0.91 118.94 127.32 3day s TRP 70 Ca 0.01 -1.56 0.07 0.00 1.22 0.00 0.00 56.10 55.84 3day s TRP 70 Cb -0.12 -1.70 -0.02 0.00 -1.50 0.00 0.00 33.47 30.13 3day s TRP 70 CO -0.03 -0.75 -0.25 -0.46 -4.62 0.00 0.00 176.95 170.84 3day s TRP 71 N 1.38 2.39 0.05 5.86 -0.00 0.05 -1.00 118.94 127.67 3day s TRP 71 Ca 0.01 -0.49 0.03 0.00 -0.00 0.00 0.00 56.10 55.65 3day s TRP 71 Cb -0.15 -1.54 -0.03 0.00 -0.00 0.00 0.00 33.47 31.76 3day s TRP 71 CO -0.09 -0.07 -0.09 0.14 -0.00 0.00 0.00 176.95 176.83 3day s VAL 72 N -0.50 0.68 -1.69 5.86 -7.23 -0.29 -1.12 120.40 116.11 3day s VAL 72 Ca 0.06 -1.17 0.22 0.00 -1.81 0.00 0.00 61.98 59.28 3day s VAL 72 Cb -0.11 -0.77 -0.08 0.00 0.56 0.00 0.00 36.38 35.98 3day s VAL 72 CO 0.00 -0.37 1.03 -0.46 -0.31 0.00 0.00 175.10 174.99 3day n ASN 73 N 1.35 1.68 0.00 4.85 0.23 -0.88 -1.00 115.26 121.49 3day n ASN 73 Ca -0.22 -1.34 0.00 0.00 -0.53 0.00 0.00 54.58 52.49 3day n ASN 73 Cb 0.55 0.65 0.00 0.00 -2.08 0.00 0.00 39.78 38.90 3day n ASN 73 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3day n GLY 74 N 1.45 0.72 0.03 4.83 0.00 -1.26 -4.57 105.19 106.39 3day n GLY 74 Ca 0.07 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.12 3day n GLY 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3day n LYS 75 N -2.54 2.18 0.00 1.61 5.02 -1.26 -5.00 118.16 118.17 3day n LYS 75 Ca 0.00 -1.59 0.00 0.00 -2.02 0.00 0.00 58.31 54.70 3day n LYS 75 Cb 0.00 -1.03 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 3day n LYS 75 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3day n GLY 76 N -0.62 0.66 3.89 0.72 0.00 -1.26 -5.10 105.19 103.48 3day n GLY 76 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 3day n GLY 76 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3day s LYS 77 N -0.74 3.49 -0.11 1.61 2.20 -1.26 -5.04 119.74 119.89 3day s LYS 77 Ca 0.00 -0.15 -0.08 0.00 -0.36 0.00 0.00 55.97 55.38 3day s LYS 77 Cb 0.00 -3.14 0.04 0.00 -1.51 0.00 0.00 37.83 33.22 3day s LYS 77 CO 0.00 0.72 0.28 -1.83 -0.36 0.00 0.00 175.35 174.16 3day s GLU 78 N -1.46 0.29 0.01 4.03 1.03 -1.26 -2.07 118.70 119.27 3day s GLU 78 Ca 0.22 0.49 0.03 0.00 0.03 0.00 0.00 54.97 55.74 3day s GLU 78 Cb -0.13 0.03 -0.01 0.00 -0.80 0.00 0.00 34.13 33.22 3day s GLU 78 CO 0.11 -0.10 -0.09 -0.51 -1.33 0.00 0.00 175.26 173.34 3day s LEU 79 N 0.73 2.08 -0.01 1.83 1.43 -0.28 -5.00 118.68 119.47 3day s LEU 79 Ca -0.05 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 3day s LEU 79 Cb -0.06 -0.39 0.02 0.00 0.03 0.00 0.00 46.19 45.78 3day s LEU 79 CO -0.05 0.04 0.01 -0.32 0.23 0.00 0.00 176.35 176.26 3day s MET 80 N -0.57 0.01 -0.13 1.70 1.75 -1.26 -0.77 119.30 120.04 3day s MET 80 Ca 0.01 0.10 -0.00 0.00 -1.25 0.00 0.00 55.69 54.54 3day s MET 80 Cb -0.05 -0.17 -0.02 0.00 2.84 0.00 0.00 34.83 37.43 3day s MET 80 CO 0.00 -0.10 -0.12 -1.58 -0.65 0.00 0.00 175.02 172.57 3day s TRP 81 N 0.63 2.82 0.98 4.11 0.51 -0.09 -5.00 118.94 122.91 3day s TRP 81 Ca -0.05 -0.60 -0.16 0.00 -2.12 0.00 0.00 56.10 53.18 3day s TRP 81 Cb -0.08 -1.84 0.19 0.00 -0.81 0.00 0.00 33.47 30.93 3day s TRP 81 CO -0.02 -0.18 1.24 0.54 -0.51 0.00 0.00 176.95 178.02 3day s ASN 82 N 0.30 2.97 0.29 2.95 2.20 -1.26 -0.20 114.94 122.18 3day s ASN 82 Ca -0.10 0.50 -0.01 0.00 -0.94 0.00 0.00 52.86 52.32 3day s ASN 82 Cb -0.16 -0.72 0.43 0.00 -2.00 0.00 0.00 41.25 38.81 3day s ASN 82 CO 0.05 -2.85 1.87 -0.26 -2.94 0.00 0.00 177.10 172.97 3day h PHE 83 N -1.71 0.88 -0.18 1.54 0.04 -1.82 0.25 116.94 115.94 3day h PHE 83 Ca -0.46 -0.05 -0.04 0.00 2.80 0.00 0.00 57.97 60.22 3day h PHE 83 Cb 1.27 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 39.15 3day h PHE 83 CO -0.93 0.69 -0.06 -0.09 -0.60 0.00 0.00 178.31 177.32 3day h ARG 84 N 0.85 0.36 -0.57 1.51 2.43 -1.85 -1.75 114.38 115.36 3day h ARG 84 Ca 0.20 -0.15 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 3day h ARG 84 Cb 0.19 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 3day h ARG 84 CO -0.02 0.64 0.36 0.93 -1.51 0.00 0.00 179.97 180.38 3day h GLU 85 N 0.05 0.71 -0.24 0.20 5.08 -1.90 -0.29 114.58 118.18 3day h GLU 85 Ca 0.04 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 3day h GLU 85 Cb 0.52 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 3day h GLU 85 CO 0.02 0.47 -0.00 1.25 -1.00 0.00 0.00 179.01 179.75 3day h LEU 86 N 0.73 -0.10 -0.13 1.33 5.85 -0.96 0.16 115.31 122.19 3day h LEU 86 Ca 0.22 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.99 3day h LEU 86 Cb -0.03 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 3day h LEU 86 CO -0.07 -0.02 0.08 -1.28 -0.34 0.00 0.00 178.44 176.81 3day h SER 87 N 0.07 0.15 -0.35 1.25 0.87 -1.10 0.64 113.55 115.09 3day h SER 87 Ca 0.12 -0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 3day h SER 87 Cb 0.15 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 3day h SER 87 CO -0.20 0.15 0.16 -0.33 -0.53 0.00 0.00 176.83 176.08 3day h GLU 88 N 0.15 0.52 -0.31 2.24 5.08 -0.94 -0.75 114.58 120.56 3day h GLU 88 Ca 0.05 -0.09 -0.14 0.00 -1.00 0.00 0.00 59.36 58.18 3day h GLU 88 Cb 0.02 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3day h GLU 88 CO -0.01 0.49 -0.36 -0.97 -1.00 0.00 0.00 179.01 177.16 3day h ASN 89 N 0.43 0.75 0.91 1.42 -1.24 -0.59 -1.50 115.58 115.76 3day h ASN 89 Ca 0.12 -0.32 -0.12 0.00 0.71 0.00 0.00 56.30 56.69 3day h ASN 89 Cb 0.16 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 38.98 3day h ASN 89 CO -0.01 1.04 -0.57 0.77 -1.29 0.00 0.00 177.43 177.37 3day h SER 90 N 0.60 0.00 -0.59 1.15 4.64 -0.80 -1.64 113.55 116.91 3day h SER 90 Ca 0.06 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.31 3day h SER 90 Cb 0.89 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.96 3day h SER 90 CO 0.08 0.57 0.11 1.56 -0.87 0.00 0.00 176.83 178.28 3day h GLN 91 N 0.00 0.97 -0.40 4.77 4.20 -0.91 -0.40 115.11 123.35 3day h GLN 91 Ca -0.01 -0.25 0.07 0.00 0.06 0.00 0.00 58.65 58.52 3day h GLN 91 Cb 1.18 -0.12 -0.06 0.00 0.30 0.00 0.00 27.48 28.78 3day h GLN 91 CO 0.07 0.91 0.04 1.96 -0.67 0.00 0.00 178.83 181.14 3day h GLN 92 N 0.88 0.14 -0.55 1.46 4.20 -1.04 -0.84 115.11 119.37 3day h GLN 92 Ca 0.18 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.92 3day h GLN 92 Cb 0.40 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 3day h GLN 92 CO 0.01 0.10 0.31 0.00 -0.67 0.00 0.00 178.83 178.58 3day h ALA 93 N 1.33 0.71 -0.91 3.87 0.00 -1.03 -0.79 119.26 122.44 3day h ALA 93 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3day h ALA 93 Cb 0.26 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3day h ALA 93 CO -0.30 0.01 0.55 0.00 0.00 0.00 0.00 179.25 179.51 3day h ALA 94 N 1.26 1.26 -0.89 0.00 0.00 -0.75 -1.85 119.26 118.30 3day h ALA 94 Ca 0.23 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3day h ALA 94 Cb 0.07 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3day h ALA 94 CO -0.12 0.64 0.47 -0.91 0.00 0.00 0.00 179.25 179.32 3day h ASN 95 N 1.25 1.12 -0.38 0.00 2.35 -0.50 -0.80 115.58 118.62 3day h ASN 95 Ca 0.33 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.94 3day h ASN 95 Cb -0.06 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.01 3day h ASN 95 CO -0.06 0.91 0.13 0.58 -1.65 0.00 0.00 177.43 177.33 3day h VAL 96 N 1.25 1.21 -0.34 2.81 2.07 -0.52 0.41 116.25 123.14 3day h VAL 96 Ca 0.31 -0.67 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 3day h VAL 96 Cb 0.05 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 3day h VAL 96 CO -0.05 0.24 -0.14 -0.07 0.02 0.00 0.00 177.57 177.57 3day h LEU 97 N 0.46 0.72 0.14 2.57 3.38 -1.17 -0.93 115.31 120.49 3day h LEU 97 Ca 0.12 -0.40 -0.32 0.00 0.09 0.00 0.00 57.88 57.38 3day h LEU 97 Cb 0.24 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3day h LEU 97 CO -0.01 0.95 -1.57 0.77 0.09 0.00 0.00 178.44 178.68 3day h SER 98 N 0.48 0.48 0.00 -0.43 4.64 -1.15 -1.95 113.55 115.61 3day h SER 98 Ca 0.08 -0.65 0.00 0.00 -0.47 0.00 0.00 61.79 60.75 3day h SER 98 Cb 0.67 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3day h SER 98 CO 0.05 1.54 0.00 0.61 -0.87 0.00 0.00 176.83 178.16 3day n GLY 99 N 1.71 0.90 0.30 -0.77 0.00 0.15 -3.50 105.19 103.97 3day n GLY 99 Ca -0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.95 3day n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3day h ALA 100 N -2.00 1.20 0.00 4.61 0.00 -1.52 -1.99 119.26 119.56 3day h ALA 100 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3day h ALA 100 Cb 0.00 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3day h ALA 100 CO 0.00 -0.43 -0.58 0.00 0.00 0.00 0.00 179.25 178.24 3day n GLY 102 N 1.48 0.77 3.74 0.00 0.00 -0.75 -4.95 105.19 105.47 3day n GLY 102 Ca 0.05 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 3day n GLY 102 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3day s LEU 103 N -1.38 4.47 0.14 0.99 1.43 -0.74 -4.99 118.68 118.60 3day s LEU 103 Ca 0.00 2.24 0.05 0.00 -1.03 0.00 0.00 54.13 55.38 3day s LEU 103 Cb 0.00 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.57 3day s LEU 103 CO 0.00 -0.32 0.09 -1.10 0.23 0.00 0.00 176.35 175.26 3day s GLN 104 N -0.52 2.80 0.06 1.70 -1.52 -1.26 -4.37 119.66 116.54 3day s GLN 104 Ca 0.51 -0.86 -0.37 0.00 -1.95 0.00 0.00 55.36 52.68 3day s GLN 104 Cb -0.32 -2.61 -0.17 0.00 -0.22 0.00 0.00 33.01 29.68 3day s GLN 104 CO 0.38 0.50 1.31 -2.13 -0.25 0.00 0.00 175.29 175.10 3day n ARG 105 N -0.06 0.97 -0.02 2.91 0.63 -1.26 -0.87 116.66 118.95 3day n ARG 105 Ca -0.09 0.35 0.00 0.00 -0.92 0.00 0.00 57.85 57.19 3day n ARG 105 Cb 0.54 -1.97 0.00 0.00 0.45 0.00 0.00 32.46 31.48 3day n ARG 105 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3day n GLY 106 N 2.42 1.41 3.77 5.14 0.00 0.27 -5.01 105.19 113.19 3day n GLY 106 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 3day n GLY 106 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3day s ASP 107 N -2.96 6.67 -0.16 1.61 1.01 -0.05 -4.60 116.67 118.20 3day s ASP 107 Ca 0.00 2.46 -0.14 0.00 0.71 0.00 0.00 52.55 55.59 3day s ASP 107 Cb 0.00 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.26 3day s ASP 107 CO 0.00 -0.58 0.29 -0.13 0.21 0.00 0.00 175.17 174.96 3day s ARG 108 N -2.03 4.25 -0.20 8.23 0.52 -1.26 -0.92 118.95 127.53 3day s ARG 108 Ca 0.53 0.08 0.00 0.00 -0.52 0.00 0.00 55.73 55.82 3day s ARG 108 Cb -0.34 -3.42 0.05 0.00 0.52 0.00 0.00 34.95 31.76 3day s ARG 108 CO 0.44 0.25 -0.07 0.08 0.02 0.00 0.00 175.30 176.02 3day s VAL 109 N 0.45 1.42 0.24 3.52 1.01 0.92 -1.15 120.40 126.81 3day s VAL 109 Ca 0.16 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 3day s VAL 109 Cb -0.13 -1.62 -0.09 0.00 0.00 0.00 0.00 36.38 34.55 3day s VAL 109 CO 0.04 0.04 1.03 0.00 0.00 0.00 0.00 175.10 176.20 3day s ALA 110 N 1.47 3.37 -0.17 5.51 0.00 0.09 -0.40 121.76 131.64 3day s ALA 110 Ca -0.03 0.77 -0.01 0.00 0.00 0.00 0.00 51.96 52.69 3day s ALA 110 Cb -0.17 -3.28 0.05 0.00 0.00 0.00 0.00 23.12 19.71 3day s ALA 110 CO -0.07 -0.02 -0.02 0.08 0.00 0.00 0.00 175.76 175.73 3day s VAL 111 N -1.00 0.90 -0.53 0.00 1.01 -0.46 -0.00 120.40 120.32 3day s VAL 111 Ca 0.44 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.86 3day s VAL 111 Cb -0.29 -1.19 0.16 0.00 0.00 0.00 0.00 36.38 35.06 3day s VAL 111 CO 0.36 0.01 0.37 -0.69 0.00 0.00 0.00 175.10 175.16 3day s VAL 112 N 1.71 1.57 0.11 2.92 1.01 0.52 -0.26 120.40 127.98 3day s VAL 112 Ca -0.00 -3.24 0.08 0.00 0.00 0.00 0.00 61.98 58.82 3day s VAL 112 Cb -0.16 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 3day s VAL 112 CO -0.07 -1.06 -0.20 -0.76 0.00 0.00 0.00 175.10 173.01 3day s LEU 113 N -0.43 2.33 0.00 3.92 1.43 -1.26 -3.41 118.68 121.26 3day s LEU 113 Ca 0.26 -0.73 -0.02 0.00 -1.03 0.00 0.00 54.13 52.61 3day s LEU 113 Cb -0.07 -0.84 0.03 0.00 0.03 0.00 0.00 46.19 45.35 3day s LEU 113 CO -0.13 0.02 0.19 -0.81 0.23 0.00 0.00 176.35 175.84 3day n PRO 114 N 0.90 -0.34 -1.91 1.29 -0.04 -1.26 -4.49 135.00 129.15 3day n PRO 114 Ca -0.18 -0.29 -0.41 0.00 -0.04 0.00 0.00 63.50 62.58 3day n PRO 114 Cb 0.54 -0.20 -0.02 0.00 -0.04 0.00 0.00 33.50 33.79 3day n PRO 114 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3day n ARG 115 N -1.48 2.59 -4.39 0.54 1.74 -1.26 -4.74 116.66 109.66 3day n ARG 115 Ca 0.02 -2.65 -0.29 0.00 -0.77 0.00 0.00 57.85 54.16 3day n ARG 115 Cb 0.08 -3.33 -0.13 0.00 -1.02 0.00 0.00 32.46 28.06 3day n ARG 115 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3day s VAL 116 N 4.63 2.23 0.55 1.55 -7.23 -1.26 -3.93 120.40 116.95 3day s VAL 116 Ca 0.53 -1.75 0.27 0.00 -1.81 0.00 0.00 61.98 59.22 3day s VAL 116 Cb 0.10 -1.98 0.39 0.00 0.56 0.00 0.00 36.38 35.45 3day s VAL 116 CO 0.02 0.08 1.99 -0.65 -0.31 0.00 0.00 175.10 176.23 3day h PRO 117 N 3.88 0.00 0.00 4.82 0.11 -1.98 -1.63 132.00 137.20 3day h PRO 117 Ca -0.51 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 3day h PRO 117 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 3day h PRO 117 CO 0.39 0.00 -0.07 0.93 -0.21 0.00 0.00 178.00 179.04 3day h GLU 118 N 0.00 0.00 -0.10 1.05 3.07 -1.96 -1.35 114.58 115.29 3day h GLU 118 Ca 0.22 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 59.09 3day h GLU 118 Cb 0.99 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.89 3day h GLU 118 CO -0.00 0.07 0.03 2.35 -1.40 0.00 0.00 179.01 180.06 3day h TRP 119 N 0.00 0.05 -0.62 4.33 7.01 -1.58 0.19 115.95 125.33 3day h TRP 119 Ca -0.00 0.01 -0.08 0.00 2.11 0.00 0.00 58.89 60.93 3day h TRP 119 Cb 0.21 -0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.24 3day h TRP 119 CO 0.00 0.02 0.07 -1.49 -2.79 0.00 0.00 178.44 174.26 3day h TRP 120 N 0.07 1.11 -0.50 2.65 6.55 -1.44 -1.44 115.95 122.95 3day h TRP 120 Ca 0.04 -0.17 -0.04 0.00 0.95 0.00 0.00 58.89 59.68 3day h TRP 120 Cb 0.03 -0.30 -0.02 0.00 -0.86 0.00 0.00 29.16 28.01 3day h TRP 120 CO -0.11 0.96 0.15 -0.07 -1.05 0.00 0.00 178.44 178.32 3day h LEU 121 N 0.94 0.75 -0.75 -4.49 3.38 -1.20 -2.16 115.31 111.78 3day h LEU 121 Ca 0.18 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 3day h LEU 121 Cb 0.47 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3day h LEU 121 CO 0.02 0.77 -0.13 0.58 0.09 0.00 0.00 178.44 179.76 3day h VAL 122 N 0.69 1.26 -0.24 1.22 2.07 -0.41 0.69 116.25 121.53 3day h VAL 122 Ca 0.16 -1.21 -0.12 0.00 0.82 0.00 0.00 66.70 66.35 3day h VAL 122 Cb 0.29 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3day h VAL 122 CO -0.00 0.42 -0.32 0.40 0.02 0.00 0.00 177.57 178.09 3day h ILE 123 N 0.74 1.31 -0.72 4.57 1.08 -1.23 -0.44 117.51 122.82 3day h ILE 123 Ca 0.12 -1.51 -0.04 0.00 -0.39 0.00 0.00 64.86 63.04 3day h ILE 123 Cb 0.63 1.71 -0.03 0.00 -3.07 0.00 0.00 36.82 36.06 3day h ILE 123 CO 0.04 0.47 0.28 -0.07 -0.69 0.00 0.00 178.15 178.19 3day h LEU 124 N 0.35 0.99 -0.80 1.44 3.38 -1.24 -0.96 115.31 118.48 3day h LEU 124 Ca 0.03 -0.17 0.13 0.00 0.09 0.00 0.00 57.88 57.96 3day h LEU 124 Cb 0.90 -0.26 -0.09 0.00 0.09 0.00 0.00 40.66 41.30 3day h LEU 124 CO 0.07 0.90 0.39 1.23 0.09 0.00 0.00 178.44 181.12 3day h GLY 125 N 1.03 1.25 0.88 0.83 0.00 -0.54 -0.78 103.07 105.75 3day h GLY 125 Ca 0.24 -0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.27 3day h GLY 125 CO -0.02 -0.02 -0.12 0.00 0.00 0.00 0.00 176.54 176.38 3day h ILE 127 N 0.31 0.96 -0.85 0.00 2.04 -0.74 0.16 117.51 119.39 3day h ILE 127 Ca 0.06 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.81 3day h ILE 127 Cb 0.63 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 3day h ILE 127 CO 0.04 0.06 0.56 0.03 0.00 0.00 0.00 178.15 178.84 3day h ARG 128 N 0.34 1.12 -0.23 2.37 3.08 -1.04 -3.05 114.38 116.98 3day h ARG 128 Ca 0.15 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3day h ARG 128 Cb 0.08 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.88 3day h ARG 128 CO -0.12 0.74 0.00 0.00 -1.07 0.00 0.00 179.97 179.52 3day n ALA 129 N -2.34 2.49 -3.46 0.04 0.00 -0.70 -0.73 120.51 115.82 3day n ALA 129 Ca 0.09 -0.64 -0.22 0.00 0.00 0.00 0.00 53.44 52.67 3day n ALA 129 Cb 0.02 -1.03 0.07 0.00 0.00 0.00 0.00 19.45 18.51 3day n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3day n GLY 130 N 1.21 -0.45 3.77 0.00 0.00 -0.32 -4.28 105.19 105.12 3day n GLY 130 Ca 0.17 0.18 -0.32 0.00 0.00 0.00 0.00 46.02 46.04 3day n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3day s LEU 131 N -6.83 3.83 -0.52 0.99 1.43 0.42 -0.57 118.68 117.43 3day s LEU 131 Ca 0.52 0.10 -0.25 0.00 -1.03 0.00 0.00 54.13 53.47 3day s LEU 131 Cb -0.23 -2.27 0.04 0.00 0.03 0.00 0.00 46.19 43.75 3day s LEU 131 CO 0.64 0.26 0.93 -0.63 0.23 0.00 0.00 176.35 177.78 3day s ILE 132 N -1.21 4.43 0.18 -0.59 1.01 -0.10 -4.38 121.20 120.53 3day s ILE 132 Ca 0.23 0.45 -0.24 0.00 0.00 0.00 0.00 60.65 61.10 3day s ILE 132 Cb -0.12 -4.49 -0.08 0.00 0.01 0.00 0.00 42.46 37.78 3day s ILE 132 CO 0.15 -1.00 0.76 0.72 0.00 0.00 0.00 174.94 175.57 3day s PHE 133 N 3.86 3.85 -0.48 3.97 -0.12 -0.40 -0.05 117.98 128.61 3day s PHE 133 Ca 0.33 1.58 0.04 0.00 -0.05 0.00 0.00 56.93 58.82 3day s PHE 133 Cb -0.12 -2.73 0.16 0.00 -0.63 0.00 0.00 43.02 39.70 3day s PHE 133 CO 0.22 0.48 0.35 -1.64 -0.05 0.00 0.00 175.22 174.58 3day s MET 134 N -1.33 1.31 0.34 1.99 -1.94 0.47 -1.56 119.30 118.58 3day s MET 134 Ca 0.37 -2.33 -0.27 0.00 -1.71 0.00 0.00 55.69 51.75 3day s MET 134 Cb -0.22 -2.02 -0.09 0.00 2.01 0.00 0.00 34.83 34.51 3day s MET 134 CO 0.25 -1.32 1.13 -2.14 -0.01 0.00 0.00 175.02 172.93 3day s PRO 135 N -0.18 4.38 0.03 2.03 0.02 -1.26 -1.36 135.00 138.66 3day s PRO 135 Ca 0.28 1.80 -0.02 0.00 0.02 0.00 0.00 61.00 63.07 3day s PRO 135 Cb -0.04 -2.93 -0.02 0.00 0.02 0.00 0.00 34.50 31.52 3day s PRO 135 CO -0.15 -0.02 0.01 0.20 -0.33 0.00 0.00 177.00 176.71 3day s GLY 136 N -1.03 0.28 0.18 0.52 0.00 0.64 -4.68 107.32 103.24 3day s GLY 136 Ca 0.50 -0.73 -0.31 0.00 0.00 0.00 0.00 44.72 44.19 3day s GLY 136 CO 0.39 -0.83 1.44 -1.08 0.00 0.00 0.00 173.10 173.02 3day s THR 137 N -2.39 2.91 -0.06 0.90 -1.32 -1.26 -4.12 115.64 110.29 3day s THR 137 Ca -0.07 0.70 0.20 0.00 -1.21 0.00 0.00 61.69 61.30 3day s THR 137 Cb -0.03 -3.45 0.20 0.00 -1.51 0.00 0.00 72.50 67.71 3day s THR 137 CO -0.04 0.08 1.57 0.16 -2.21 0.00 0.00 174.62 174.18 3day h ILE 138 N 3.88 0.00 0.00 5.08 3.07 -1.88 -2.15 117.51 125.50 3day h ILE 138 Ca -0.44 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.97 3day h ILE 138 Cb 1.21 0.44 0.00 0.00 -0.27 0.00 0.00 36.82 38.20 3day h ILE 138 CO 0.83 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.93 3day n GLN 139 N -2.23 0.31 -1.92 0.16 1.13 -1.26 -4.86 117.38 108.70 3day n GLN 139 Ca -0.01 0.09 -0.41 0.00 -1.94 0.00 0.00 57.00 54.72 3day n GLN 139 Cb 0.15 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 28.98 3day n GLN 139 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 3day s MET 140 N -2.54 4.21 0.75 -1.09 -1.94 -0.81 -5.04 119.30 112.84 3day s MET 140 Ca 0.20 2.41 -0.11 0.00 -1.71 0.00 0.00 55.69 56.48 3day s MET 140 Cb 0.14 -3.06 0.04 0.00 2.01 0.00 0.00 34.83 33.95 3day s MET 140 CO 0.31 -0.48 1.10 0.15 -0.01 0.00 0.00 175.02 176.09 3day s LYS 141 N -0.69 2.51 0.50 2.03 -0.14 -1.26 -4.86 119.74 117.82 3day s LYS 141 Ca 0.59 0.52 0.20 0.00 -1.36 0.00 0.00 55.97 55.93 3day s LYS 141 Cb -0.44 -1.98 1.27 0.00 -1.68 0.00 0.00 37.83 35.01 3day s LYS 141 CO 0.47 -1.30 2.07 0.66 -0.76 0.00 0.00 175.35 176.50 3day h SER 142 N -0.85 0.00 0.61 2.83 4.64 -1.96 -1.06 113.55 117.77 3day h SER 142 Ca -0.46 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.74 3day h SER 142 Cb 1.26 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.33 3day h SER 142 CO 0.62 0.12 -0.60 0.71 -0.87 0.00 0.00 176.83 176.81 3day h THR 143 N 0.00 1.42 -0.14 2.95 1.35 -1.94 -0.70 112.91 115.85 3day h THR 143 Ca -0.00 -2.06 -0.19 0.00 -0.55 0.00 0.00 66.41 63.60 3day h THR 143 Cb 0.24 2.12 0.01 0.00 -1.73 0.00 0.00 68.15 68.79 3day h THR 143 CO 0.02 0.59 -0.66 0.44 -0.25 0.00 0.00 175.52 175.65 3day h ASP 144 N 0.00 0.83 -0.17 5.36 3.32 -1.60 -2.58 116.42 121.58 3day h ASP 144 Ca -0.01 -0.63 -0.01 0.00 0.02 0.00 0.00 57.03 56.41 3day h ASP 144 Cb 1.07 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 3day h ASP 144 CO 0.08 1.32 0.09 0.40 -1.72 0.00 0.00 179.24 179.40 3day h ILE 145 N 0.39 1.12 -0.47 0.35 2.04 -1.23 -1.68 117.51 118.04 3day h ILE 145 Ca -0.04 -0.35 0.09 0.00 1.00 0.00 0.00 64.86 65.57 3day h ILE 145 Cb 1.29 1.04 -0.09 0.00 -0.74 0.00 0.00 36.82 38.33 3day h ILE 145 CO 0.14 0.11 -0.08 0.25 0.00 0.00 0.00 178.15 178.57 3day h LEU 146 N 0.16 -0.37 -0.13 1.44 5.85 -1.18 -1.01 115.31 120.06 3day h LEU 146 Ca 0.06 0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.93 3day h LEU 146 Cb 0.11 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3day h LEU 146 CO -0.01 -0.13 0.03 0.22 -0.34 0.00 0.00 178.44 178.21 3day h TYR 147 N 0.03 0.04 -0.33 1.25 3.20 -1.17 0.18 116.97 120.17 3day h TYR 147 Ca 0.23 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 3day h TYR 147 Cb 0.35 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3day h TYR 147 CO -0.37 0.02 0.02 0.00 -1.64 0.00 0.00 178.16 176.18 3day h ARG 148 N 0.08 0.57 -0.17 1.82 3.08 -1.15 0.19 114.38 118.79 3day h ARG 148 Ca 0.06 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 3day h ARG 148 Cb 0.05 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3day h ARG 148 CO -0.08 0.68 0.10 -0.07 -1.07 0.00 0.00 179.97 179.53 3day h LEU 149 N 0.38 0.21 -0.02 3.04 3.38 -0.92 -0.91 115.31 120.48 3day h LEU 149 Ca 0.10 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3day h LEU 149 Cb 0.41 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 3day h LEU 149 CO 0.01 0.23 0.00 1.56 0.09 0.00 0.00 178.44 180.34 3day h GLN 150 N 0.18 0.03 -0.47 1.13 4.20 -0.59 -1.29 115.11 118.31 3day h GLN 150 Ca 0.06 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 3day h GLN 150 Cb 0.06 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 3day h GLN 150 CO -0.01 0.25 0.14 0.52 -0.67 0.00 0.00 178.83 179.06 3day h MET 151 N -0.20 0.69 -0.00 1.46 2.86 -0.53 -2.50 114.93 116.71 3day h MET 151 Ca 0.01 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 3day h MET 151 Cb 0.24 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.78 3day h MET 151 CO 0.00 0.61 -0.55 -1.13 1.06 0.00 0.00 176.91 176.90 3day n SER 152 N -4.32 0.77 -4.02 1.22 3.41 -0.36 -4.96 113.62 105.38 3day n SER 152 Ca 0.03 -0.58 -0.31 0.00 -0.26 0.00 0.00 58.87 57.76 3day n SER 152 Cb 0.19 0.38 -0.00 0.00 -0.26 0.00 0.00 64.21 64.52 3day n SER 152 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3day n LYS 153 N -1.26 -4.15 -1.67 4.33 5.02 -0.50 -4.85 118.16 115.08 3day n LYS 153 Ca 0.07 0.48 -0.45 0.00 -2.02 0.00 0.00 58.31 56.38 3day n LYS 153 Cb 0.34 -5.12 -0.03 0.00 -0.02 0.00 0.00 35.03 30.21 3day n LYS 153 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3day n ALA 154 N -4.48 1.08 0.24 7.82 0.00 -1.11 -4.81 120.51 119.24 3day n ALA 154 Ca -0.05 0.42 0.12 0.00 0.00 0.00 0.00 53.44 53.92 3day n ALA 154 Cb 0.56 -2.28 0.09 0.00 0.00 0.00 0.00 19.45 17.83 3day n ALA 154 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3day h LYS 155 N 4.38 0.00 -3.40 0.00 1.57 -1.29 -2.67 116.57 115.16 3day h LYS 155 Ca -0.45 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.19 3day h LYS 155 Cb 1.28 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.38 3day h LYS 155 CO 0.77 0.00 -0.45 0.00 -0.57 0.00 0.00 179.45 179.20 3day s ALA 156 N -3.28 -0.43 -0.06 3.86 0.00 -1.12 -0.48 121.76 120.25 3day s ALA 156 Ca 0.03 0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.03 3day s ALA 156 Cb 0.09 0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.29 3day s ALA 156 CO 0.74 -0.21 -0.12 -1.50 0.00 0.00 0.00 175.76 174.67 3day s ILE 157 N -1.24 1.13 -0.24 0.00 2.07 -0.47 -0.73 121.20 121.72 3day s ILE 157 Ca -0.13 -0.49 -0.07 0.00 -1.41 0.00 0.00 60.65 58.55 3day s ILE 157 Cb -0.07 -1.03 -0.03 0.00 0.13 0.00 0.00 42.46 41.47 3day s ILE 157 CO 0.02 0.35 0.06 -0.69 -1.91 0.00 0.00 174.94 172.77 3day s VAL 158 N 0.59 4.27 0.12 4.00 1.01 1.00 -1.00 120.40 130.39 3day s VAL 158 Ca -0.13 -0.19 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 3day s VAL 158 Cb -0.15 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.21 3day s VAL 158 CO 0.03 0.35 0.10 0.00 0.00 0.00 0.00 175.10 175.59 3day s ALA 159 N 1.51 0.56 0.43 5.51 0.00 -0.50 -0.36 121.76 128.91 3day s ALA 159 Ca 0.06 -1.25 0.08 0.00 0.00 0.00 0.00 51.96 50.84 3day s ALA 159 Cb -0.15 0.75 0.01 0.00 0.00 0.00 0.00 23.12 23.73 3day s ALA 159 CO 0.03 -0.51 0.53 0.20 0.00 0.00 0.00 175.76 176.02 3day s GLY 160 N -3.00 1.99 0.44 0.00 0.00 -1.22 -0.73 107.32 104.80 3day s GLY 160 Ca 0.19 -1.74 0.30 0.00 0.00 0.00 0.00 44.72 43.47 3day s GLY 160 CO -0.01 -1.55 1.88 1.29 0.00 0.00 0.00 173.10 174.70 3day h ASP 161 N 0.71 0.00 0.71 1.64 3.04 -1.96 -1.80 116.42 118.75 3day h ASP 161 Ca -0.40 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.39 3day h ASP 161 Cb 1.28 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.57 3day h ASP 161 CO 0.48 0.00 0.00 -0.62 -2.04 0.00 0.00 179.24 177.06 3day n GLU 162 N -2.76 0.19 0.00 4.15 1.02 -1.26 -3.74 120.64 118.25 3day n GLU 162 Ca 0.01 0.04 0.01 0.00 -0.02 0.00 0.00 57.16 57.20 3day n GLU 162 Cb 0.28 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.20 3day n GLU 162 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 3day n VAL 163 N -1.39 0.00 0.22 2.62 0.24 -0.70 -4.77 118.33 114.56 3day n VAL 163 Ca 0.10 -0.48 0.07 0.00 -2.04 0.00 0.00 64.34 61.99 3day n VAL 163 Cb 0.26 1.00 0.58 0.00 -1.47 0.00 0.00 33.84 34.22 3day n VAL 163 CO 0.00 0.00 0.00 0.16 -2.14 0.00 0.00 176.83 174.85 3day h ILE 164 N 0.01 1.04 -0.26 1.34 3.07 -1.59 -0.91 117.51 120.22 3day h ILE 164 Ca 0.00 -0.17 -0.06 0.00 1.55 0.00 0.00 64.86 66.17 3day h ILE 164 Cb 0.03 1.03 -0.01 0.00 -0.27 0.00 0.00 36.82 37.60 3day h ILE 164 CO 0.00 0.05 -0.09 1.56 -1.05 0.00 0.00 178.15 178.63 3day h GLN 165 N 0.06 0.51 -0.66 0.16 4.20 -1.86 -0.89 115.11 116.64 3day h GLN 165 Ca 0.01 -0.21 -0.01 0.00 0.06 0.00 0.00 58.65 58.51 3day h GLN 165 Cb 0.07 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 3day h GLN 165 CO 0.00 0.75 0.38 0.93 -0.67 0.00 0.00 178.83 180.23 3day h GLU 166 N 0.25 0.90 -0.53 1.46 5.08 -1.72 -2.30 114.58 117.72 3day h GLU 166 Ca 0.06 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3day h GLU 166 Cb 0.57 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 3day h GLU 166 CO 0.03 0.65 0.33 0.28 -1.00 0.00 0.00 179.01 179.30 3day h VAL 167 N 0.89 1.08 0.00 3.13 2.07 -1.04 -2.81 116.25 119.58 3day h VAL 167 Ca 0.23 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.53 3day h VAL 167 Cb -0.00 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 3day h VAL 167 CO -0.04 0.12 0.00 0.44 0.02 0.00 0.00 177.57 178.11 3day h ASP 168 N 0.66 0.00 0.53 0.57 3.32 -0.95 -0.25 116.42 120.30 3day h ASP 168 Ca 0.21 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 3day h ASP 168 Cb -0.01 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 3day h ASP 168 CO -0.08 0.00 -0.12 0.71 -1.72 0.00 0.00 179.24 178.03 3day h THR 169 N 0.00 0.46 0.00 0.35 1.35 -1.14 -3.35 112.91 110.58 3day h THR 169 Ca 0.00 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 3day h THR 169 Cb 0.64 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 3day h THR 169 CO 0.00 0.12 0.00 1.33 -0.25 0.00 0.00 175.52 176.72 3day n VAL 170 N -3.49 0.00 -0.13 6.82 0.24 -0.66 -4.81 118.33 116.31 3day n VAL 170 Ca -0.01 -0.42 -0.00 0.00 -2.04 0.00 0.00 64.34 61.87 3day n VAL 170 Cb 0.28 1.02 0.26 0.00 -1.47 0.00 0.00 33.84 33.93 3day n VAL 170 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3day h ALA 171 N 0.00 1.41 0.00 2.33 0.00 -1.22 -0.89 119.26 120.90 3day h ALA 171 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3day h ALA 171 Cb 0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3day h ALA 171 CO 0.00 0.47 -0.03 0.66 0.00 0.00 0.00 179.25 180.35 3day h SER 172 N 0.81 0.00 -0.07 0.00 4.64 -1.86 -0.93 113.55 116.14 3day h SER 172 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3day h SER 172 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3day h SER 172 CO -0.03 0.03 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 3day n GLU 173 N -3.27 1.25 -3.92 4.77 1.02 -0.34 -4.66 120.64 115.48 3day n GLU 173 Ca -0.02 -0.37 -0.31 0.00 -0.02 0.00 0.00 57.16 56.44 3day n GLU 173 Cb 0.17 -1.25 -0.13 0.00 -0.02 0.00 0.00 31.44 30.21 3day n GLU 173 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3day h PRO 175 N 6.55 0.00 0.00 0.00 0.13 -1.83 -2.30 132.00 134.55 3day h PRO 175 Ca -0.07 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.00 3day h PRO 175 Cb 0.90 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 3day h PRO 175 CO 0.69 0.05 -0.29 0.77 -0.23 0.00 0.00 178.00 178.99 3day h SER 176 N 0.00 0.00 -2.49 1.44 0.02 -1.90 -3.45 113.55 107.17 3day h SER 176 Ca -0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 3day h SER 176 Cb 0.65 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 3day h SER 176 CO 0.01 0.29 1.27 -0.22 -1.14 0.00 0.00 176.83 177.04 3day s LEU 177 N -6.50 3.74 -0.09 5.07 2.96 -0.87 -4.13 118.68 118.86 3day s LEU 177 Ca 0.03 1.74 0.06 0.00 -0.22 0.00 0.00 54.13 55.75 3day s LEU 177 Cb 0.08 -3.52 -0.10 0.00 0.50 0.00 0.00 46.19 43.15 3day s LEU 177 CO 0.69 -1.53 -0.00 -1.14 -1.32 0.00 0.00 176.35 173.04 3day n ARG 178 N 8.13 2.00 -4.83 1.98 0.63 0.36 -4.99 116.66 119.95 3day n ARG 178 Ca 0.23 0.01 -0.31 0.00 -0.92 0.00 0.00 57.85 56.86 3day n ARG 178 Cb 0.45 -1.22 -0.17 0.00 0.45 0.00 0.00 32.46 31.97 3day n ARG 178 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 3day s ILE 179 N -2.21 1.92 -0.23 5.15 -1.09 -0.59 -5.03 121.20 119.12 3day s ILE 179 Ca -0.07 -0.92 -0.02 0.00 -2.23 0.00 0.00 60.65 57.41 3day s ILE 179 Cb 0.03 -1.70 0.01 0.00 -1.58 0.00 0.00 42.46 39.22 3day s ILE 179 CO 0.33 0.53 -0.07 -0.54 -1.23 0.00 0.00 174.94 173.96 3day s LYS 180 N 0.67 3.08 -0.19 2.79 1.02 -1.26 -1.37 119.74 124.47 3day s LYS 180 Ca -0.12 -0.81 -0.00 0.00 0.02 0.00 0.00 55.97 55.06 3day s LYS 180 Cb -0.16 -2.95 0.01 0.00 -0.52 0.00 0.00 37.83 34.21 3day s LYS 180 CO 0.02 -0.30 -0.16 -1.17 -0.92 0.00 0.00 175.35 172.83 3day s LEU 181 N 1.39 2.35 -0.14 3.17 2.96 -0.17 -0.15 118.68 128.09 3day s LEU 181 Ca 0.03 -0.59 -0.04 0.00 -0.22 0.00 0.00 54.13 53.32 3day s LEU 181 Cb -0.15 -1.55 -0.03 0.00 0.50 0.00 0.00 46.19 44.96 3day s LEU 181 CO -0.05 -0.01 -0.02 -0.22 -1.32 0.00 0.00 176.35 174.74 3day s LEU 182 N 1.34 3.41 -0.32 -0.68 2.96 -0.22 -1.41 118.68 123.76 3day s LEU 182 Ca 0.05 -0.03 -0.06 0.00 -0.22 0.00 0.00 54.13 53.87 3day s LEU 182 Cb -0.13 -1.81 0.03 0.00 0.50 0.00 0.00 46.19 44.77 3day s LEU 182 CO -0.10 0.22 0.08 -0.69 -1.32 0.00 0.00 176.35 174.54 3day s VAL 183 N 0.04 3.73 -0.15 1.68 1.01 0.10 -1.43 120.40 125.37 3day s VAL 183 Ca 0.01 -1.02 -0.31 0.00 0.00 0.00 0.00 61.98 60.67 3day s VAL 183 Cb -0.13 -3.05 0.13 0.00 0.00 0.00 0.00 36.38 33.33 3day s VAL 183 CO 0.02 -0.08 1.06 -0.55 0.00 0.00 0.00 175.10 175.55 3day s SER 184 N 1.42 -0.28 0.12 3.32 0.15 -1.26 -3.71 113.70 113.46 3day s SER 184 Ca -0.01 0.18 0.22 0.00 0.70 0.00 0.00 55.95 57.05 3day s SER 184 Cb -0.19 0.25 0.89 0.00 -1.71 0.00 0.00 66.02 65.27 3day s SER 184 CO 0.02 -0.34 1.69 -0.62 1.20 0.00 0.00 173.24 175.19 3day n GLU 185 N 0.32 0.11 -4.54 5.44 -0.58 -1.26 -4.74 120.64 115.39 3day n GLU 185 Ca -0.06 0.24 -0.26 0.00 -0.42 0.00 0.00 57.16 56.66 3day n GLU 185 Cb 0.59 -1.67 -0.10 0.00 -0.57 0.00 0.00 31.44 29.69 3day n GLU 185 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3day s LYS 186 N -3.11 1.81 0.25 3.49 1.02 -1.26 -5.16 119.74 116.77 3day s LYS 186 Ca 0.08 -1.92 0.02 0.00 0.02 0.00 0.00 55.97 54.18 3day s LYS 186 Cb 0.12 -1.71 -0.03 0.00 -0.52 0.00 0.00 37.83 35.68 3day s LYS 186 CO 0.42 0.16 0.40 -1.54 -0.92 0.00 0.00 175.35 173.87 3day s SER 187 N -3.60 6.33 -0.03 2.83 1.04 -1.26 -4.98 113.70 114.03 3day s SER 187 Ca 0.32 0.24 -0.01 0.00 0.48 0.00 0.00 55.95 56.99 3day s SER 187 Cb 0.02 -1.94 0.03 0.00 0.10 0.00 0.00 66.02 64.23 3day s SER 187 CO 0.16 -0.10 0.05 0.00 0.98 0.00 0.00 173.24 174.33 3day s ASP 189 N 1.13 6.38 0.00 0.00 1.01 -1.26 -1.85 116.67 122.09 3day s ASP 189 Ca -0.09 2.98 0.00 0.00 0.71 0.00 0.00 52.55 56.16 3day s ASP 189 Cb -0.13 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.15 3day s ASP 189 CO -0.03 -0.87 0.00 0.61 0.21 0.00 0.00 175.17 175.09 3day n GLY 190 N 1.19 2.54 3.47 0.21 0.00 -1.26 -5.04 105.19 106.31 3day n GLY 190 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 3day n GLY 190 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3day s TRP 191 N -2.32 2.91 0.40 1.61 0.52 -0.77 -4.55 118.94 116.75 3day s TRP 191 Ca 0.00 -0.34 -0.25 0.00 0.02 0.00 0.00 56.10 55.53 3day s TRP 191 Cb 0.00 -1.85 -0.08 0.00 -1.15 0.00 0.00 33.47 30.39 3day s TRP 191 CO 0.00 -0.01 1.15 -0.51 0.02 0.00 0.00 176.95 177.60 3day s LEU 192 N 0.05 4.17 -0.89 2.99 1.43 0.78 -4.57 118.68 122.64 3day s LEU 192 Ca -0.02 2.28 -0.19 0.00 -1.03 0.00 0.00 54.13 55.17 3day s LEU 192 Cb -0.14 -4.07 0.12 0.00 0.03 0.00 0.00 46.19 42.13 3day s LEU 192 CO 0.03 -0.66 1.10 0.21 0.23 0.00 0.00 176.35 177.26 3day s ASN 193 N -1.24 6.56 0.20 2.29 3.84 -1.26 -1.05 114.94 124.27 3day s ASN 193 Ca 0.58 -1.89 -0.17 0.00 0.21 0.00 0.00 52.86 51.59 3day s ASN 193 Cb -0.29 -2.40 0.18 0.00 -0.55 0.00 0.00 41.25 38.19 3day s ASN 193 CO 0.36 -1.12 1.60 0.15 -2.79 0.00 0.00 177.10 175.30 3day h PHE 194 N 8.95 -0.67 -0.56 0.43 3.57 -1.61 -1.01 116.94 126.05 3day h PHE 194 Ca 0.09 0.07 -0.07 0.00 3.53 0.00 0.00 57.97 61.59 3day h PHE 194 Cb 1.03 0.39 -0.02 0.00 2.79 0.00 0.00 35.95 40.14 3day h PHE 194 CO 1.13 -0.34 0.08 0.87 -2.23 0.00 0.00 178.31 177.82 3day h LYS 195 N -0.10 0.93 -0.26 1.11 1.57 -1.85 0.21 116.57 118.18 3day h LYS 195 Ca 0.27 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 3day h LYS 195 Cb 0.53 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 3day h LYS 195 CO -0.68 0.90 0.01 -0.22 -0.57 0.00 0.00 179.45 178.89 3day h LYS 196 N 0.82 0.44 -0.86 3.15 1.63 -1.89 -2.66 116.57 117.19 3day h LYS 196 Ca 0.17 -0.13 -0.02 0.00 -0.85 0.00 0.00 60.65 59.81 3day h LYS 196 Cb 0.42 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.97 3day h LYS 196 CO 0.01 0.60 0.45 -0.07 -3.45 0.00 0.00 179.45 176.99 3day h LEU 197 N 0.23 1.10 -0.18 5.20 3.38 -0.96 -2.55 115.31 121.54 3day h LEU 197 Ca 0.07 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 57.96 3day h LEU 197 Cb 0.39 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3day h LEU 197 CO 0.01 0.90 0.01 0.25 0.09 0.00 0.00 178.44 179.70 3day h LEU 198 N 1.22 -0.04 -1.25 1.67 5.85 -0.52 -1.43 115.31 120.80 3day h LEU 198 Ca 0.30 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 59.00 3day h LEU 198 Cb 0.07 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 3day h LEU 198 CO -0.04 0.00 -0.13 -1.13 -0.34 0.00 0.00 178.44 176.80 3day h ASN 199 N 0.07 0.33 1.39 1.25 -1.24 -1.35 -2.22 115.58 113.82 3day h ASN 199 Ca 0.08 -0.08 0.00 0.00 0.71 0.00 0.00 56.30 57.01 3day h ASN 199 Cb 0.09 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.05 3day h ASN 199 CO -0.13 0.50 0.00 -0.33 -1.29 0.00 0.00 177.43 176.18 3day h GLU 200 N 0.33 0.00 -7.03 6.67 5.08 -1.09 -3.47 114.58 115.07 3day h GLU 200 Ca 0.06 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.96 3day h GLU 200 Cb 0.44 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.70 3day h GLU 200 CO 0.03 0.00 0.38 0.00 -1.00 0.00 0.00 179.01 178.41 3day s ALA 201 N -3.36 2.98 0.33 3.43 0.00 -0.57 -5.03 121.76 119.54 3day s ALA 201 Ca 0.05 0.58 -0.29 0.00 0.00 0.00 0.00 51.96 52.30 3day s ALA 201 Cb 0.08 -3.23 -0.10 0.00 0.00 0.00 0.00 23.12 19.87 3day s ALA 201 CO 0.57 -0.16 1.35 0.45 0.00 0.00 0.00 175.76 177.98 3day s SER 202 N -1.90 6.68 0.00 0.00 0.15 -1.26 -4.87 113.70 112.50 3day s SER 202 Ca 0.63 2.75 0.30 0.00 0.70 0.00 0.00 55.95 60.33 3day s SER 202 Cb -0.16 -2.65 1.73 0.00 -1.71 0.00 0.00 66.02 63.22 3day s SER 202 CO 0.20 -0.62 2.11 0.35 1.20 0.00 0.00 173.24 176.49 3day n THR 203 N 0.91 0.01 -3.64 6.45 -2.24 -1.26 -3.39 114.28 111.12 3day n THR 203 Ca 0.01 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.41 3day n THR 203 Cb 0.41 -0.53 -0.12 0.00 -2.10 0.00 0.00 70.33 68.00 3day n THR 203 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3day s THR 204 N -2.14 4.72 -0.03 4.28 2.01 -1.26 -4.66 115.64 118.55 3day s THR 204 Ca 0.41 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 62.13 3day s THR 204 Cb 0.21 -3.38 -0.01 0.00 0.01 0.00 0.00 72.50 69.32 3day s THR 204 CO 0.37 0.09 -0.18 -2.28 -0.69 0.00 0.00 174.62 171.93 3day s HIS 205 N 1.64 1.76 -0.74 4.92 2.46 -1.26 -4.93 115.29 119.14 3day s HIS 205 Ca 0.05 -0.44 -0.23 0.00 0.47 0.00 0.00 55.06 54.90 3day s HIS 205 Cb -0.17 -1.16 0.06 0.00 -0.13 0.00 0.00 32.58 31.18 3day s HIS 205 CO 0.07 -0.12 1.11 -1.01 -2.47 0.00 0.00 174.74 172.32 3day s HIS 206 N -0.16 2.60 0.26 3.88 3.76 -1.26 -4.99 115.29 119.38 3day s HIS 206 Ca 0.00 -0.52 -0.31 0.00 -0.15 0.00 0.00 55.06 54.08 3day s HIS 206 Cb -0.10 -4.42 -0.12 0.00 1.11 0.00 0.00 32.58 29.05 3day s HIS 206 CO 0.01 -1.78 1.54 0.00 -0.85 0.00 0.00 174.74 173.66 3day s VAL 208 N 0.14 2.87 -1.33 0.00 1.01 0.10 -4.91 120.40 118.28 3day s VAL 208 Ca 0.68 0.71 -0.17 0.00 0.00 0.00 0.00 61.98 63.20 3day s VAL 208 Cb -0.57 -3.45 0.07 0.00 0.00 0.00 0.00 36.38 32.43 3day s VAL 208 CO 0.47 0.10 1.84 1.21 0.00 0.00 0.00 175.10 178.72 3day n GLU 209 N 2.65 3.14 -2.44 2.72 2.13 -1.26 -4.92 120.64 122.65 3day n GLU 209 Ca 0.07 -3.16 -0.39 0.00 0.66 0.00 0.00 57.16 54.35 3day n GLU 209 Cb 0.41 -3.42 -0.04 0.00 0.27 0.00 0.00 31.44 28.66 3day n GLU 209 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 3day s THR 210 N 3.80 3.45 0.41 6.31 -4.23 -1.26 -4.97 115.64 119.15 3day s THR 210 Ca 0.52 1.34 -0.25 0.00 -1.18 0.00 0.00 61.69 62.11 3day s THR 210 Cb 0.06 -3.80 -0.08 0.00 1.34 0.00 0.00 72.50 70.01 3day s THR 210 CO 0.04 0.23 1.17 -0.83 -0.54 0.00 0.00 174.62 174.69 3day s GLY 211 N -1.05 2.85 0.52 3.99 0.00 -1.26 -1.88 107.32 110.48 3day s GLY 211 Ca 0.50 0.97 0.16 0.00 0.00 0.00 0.00 44.72 46.35 3day s GLY 211 CO 0.38 1.48 2.14 1.48 0.00 0.00 0.00 173.10 178.58 3day h SER 212 N 2.52 0.00 -0.15 1.64 4.64 -1.39 -2.09 113.55 118.72 3day h SER 212 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3day h SER 212 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3day h SER 212 CO 0.62 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.59 3day n GLN 213 N -4.50 1.58 -2.10 4.77 6.02 -1.26 -1.48 117.38 120.41 3day n GLN 213 Ca -0.03 -1.64 -0.38 0.00 -0.01 0.00 0.00 57.00 54.94 3day n GLN 213 Cb 0.10 -1.31 0.00 0.00 1.02 0.00 0.00 30.24 30.05 3day n GLN 213 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3day s GLU 214 N -1.19 3.67 0.15 -1.09 2.12 -0.79 -4.79 118.70 116.78 3day s GLU 214 Ca 0.22 1.97 -0.31 0.00 0.36 0.00 0.00 54.97 57.20 3day s GLU 214 Cb 0.14 -2.46 -0.09 0.00 0.26 0.00 0.00 34.13 31.97 3day s GLU 214 CO 0.20 -0.68 1.52 0.00 -0.54 0.00 0.00 175.26 175.75 3day s ALA 215 N -1.42 3.72 -0.05 6.30 0.00 -1.26 -2.09 121.76 126.96 3day s ALA 215 Ca 0.64 1.30 0.02 0.00 0.00 0.00 0.00 51.96 53.91 3day s ALA 215 Cb -0.34 -3.60 -0.05 0.00 0.00 0.00 0.00 23.12 19.14 3day s ALA 215 CO 0.41 -0.74 -0.03 0.45 0.00 0.00 0.00 175.76 175.85 3day n SER 216 N 4.00 3.64 -3.88 0.00 2.88 0.26 -4.71 113.62 115.82 3day n SER 216 Ca 0.13 -0.02 -0.11 0.00 -1.33 0.00 0.00 58.87 57.54 3day n SER 216 Cb 0.40 0.15 -0.10 0.00 -0.75 0.00 0.00 64.21 63.91 3day n SER 216 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3day s ALA 217 N -2.12 -0.28 -0.14 -1.46 0.00 -0.82 -1.28 121.76 115.67 3day s ALA 217 Ca -0.06 -0.23 0.00 0.00 0.00 0.00 0.00 51.96 51.68 3day s ALA 217 Cb 0.02 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.31 3day s ALA 217 CO 0.16 -0.24 -0.13 0.42 0.00 0.00 0.00 175.76 175.97 3day s ILE 218 N -1.70 1.46 -0.23 0.00 1.01 -0.60 -1.11 121.20 120.03 3day s ILE 218 Ca -0.12 -0.56 -0.07 0.00 0.00 0.00 0.00 60.65 59.90 3day s ILE 218 Cb -0.06 -1.38 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 3day s ILE 218 CO 0.00 0.44 0.05 -0.31 0.00 0.00 0.00 174.94 175.12 3day s TYR 219 N 1.51 3.08 0.10 3.97 2.02 -0.20 -4.08 117.35 123.76 3day s TYR 219 Ca 0.05 -0.40 -0.30 0.00 -0.37 0.00 0.00 57.07 56.04 3day s TYR 219 Cb -0.13 -2.18 -0.06 0.00 -0.40 0.00 0.00 41.96 39.20 3day s TYR 219 CO -0.10 -0.28 1.03 -0.06 -1.57 0.00 0.00 175.55 174.56 3day s PHE 220 N 1.33 3.69 0.64 2.71 0.08 -1.26 -0.62 117.98 124.55 3day s PHE 220 Ca 0.05 1.67 -0.13 0.00 0.12 0.00 0.00 56.93 58.64 3day s PHE 220 Cb -0.15 -3.16 -0.02 0.00 -0.57 0.00 0.00 43.02 39.12 3day s PHE 220 CO 0.03 -0.20 1.05 0.95 -0.10 0.00 0.00 175.22 176.95 3day s THR 221 N 0.26 4.02 -0.68 0.64 -4.23 -0.27 -4.92 115.64 110.46 3day s THR 221 Ca 0.50 0.78 0.22 0.00 -1.18 0.00 0.00 61.69 62.01 3day s THR 221 Cb -0.25 -3.44 0.23 0.00 1.34 0.00 0.00 72.50 70.38 3day s THR 221 CO 0.31 -0.74 1.69 -1.54 -0.54 0.00 0.00 174.62 173.80 3day n SER 222 N -2.61 0.50 0.00 3.99 3.41 -1.26 -4.38 113.62 113.26 3day n SER 222 Ca 0.08 0.60 0.00 0.00 -0.26 0.00 0.00 58.87 59.29 3day n SER 222 Cb 0.53 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 3day n SER 222 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3day n GLY 223 N 0.34 1.01 0.19 5.00 0.00 -1.26 -4.52 105.19 105.95 3day n GLY 223 Ca 0.03 -0.20 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 3day n GLY 223 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3day h THR 224 N 0.00 1.15 -0.01 2.61 2.02 -1.92 -2.95 112.91 113.81 3day h THR 224 Ca 0.00 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.79 3day h THR 224 Cb 0.03 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 3day h THR 224 CO 0.00 0.16 -0.37 -1.54 0.37 0.00 0.00 175.52 174.14 3day n SER 225 N -4.73 1.47 0.00 4.18 3.41 -1.26 -4.41 113.62 112.28 3day n SER 225 Ca 0.00 -1.17 0.00 0.00 -0.26 0.00 0.00 58.87 57.44 3day n SER 225 Cb 0.08 0.30 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 3day n SER 225 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3day n GLY 226 N 1.38 -0.61 3.69 5.00 0.00 -1.11 -4.77 105.19 108.77 3day n GLY 226 Ca 0.11 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 3day n GLY 226 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3day n LEU 227 N 0.00 3.77 -4.61 0.99 4.77 -1.26 -4.27 117.00 116.38 3day n LEU 227 Ca 0.00 1.13 -0.47 0.00 -0.03 0.00 0.00 56.01 56.64 3day n LEU 227 Cb 0.00 -1.48 -0.03 0.00 -2.33 0.00 0.00 43.42 39.57 3day n LEU 227 CO 0.00 -0.67 0.82 -2.65 -1.33 0.00 0.00 177.39 173.56 3day n PRO 228 N 0.20 1.48 -3.85 3.23 -0.02 -1.26 -4.79 135.00 129.99 3day n PRO 228 Ca 0.06 0.53 -0.34 0.00 -2.02 0.00 0.00 63.50 61.74 3day n PRO 228 Cb 0.38 -2.08 -0.05 0.00 -0.02 0.00 0.00 33.50 31.74 3day n PRO 228 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3day s LYS 229 N -0.43 3.49 -0.48 -0.52 1.02 -1.26 -4.82 119.74 116.75 3day s LYS 229 Ca 0.71 -0.23 -0.20 0.00 0.02 0.00 0.00 55.97 56.27 3day s LYS 229 Cb -0.77 -3.08 0.04 0.00 -0.52 0.00 0.00 37.83 33.50 3day s LYS 229 CO 0.51 0.65 0.64 -1.64 -0.92 0.00 0.00 175.35 174.60 3day s MET 230 N -1.93 3.18 -0.39 1.68 -1.94 -1.26 -1.12 119.30 117.52 3day s MET 230 Ca 0.28 -0.67 -0.16 0.00 -1.71 0.00 0.00 55.69 53.43 3day s MET 230 Cb -0.13 -4.04 0.01 0.00 2.01 0.00 0.00 34.83 32.68 3day s MET 230 CO 0.18 -1.14 0.37 0.00 -0.01 0.00 0.00 175.02 174.43 3day s ALA 231 N 2.74 3.46 -0.12 3.03 0.00 0.21 -0.47 121.76 130.61 3day s ALA 231 Ca 0.18 -1.45 -0.20 0.00 0.00 0.00 0.00 51.96 50.49 3day s ALA 231 Cb -0.17 -2.92 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 3day s ALA 231 CO 0.15 -1.36 0.58 -2.00 0.00 0.00 0.00 175.76 173.13 3day s GLU 232 N 1.98 4.34 0.02 0.00 2.12 -0.92 -1.03 118.70 125.22 3day s GLU 232 Ca 0.10 0.62 0.08 0.00 0.36 0.00 0.00 54.97 56.13 3day s GLU 232 Cb -0.17 -3.47 -0.03 0.00 0.26 0.00 0.00 34.13 30.72 3day s GLU 232 CO 0.12 0.04 -0.22 -1.01 -0.54 0.00 0.00 175.26 173.66 3day s HIS 233 N 0.96 2.46 0.49 5.30 3.76 -0.26 0.59 115.29 128.59 3day s HIS 233 Ca 0.30 -0.32 0.01 0.00 -0.15 0.00 0.00 55.06 54.90 3day s HIS 233 Cb -0.16 -1.46 0.01 0.00 1.11 0.00 0.00 32.58 32.08 3day s HIS 233 CO 0.13 0.16 0.71 -1.54 -0.85 0.00 0.00 174.74 173.35 3day s SER 234 N -1.17 5.56 0.28 1.40 1.04 -1.26 -0.57 113.70 118.98 3day s SER 234 Ca 0.13 0.09 0.01 0.00 0.48 0.00 0.00 55.95 56.66 3day s SER 234 Cb -0.10 -1.16 0.60 0.00 0.10 0.00 0.00 66.02 65.45 3day s SER 234 CO 0.03 -0.91 1.77 1.88 0.98 0.00 0.00 173.24 176.99 3day h TYR 235 N 0.27 0.88 0.16 5.02 0.05 -1.49 -2.72 116.97 119.14 3day h TYR 235 Ca -0.44 0.03 -0.29 0.00 0.05 0.00 0.00 58.73 58.08 3day h TYR 235 Cb 1.28 -0.25 0.01 0.00 1.01 0.00 0.00 36.73 38.78 3day h TYR 235 CO 0.41 0.21 -1.31 0.66 -1.05 0.00 0.00 178.16 177.08 3day h SER 236 N 0.69 0.53 0.33 3.88 4.64 -1.54 -0.73 113.55 121.35 3day h SER 236 Ca 0.50 -0.57 -0.02 0.00 -0.47 0.00 0.00 61.79 61.23 3day h SER 236 Cb 0.72 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.63 3day h SER 236 CO -0.36 1.45 -0.11 0.77 -0.87 0.00 0.00 176.83 177.70 3day h SER 237 N 0.09 0.00 0.00 4.97 4.64 -1.75 -1.02 113.55 120.49 3day h SER 237 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3day h SER 237 Cb 2.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.11 3day h SER 237 CO 0.22 0.11 -0.53 0.18 -0.87 0.00 0.00 176.83 175.94 3day n LEU 238 N -3.69 1.24 0.05 5.97 4.77 -1.04 -4.03 117.00 120.28 3day n LEU 238 Ca -0.02 0.32 -0.17 0.00 -0.03 0.00 0.00 56.01 56.12 3day n LEU 238 Cb 0.23 -0.69 -0.08 0.00 -2.33 0.00 0.00 43.42 40.55 3day n LEU 238 CO 0.30 -0.40 0.13 1.23 -1.33 0.00 0.00 177.39 177.32 3day h GLY 239 N -0.66 0.63 0.90 -0.72 0.00 -1.17 -1.17 103.07 100.88 3day h GLY 239 Ca 0.00 -1.11 -0.18 0.00 0.00 0.00 0.00 47.33 46.04 3day h GLY 239 CO 0.00 0.98 -0.71 -2.00 0.00 0.00 0.00 176.54 174.80 3day h LEU 240 N 0.32 0.63 -0.02 3.11 5.85 -1.36 -1.20 115.31 122.65 3day h LEU 240 Ca -0.11 -0.75 0.03 0.00 0.84 0.00 0.00 57.88 57.89 3day h LEU 240 Cb 1.64 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.44 3day h LEU 240 CO 0.18 1.30 -0.19 0.50 -0.34 0.00 0.00 178.44 179.90 3day h LYS 241 N 0.03 -0.29 -0.50 1.25 1.63 -1.30 0.19 116.57 117.59 3day h LYS 241 Ca -0.09 0.02 0.07 0.00 -0.85 0.00 0.00 60.65 59.80 3day h LYS 241 Cb 1.41 0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 33.05 3day h LYS 241 CO 0.14 -0.19 0.17 0.00 -3.45 0.00 0.00 179.45 176.12 3day h ALA 242 N 0.62 0.61 -0.46 5.00 0.00 -1.21 0.14 119.26 123.96 3day h ALA 242 Ca 0.06 0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.12 3day h ALA 242 Cb 0.38 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.14 3day h ALA 242 CO -0.19 -0.22 0.03 -0.22 0.00 0.00 0.00 179.25 178.65 3day h LYS 243 N 0.35 0.14 -0.26 0.00 3.64 -0.82 -0.28 116.57 119.34 3day h LYS 243 Ca 0.24 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.53 3day h LYS 243 Cb 0.26 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 3day h LYS 243 CO -0.25 0.10 -0.17 0.52 -2.27 0.00 0.00 179.45 177.38 3day h MET 244 N 0.15 0.46 -0.00 1.90 2.86 0.13 -2.89 114.93 117.54 3day h MET 244 Ca 0.23 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 3day h MET 244 Cb 0.33 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.94 3day h MET 244 CO -0.35 0.62 -0.08 -0.25 1.06 0.00 0.00 176.91 177.90 3day n ASP 245 N -4.18 0.13 -4.67 1.22 8.00 0.42 -4.96 116.55 112.51 3day n ASP 245 Ca 0.00 0.13 -0.47 0.00 0.71 0.00 0.00 54.79 55.17 3day n ASP 245 Cb 0.34 -0.30 -0.04 0.00 -0.02 0.00 0.00 41.12 41.10 3day n ASP 245 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3day n ALA 246 N -1.39 1.19 -0.12 2.24 0.00 -0.17 -1.98 120.51 120.29 3day n ALA 246 Ca 0.09 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.95 3day n ALA 246 Cb 0.31 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.39 3day n ALA 246 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3day n GLY 247 N 3.59 0.55 0.31 0.00 0.00 -1.26 -4.98 105.19 103.41 3day n GLY 247 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 3day n GLY 247 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 3day h TRP 248 N 0.00 0.19 0.00 1.61 5.08 -1.73 -0.79 115.95 120.31 3day h TRP 248 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 3day h TRP 248 Cb 0.00 -0.06 0.00 0.00 -3.00 0.00 0.00 29.16 26.10 3day h TRP 248 CO 0.00 0.10 0.00 0.25 -1.28 0.00 0.00 178.44 177.51 3day n THR 249 N -4.48 0.95 -0.17 0.12 -2.24 -1.26 -3.79 114.28 103.41 3day n THR 249 Ca 0.03 0.42 0.00 0.00 -2.27 0.00 0.00 64.05 62.23 3day n THR 249 Cb 0.25 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 3day n THR 249 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3day n GLY 250 N -0.51 1.24 3.76 3.38 0.00 -0.30 -4.78 105.19 107.98 3day n GLY 250 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 3day n GLY 250 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3day s LEU 251 N 0.00 3.98 0.29 0.99 2.96 -1.26 -5.03 118.68 120.61 3day s LEU 251 Ca 0.00 2.80 0.04 0.00 -0.22 0.00 0.00 54.13 56.75 3day s LEU 251 Cb 0.00 -4.12 -0.06 0.00 0.50 0.00 0.00 46.19 42.51 3day s LEU 251 CO 0.00 -1.36 0.04 -1.10 -1.32 0.00 0.00 176.35 172.61 3day s GLN 252 N -2.69 1.55 0.40 1.98 -0.21 -1.26 -4.53 119.66 114.90 3day s GLN 252 Ca 0.66 -1.84 0.10 0.00 0.02 0.00 0.00 55.36 54.30 3day s GLN 252 Cb -0.41 -0.75 0.89 0.00 1.00 0.00 0.00 33.01 33.74 3day s GLN 252 CO 0.51 -0.17 1.99 0.00 -2.12 0.00 0.00 175.29 175.50 3day h ALA 253 N 2.24 1.84 -0.39 6.09 0.00 -1.90 -1.92 119.26 125.22 3day h ALA 253 Ca -0.40 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3day h ALA 253 Cb 1.24 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3day h ALA 253 CO 0.67 0.06 0.00 0.43 0.00 0.00 0.00 179.25 180.42 3day n SER 254 N -4.48 2.07 -4.92 0.00 7.64 -1.26 -3.43 113.62 109.24 3day n SER 254 Ca 0.08 -2.00 -0.20 0.00 1.01 0.00 0.00 58.87 57.77 3day n SER 254 Cb 0.25 -0.26 -0.02 0.00 -1.01 0.00 0.00 64.21 63.17 3day n SER 254 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3day s ASP 255 N -1.00 5.46 -0.17 6.43 1.01 -0.72 -4.96 116.67 122.72 3day s ASP 255 Ca 0.26 -0.47 -0.01 0.00 0.71 0.00 0.00 52.55 53.03 3day s ASP 255 Cb 0.13 -0.86 -0.01 0.00 1.01 0.00 0.00 42.92 43.20 3day s ASP 255 CO 0.18 -0.54 -0.11 -0.63 0.21 0.00 0.00 175.17 174.28 3day s ILE 256 N -2.33 3.03 -0.13 0.77 1.01 -1.26 -1.50 121.20 120.79 3day s ILE 256 Ca 0.47 -0.64 -0.04 0.00 0.00 0.00 0.00 60.65 60.44 3day s ILE 256 Cb -0.07 -2.31 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 3day s ILE 256 CO 0.29 0.49 0.01 -0.32 0.00 0.00 0.00 174.94 175.41 3day s MET 257 N 0.92 3.45 -0.39 2.79 1.75 -0.35 -1.78 119.30 125.69 3day s MET 257 Ca -0.02 -0.41 -0.07 0.00 -1.25 0.00 0.00 55.69 53.93 3day s MET 257 Cb -0.15 -2.95 0.07 0.00 2.84 0.00 0.00 34.83 34.64 3day s MET 257 CO -0.00 0.47 0.20 -0.46 -0.65 0.00 0.00 175.02 174.57 3day s TRP 258 N -0.22 3.34 -0.26 4.11 -0.00 0.43 -0.83 118.94 125.51 3day s TRP 258 Ca 0.06 -1.61 -0.18 0.00 -0.00 0.00 0.00 56.10 54.37 3day s TRP 258 Cb -0.12 -2.77 -0.03 0.00 -0.00 0.00 0.00 33.47 30.55 3day s TRP 258 CO 0.02 -0.83 0.53 0.99 -0.00 0.00 0.00 176.95 177.66 3day s THR 259 N 1.38 5.06 -0.43 5.86 2.01 -1.26 -1.44 115.64 126.82 3day s THR 259 Ca 0.02 0.91 -0.15 0.00 0.31 0.00 0.00 61.69 62.78 3day s THR 259 Cb -0.22 -3.84 0.04 0.00 0.01 0.00 0.00 72.50 68.49 3day s THR 259 CO 0.01 0.09 0.34 -0.63 -0.69 0.00 0.00 174.62 173.74 3day s ILE 260 N 2.27 5.24 -0.17 1.82 1.01 0.73 -4.91 121.20 127.19 3day s ILE 260 Ca 0.22 -0.77 -0.28 0.00 0.00 0.00 0.00 60.65 59.82 3day s ILE 260 Cb -0.16 -4.00 0.08 0.00 0.01 0.00 0.00 42.46 38.40 3day s ILE 260 CO 0.09 -0.40 0.76 -0.55 0.00 0.00 0.00 174.94 174.84 3day s SER 261 N 1.98 -0.65 0.37 3.58 0.15 -1.26 -4.54 113.70 113.33 3day s SER 261 Ca 0.05 0.99 -0.28 0.00 0.70 0.00 0.00 55.95 57.41 3day s SER 261 Cb -0.21 0.92 -0.11 0.00 -1.71 0.00 0.00 66.02 64.91 3day s SER 261 CO 0.09 -0.40 1.48 -0.62 1.20 0.00 0.00 173.24 175.00 3day s ASP 262 N -0.42 6.37 0.25 5.45 -1.08 -1.26 -4.91 116.67 121.07 3day s ASP 262 Ca -0.04 3.03 0.22 0.00 -0.52 0.00 0.00 52.55 55.24 3day s ASP 262 Cb -0.03 -2.67 0.97 0.00 -1.46 0.00 0.00 42.92 39.74 3day s ASP 262 CO 0.04 -0.86 1.68 0.35 0.52 0.00 0.00 175.17 176.90 3day n THR 263 N 0.51 0.89 0.66 1.71 -2.24 -1.26 -3.21 114.28 111.33 3day n THR 263 Ca 0.01 0.31 0.13 0.00 -2.27 0.00 0.00 64.05 62.22 3day n THR 263 Cb 0.39 -1.24 0.46 0.00 -2.10 0.00 0.00 70.33 67.84 3day n THR 263 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3day n GLY 264 N -0.21 -1.55 3.74 3.38 0.00 -1.26 -4.69 105.19 104.59 3day n GLY 264 Ca 0.02 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 3day n GLY 264 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3day s TRP 265 N -3.11 2.92 0.49 1.61 0.52 -1.20 -4.28 118.94 115.89 3day s TRP 265 Ca 0.10 -0.15 0.15 0.00 0.02 0.00 0.00 56.10 56.22 3day s TRP 265 Cb 0.13 -1.32 1.15 0.00 -1.15 0.00 0.00 33.47 32.28 3day s TRP 265 CO 0.53 0.56 2.08 0.97 0.02 0.00 0.00 176.95 181.11 3day h ILE 266 N 1.79 1.06 -0.91 2.03 2.10 -1.90 -1.11 117.51 120.55 3day h ILE 266 Ca -0.47 -0.28 0.26 0.00 1.08 0.00 0.00 64.86 65.46 3day h ILE 266 Cb 1.24 1.15 -0.15 0.00 -1.09 0.00 0.00 36.82 37.97 3day h ILE 266 CO 0.60 0.08 0.29 0.25 -1.08 0.00 0.00 178.15 178.29 3day h LEU 267 N 0.00 0.07 -0.18 2.19 5.85 -1.95 -1.79 115.31 119.49 3day h LEU 267 Ca -0.00 0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 3day h LEU 267 Cb 0.14 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 3day h LEU 267 CO 0.01 -0.18 0.05 -1.13 -0.34 0.00 0.00 178.44 176.85 3day h ASN 268 N 0.20 0.27 -0.63 1.25 -1.24 -1.42 0.58 115.58 114.59 3day h ASN 268 Ca 0.60 -0.22 -0.07 0.00 0.71 0.00 0.00 56.30 57.32 3day h ASN 268 Cb 1.26 -0.07 -0.03 0.00 0.73 0.00 0.00 38.32 40.22 3day h ASN 268 CO -0.67 0.42 0.12 -0.29 -1.29 0.00 0.00 177.43 175.72 3day h ILE 269 N 0.11 1.26 -0.01 2.57 6.09 -1.59 -1.58 117.51 124.36 3day h ILE 269 Ca 0.06 -0.99 -0.24 0.00 -1.37 0.00 0.00 64.86 62.32 3day h ILE 269 Cb 0.25 0.67 0.02 0.00 0.47 0.00 0.00 36.82 38.23 3day h ILE 269 CO -0.00 0.37 -0.94 -0.07 -3.07 0.00 0.00 178.15 174.44 3day h LEU 270 N 0.95 0.84 0.00 2.19 3.38 -1.17 -0.71 115.31 120.79 3day h LEU 270 Ca 0.19 -0.74 -0.20 0.00 0.09 0.00 0.00 57.88 57.23 3day h LEU 270 Cb 0.41 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 3day h LEU 270 CO 0.01 1.47 -1.76 0.00 0.09 0.00 0.00 178.44 178.25 3day h SER 272 N 0.00 0.40 0.00 0.00 0.87 -1.33 -3.39 113.55 110.10 3day h SER 272 Ca -0.30 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 59.96 3day h SER 272 Cb 1.53 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 63.37 3day h SER 272 CO -0.03 1.08 -0.42 -0.11 -0.53 0.00 0.00 176.83 176.83 3day n LEU 273 N -3.74 1.02 -0.06 2.23 0.00 -0.96 -4.74 117.00 110.75 3day n LEU 273 Ca -0.05 0.16 -0.13 0.00 0.00 0.00 0.00 56.01 55.99 3day n LEU 273 Cb 0.78 -0.51 -0.06 0.00 0.00 0.00 0.00 43.42 43.63 3day n LEU 273 CO 0.49 -0.45 0.59 0.24 0.00 0.00 0.00 177.39 178.25 3day h MET 274 N -0.42 0.43 0.43 1.96 2.86 -1.19 -2.61 114.93 116.40 3day h MET 274 Ca 0.00 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.40 3day h MET 274 Cb 0.42 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 3day h MET 274 CO 0.00 0.80 -0.35 1.49 1.06 0.00 0.00 176.91 179.91 3day h GLU 275 N 0.09 -0.76 -0.66 1.72 4.57 -1.50 0.29 114.58 118.33 3day h GLU 275 Ca 0.03 0.05 -0.05 0.00 -1.18 0.00 0.00 59.36 58.20 3day h GLU 275 Cb 0.73 0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 29.46 3day h GLU 275 CO 0.05 -0.50 0.20 -1.00 -1.18 0.00 0.00 179.01 176.58 3day h PRO 276 N -0.78 1.03 0.00 0.92 0.13 -1.75 -3.07 132.00 128.47 3day h PRO 276 Ca -0.04 -0.22 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 3day h PRO 276 Cb 0.68 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.66 3day h PRO 276 CO -0.02 0.90 -0.23 -1.49 -0.23 0.00 0.00 178.00 176.93 3day h TRP 277 N 0.96 0.00 -0.65 1.56 6.55 -1.35 0.74 115.95 123.75 3day h TRP 277 Ca 0.21 0.00 0.02 0.00 0.95 0.00 0.00 58.89 60.07 3day h TRP 277 Cb 0.30 0.00 -0.03 0.00 -0.86 0.00 0.00 29.16 28.57 3day h TRP 277 CO 0.02 0.23 0.43 0.00 -1.05 0.00 0.00 178.44 178.07 3day h ALA 278 N 1.77 1.58 0.00 1.49 0.00 -0.87 -3.07 119.26 120.16 3day h ALA 278 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3day h ALA 278 Cb 1.05 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3day h ALA 278 CO 0.03 0.38 -0.62 1.28 0.00 0.00 0.00 179.25 180.32 3day n LEU 279 N -4.45 0.58 -0.13 0.00 4.77 -0.59 -4.94 117.00 112.25 3day n LEU 279 Ca 0.07 0.02 -0.02 0.00 -0.03 0.00 0.00 56.01 56.06 3day n LEU 279 Cb 0.08 -0.20 -0.01 0.00 -2.33 0.00 0.00 43.42 40.95 3day n LEU 279 CO 0.35 0.08 -0.02 0.61 -1.33 0.00 0.00 177.39 177.09 3day n GLY 280 N 1.45 0.53 3.91 -0.72 0.00 -0.56 -4.20 105.19 105.61 3day n GLY 280 Ca 0.05 -0.69 -0.27 0.00 0.00 0.00 0.00 46.02 45.11 3day n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3day s ALA 281 N -2.03 3.19 0.01 4.61 0.00 0.15 -4.74 121.76 122.94 3day s ALA 281 Ca 0.00 -0.69 -0.16 0.00 0.00 0.00 0.00 51.96 51.11 3day s ALA 281 Cb 0.00 -2.68 -0.06 0.00 0.00 0.00 0.00 23.12 20.38 3day s ALA 281 CO 0.00 -0.99 0.46 0.00 0.00 0.00 0.00 175.76 175.23 3day s THR 283 N -0.91 4.63 -0.15 0.00 -1.32 -0.20 -1.22 115.64 116.46 3day s THR 283 Ca 0.26 -0.11 -0.04 0.00 -1.21 0.00 0.00 61.69 60.59 3day s THR 283 Cb -0.17 -3.02 -0.03 0.00 -1.51 0.00 0.00 72.50 67.76 3day s THR 283 CO 0.15 0.53 -0.02 0.12 -2.21 0.00 0.00 174.62 173.20 3day s PHE 284 N -0.23 3.08 -0.10 9.09 5.36 -0.01 -1.10 117.98 134.07 3day s PHE 284 Ca 0.07 -0.16 -0.01 0.00 -0.96 0.00 0.00 56.93 55.87 3day s PHE 284 Cb -0.12 -1.95 0.03 0.00 -0.34 0.00 0.00 43.02 40.63 3day s PHE 284 CO 0.02 0.07 -0.04 0.08 -1.46 0.00 0.00 175.22 173.88 3day s VAL 285 N 0.18 0.76 -0.22 3.12 1.01 -0.17 -4.19 120.40 120.88 3day s VAL 285 Ca -0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.78 3day s VAL 285 Cb -0.13 -0.84 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 3day s VAL 285 CO 0.02 0.32 0.07 -2.28 0.00 0.00 0.00 175.10 173.24 3day s HIS 286 N 1.82 3.15 0.30 5.22 2.46 -1.26 -1.14 115.29 125.84 3day s HIS 286 Ca 0.05 -0.19 0.03 0.00 0.47 0.00 0.00 55.06 55.43 3day s HIS 286 Cb -0.12 -2.18 0.79 0.00 -0.13 0.00 0.00 32.58 30.93 3day s HIS 286 CO -0.07 -0.14 1.60 1.25 -2.47 0.00 0.00 174.74 174.91 3day h LEU 287 N 7.62 -0.21 -3.53 8.88 5.85 -1.19 -3.46 115.31 129.27 3day h LEU 287 Ca -0.37 0.24 -0.57 0.00 0.84 0.00 0.00 57.88 58.03 3day h LEU 287 Cb 1.18 0.38 -0.02 0.00 0.37 0.00 0.00 40.66 42.57 3day h LEU 287 CO 0.62 -0.28 -0.99 -0.11 -0.34 0.00 0.00 178.44 177.34 3day n LEU 288 N -5.36 -0.90 0.29 2.25 7.94 -1.26 -4.56 117.00 115.40 3day n LEU 288 Ca 0.24 -1.23 0.16 0.00 -1.11 0.00 0.00 56.01 54.06 3day n LEU 288 Cb 0.77 -1.79 0.88 0.00 0.53 0.00 0.00 43.42 43.81 3day n LEU 288 CO -0.01 0.70 1.07 1.55 -1.11 0.00 0.00 177.39 179.59 3day h PRO 289 N -2.39 0.00 -0.12 1.96 0.13 -1.89 -2.46 132.00 127.23 3day h PRO 289 Ca -0.70 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 3day h PRO 289 Cb 1.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.53 3day h PRO 289 CO 0.53 0.05 0.00 1.63 -0.23 0.00 0.00 178.00 179.98 3day n LYS 290 N -3.60 1.93 -3.94 0.86 5.02 -1.26 -4.99 118.16 112.18 3day n LYS 290 Ca -0.02 -1.47 -0.29 0.00 -2.02 0.00 0.00 58.31 54.51 3day n LYS 290 Cb 0.16 -1.12 0.01 0.00 -0.02 0.00 0.00 35.03 34.05 3day n LYS 290 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3day n PHE 291 N 0.10 -1.98 -2.73 2.13 7.35 -0.93 -4.88 117.46 116.52 3day n PHE 291 Ca 0.05 0.84 -0.43 0.00 -0.76 0.00 0.00 57.45 57.15 3day n PHE 291 Cb 0.27 -3.80 -0.03 0.00 0.35 0.00 0.00 39.48 36.27 3day n PHE 291 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3day s ASP 292 N -3.74 7.04 0.39 -2.13 -1.08 -1.26 -4.93 116.67 110.96 3day s ASP 292 Ca 0.41 1.30 0.12 0.00 -0.52 0.00 0.00 52.55 53.86 3day s ASP 292 Cb -0.21 -2.51 0.80 0.00 -1.46 0.00 0.00 42.92 39.54 3day s ASP 292 CO 0.86 -0.59 1.89 1.55 0.52 0.00 0.00 175.17 179.40 3day h PRO 293 N 7.46 0.10 -0.50 4.34 0.13 -1.94 -1.83 132.00 139.76 3day h PRO 293 Ca -0.22 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.81 3day h PRO 293 Cb 1.08 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 3day h PRO 293 CO 0.93 0.34 0.01 1.25 -0.23 0.00 0.00 178.00 180.30 3day h LEU 294 N 0.09 0.79 -0.92 1.56 5.85 -1.93 -1.06 115.31 119.70 3day h LEU 294 Ca 0.02 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 3day h LEU 294 Cb 0.48 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 3day h LEU 294 CO 0.03 0.85 0.39 0.58 -0.34 0.00 0.00 178.44 179.96 3day h VAL 295 N 0.77 1.25 -0.39 1.05 2.07 -1.77 -0.83 116.25 118.40 3day h VAL 295 Ca 0.15 -0.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.92 3day h VAL 295 Cb 0.45 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3day h VAL 295 CO 0.02 0.30 0.07 0.40 0.02 0.00 0.00 177.57 178.38 3day h ILE 296 N 1.16 1.24 0.03 4.57 2.04 -0.73 -1.42 117.51 124.40 3day h ILE 296 Ca 0.28 -0.84 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 3day h ILE 296 Cb 0.11 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 3day h ILE 296 CO -0.04 0.29 -0.01 0.25 0.00 0.00 0.00 178.15 178.64 3day h LEU 297 N 0.49 -0.03 -1.06 1.44 5.85 -1.05 -1.37 115.31 119.58 3day h LEU 297 Ca 0.12 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.87 3day h LEU 297 Cb 0.35 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 3day h LEU 297 CO 0.01 -0.01 0.63 0.11 -0.34 0.00 0.00 178.44 178.83 3day h LYS 298 N -0.05 1.16 -0.11 1.25 1.57 -1.07 -1.63 116.57 117.69 3day h LYS 298 Ca -0.00 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 3day h LYS 298 Cb 0.04 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.08 3day h LYS 298 CO 0.01 0.77 0.03 1.15 -0.57 0.00 0.00 179.45 180.84 3day h THR 299 N 1.19 1.17 -1.00 -0.16 2.02 -0.95 -0.66 112.91 114.53 3day h THR 299 Ca 0.39 -0.53 0.11 0.00 0.77 0.00 0.00 66.41 67.15 3day h THR 299 Cb 0.04 1.33 -0.08 0.00 -1.74 0.00 0.00 68.15 67.70 3day h THR 299 CO -0.13 0.16 0.63 -0.07 0.37 0.00 0.00 175.52 176.48 3day h LEU 300 N -0.01 0.93 0.00 2.58 3.38 -1.02 -2.11 115.31 119.06 3day h LEU 300 Ca 0.03 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3day h LEU 300 Cb 0.21 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3day h LEU 300 CO -0.00 0.50 -0.12 -1.28 0.09 0.00 0.00 178.44 177.63 3day h SER 301 N 1.01 0.00 0.00 -0.43 0.87 -0.98 -3.36 113.55 110.65 3day h SER 301 Ca 0.49 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.05 3day h SER 301 Cb 0.45 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.41 3day h SER 301 CO -0.26 0.00 -1.44 -1.20 -0.53 0.00 0.00 176.83 173.41 3day n SER 302 N -3.02 0.79 -4.25 6.23 7.64 -0.28 -4.89 113.62 115.85 3day n SER 302 Ca 0.04 -0.38 -0.23 0.00 1.01 0.00 0.00 58.87 59.31 3day n SER 302 Cb 0.53 1.50 -0.13 0.00 -1.01 0.00 0.00 64.21 65.10 3day n SER 302 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 3day s TYR 303 N -3.05 1.65 -1.37 1.43 2.02 -0.84 -5.05 117.35 112.14 3day s TYR 303 Ca -0.01 -0.41 -0.09 0.00 -0.37 0.00 0.00 57.07 56.19 3day s TYR 303 Cb 0.13 -0.93 -0.12 0.00 -0.40 0.00 0.00 41.96 40.64 3day s TYR 303 CO 0.76 0.14 3.07 -0.35 -1.57 0.00 0.00 175.55 177.60 3day n PRO 304 N 1.36 3.44 -2.42 -1.71 -0.04 -1.26 -4.77 135.00 129.61 3day n PRO 304 Ca -0.19 -2.02 -0.43 0.00 -0.04 0.00 0.00 63.50 60.82 3day n PRO 304 Cb 0.54 -2.67 -0.02 0.00 -0.04 0.00 0.00 33.50 31.30 3day n PRO 304 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3day s ILE 305 N 1.96 4.17 -0.11 0.52 1.01 -1.26 -4.51 121.20 122.97 3day s ILE 305 Ca 0.69 1.34 0.16 0.00 0.00 0.00 0.00 60.65 62.85 3day s ILE 305 Cb 0.20 -4.12 -0.20 0.00 0.01 0.00 0.00 42.46 38.36 3day s ILE 305 CO -0.05 -0.40 0.60 1.17 0.00 0.00 0.00 174.94 176.26 3day n LYS 306 N 7.17 0.64 -4.05 2.79 4.81 -0.73 -3.28 118.16 125.51 3day n LYS 306 Ca 0.15 0.17 -0.13 0.00 -0.87 0.00 0.00 58.31 57.62 3day n LYS 306 Cb 0.46 -1.73 -0.13 0.00 0.02 0.00 0.00 35.03 33.65 3day n LYS 306 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 3day s SER 307 N -5.72 0.49 0.02 3.14 0.01 -1.09 -0.38 113.70 110.18 3day s SER 307 Ca -0.05 -0.25 0.01 0.00 1.31 0.00 0.00 55.95 56.97 3day s SER 307 Cb 0.08 -0.00 -0.02 0.00 0.21 0.00 0.00 66.02 66.29 3day s SER 307 CO 0.83 -0.07 -0.04 0.00 0.41 0.00 0.00 173.24 174.36 3day s MET 308 N -0.65 0.35 -0.08 12.44 0.23 0.22 -0.43 119.30 131.38 3day s MET 308 Ca -0.04 -0.50 0.02 0.00 -1.03 0.00 0.00 55.69 54.15 3day s MET 308 Cb -0.05 -0.12 0.01 0.00 -1.53 0.00 0.00 34.83 33.14 3day s MET 308 CO -0.00 0.02 -0.14 1.41 -2.03 0.00 0.00 175.02 174.27 3day s MET 309 N -1.06 2.00 0.14 3.16 0.00 -0.52 -1.02 119.30 121.99 3day s MET 309 Ca -0.09 -0.51 -0.21 0.00 0.00 0.00 0.00 55.69 54.88 3day s MET 309 Cb -0.07 -1.63 0.06 0.00 0.00 0.00 0.00 34.83 33.18 3day s MET 309 CO -0.00 0.03 0.54 0.20 0.00 0.00 0.00 175.02 175.79 3day s GLY 310 N 0.70 -0.51 0.75 2.11 0.00 -1.09 -0.19 107.32 109.09 3day s GLY 310 Ca -0.13 0.36 -0.15 0.00 0.00 0.00 0.00 44.72 44.80 3day s GLY 310 CO 0.03 0.05 0.94 0.00 0.00 0.00 0.00 173.10 174.13 3day n ALA 311 N -0.26 -0.47 -0.28 3.20 0.00 -1.26 -3.65 120.51 117.79 3day n ALA 311 Ca -0.17 -0.25 0.21 0.00 0.00 0.00 0.00 53.44 53.23 3day n ALA 311 Cb 0.64 -2.10 0.52 0.00 0.00 0.00 0.00 19.45 18.51 3day n ALA 311 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3day h PRO 312 N -0.49 0.37 -0.69 0.00 0.11 -1.87 -0.72 132.00 128.72 3day h PRO 312 Ca -0.47 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.72 3day h PRO 312 Cb 1.32 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 3day h PRO 312 CO 0.45 0.25 0.46 0.97 -0.21 0.00 0.00 178.00 179.92 3day h ILE 313 N 0.38 0.92 -0.47 4.15 2.10 -1.95 -2.14 117.51 120.50 3day h ILE 313 Ca 0.52 -0.19 0.04 0.00 1.08 0.00 0.00 64.86 66.31 3day h ILE 313 Cb 1.36 0.31 -0.04 0.00 -1.09 0.00 0.00 36.82 37.36 3day h ILE 313 CO -0.21 0.10 0.23 0.58 -1.08 0.00 0.00 178.15 177.77 3day h VAL 314 N 0.56 0.96 -0.26 2.19 2.07 -1.46 -0.62 116.25 119.69 3day h VAL 314 Ca 0.32 -0.16 -0.15 0.00 0.82 0.00 0.00 66.70 67.53 3day h VAL 314 Cb 0.50 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3day h VAL 314 CO -0.11 0.08 -0.45 1.88 0.02 0.00 0.00 177.57 179.00 3day h TYR 315 N 0.46 0.79 -0.73 1.57 0.05 -1.52 -1.20 116.97 116.40 3day h TYR 315 Ca 0.21 -0.25 -0.04 0.00 0.05 0.00 0.00 58.73 58.69 3day h TYR 315 Cb 0.12 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.66 3day h TYR 315 CO -0.10 0.99 0.29 0.00 -1.05 0.00 0.00 178.16 178.28 3day h ARG 316 N 0.52 1.09 -0.46 4.88 3.08 -1.15 -1.10 114.38 121.24 3day h ARG 316 Ca 0.03 -0.20 -0.13 0.00 0.07 0.00 0.00 59.98 59.75 3day h ARG 316 Cb 0.99 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 3day h ARG 316 CO 0.09 0.90 -0.22 0.52 -1.07 0.00 0.00 179.97 180.19 3day h MET 317 N 1.05 0.94 -0.56 0.04 2.86 -0.97 -3.05 114.93 115.23 3day h MET 317 Ca 0.24 -0.40 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 3day h MET 317 Cb 0.22 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 3day h MET 317 CO -0.02 1.06 -0.06 -0.07 1.06 0.00 0.00 176.91 178.88 3day h LEU 318 N 0.81 1.02 -2.45 1.22 3.38 -0.90 -2.16 115.31 116.24 3day h LEU 318 Ca 0.11 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 3day h LEU 318 Cb 0.79 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 3day h LEU 318 CO 0.07 1.11 -0.03 -0.07 0.09 0.00 0.00 178.44 179.61 3day h LEU 319 N 0.93 0.00 -0.39 1.67 3.38 -1.13 -1.27 115.31 118.50 3day h LEU 319 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3day h LEU 319 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 3day h LEU 319 CO 0.04 0.03 -0.19 0.00 0.09 0.00 0.00 178.44 178.41 3day n GLN 320 N -3.52 0.79 -2.46 1.13 6.02 -0.82 -4.85 117.38 113.66 3day n GLN 320 Ca -0.03 -0.39 -0.24 0.00 -0.01 0.00 0.00 57.00 56.34 3day n GLN 320 Cb 0.13 -1.49 0.07 0.00 1.02 0.00 0.00 30.24 29.97 3day n GLN 320 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3day s GLN 321 N -2.48 2.10 -1.04 -1.09 -1.52 -0.48 -5.01 119.66 110.14 3day s GLN 321 Ca 0.26 -0.70 -0.18 0.00 -1.95 0.00 0.00 55.36 52.80 3day s GLN 321 Cb 0.20 -2.32 0.13 0.00 -0.22 0.00 0.00 33.01 30.80 3day s GLN 321 CO 0.50 -1.16 1.28 0.34 -0.25 0.00 0.00 175.29 175.99 3day s ASP 322 N -4.56 6.75 0.00 5.90 2.15 -1.26 -4.83 116.67 120.82 3day s ASP 322 Ca 0.61 -2.28 0.21 0.00 0.43 0.00 0.00 52.55 51.53 3day s ASP 322 Cb -0.09 -2.43 0.96 0.00 -0.30 0.00 0.00 42.92 41.07 3day s ASP 322 CO 0.43 -1.02 1.69 0.18 -0.17 0.00 0.00 175.17 176.27 3day n LEU 323 N 6.63 0.00 0.10 -1.34 4.77 -1.26 -2.46 117.00 123.44 3day n LEU 323 Ca 0.30 0.44 -0.01 0.00 -0.03 0.00 0.00 56.01 56.71 3day n LEU 323 Cb 0.47 -0.44 0.26 0.00 -2.33 0.00 0.00 43.42 41.38 3day n LEU 323 CO 0.57 -0.12 0.69 0.28 -1.33 0.00 0.00 177.39 177.48 3day h SER 324 N 0.00 0.24 0.29 -1.43 0.02 -1.94 -3.33 113.55 107.40 3day h SER 324 Ca 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3day h SER 324 Cb 0.32 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.79 3day h SER 324 CO 0.00 0.59 -0.92 -1.20 -1.14 0.00 0.00 176.83 174.16 3day n SER 325 N -4.07 0.69 -3.53 3.07 7.64 -1.03 -4.61 113.62 111.78 3day n SER 325 Ca -0.01 -0.48 -0.27 0.00 1.01 0.00 0.00 58.87 59.12 3day n SER 325 Cb 0.44 0.77 -0.10 0.00 -1.01 0.00 0.00 64.21 64.31 3day n SER 325 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3day n TYR 326 N -1.70 0.82 -2.40 1.43 4.01 -1.23 -5.11 117.16 112.98 3day n TYR 326 Ca 0.03 -3.72 -0.33 0.00 -0.16 0.00 0.00 57.90 53.73 3day n TYR 326 Cb 0.38 -0.15 -0.03 0.00 -0.31 0.00 0.00 39.34 39.23 3day n TYR 326 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3day s LYS 327 N -0.78 3.83 -0.38 -0.72 -0.14 -1.26 -4.81 119.74 115.48 3day s LYS 327 Ca 0.31 1.09 0.10 0.00 -1.36 0.00 0.00 55.97 56.11 3day s LYS 327 Cb 0.04 -2.11 0.30 0.00 -1.68 0.00 0.00 37.83 34.37 3day s LYS 327 CO -0.16 -0.38 0.63 1.97 -0.76 0.00 0.00 175.35 176.65 3day n PHE 328 N -1.46 -0.20 0.33 3.18 1.16 -1.26 -4.41 117.46 114.79 3day n PHE 328 Ca 0.07 -3.63 0.19 0.00 -1.87 0.00 0.00 57.45 52.22 3day n PHE 328 Cb 0.54 -0.33 1.04 0.00 -1.61 0.00 0.00 39.48 39.12 3day n PHE 328 CO 0.00 0.00 0.00 -1.00 -1.87 0.00 0.00 176.76 173.89 3day h PRO 329 N 3.54 0.00 0.00 3.97 0.13 -1.95 -1.01 132.00 136.68 3day h PRO 329 Ca 0.08 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.19 3day h PRO 329 Cb 0.93 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.05 3day h PRO 329 CO 0.47 0.00 -0.10 1.12 -0.23 0.00 0.00 178.00 179.26 3day h HIS 330 N 0.00 0.00 -3.37 1.56 2.07 -1.93 -3.45 115.15 110.04 3day h HIS 330 Ca 0.00 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.99 3day h HIS 330 Cb 0.26 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.24 3day h HIS 330 CO 0.00 0.10 0.48 -1.17 -3.07 0.00 0.00 177.93 174.27 3day s LEU 331 N -6.27 4.41 0.00 6.12 2.96 -0.38 -4.34 118.68 121.19 3day s LEU 331 Ca 0.06 1.95 0.00 0.00 -0.22 0.00 0.00 54.13 55.92 3day s LEU 331 Cb 0.06 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.16 3day s LEU 331 CO 0.68 -0.33 0.00 0.00 -1.32 0.00 0.00 176.35 175.38 3day n GLN 332 N 3.39 2.06 -4.22 1.98 1.13 0.48 -5.03 117.38 117.17 3day n GLN 332 Ca 0.06 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.79 3day n GLN 332 Cb 0.47 -0.78 -0.16 0.00 0.11 0.00 0.00 30.24 29.89 3day n GLN 332 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3day s ASN 333 N -2.24 3.46 -0.19 1.08 0.01 -0.35 -4.85 114.94 111.86 3day s ASN 333 Ca 0.00 -0.56 0.01 0.00 -0.71 0.00 0.00 52.86 51.60 3day s ASN 333 Cb 0.00 -1.54 0.04 0.00 0.41 0.00 0.00 41.25 40.16 3day s ASN 333 CO 0.00 0.02 -0.10 0.00 -1.51 0.00 0.00 177.10 175.51 3day s VAL 335 N 1.43 2.02 0.05 0.00 -7.23 -0.19 -0.36 120.40 116.13 3day s VAL 335 Ca -0.01 -2.25 -0.05 0.00 -1.81 0.00 0.00 61.98 57.86 3day s VAL 335 Cb -0.16 -2.12 -0.01 0.00 0.56 0.00 0.00 36.38 34.65 3day s VAL 335 CO -0.08 -0.49 0.09 0.28 -0.31 0.00 0.00 175.10 174.59 3day s THR 336 N -2.70 0.15 0.17 5.32 -1.32 -0.80 -2.67 115.64 113.79 3day s THR 336 Ca 0.24 -1.24 -0.18 0.00 -1.21 0.00 0.00 61.69 59.30 3day s THR 336 Cb -0.03 -1.11 0.04 0.00 -1.51 0.00 0.00 72.50 69.89 3day s THR 336 CO 0.10 -0.68 0.51 0.54 -2.21 0.00 0.00 174.62 172.87 3day s VAL 337 N -3.12 0.03 0.00 5.08 0.11 -1.24 -0.91 120.40 120.35 3day s VAL 337 Ca -0.01 -0.61 0.00 0.00 -2.93 0.00 0.00 61.98 58.44 3day s VAL 337 Cb 0.02 -1.39 0.00 0.00 -1.53 0.00 0.00 36.38 33.48 3day s VAL 337 CO -0.07 -0.15 0.00 0.61 -3.33 0.00 0.00 175.10 172.16 3day n GLY 338 N -0.32 2.04 3.74 6.54 0.00 -1.26 -4.16 105.19 111.77 3day n GLY 338 Ca -0.12 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 3day n GLY 338 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3day s GLU 339 N 0.00 1.82 0.21 1.61 -1.05 -1.26 -5.08 118.70 114.95 3day s GLU 339 Ca 0.00 -1.21 -0.31 0.00 -0.15 0.00 0.00 54.97 53.30 3day s GLU 339 Cb 0.00 0.56 -0.10 0.00 -0.44 0.00 0.00 34.13 34.15 3day s GLU 339 CO 0.00 -0.82 1.46 -1.12 0.95 0.00 0.00 175.26 175.74 3day s SER 340 N -3.00 6.67 -0.34 0.83 0.01 -1.26 -4.79 113.70 111.81 3day s SER 340 Ca 0.17 2.60 -0.25 0.00 1.31 0.00 0.00 55.95 59.77 3day s SER 340 Cb -0.04 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.59 3day s SER 340 CO 0.10 -0.72 0.90 -0.22 0.41 0.00 0.00 173.24 173.70 3day s LEU 341 N 0.20 4.03 0.22 2.44 2.96 -1.26 -4.91 118.68 122.35 3day s LEU 341 Ca 0.63 0.65 -0.30 0.00 -0.22 0.00 0.00 54.13 54.88 3day s LEU 341 Cb -0.41 -3.23 -0.10 0.00 0.50 0.00 0.00 46.19 42.95 3day s LEU 341 CO 0.38 -0.78 1.42 -0.76 -1.32 0.00 0.00 176.35 175.29 3day s LEU 342 N 3.32 4.39 0.49 -0.68 1.43 -1.26 -4.40 118.68 121.97 3day s LEU 342 Ca 0.37 2.57 0.29 0.00 -1.03 0.00 0.00 54.13 56.33 3day s LEU 342 Cb -0.13 -3.61 1.38 0.00 0.03 0.00 0.00 46.19 43.86 3day s LEU 342 CO 0.16 -0.67 1.80 -0.65 0.23 0.00 0.00 176.35 177.23 3day h PRO 343 N 5.46 0.14 -0.44 1.29 0.11 -1.95 -1.27 132.00 135.34 3day h PRO 343 Ca -0.45 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 3day h PRO 343 Cb 1.21 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3day h PRO 343 CO 0.80 0.09 0.02 0.93 -0.21 0.00 0.00 178.00 179.63 3day h GLU 344 N 0.14 0.77 0.01 1.05 3.07 -1.99 -0.63 114.58 116.99 3day h GLU 344 Ca 0.56 -0.24 -0.00 0.00 -0.50 0.00 0.00 59.36 59.18 3day h GLU 344 Cb 1.91 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.74 3day h GLU 344 CO -0.11 0.83 -0.00 1.15 -1.40 0.00 0.00 179.01 179.47 3day h THR 345 N 0.61 1.19 -0.54 1.13 2.02 -1.63 -0.76 112.91 114.92 3day h THR 345 Ca 0.13 -0.59 0.10 0.00 0.77 0.00 0.00 66.41 66.82 3day h THR 345 Cb 0.47 1.59 -0.11 0.00 -1.74 0.00 0.00 68.15 68.36 3day h THR 345 CO 0.02 0.15 -0.30 0.25 0.37 0.00 0.00 175.52 176.01 3day h LEU 346 N -0.26 -1.04 -0.37 2.58 5.85 -1.34 -0.45 115.31 120.27 3day h LEU 346 Ca -0.00 0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.87 3day h LEU 346 Cb 0.26 0.52 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 3day h LEU 346 CO 0.00 -0.29 0.01 -0.08 -0.34 0.00 0.00 178.44 177.74 3day h GLU 347 N -0.16 0.65 -0.50 1.25 4.81 -0.99 -2.20 114.58 117.44 3day h GLU 347 Ca 0.23 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 3day h GLU 347 Cb 0.53 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 3day h GLU 347 CO -0.64 0.75 0.23 -0.97 -0.73 0.00 0.00 179.01 177.65 3day h ASN 348 N 0.47 0.67 -0.35 1.04 -1.24 -0.91 -1.42 115.58 113.84 3day h ASN 348 Ca 0.11 -0.14 0.04 0.00 0.71 0.00 0.00 56.30 57.02 3day h ASN 348 Cb 0.45 -0.17 -0.04 0.00 0.73 0.00 0.00 38.32 39.28 3day h ASN 348 CO 0.02 0.62 0.11 -0.25 -1.29 0.00 0.00 177.43 176.64 3day h TRP 349 N 0.67 0.19 -0.27 0.67 2.91 -1.02 0.12 115.95 119.21 3day h TRP 349 Ca 0.17 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.25 3day h TRP 349 Cb 0.14 -0.03 -0.04 0.00 -0.51 0.00 0.00 29.16 28.72 3day h TRP 349 CO -0.00 0.07 0.05 0.00 -1.03 0.00 0.00 178.44 177.53 3day h ARG 350 N 0.25 0.15 -0.51 2.65 3.08 -1.27 0.78 114.38 119.51 3day h ARG 350 Ca 0.16 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.24 3day h ARG 350 Cb 0.15 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 3day h ARG 350 CO -0.18 0.10 0.28 0.00 -1.07 0.00 0.00 179.97 179.10 3day h ALA 351 N 1.20 0.65 0.04 0.04 0.00 -0.78 0.13 119.26 120.55 3day h ALA 351 Ca 0.13 0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.81 3day h ALA 351 Cb 0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3day h ALA 351 CO -0.17 -0.05 -1.14 1.96 0.00 0.00 0.00 179.25 179.85 3day h GLN 352 N 0.55 0.08 0.00 0.00 1.08 -0.49 -3.39 115.11 112.95 3day h GLN 352 Ca 0.22 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 3day h GLN 352 Cb 0.09 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 3day h GLN 352 CO -0.13 1.03 -0.54 0.25 -0.95 0.00 0.00 178.83 178.49 3day n THR 353 N -3.38 0.00 -0.91 -0.54 -2.24 0.24 -4.99 114.28 102.45 3day n THR 353 Ca -0.04 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3day n THR 353 Cb 0.98 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.91 3day n THR 353 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3day n GLY 354 N 1.78 0.72 3.88 3.38 0.00 0.45 -5.02 105.19 110.38 3day n GLY 354 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3day n GLY 354 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3day s LEU 355 N 0.00 4.22 0.43 0.99 1.43 -1.26 -4.96 118.68 119.54 3day s LEU 355 Ca 0.00 0.20 -0.19 0.00 -1.03 0.00 0.00 54.13 53.12 3day s LEU 355 Cb 0.00 -2.84 -0.10 0.00 0.03 0.00 0.00 46.19 43.28 3day s LEU 355 CO 0.00 0.17 0.92 -1.81 0.23 0.00 0.00 176.35 175.86 3day s ASP 356 N -2.48 6.82 -0.21 2.29 1.01 -1.26 -3.13 116.67 119.72 3day s ASP 356 Ca 0.34 1.57 -0.05 0.00 0.71 0.00 0.00 52.55 55.12 3day s ASP 356 Cb -0.13 -2.50 -0.02 0.00 1.01 0.00 0.00 42.92 41.28 3day s ASP 356 CO 0.26 -0.39 0.01 -0.63 0.21 0.00 0.00 175.17 174.63 3day s ILE 357 N -2.26 3.93 -0.35 0.77 1.01 -1.26 -4.18 121.20 118.87 3day s ILE 357 Ca 0.60 -0.31 -0.14 0.00 0.00 0.00 0.00 60.65 60.79 3day s ILE 357 Cb -0.09 -2.79 -0.01 0.00 0.01 0.00 0.00 42.46 39.57 3day s ILE 357 CO 0.19 0.41 0.28 -0.13 0.00 0.00 0.00 174.94 175.69 3day s ARG 358 N 1.18 3.46 0.46 2.79 0.52 0.52 -4.98 118.95 122.90 3day s ARG 358 Ca 0.03 -0.62 -0.21 0.00 -0.52 0.00 0.00 55.73 54.42 3day s ARG 358 Cb -0.14 -3.82 -0.10 0.00 0.52 0.00 0.00 34.95 31.41 3day s ARG 358 CO 0.01 -0.50 1.00 -2.00 0.02 0.00 0.00 175.30 173.84 3day s GLU 359 N 1.81 4.00 0.18 3.54 2.12 -1.26 -1.91 118.70 127.17 3day s GLU 359 Ca 0.08 1.27 0.02 0.00 0.36 0.00 0.00 54.97 56.70 3day s GLU 359 Cb -0.17 -2.16 -0.05 0.00 0.26 0.00 0.00 34.13 32.01 3day s GLU 359 CO 0.11 -0.25 0.00 -1.54 -0.54 0.00 0.00 175.26 173.05 3day s SER 360 N -2.03 1.21 -0.01 -1.70 1.04 -0.09 -1.33 113.70 110.78 3day s SER 360 Ca 0.64 -1.18 -0.01 0.00 0.48 0.00 0.00 55.95 55.88 3day s SER 360 Cb -0.14 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.10 3day s SER 360 CO 0.18 -0.57 0.03 -0.47 0.98 0.00 0.00 173.24 173.38 3day s TYR 361 N -3.66 -0.01 0.00 5.02 5.04 0.20 -4.30 117.35 119.64 3day s TYR 361 Ca 0.24 0.03 0.00 0.00 -2.44 0.00 0.00 57.07 54.90 3day s TYR 361 Cb 0.06 -0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.36 3day s TYR 361 CO 0.04 -0.04 0.00 0.41 -1.34 0.00 0.00 175.55 174.62 3day n GLY 362 N 2.89 0.52 3.41 8.97 0.00 -1.26 -1.12 105.19 118.60 3day n GLY 362 Ca -0.13 -0.75 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 3day n GLY 362 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3day s GLN 363 N -1.24 1.37 0.27 1.61 -2.07 -1.20 -4.92 119.66 113.47 3day s GLN 363 Ca 0.00 -1.39 -0.02 0.00 -1.82 0.00 0.00 55.36 52.14 3day s GLN 363 Cb 0.00 0.38 0.45 0.00 -1.09 0.00 0.00 33.01 32.75 3day s GLN 363 CO 0.00 -0.52 1.86 1.15 -1.32 0.00 0.00 175.29 176.46 3day h THR 364 N 2.43 1.02 0.00 3.63 2.02 -2.01 0.11 112.91 120.12 3day h THR 364 Ca -0.30 -0.37 -0.03 0.00 0.77 0.00 0.00 66.41 66.48 3day h THR 364 Cb 1.25 -0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 3day h THR 364 CO 0.44 0.20 -0.12 -0.33 0.37 0.00 0.00 175.52 176.07 3day h GLU 365 N 1.09 0.00 0.00 6.66 3.07 -1.96 -3.33 114.58 120.10 3day h GLU 365 Ca 0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.31 3day h GLU 365 Cb 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 3day h GLU 365 CO -0.21 0.12 0.00 0.25 -1.40 0.00 0.00 179.01 177.77 3day n THR 366 N -3.63 0.00 -4.92 1.13 -2.24 -0.66 -0.75 114.28 103.21 3day n THR 366 Ca -0.02 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 3day n THR 366 Cb 0.24 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 3day n THR 366 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3day n GLY 367 N 0.71 1.46 3.63 3.38 0.00 0.30 -4.56 105.19 110.11 3day n GLY 367 Ca 0.00 -0.58 -0.43 0.00 0.00 0.00 0.00 46.02 45.02 3day n GLY 367 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3day s LEU 368 N 0.00 3.92 -0.10 0.99 2.96 -1.26 -3.26 118.68 121.93 3day s LEU 368 Ca 0.00 1.72 -0.04 0.00 -0.22 0.00 0.00 54.13 55.59 3day s LEU 368 Cb 0.00 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.11 3day s LEU 368 CO 0.00 -1.27 -0.12 0.41 -1.32 0.00 0.00 176.35 174.05 3day n THR 369 N 6.39 0.54 -4.20 3.68 -1.04 -0.28 -4.70 114.28 114.67 3day n THR 369 Ca 0.19 -0.15 -0.17 0.00 -2.04 0.00 0.00 64.05 61.89 3day n THR 369 Cb 0.45 -1.50 -0.13 0.00 -1.82 0.00 0.00 70.33 67.34 3day n THR 369 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3day s MET 371 N -1.11 1.22 -0.39 0.00 0.23 -0.24 -0.63 119.30 118.39 3day s MET 371 Ca -0.03 -0.46 -0.17 0.00 -1.03 0.00 0.00 55.69 54.00 3day s MET 371 Cb -0.07 0.56 0.01 0.00 -1.53 0.00 0.00 34.83 33.79 3day s MET 371 CO 0.01 -0.51 0.44 0.08 -2.03 0.00 0.00 175.02 173.00 3day s VAL 372 N -3.56 5.08 0.75 5.16 1.01 -0.45 -1.68 120.40 126.71 3day s VAL 372 Ca 0.00 -0.09 -0.11 0.00 0.00 0.00 0.00 61.98 61.78 3day s VAL 372 Cb -0.00 -3.97 0.05 0.00 0.00 0.00 0.00 36.38 32.45 3day s VAL 372 CO -0.11 -0.30 1.12 -0.94 0.00 0.00 0.00 175.10 174.87 3day s SER 373 N 1.79 4.98 0.41 3.32 1.04 -1.26 -4.67 113.70 119.31 3day s SER 373 Ca 0.14 0.92 0.09 0.00 0.48 0.00 0.00 55.95 57.58 3day s SER 373 Cb -0.16 -1.57 0.90 0.00 0.10 0.00 0.00 66.02 65.29 3day s SER 373 CO 0.13 -1.61 2.01 0.50 0.98 0.00 0.00 173.24 175.26 3day h LYS 374 N -0.82 0.52 0.00 4.02 1.63 -1.90 -2.17 116.57 117.84 3day h LYS 374 Ca -0.45 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.31 3day h LYS 374 Cb 1.29 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 3day h LYS 374 CO 0.65 0.34 -0.46 0.25 -3.45 0.00 0.00 179.45 176.78 3day n THR 375 N -4.47 0.05 -2.92 1.00 -2.24 -1.26 -4.94 114.28 99.50 3day n THR 375 Ca 0.07 -0.04 -0.36 0.00 -2.27 0.00 0.00 64.05 61.45 3day n THR 375 Cb 0.20 0.11 -0.06 0.00 -2.10 0.00 0.00 70.33 68.47 3day n THR 375 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3day s MET 376 N -3.02 4.39 0.41 -0.78 -1.94 -0.82 -5.04 119.30 112.50 3day s MET 376 Ca 0.11 1.10 -0.26 0.00 -1.71 0.00 0.00 55.69 54.93 3day s MET 376 Cb 0.17 -2.72 -0.10 0.00 2.01 0.00 0.00 34.83 34.19 3day s MET 376 CO 0.68 0.27 1.36 1.17 -0.01 0.00 0.00 175.02 178.49 3day n LYS 377 N 0.39 2.19 -3.35 2.03 4.81 -1.26 -4.84 118.16 118.14 3day n LYS 377 Ca 0.01 0.78 -0.38 0.00 -0.87 0.00 0.00 58.31 57.85 3day n LYS 377 Cb 0.51 -2.50 -0.06 0.00 0.02 0.00 0.00 35.03 33.00 3day n LYS 377 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 3day s ILE 378 N -1.17 5.20 -0.27 3.15 1.01 -1.26 -4.99 121.20 122.88 3day s ILE 378 Ca 0.59 0.87 0.03 0.00 0.00 0.00 0.00 60.65 62.14 3day s ILE 378 Cb -0.49 -3.78 0.07 0.00 0.01 0.00 0.00 42.46 38.26 3day s ILE 378 CO 0.60 0.32 -0.08 -0.54 0.00 0.00 0.00 174.94 175.24 3day s LYS 379 N 0.70 2.08 0.35 2.79 1.02 -1.26 -5.10 119.74 120.32 3day s LYS 379 Ca 0.24 -1.41 -0.28 0.00 0.02 0.00 0.00 55.97 54.53 3day s LYS 379 Cb -0.15 -2.92 -0.12 0.00 -0.52 0.00 0.00 37.83 34.13 3day s LYS 379 CO 0.09 -0.63 1.41 -2.30 -0.92 0.00 0.00 175.35 173.00 3day n PRO 380 N 4.42 2.41 -0.72 -1.68 -0.02 -1.26 -1.97 135.00 136.18 3day n PRO 380 Ca -0.11 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 3day n PRO 380 Cb 0.42 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 3day n PRO 380 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3day n GLY 381 N 0.83 0.85 3.32 -1.23 0.00 -1.26 -4.97 105.19 102.73 3day n GLY 381 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 3day n GLY 381 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3day s TYR 382 N -3.40 2.23 -0.83 1.61 2.02 -0.83 -4.51 117.35 113.63 3day s TYR 382 Ca 0.00 -0.41 0.16 0.00 -0.37 0.00 0.00 57.07 56.45 3day s TYR 382 Cb 0.00 -1.36 0.62 0.00 -0.40 0.00 0.00 41.96 40.82 3day s TYR 382 CO 0.00 0.08 1.54 0.00 -1.57 0.00 0.00 175.55 175.60 3day n MET 383 N 1.96 3.52 0.00 -0.62 0.00 0.90 -4.76 117.12 118.13 3day n MET 383 Ca -0.17 -2.76 0.00 0.00 0.00 0.00 0.00 57.70 54.77 3day n MET 383 Cb 0.52 -1.81 0.00 0.00 0.00 0.00 0.00 33.22 31.93 3day n MET 383 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3day n GLY 384 N 0.65 -1.79 3.76 3.17 0.00 -1.25 -3.35 105.19 106.38 3day n GLY 384 Ca 0.23 -2.02 -0.23 0.00 0.00 0.00 0.00 46.02 43.99 3day n GLY 384 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3day s THR 385 N 0.00 2.56 0.16 2.61 -4.23 -0.68 -0.80 115.64 115.26 3day s THR 385 Ca 0.00 -1.63 -0.33 0.00 -1.18 0.00 0.00 61.69 58.55 3day s THR 385 Cb 0.00 -2.99 -0.16 0.00 1.34 0.00 0.00 72.50 70.69 3day s THR 385 CO 0.00 -0.05 1.08 0.00 -0.54 0.00 0.00 174.62 175.11 3day n ALA 386 N -1.27 -1.30 -1.22 3.99 0.00 -1.26 -1.08 120.51 118.37 3day n ALA 386 Ca -0.01 0.47 -0.32 0.00 0.00 0.00 0.00 53.44 53.59 3day n ALA 386 Cb 0.63 -1.95 0.10 0.00 0.00 0.00 0.00 19.45 18.22 3day n ALA 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3day s ALA 387 N -0.29 2.15 0.24 0.00 0.00 0.68 -4.76 121.76 119.77 3day s ALA 387 Ca 0.73 0.44 -0.05 0.00 0.00 0.00 0.00 51.96 53.08 3day s ALA 387 Cb -0.90 -3.33 0.25 0.00 0.00 0.00 0.00 23.12 19.14 3day s ALA 387 CO 0.53 -1.85 1.78 0.77 0.00 0.00 0.00 175.76 177.00 3day h SER 388 N -0.94 0.96 0.37 0.00 0.02 -1.90 -1.12 113.55 110.93 3day h SER 388 Ca -0.44 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 3day h SER 388 Cb 1.25 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.54 3day h SER 388 CO 0.50 0.91 0.00 0.00 -1.14 0.00 0.00 176.83 177.10 3day s TYR 390 N -2.94 2.54 -0.65 0.00 2.02 -0.43 -4.67 117.35 113.22 3day s TYR 390 Ca 0.06 -0.61 -0.16 0.00 -0.37 0.00 0.00 57.07 55.99 3day s TYR 390 Cb 0.08 -1.64 0.15 0.00 -0.40 0.00 0.00 41.96 40.15 3day s TYR 390 CO 0.21 -0.15 0.64 0.34 -1.57 0.00 0.00 175.55 175.02 3day s ASP 391 N -0.18 6.39 -0.18 2.29 2.15 -1.26 -4.59 116.67 121.29 3day s ASP 391 Ca -0.02 -2.03 -0.08 0.00 0.43 0.00 0.00 52.55 50.85 3day s ASP 391 Cb -0.14 -2.23 -0.04 0.00 -0.30 0.00 0.00 42.92 40.21 3day s ASP 391 CO 0.03 -0.81 0.09 -0.69 -0.17 0.00 0.00 175.17 173.62 3day s VAL 392 N 1.34 5.06 0.13 1.11 1.01 -1.26 -1.06 120.40 126.73 3day s VAL 392 Ca 0.10 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 62.10 3day s VAL 392 Cb -0.22 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 3day s VAL 392 CO -0.01 0.48 0.13 -1.10 0.00 0.00 0.00 175.10 174.60 3day s GLN 393 N 0.16 0.94 -0.22 2.72 -1.52 0.10 -4.89 119.66 116.95 3day s GLN 393 Ca 0.06 -1.28 -0.14 0.00 -1.95 0.00 0.00 55.36 52.06 3day s GLN 393 Cb -0.12 0.29 -0.04 0.00 -0.22 0.00 0.00 33.01 32.92 3day s GLN 393 CO -0.00 -0.29 0.31 0.42 -0.25 0.00 0.00 175.29 175.48 3day s ILE 394 N -3.99 5.26 0.16 1.08 -1.09 -1.26 -1.07 121.20 120.29 3day s ILE 394 Ca 0.18 0.51 0.08 0.00 -2.23 0.00 0.00 60.65 59.19 3day s ILE 394 Cb 0.06 -3.64 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 3day s ILE 394 CO -0.02 0.29 -0.18 0.27 -1.23 0.00 0.00 174.94 174.07 3day s ILE 395 N 1.21 1.81 0.33 2.92 -4.36 0.32 -0.79 121.20 122.64 3day s ILE 395 Ca 0.15 -1.91 -0.01 0.00 -0.26 0.00 0.00 60.65 58.61 3day s ILE 395 Cb -0.14 -1.84 0.07 0.00 1.25 0.00 0.00 42.46 41.80 3day s ILE 395 CO 0.07 -0.32 0.45 -0.90 0.24 0.00 0.00 174.94 174.48 3day n ASP 396 N 0.29 0.50 0.33 4.36 5.68 0.08 -1.91 116.55 125.88 3day n ASP 396 Ca -0.13 -1.45 0.21 0.00 -0.50 0.00 0.00 54.79 52.92 3day n ASP 396 Cb 0.57 -0.30 1.12 0.00 -1.14 0.00 0.00 41.12 41.37 3day n ASP 396 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 3day h ASP 397 N -0.32 0.00 -0.25 -1.12 3.04 -2.01 -1.66 116.42 114.10 3day h ASP 397 Ca -0.15 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.64 3day h ASP 397 Cb 0.52 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.81 3day h ASP 397 CO 0.15 0.00 0.00 0.29 -2.04 0.00 0.00 179.24 177.64 3day n LYS 398 N -3.15 2.42 -0.72 4.15 4.01 -1.26 -4.95 118.16 118.66 3day n LYS 398 Ca -0.02 -2.12 0.00 0.00 -0.51 0.00 0.00 58.31 55.66 3day n LYS 398 Cb 0.11 -1.49 0.00 0.00 -0.51 0.00 0.00 35.03 33.13 3day n LYS 398 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3day n GLY 399 N 1.44 0.63 3.79 0.72 0.00 -0.62 -4.66 105.19 106.50 3day n GLY 399 Ca 0.17 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 3day n GLY 399 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3day s ASN 400 N -2.04 7.24 0.15 1.61 0.02 -1.26 -4.71 114.94 115.95 3day s ASN 400 Ca 0.00 1.55 -0.30 0.00 -1.02 0.00 0.00 52.86 53.09 3day s ASN 400 Cb 0.00 -2.47 -0.08 0.00 0.02 0.00 0.00 41.25 38.73 3day s ASN 400 CO 0.00 0.13 1.25 -0.69 0.02 0.00 0.00 177.10 177.82 3day s VAL 401 N -1.31 3.55 0.10 1.60 1.01 -1.26 -0.74 120.40 123.35 3day s VAL 401 Ca 0.39 1.22 0.01 0.00 0.00 0.00 0.00 61.98 63.60 3day s VAL 401 Cb -0.20 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 3day s VAL 401 CO 0.24 0.16 0.23 -0.76 0.00 0.00 0.00 175.10 174.96 3day s LEU 402 N 0.27 4.29 0.77 3.92 1.43 0.03 -4.91 118.68 124.49 3day s LEU 402 Ca 0.57 0.20 -0.11 0.00 -1.03 0.00 0.00 54.13 53.76 3day s LEU 402 Cb -0.33 -2.89 0.05 0.00 0.03 0.00 0.00 46.19 43.05 3day s LEU 402 CO 0.34 0.12 1.09 -2.16 0.23 0.00 0.00 176.35 175.97 3day s PRO 403 N -2.80 2.29 0.68 1.29 0.04 -1.26 -4.76 135.00 130.48 3day s PRO 403 Ca 0.34 1.15 -0.17 0.00 0.04 0.00 0.00 61.00 62.37 3day s PRO 403 Cb -0.12 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 3day s PRO 403 CO 0.28 -1.61 0.87 -0.35 0.04 0.00 0.00 177.00 176.22 3day n PRO 404 N -3.50 0.59 -0.98 0.56 -0.04 -1.26 -3.06 135.00 127.31 3day n PRO 404 Ca 0.09 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 3day n PRO 404 Cb 0.53 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.88 3day n PRO 404 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3day n GLY 405 N 1.29 0.74 3.40 0.55 0.00 -0.10 -5.01 105.19 106.06 3day n GLY 405 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 3day n GLY 405 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3day s THR 406 N -2.96 3.44 0.26 2.61 2.01 -1.17 -4.98 115.64 114.84 3day s THR 406 Ca 0.00 -0.50 -0.30 0.00 0.31 0.00 0.00 61.69 61.20 3day s THR 406 Cb 0.00 -2.51 -0.09 0.00 0.01 0.00 0.00 72.50 69.91 3day s THR 406 CO 0.00 0.48 1.16 -0.70 -0.69 0.00 0.00 174.62 174.87 3day s GLU 407 N 0.70 4.56 0.00 4.92 2.12 -1.26 -4.51 118.70 125.23 3day s GLU 407 Ca -0.04 1.88 0.00 0.00 0.36 0.00 0.00 54.97 57.17 3day s GLU 407 Cb -0.15 -3.19 0.00 0.00 0.26 0.00 0.00 34.13 31.05 3day s GLU 407 CO 0.02 0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.22 3day n GLY 408 N 1.45 1.97 3.75 -1.50 0.00 -0.72 -5.00 105.19 105.15 3day n GLY 408 Ca 0.01 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.81 3day n GLY 408 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3day s ASP 409 N 0.54 7.04 -0.01 1.61 1.01 -0.80 -1.31 116.67 124.74 3day s ASP 409 Ca 0.00 1.24 -0.30 0.00 0.71 0.00 0.00 52.55 54.20 3day s ASP 409 Cb 0.00 -2.40 -0.04 0.00 1.01 0.00 0.00 42.92 41.50 3day s ASP 409 CO 0.00 0.06 1.12 -0.63 0.21 0.00 0.00 175.17 175.93 3day s ILE 410 N -0.07 4.40 0.02 0.77 1.01 -0.03 -0.52 121.20 126.78 3day s ILE 410 Ca 0.33 1.72 -0.03 0.00 0.00 0.00 0.00 60.65 62.67 3day s ILE 410 Cb -0.19 -4.10 -0.02 0.00 0.01 0.00 0.00 42.46 38.16 3day s ILE 410 CO 0.19 0.08 0.04 -0.83 0.00 0.00 0.00 174.94 174.41 3day s GLY 411 N 1.17 0.21 -0.16 6.18 0.00 -0.24 -2.11 107.32 112.37 3day s GLY 411 Ca 0.55 -0.56 -0.01 0.00 0.00 0.00 0.00 44.72 44.70 3day s GLY 411 CO 0.25 -0.66 -0.12 -0.42 0.00 0.00 0.00 173.10 172.15 3day s ILE 412 N -2.03 2.97 0.09 0.90 1.01 -0.69 -0.72 121.20 122.73 3day s ILE 412 Ca -0.10 -0.66 -0.31 0.00 0.00 0.00 0.00 60.65 59.58 3day s ILE 412 Cb -0.05 -2.28 -0.09 0.00 0.01 0.00 0.00 42.46 40.05 3day s ILE 412 CO -0.02 0.50 1.70 -0.60 0.00 0.00 0.00 174.94 176.51 3day s ARG 413 N 0.82 4.18 0.00 2.79 3.52 -0.22 -0.41 118.95 129.63 3day s ARG 413 Ca -0.04 2.41 0.00 0.00 -0.13 0.00 0.00 55.73 57.97 3day s ARG 413 Cb -0.15 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.66 3day s ARG 413 CO 0.01 -0.76 0.23 1.33 -0.81 0.00 0.00 175.30 175.30 3day n VAL 414 N 4.70 0.00 -4.62 7.11 0.24 0.13 -4.44 118.33 121.45 3day n VAL 414 Ca 0.16 -0.47 -0.23 0.00 -2.04 0.00 0.00 64.34 61.77 3day n VAL 414 Cb 0.40 1.03 -0.15 0.00 -1.47 0.00 0.00 33.84 33.66 3day n VAL 414 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3day s LYS 415 N -0.46 1.18 0.33 7.34 1.02 -0.99 -1.99 119.74 126.18 3day s LYS 415 Ca 0.00 -0.64 0.24 0.00 0.02 0.00 0.00 55.97 55.60 3day s LYS 415 Cb 0.00 -1.17 0.47 0.00 -0.52 0.00 0.00 37.83 36.62 3day s LYS 415 CO 0.00 0.31 1.62 -1.00 -0.92 0.00 0.00 175.35 175.36 3day h PRO 416 N 5.47 0.00 -4.88 -1.68 0.13 -1.95 -3.47 132.00 125.62 3day h PRO 416 Ca -0.37 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.11 3day h PRO 416 Cb 1.16 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.10 3day h PRO 416 CO 0.47 0.00 -0.55 0.42 -0.23 0.00 0.00 178.00 178.11 3day s ILE 417 N -3.18 4.91 -0.23 -3.56 -1.09 -1.25 -1.27 121.20 115.53 3day s ILE 417 Ca 0.08 -0.05 -0.29 0.00 -2.23 0.00 0.00 60.65 58.15 3day s ILE 417 Cb 0.08 -3.37 0.01 0.00 -1.58 0.00 0.00 42.46 37.60 3day s ILE 417 CO 0.66 0.22 1.07 -0.60 -1.23 0.00 0.00 174.94 175.06 3day s ARG 418 N 1.69 4.25 0.60 2.79 3.52 0.16 -4.32 118.95 127.64 3day s ARG 418 Ca 0.06 1.38 -0.17 0.00 -0.13 0.00 0.00 55.73 56.88 3day s ARG 418 Cb -0.16 -3.66 -0.03 0.00 -1.56 0.00 0.00 34.95 29.54 3day s ARG 418 CO 0.08 -0.65 1.09 -1.25 -0.81 0.00 0.00 175.30 173.76 3day s PRO 419 N 3.26 3.15 0.25 5.12 0.04 -1.26 -4.30 135.00 141.26 3day s PRO 419 Ca 0.45 1.38 -0.30 0.00 0.04 0.00 0.00 61.00 62.57 3day s PRO 419 Cb -0.16 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.28 3day s PRO 419 CO 0.08 -0.97 1.46 0.42 0.04 0.00 0.00 177.00 178.03 3day s ILE 420 N -2.23 2.58 0.00 0.56 1.01 -1.26 -2.89 121.20 118.97 3day s ILE 420 Ca 0.67 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.81 3day s ILE 420 Cb -0.19 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 38.97 3day s ILE 420 CO 0.35 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.98 3day n GLY 421 N 2.25 1.23 3.76 6.18 0.00 -1.26 -4.78 105.19 112.58 3day n GLY 421 Ca 0.07 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 3day n GLY 421 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3day s ILE 422 N -1.49 3.30 1.21 -0.61 -1.09 -1.14 -4.36 121.20 117.03 3day s ILE 422 Ca 0.00 1.30 -0.17 0.00 -2.23 0.00 0.00 60.65 59.55 3day s ILE 422 Cb 0.00 -3.83 0.29 0.00 -1.58 0.00 0.00 42.46 37.34 3day s ILE 422 CO 0.00 0.30 1.04 0.72 -1.23 0.00 0.00 174.94 175.78 3day s PHE 423 N -1.09 0.73 -0.82 3.97 -0.00 0.07 -4.78 117.98 116.06 3day s PHE 423 Ca 0.46 0.76 0.24 0.00 -0.00 0.00 0.00 56.93 58.39 3day s PHE 423 Cb -0.34 -3.19 0.37 0.00 -0.00 0.00 0.00 43.02 39.85 3day s PHE 423 CO 0.44 -3.98 1.31 0.43 -0.00 0.00 0.00 175.22 173.42 3day n SER 424 N -4.91 0.59 0.00 1.98 7.64 0.20 -5.01 113.62 114.11 3day n SER 424 Ca 0.09 -0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.83 3day n SER 424 Cb 0.58 0.32 0.00 0.00 -1.01 0.00 0.00 64.21 64.10 3day n SER 424 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3day n GLY 425 N 1.43 2.92 3.69 0.23 0.00 -1.25 -4.98 105.19 107.22 3day n GLY 425 Ca 0.04 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.64 3day n GLY 425 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3day s TYR 426 N -2.16 3.19 0.12 1.61 2.02 -1.26 -2.16 117.35 118.71 3day s TYR 426 Ca 0.00 1.22 -0.33 0.00 -0.37 0.00 0.00 57.07 57.59 3day s TYR 426 Cb 0.00 -3.42 -0.13 0.00 -0.40 0.00 0.00 41.96 38.02 3day s TYR 426 CO 0.00 -1.29 1.71 0.28 -1.57 0.00 0.00 175.55 174.68 3day n VAL 427 N 4.64 0.17 -0.85 0.71 0.31 0.37 -2.04 118.33 121.64 3day n VAL 427 Ca 0.11 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 3day n VAL 427 Cb 0.46 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 3day n VAL 427 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3day n ASP 428 N 4.49 -1.77 -3.17 4.52 8.00 -1.26 -4.79 116.55 122.57 3day n ASP 428 Ca 0.18 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.49 3day n ASP 428 Cb 0.32 -1.54 -0.03 0.00 -0.02 0.00 0.00 41.12 39.85 3day n ASP 428 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3day n ASN 429 N -0.20 1.18 0.28 -2.24 4.05 -0.86 -4.91 115.26 112.56 3day n ASN 429 Ca 0.00 -3.07 0.13 0.00 0.45 0.00 0.00 54.58 52.09 3day n ASN 429 Cb 0.10 -0.62 0.80 0.00 1.23 0.00 0.00 39.78 41.29 3day n ASN 429 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 3day h PRO 430 N 3.04 0.00 -0.65 1.20 0.13 -1.91 -1.71 132.00 132.11 3day h PRO 430 Ca 0.10 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.19 3day h PRO 430 Cb 0.92 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.02 3day h PRO 430 CO 0.53 0.06 0.25 -0.44 -0.23 0.00 0.00 178.00 178.18 3day h ASP 431 N 0.00 0.90 -0.24 1.44 3.32 -1.94 -0.77 116.42 119.14 3day h ASP 431 Ca -0.00 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 56.86 3day h ASP 431 Cb 0.16 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 3day h ASP 431 CO 0.01 0.83 0.08 0.50 -1.72 0.00 0.00 179.24 178.94 3day h LYS 432 N 0.92 0.37 -0.01 3.56 1.63 -1.73 -1.08 116.57 120.24 3day h LYS 432 Ca 0.22 -0.08 0.03 0.00 -0.85 0.00 0.00 60.65 59.96 3day h LYS 432 Cb 0.22 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.76 3day h LYS 432 CO -0.02 0.45 -0.15 1.15 -3.45 0.00 0.00 179.45 177.44 3day h THR 433 N 0.22 0.63 -0.77 1.00 2.02 -1.32 -2.82 112.91 111.88 3day h THR 433 Ca 0.08 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.27 3day h THR 433 Cb 0.23 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 3day h THR 433 CO -0.00 0.00 0.51 0.00 0.37 0.00 0.00 175.52 176.40 3day h ALA 434 N 0.72 1.48 0.00 6.16 0.00 -1.03 -1.76 119.26 124.83 3day h ALA 434 Ca 0.05 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3day h ALA 434 Cb 0.31 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3day h ALA 434 CO -0.15 0.47 -0.01 0.00 0.00 0.00 0.00 179.25 179.56 3day h ALA 435 N 1.53 1.07 -0.35 0.00 0.00 -0.94 -1.12 119.26 119.46 3day h ALA 435 Ca 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3day h ALA 435 Cb -0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3day h ALA 435 CO -0.07 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.28 3day n ASN 436 N -3.19 2.27 -4.57 0.00 4.13 -0.66 -4.85 115.26 108.38 3day n ASN 436 Ca -0.02 -1.90 -0.35 0.00 1.68 0.00 0.00 54.58 53.98 3day n ASN 436 Cb 0.11 -0.23 -0.11 0.00 -1.54 0.00 0.00 39.78 38.01 3day n ASN 436 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3day s ILE 437 N -1.54 4.66 -0.22 2.41 1.01 -0.42 0.01 121.20 127.10 3day s ILE 437 Ca 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.90 3day s ILE 437 Cb 0.17 -3.13 0.06 0.00 0.01 0.00 0.00 42.46 39.57 3day s ILE 437 CO 0.24 0.41 -0.05 -0.60 0.00 0.00 0.00 174.94 174.93 3day s ARG 438 N 0.81 1.58 7.54 2.79 3.52 0.05 -4.97 118.95 130.27 3day s ARG 438 Ca 0.04 -0.87 0.00 0.00 -0.13 0.00 0.00 55.73 54.77 3day s ARG 438 Cb -0.14 -2.46 0.00 0.00 -1.56 0.00 0.00 34.95 30.80 3day s ARG 438 CO 0.02 -0.56 0.00 0.41 -0.81 0.00 0.00 175.30 174.37 3day n GLY 439 N 4.73 3.65 1.28 8.12 0.00 -1.26 -1.53 105.19 120.17 3day n GLY 439 Ca -0.12 0.20 0.09 0.00 0.00 0.00 0.00 46.02 46.19 3day n GLY 439 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3day n ASP 440 N 9.68 3.73 -4.14 1.61 8.00 -1.26 -4.93 116.55 129.23 3day n ASP 440 Ca 0.00 -2.17 -0.24 0.00 0.71 0.00 0.00 54.79 53.09 3day n ASP 440 Cb 0.00 -0.47 -0.15 0.00 -0.02 0.00 0.00 41.12 40.47 3day n ASP 440 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3day s PHE 441 N -1.45 1.46 -0.17 1.24 0.08 -0.58 0.22 117.98 118.77 3day s PHE 441 Ca 0.43 -0.28 -0.28 0.00 0.12 0.00 0.00 56.93 56.92 3day s PHE 441 Cb 0.25 -0.94 -0.00 0.00 -0.57 0.00 0.00 43.02 41.76 3day s PHE 441 CO 0.25 -0.03 0.98 -0.46 -0.10 0.00 0.00 175.22 175.87 3day s TRP 442 N -0.38 3.42 -0.17 0.36 -0.11 0.45 -0.77 118.94 121.75 3day s TRP 442 Ca 0.06 1.46 -0.28 0.00 1.22 0.00 0.00 56.10 58.57 3day s TRP 442 Cb -0.06 -3.18 -0.01 0.00 -1.50 0.00 0.00 33.47 28.72 3day s TRP 442 CO -0.01 -0.34 0.94 -0.51 -4.62 0.00 0.00 176.95 172.42 3day s LEU 443 N 2.55 4.18 0.45 5.86 1.43 0.10 -1.71 118.68 131.54 3day s LEU 443 Ca 0.44 1.34 0.25 0.00 -1.03 0.00 0.00 54.13 55.13 3day s LEU 443 Cb -0.17 -3.42 0.89 0.00 0.03 0.00 0.00 46.19 43.52 3day s LEU 443 CO 0.12 -0.49 1.81 -0.07 0.23 0.00 0.00 176.35 177.95 3day h LEU 444 N 8.54 0.00 0.00 1.79 4.07 -1.75 -3.47 115.31 124.49 3day h LEU 444 Ca -0.27 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.69 3day h LEU 444 Cb 1.12 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.86 3day h LEU 444 CO 0.88 0.19 0.00 0.61 -1.08 0.00 0.00 178.44 179.04 3day n GLY 445 N 0.28 0.79 3.74 0.83 0.00 -1.26 -5.04 105.19 104.53 3day n GLY 445 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 3day n GLY 445 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3day s ASP 446 N -2.63 5.55 0.35 1.61 1.01 -1.26 -0.93 116.67 120.37 3day s ASP 446 Ca 0.00 0.19 -0.18 0.00 0.71 0.00 0.00 52.55 53.27 3day s ASP 446 Cb 0.00 -1.61 -0.10 0.00 1.01 0.00 0.00 42.92 42.22 3day s ASP 446 CO 0.00 0.35 0.82 -0.13 0.21 0.00 0.00 175.17 176.42 3day s ARG 447 N -1.18 4.14 0.24 8.23 1.81 0.01 -0.86 118.95 131.35 3day s ARG 447 Ca 0.17 0.89 -0.17 0.00 -1.72 0.00 0.00 55.73 54.89 3day s ARG 447 Cb -0.12 -2.41 0.01 0.00 -0.45 0.00 0.00 34.95 31.99 3day s ARG 447 CO 0.06 0.12 0.57 0.20 -0.68 0.00 0.00 175.30 175.57 3day s GLY 448 N -2.14 0.12 -0.01 -3.53 0.00 -0.43 -0.30 107.32 101.03 3day s GLY 448 Ca 0.56 -0.47 0.06 0.00 0.00 0.00 0.00 44.72 44.86 3day s GLY 448 CO 0.17 -0.33 -0.18 -0.42 0.00 0.00 0.00 173.10 172.33 3day s ILE 449 N -3.94 1.42 -0.15 0.90 1.01 -0.62 -1.75 121.20 118.08 3day s ILE 449 Ca 0.14 -0.77 -0.05 0.00 0.00 0.00 0.00 60.65 59.98 3day s ILE 449 Cb -0.02 -1.18 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 3day s ILE 449 CO 0.04 0.40 0.01 -0.75 0.00 0.00 0.00 174.94 174.65 3day s LYS 450 N -0.42 3.62 0.83 2.79 2.20 -1.26 -0.65 119.74 126.86 3day s LYS 450 Ca 0.07 -0.42 -0.08 0.00 -0.36 0.00 0.00 55.97 55.17 3day s LYS 450 Cb -0.07 -3.00 0.18 0.00 -1.51 0.00 0.00 37.83 33.43 3day s LYS 450 CO -0.01 0.37 1.14 -0.40 -0.36 0.00 0.00 175.35 176.09 3day n ASP 451 N 3.17 0.70 0.18 1.43 5.75 -0.26 -0.93 116.55 126.60 3day n ASP 451 Ca -0.17 -1.78 0.13 0.00 -0.01 0.00 0.00 54.79 52.95 3day n ASP 451 Cb 0.53 -0.81 0.70 0.00 -1.03 0.00 0.00 41.12 40.51 3day n ASP 451 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 3day h GLU 452 N 0.00 0.00 -0.21 0.11 4.11 -1.95 -1.04 114.58 115.60 3day h GLU 452 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.06 3day h GLU 452 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3day h GLU 452 CO 0.32 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.15 3day n ASP 453 N -4.34 2.29 0.00 3.06 8.00 -1.26 -4.94 116.55 119.36 3day n ASP 453 Ca 0.01 -1.80 0.00 0.00 0.71 0.00 0.00 54.79 53.71 3day n ASP 453 Cb 0.27 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 3day n ASP 453 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3day n GLY 454 N 1.26 0.57 3.73 0.44 0.00 -0.39 -5.02 105.19 105.78 3day n GLY 454 Ca 0.17 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 3day n GLY 454 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3day s TYR 455 N -2.00 3.71 0.01 1.61 4.12 -1.26 -4.39 117.35 119.16 3day s TYR 455 Ca 0.00 1.70 -0.20 0.00 0.02 0.00 0.00 57.07 58.60 3day s TYR 455 Cb 0.00 -3.15 -0.06 0.00 -1.52 0.00 0.00 41.96 37.24 3day s TYR 455 CO 0.00 -0.14 0.57 -0.06 0.02 0.00 0.00 175.55 175.94 3day s PHE 456 N 0.10 3.71 -0.20 2.71 0.08 0.02 -1.11 117.98 123.30 3day s PHE 456 Ca 0.49 1.19 -0.04 0.00 0.12 0.00 0.00 56.93 58.69 3day s PHE 456 Cb -0.25 -2.55 -0.02 0.00 -0.57 0.00 0.00 43.02 39.63 3day s PHE 456 CO 0.31 0.43 -0.03 -1.14 -0.10 0.00 0.00 175.22 174.69 3day s GLN 457 N -0.46 3.52 0.18 0.44 0.74 0.17 -0.07 119.66 124.18 3day s GLN 457 Ca 0.30 -0.57 -0.31 0.00 0.05 0.00 0.00 55.36 54.82 3day s GLN 457 Cb -0.18 -3.00 -0.09 0.00 1.10 0.00 0.00 33.01 30.84 3day s GLN 457 CO 0.17 -0.02 1.46 0.12 -0.55 0.00 0.00 175.29 176.47 3day s PHE 458 N 1.05 3.11 -0.12 1.67 5.36 -1.26 -1.59 117.98 126.20 3day s PHE 458 Ca 0.01 0.89 0.16 0.00 -0.96 0.00 0.00 56.93 57.03 3day s PHE 458 Cb -0.15 -3.80 0.27 0.00 -0.34 0.00 0.00 43.02 39.00 3day s PHE 458 CO 0.01 -2.78 1.14 -1.33 -1.46 0.00 0.00 175.22 170.80 3day n MET 459 N 3.32 1.12 0.00 10.12 2.81 0.59 -4.91 117.12 130.16 3day n MET 459 Ca 0.10 -2.43 0.00 0.00 -1.81 0.00 0.00 57.70 53.57 3day n MET 459 Cb 0.40 -1.35 0.00 0.00 -0.71 0.00 0.00 33.22 31.56 3day n MET 459 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3day n GLY 460 N -1.19 2.16 3.72 3.03 0.00 -1.25 -4.69 105.19 106.98 3day n GLY 460 Ca 0.14 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 3day n GLY 460 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3day s ARG 461 N -2.77 4.27 0.24 1.61 0.52 -1.26 -0.81 118.95 120.76 3day s ARG 461 Ca 0.00 2.21 -0.04 0.00 -0.52 0.00 0.00 55.73 57.38 3day s ARG 461 Cb 0.00 -3.20 0.45 0.00 0.52 0.00 0.00 34.95 32.72 3day s ARG 461 CO 0.00 -0.51 1.75 0.00 0.02 0.00 0.00 175.30 176.55 3day h ALA 462 N 6.76 1.09 0.00 2.13 0.00 -1.35 -0.54 119.26 127.36 3day h ALA 462 Ca -0.42 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3day h ALA 462 Cb 1.21 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3day h ALA 462 CO 0.88 -0.15 0.00 -0.44 0.00 0.00 0.00 179.25 179.54 3day h ASP 463 N 0.51 0.00 0.35 0.00 5.19 -1.92 -2.83 116.42 117.72 3day h ASP 463 Ca 0.41 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.82 3day h ASP 463 Cb 0.58 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.09 3day h ASP 463 CO -0.37 0.00 -0.67 0.47 -3.12 0.00 0.00 179.24 175.55 3day n ASP 464 N -2.49 0.66 -4.75 6.45 8.00 -0.21 -4.90 116.55 119.31 3day n ASP 464 Ca 0.00 -0.47 -0.41 0.00 0.71 0.00 0.00 54.79 54.63 3day n ASP 464 Cb 0.18 0.50 -0.04 0.00 -0.02 0.00 0.00 41.12 41.74 3day n ASP 464 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3day s ILE 465 N -3.01 3.72 -0.17 0.53 -1.09 -1.07 -4.38 121.20 115.73 3day s ILE 465 Ca 0.10 1.57 -0.08 0.00 -2.23 0.00 0.00 60.65 60.01 3day s ILE 465 Cb 0.17 -4.00 -0.04 0.00 -1.58 0.00 0.00 42.46 37.00 3day s ILE 465 CO 0.76 0.31 0.09 -0.63 -1.23 0.00 0.00 174.94 174.24 3day s ILE 466 N -0.58 5.10 -0.41 2.92 1.01 0.13 -4.91 121.20 124.46 3day s ILE 466 Ca 0.48 0.07 -0.07 0.00 0.00 0.00 0.00 60.65 61.13 3day s ILE 466 Cb -0.30 -3.28 0.09 0.00 0.01 0.00 0.00 42.46 38.97 3day s ILE 466 CO 0.37 0.49 0.22 0.20 0.00 0.00 0.00 174.94 176.22 3day s ASN 467 N 0.02 5.45 -0.09 3.58 0.01 -1.26 0.42 114.94 123.07 3day s ASN 467 Ca 0.08 -1.64 0.02 0.00 -0.71 0.00 0.00 52.86 50.60 3day s ASN 467 Cb -0.12 -1.91 0.01 0.00 0.41 0.00 0.00 41.25 39.64 3day s ASN 467 CO 0.00 -0.52 -0.15 -0.55 -1.51 0.00 0.00 177.10 174.38 3day s SER 468 N 1.98 2.29 -1.57 -1.22 0.15 -0.13 -3.82 113.70 111.38 3day s SER 468 Ca 0.04 -0.39 -0.12 0.00 0.70 0.00 0.00 55.95 56.17 3day s SER 468 Cb -0.23 -1.03 0.10 0.00 -1.71 0.00 0.00 66.02 63.15 3day s SER 468 CO -0.00 0.03 0.75 -1.20 1.20 0.00 0.00 173.24 174.01 3day n SER 469 N 4.05 -2.87 -0.39 5.45 7.64 -1.23 0.41 113.62 126.68 3day n SER 469 Ca -0.20 -0.94 -0.05 0.00 1.01 0.00 0.00 58.87 58.69 3day n SER 469 Cb 0.51 -3.18 -0.02 0.00 -1.01 0.00 0.00 64.21 60.52 3day n SER 469 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3day n GLY 470 N -1.62 0.66 3.78 0.23 0.00 -1.26 -5.03 105.19 101.95 3day n GLY 470 Ca -0.04 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 3day n GLY 470 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3day s TYR 471 N -1.82 3.16 -0.22 1.61 2.02 0.17 -5.11 117.35 117.16 3day s TYR 471 Ca 0.00 0.04 -0.06 0.00 -0.37 0.00 0.00 57.07 56.68 3day s TYR 471 Cb 0.00 -1.58 -0.03 0.00 -0.40 0.00 0.00 41.96 39.95 3day s TYR 471 CO 0.00 0.52 0.03 1.03 -1.57 0.00 0.00 175.55 175.55 3day s ARG 472 N -2.59 3.64 -0.15 -0.62 0.52 -1.26 -0.96 118.95 117.55 3day s ARG 472 Ca 0.29 -0.50 0.01 0.00 -0.52 0.00 0.00 55.73 55.01 3day s ARG 472 Cb -0.12 -3.17 0.02 0.00 0.52 0.00 0.00 34.95 32.21 3day s ARG 472 CO 0.22 -0.04 -0.15 0.42 0.02 0.00 0.00 175.30 175.77 3day s ILE 473 N 1.18 1.63 0.05 1.52 1.09 0.17 -4.95 121.20 121.88 3day s ILE 473 Ca 0.03 -0.67 -0.24 0.00 -1.10 0.00 0.00 60.65 58.67 3day s ILE 473 Cb -0.14 -1.52 -0.06 0.00 -1.06 0.00 0.00 42.46 39.68 3day s ILE 473 CO 0.02 0.47 0.74 -0.83 -0.10 0.00 0.00 174.94 175.24 3day s GLY 474 N 1.42 2.77 0.29 6.18 0.00 -1.26 0.18 107.32 116.90 3day s GLY 474 Ca 0.04 0.24 0.04 0.00 0.00 0.00 0.00 44.72 45.04 3day s GLY 474 CO -0.10 1.02 1.73 -0.56 0.00 0.00 0.00 173.10 175.18 3day h PRO 475 N 5.56 0.39 -0.75 2.90 0.13 -1.85 -3.28 132.00 135.11 3day h PRO 475 Ca -0.44 -0.15 0.11 0.00 -0.87 0.00 0.00 66.00 64.64 3day h PRO 475 Cb 1.20 -0.02 -0.08 0.00 0.13 0.00 0.00 31.00 32.24 3day h PRO 475 CO 0.70 0.65 0.37 0.77 -0.23 0.00 0.00 178.00 180.26 3day h SER 476 N 0.34 0.47 -0.21 1.44 0.02 -1.94 0.12 113.55 113.79 3day h SER 476 Ca 0.05 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 3day h SER 476 Cb 0.69 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 3day h SER 476 CO 0.05 0.25 0.03 -0.08 -1.14 0.00 0.00 176.83 175.94 3day h GLU 477 N 0.60 0.35 -0.09 3.45 4.81 -1.99 -0.03 114.58 121.68 3day h GLU 477 Ca 0.38 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.51 3day h GLU 477 Cb 0.44 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 3day h GLU 477 CO -0.30 0.51 0.05 0.28 -0.73 0.00 0.00 179.01 178.82 3day h VAL 478 N 0.14 1.11 -0.82 0.32 2.07 -1.53 -1.29 116.25 116.26 3day h VAL 478 Ca 0.06 -0.33 0.15 0.00 0.82 0.00 0.00 66.70 67.40 3day h VAL 478 Cb 0.33 1.17 -0.10 0.00 -1.52 0.00 0.00 31.29 31.17 3day h VAL 478 CO 0.01 0.10 0.39 -0.33 0.02 0.00 0.00 177.57 177.75 3day h GLU 479 N 0.03 0.53 -0.12 1.57 5.08 -0.72 0.88 114.58 121.83 3day h GLU 479 Ca 0.03 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3day h GLU 479 Cb 0.12 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 3day h GLU 479 CO -0.00 0.35 -0.10 -0.91 -1.00 0.00 0.00 179.01 177.35 3day h ASN 480 N 0.54 0.30 -0.77 1.42 2.35 -0.73 -1.27 115.58 117.42 3day h ASN 480 Ca 0.45 -0.46 0.16 0.00 -0.55 0.00 0.00 56.30 55.91 3day h ASN 480 Cb 0.67 -0.08 -0.11 0.00 0.05 0.00 0.00 38.32 38.85 3day h ASN 480 CO -0.39 0.69 0.24 0.00 -1.65 0.00 0.00 177.43 176.33 3day h ALA 481 N 0.61 1.06 -0.42 -0.83 0.00 -0.91 -2.58 119.26 116.19 3day h ALA 481 Ca 0.02 0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3day h ALA 481 Cb 0.60 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3day h ALA 481 CO 0.03 -0.30 -0.04 -0.07 0.00 0.00 0.00 179.25 178.86 3day h LEU 482 N 0.34 0.76 -2.44 0.00 3.38 -0.53 -2.98 115.31 113.83 3day h LEU 482 Ca 0.44 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3day h LEU 482 Cb 0.74 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 3day h LEU 482 CO -0.49 0.91 -0.03 0.24 0.09 0.00 0.00 178.44 179.16 3day h MET 483 N 0.59 0.00 0.00 1.13 2.86 -0.99 -1.53 114.93 117.00 3day h MET 483 Ca 0.11 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 3day h MET 483 Cb 0.54 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.19 3day h MET 483 CO 0.03 0.03 -0.16 0.93 1.06 0.00 0.00 176.91 178.79 3day h GLU 484 N 0.00 0.00 -6.64 1.72 5.08 -1.30 -3.44 114.58 110.01 3day h GLU 484 Ca -0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 3day h GLU 484 Cb 0.09 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 3day h GLU 484 CO 0.00 0.16 0.46 -1.58 -1.00 0.00 0.00 179.01 177.05 3day s HIS 485 N -4.35 3.64 0.37 4.33 2.46 -0.57 -4.94 115.29 116.23 3day s HIS 485 Ca -0.03 1.63 0.36 0.00 0.47 0.00 0.00 55.06 57.49 3day s HIS 485 Cb 0.14 -3.23 1.77 0.00 -0.13 0.00 0.00 32.58 31.13 3day s HIS 485 CO 0.64 -0.45 2.14 -1.00 -2.47 0.00 0.00 174.74 173.60 3day h PRO 486 N 5.24 0.00 0.00 2.88 0.13 -1.86 -2.26 132.00 136.12 3day h PRO 486 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.63 3day h PRO 486 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 3day h PRO 486 CO 0.73 0.03 -0.29 0.00 -0.23 0.00 0.00 178.00 178.24 3day h ALA 487 N 1.97 1.15 -2.49 -0.56 0.00 -1.92 -3.43 119.26 113.99 3day h ALA 487 Ca -0.00 -0.26 -0.64 0.00 0.00 0.00 0.00 54.91 54.00 3day h ALA 487 Cb 0.29 -0.05 -0.15 0.00 0.00 0.00 0.00 17.79 17.89 3day h ALA 487 CO 0.00 0.36 -0.09 0.08 0.00 0.00 0.00 179.25 179.60 3day s VAL 488 N -3.89 5.05 -0.07 0.00 1.01 -0.85 -0.54 120.40 121.10 3day s VAL 488 Ca -0.01 0.35 -0.06 0.00 0.00 0.00 0.00 61.98 62.26 3day s VAL 488 Cb 0.12 -3.92 -0.28 0.00 0.00 0.00 0.00 36.38 32.30 3day s VAL 488 CO 0.66 -0.16 0.55 0.58 0.00 0.00 0.00 175.10 176.73 3day h VAL 489 N 5.58 0.81 -2.73 2.92 2.07 -1.27 -3.45 116.25 120.18 3day h VAL 489 Ca -0.28 -2.48 -0.07 0.00 0.82 0.00 0.00 66.70 64.68 3day h VAL 489 Cb 1.13 2.61 -0.17 0.00 -1.52 0.00 0.00 31.29 33.34 3day h VAL 489 CO 0.75 0.84 -0.02 -1.61 0.02 0.00 0.00 177.57 177.56 3day s GLU 490 N -2.58 0.95 -0.06 1.57 2.02 -1.20 -5.01 118.70 114.39 3day s GLU 490 Ca -0.17 -0.16 -0.22 0.00 0.02 0.00 0.00 54.97 54.43 3day s GLU 490 Cb 0.06 0.44 0.05 0.00 0.10 0.00 0.00 34.13 34.78 3day s GLU 490 CO 0.81 -0.32 0.51 -0.08 0.02 0.00 0.00 175.26 176.20 3day s THR 491 N -2.03 0.02 -0.04 3.63 -1.32 -1.26 -0.32 115.64 114.32 3day s THR 491 Ca -0.08 -0.19 0.04 0.00 -1.21 0.00 0.00 61.69 60.26 3day s THR 491 Cb -0.01 -0.80 -0.00 0.00 -1.51 0.00 0.00 72.50 70.17 3day s THR 491 CO 0.01 -0.10 -0.17 0.00 -2.21 0.00 0.00 174.62 172.15 3day s ALA 492 N -0.97 1.51 -0.16 11.08 0.00 -0.57 -4.98 121.76 127.66 3day s ALA 492 Ca -0.10 -0.69 -0.02 0.00 0.00 0.00 0.00 51.96 51.15 3day s ALA 492 Cb -0.03 -0.50 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 3day s ALA 492 CO 0.06 0.28 -0.09 0.08 0.00 0.00 0.00 175.76 176.09 3day s VAL 493 N 0.02 3.22 0.09 0.00 1.01 -1.26 -0.52 120.40 122.95 3day s VAL 493 Ca -0.03 -0.58 -0.02 0.00 0.00 0.00 0.00 61.98 61.35 3day s VAL 493 Cb -0.11 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 3day s VAL 493 CO 0.02 0.49 0.04 0.27 0.00 0.00 0.00 175.10 175.92 3day s ILE 494 N 0.75 0.16 0.55 2.22 -4.36 0.33 -4.74 121.20 116.12 3day s ILE 494 Ca -0.04 -1.76 -0.18 0.00 -0.26 0.00 0.00 60.65 58.41 3day s ILE 494 Cb -0.15 -1.70 -0.05 0.00 1.25 0.00 0.00 42.46 41.81 3day s ILE 494 CO 0.02 -0.74 1.07 -0.94 0.24 0.00 0.00 174.94 174.58 3day s SER 495 N -2.96 5.91 0.02 4.36 1.04 -1.26 -0.81 113.70 119.99 3day s SER 495 Ca 0.13 1.93 0.02 0.00 0.48 0.00 0.00 55.95 58.51 3day s SER 495 Cb 0.07 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.63 3day s SER 495 CO -0.05 -1.08 -0.07 -0.55 0.98 0.00 0.00 173.24 172.47 3day s SER 496 N -2.32 0.76 0.32 7.02 0.15 0.05 -4.82 113.70 114.86 3day s SER 496 Ca 0.67 -0.32 -0.29 0.00 0.70 0.00 0.00 55.95 56.70 3day s SER 496 Cb -0.18 -0.02 -0.10 0.00 -1.71 0.00 0.00 66.02 64.01 3day s SER 496 CO 0.30 -0.07 1.33 -2.16 1.20 0.00 0.00 173.24 173.84 3day s PRO 497 N -0.85 4.34 0.00 5.44 0.04 -1.26 -0.34 135.00 142.36 3day s PRO 497 Ca -0.04 2.23 0.00 0.00 0.04 0.00 0.00 61.00 63.23 3day s PRO 497 Cb -0.06 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.40 3day s PRO 497 CO 0.00 -0.23 0.00 -3.47 0.04 0.00 0.00 177.00 173.34 3day n ASP 498 N 1.07 0.00 -2.26 6.66 2.03 -1.26 -4.76 116.55 118.03 3day n ASP 498 Ca 0.01 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.22 3day n ASP 498 Cb 0.42 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.80 3day n ASP 498 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3day n ARG 501 N 0.00 -0.93 0.00 -0.67 1.74 -1.26 -4.93 116.66 110.61 3day n ARG 501 Ca 0.00 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 3day n ARG 501 Cb 0.00 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 3day n ARG 501 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3day n GLY 502 N -0.65 1.21 3.29 -0.13 0.00 -1.26 -3.49 105.19 104.16 3day n GLY 502 Ca 0.03 0.41 -0.15 0.00 0.00 0.00 0.00 46.02 46.31 3day n GLY 502 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3day s GLU 503 N 0.00 1.51 0.09 1.61 -1.05 -1.25 -4.61 118.70 115.01 3day s GLU 503 Ca 0.00 -1.77 0.04 0.00 -0.15 0.00 0.00 54.97 53.09 3day s GLU 503 Cb 0.00 0.32 -0.04 0.00 -0.44 0.00 0.00 34.13 33.98 3day s GLU 503 CO 0.00 -0.55 -0.10 0.08 0.95 0.00 0.00 175.26 175.64 3day s VAL 504 N -3.76 0.93 -0.12 1.83 1.01 0.53 -4.27 120.40 116.56 3day s VAL 504 Ca 0.38 -1.60 -0.30 0.00 0.00 0.00 0.00 61.98 60.46 3day s VAL 504 Cb 0.04 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 3day s VAL 504 CO 0.19 -0.54 1.22 -0.69 0.00 0.00 0.00 175.10 175.28 3day s VAL 505 N -2.35 4.31 -0.06 2.92 1.01 -1.26 -0.77 120.40 124.19 3day s VAL 505 Ca 0.05 1.60 0.06 0.00 0.00 0.00 0.00 61.98 63.68 3day s VAL 505 Cb -0.03 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.30 3day s VAL 505 CO 0.00 -0.08 -0.24 -0.75 0.00 0.00 0.00 175.10 174.04 3day s LYS 506 N 2.88 2.62 -0.20 2.72 2.20 0.01 -0.75 119.74 129.22 3day s LYS 506 Ca 0.54 -0.88 -0.07 0.00 -0.36 0.00 0.00 55.97 55.21 3day s LYS 506 Cb -0.22 -2.21 -0.03 0.00 -1.51 0.00 0.00 37.83 33.85 3day s LYS 506 CO 0.17 0.38 0.04 0.00 -0.36 0.00 0.00 175.35 175.59 3day s ALA 507 N -0.15 3.24 -0.17 3.13 0.00 -0.32 -0.51 121.76 126.98 3day s ALA 507 Ca -0.04 -0.88 -0.23 0.00 0.00 0.00 0.00 51.96 50.81 3day s ALA 507 Cb -0.14 -1.89 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 3day s ALA 507 CO 0.04 -0.02 0.70 -0.06 0.00 0.00 0.00 175.76 176.42 3day s PHE 508 N 0.76 3.42 -0.10 0.00 0.08 0.32 -0.88 117.98 121.59 3day s PHE 508 Ca 0.02 1.08 0.01 0.00 0.12 0.00 0.00 56.93 58.16 3day s PHE 508 Cb -0.14 -2.86 0.02 0.00 -0.57 0.00 0.00 43.02 39.47 3day s PHE 508 CO 0.02 -0.15 -0.11 0.08 -0.10 0.00 0.00 175.22 174.96 3day s VAL 509 N 1.79 1.18 -0.33 -0.44 1.01 -0.45 -1.52 120.40 121.65 3day s VAL 509 Ca 0.33 -0.44 -0.20 0.00 0.00 0.00 0.00 61.98 61.67 3day s VAL 509 Cb -0.16 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.08 3day s VAL 509 CO 0.12 0.38 0.59 -0.69 0.00 0.00 0.00 175.10 175.51 3day s VAL 510 N 1.17 4.95 0.35 2.92 1.01 0.56 -1.49 120.40 129.88 3day s VAL 510 Ca -0.04 0.66 -0.25 0.00 0.00 0.00 0.00 61.98 62.35 3day s VAL 510 Cb -0.14 -4.00 -0.10 0.00 0.00 0.00 0.00 36.38 32.14 3day s VAL 510 CO -0.03 -0.19 0.95 -0.76 0.00 0.00 0.00 175.10 175.07 3day s LEU 511 N 2.56 4.24 0.36 3.92 1.43 -1.26 -0.83 118.68 129.10 3day s LEU 511 Ca 0.23 1.80 -0.28 0.00 -1.03 0.00 0.00 54.13 54.85 3day s LEU 511 Cb -0.15 -4.15 -0.11 0.00 0.03 0.00 0.00 46.19 41.81 3day s LEU 511 CO 0.13 -0.15 1.48 0.00 0.23 0.00 0.00 176.35 178.04 3day n ALA 512 N 0.25 2.23 -0.30 4.21 0.00 0.29 -4.74 120.51 122.45 3day n ALA 512 Ca 0.03 0.35 0.13 0.00 0.00 0.00 0.00 53.44 53.96 3day n ALA 512 Cb 0.51 -2.40 0.30 0.00 0.00 0.00 0.00 19.45 17.86 3day n ALA 512 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3day h SER 513 N 3.24 0.08 0.51 0.00 0.02 -1.96 0.15 113.55 115.59 3day h SER 513 Ca -0.49 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3day h SER 513 Cb 1.25 0.24 0.00 0.00 0.14 0.00 0.00 62.40 64.02 3day h SER 513 CO 0.67 -0.13 0.00 0.06 -1.14 0.00 0.00 176.83 176.29 3day h GLN 514 N 0.24 0.00 -0.00 3.45 3.07 -1.97 -2.73 115.11 117.17 3day h GLN 514 Ca 0.56 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.30 3day h GLN 514 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.69 3day h GLN 514 CO -0.63 0.00 -0.51 1.19 0.09 0.00 0.00 178.83 178.97 3day n PHE 515 N -3.05 0.00 0.28 0.06 3.72 0.50 -4.14 117.46 114.83 3day n PHE 515 Ca -0.01 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.52 3day n PHE 515 Cb 0.19 -0.22 0.79 0.00 -0.94 0.00 0.00 39.48 39.30 3day n PHE 515 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3day h LEU 516 N 0.14 0.00 0.00 4.37 3.38 -1.50 -1.42 115.31 120.28 3day h LEU 516 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3day h LEU 516 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3day h LEU 516 CO 0.00 0.06 -0.13 -1.54 0.09 0.00 0.00 178.44 176.92 3day n SER 517 N -3.88 0.60 -4.78 -0.43 3.41 -1.26 -4.89 113.62 102.40 3day n SER 517 Ca -0.03 0.44 -0.35 0.00 -0.26 0.00 0.00 58.87 58.67 3day n SER 517 Cb 0.15 -0.51 -0.00 0.00 -0.26 0.00 0.00 64.21 63.59 3day n SER 517 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3day s HIS 518 N -3.08 2.73 0.02 7.33 3.76 -0.54 -4.98 115.29 120.53 3day s HIS 518 Ca 0.11 1.55 -0.30 0.00 -0.15 0.00 0.00 55.06 56.26 3day s HIS 518 Cb 0.14 -3.24 -0.07 0.00 1.11 0.00 0.00 32.58 30.52 3day s HIS 518 CO 0.61 -1.44 1.70 0.34 -0.85 0.00 0.00 174.74 175.10 3day s ASP 519 N -1.86 6.60 0.20 1.40 2.15 -1.26 -4.92 116.67 118.99 3day s ASP 519 Ca 0.71 2.42 -0.05 0.00 0.43 0.00 0.00 52.55 56.07 3day s ASP 519 Cb -0.22 -2.55 0.14 0.00 -0.30 0.00 0.00 42.92 39.99 3day s ASP 519 CO 0.26 -0.93 1.58 -0.65 -0.17 0.00 0.00 175.17 175.27 3day h PRO 520 N 9.11 0.73 -0.74 4.34 0.11 -1.94 -0.03 132.00 143.59 3day h PRO 520 Ca -0.42 -0.35 0.10 0.00 0.11 0.00 0.00 66.00 65.44 3day h PRO 520 Cb 1.20 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.23 3day h PRO 520 CO 0.94 0.96 0.38 1.49 -0.21 0.00 0.00 178.00 181.56 3day h GLU 521 N 0.62 0.62 -0.12 1.05 4.81 -1.99 0.37 114.58 119.94 3day h GLU 521 Ca 0.07 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.11 3day h GLU 521 Cb 0.86 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 30.11 3day h GLU 521 CO 0.07 0.41 -0.52 0.37 -0.73 0.00 0.00 179.01 178.61 3day h GLN 522 N 0.64 0.56 -0.75 1.92 4.15 -1.90 -2.35 115.11 117.39 3day h GLN 522 Ca 0.36 -0.45 -0.05 0.00 0.77 0.00 0.00 58.65 59.29 3day h GLN 522 Cb 0.38 0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.13 3day h GLN 522 CO -0.27 1.07 0.28 1.25 -1.93 0.00 0.00 178.83 179.23 3day h LEU 523 N 0.19 1.05 -0.02 -2.39 5.85 -0.78 -1.73 115.31 117.48 3day h LEU 523 Ca -0.03 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.54 3day h LEU 523 Cb 1.16 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 3day h LEU 523 CO 0.11 0.95 -0.16 0.74 -0.34 0.00 0.00 178.44 179.74 3day h THR 524 N 1.10 0.60 -0.58 1.05 2.02 -0.20 0.76 112.91 117.65 3day h THR 524 Ca 0.25 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.51 3day h THR 524 Cb 0.24 0.60 -0.07 0.00 -1.74 0.00 0.00 68.15 67.19 3day h THR 524 CO -0.02 0.00 0.23 0.11 0.37 0.00 0.00 175.52 176.21 3day h LYS 525 N -0.26 0.41 -0.84 6.66 1.57 -1.33 0.20 116.57 122.97 3day h LYS 525 Ca 0.06 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 3day h LYS 525 Cb 0.34 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.51 3day h LYS 525 CO -0.17 0.27 0.47 0.93 -0.57 0.00 0.00 179.45 180.38 3day h GLU 526 N 0.42 1.17 -0.21 3.15 5.08 -0.79 0.11 114.58 123.50 3day h GLU 526 Ca 0.29 -0.13 -0.20 0.00 -1.00 0.00 0.00 59.36 58.32 3day h GLU 526 Cb 0.32 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 29.34 3day h GLU 526 CO -0.27 0.85 -0.63 -0.07 -1.00 0.00 0.00 179.01 177.88 3day h LEU 527 N 1.18 0.92 -0.36 1.33 3.38 -0.26 -1.87 115.31 119.63 3day h LEU 527 Ca 0.30 -0.58 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 3day h LEU 527 Cb 0.02 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3day h LEU 527 CO -0.05 1.35 0.16 1.56 0.09 0.00 0.00 178.44 181.55 3day h GLN 528 N 0.55 0.52 -0.99 1.13 4.20 -0.28 -1.98 115.11 118.27 3day h GLN 528 Ca -0.02 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 58.62 3day h GLN 528 Cb 1.25 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.89 3day h GLN 528 CO 0.14 0.48 0.65 1.96 -0.67 0.00 0.00 178.83 181.39 3day h GLN 529 N 0.44 1.30 -0.16 1.46 4.20 -0.85 -1.62 115.11 119.88 3day h GLN 529 Ca 0.12 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 3day h GLN 529 Cb 0.14 -0.29 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 3day h GLN 529 CO -0.01 0.86 0.06 1.25 -0.67 0.00 0.00 178.83 180.32 3day h HIS 530 N 1.34 0.24 0.18 2.96 -0.00 -1.00 -2.57 115.15 116.30 3day h HIS 530 Ca 0.36 -0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.71 3day h HIS 530 Cb -0.15 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 27.19 3day h HIS 530 CO 0.00 0.31 -0.09 0.28 -0.00 0.00 0.00 177.93 178.43 3day h VAL 531 N 0.10 0.87 -0.62 5.26 2.07 -1.22 -2.09 116.25 120.62 3day h VAL 531 Ca 0.05 -0.25 0.18 0.00 0.82 0.00 0.00 66.70 67.50 3day h VAL 531 Cb 0.17 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 3day h VAL 531 CO -0.00 0.06 0.94 0.11 0.02 0.00 0.00 177.57 178.69 3day h LYS 532 N -0.37 0.00 0.00 1.57 1.57 -1.16 0.12 116.57 118.30 3day h LYS 532 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3day h LYS 532 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3day h LYS 532 CO 0.04 0.00 -1.31 -1.13 -0.57 0.00 0.00 179.45 176.48 3day n SER 533 N -3.17 0.56 -0.01 0.86 3.41 -0.81 -4.33 113.62 110.12 3day n SER 533 Ca 0.13 -0.40 0.08 0.00 -0.26 0.00 0.00 58.87 58.43 3day n SER 533 Cb 1.14 1.22 -0.14 0.00 -0.26 0.00 0.00 64.21 66.17 3day n SER 533 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3day n VAL 534 N -1.91 0.04 -4.28 -3.33 0.24 0.34 -5.04 118.33 104.39 3day n VAL 534 Ca 0.01 -0.42 -0.15 0.00 -2.04 0.00 0.00 64.34 61.74 3day n VAL 534 Cb 0.44 0.07 -0.10 0.00 -1.47 0.00 0.00 33.84 32.78 3day n VAL 534 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3day s THR 535 N -3.22 0.42 -0.07 3.34 -4.23 -0.78 -5.09 115.64 106.01 3day s THR 535 Ca -0.07 -2.00 -0.38 0.00 -1.18 0.00 0.00 61.69 58.07 3day s THR 535 Cb 0.11 -2.56 -0.16 0.00 1.34 0.00 0.00 72.50 71.23 3day s THR 535 CO 0.75 -0.04 1.52 0.00 -0.54 0.00 0.00 174.62 176.31 3day n ALA 536 N -0.40 -0.57 0.09 3.99 0.00 -1.26 -4.64 120.51 117.72 3day n ALA 536 Ca 0.00 0.46 0.06 0.00 0.00 0.00 0.00 53.44 53.95 3day n ALA 536 Cb 0.66 -2.15 0.29 0.00 0.00 0.00 0.00 19.45 18.25 3day n ALA 536 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3day n PRO 537 N 3.82 0.07 0.02 0.00 -0.02 -1.26 -1.44 135.00 136.18 3day n PRO 537 Ca 0.22 0.56 0.12 0.00 -2.02 0.00 0.00 63.50 62.37 3day n PRO 537 Cb 0.17 -1.76 0.51 0.00 -0.02 0.00 0.00 33.50 32.40 3day n PRO 537 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 3day n TYR 538 N -1.87 0.13 1.21 6.00 0.18 -1.26 -3.38 117.16 118.17 3day n TYR 538 Ca -0.01 0.04 0.13 0.00 1.88 0.00 0.00 57.90 59.94 3day n TYR 538 Cb 0.05 -0.57 0.30 0.00 -0.38 0.00 0.00 39.34 38.74 3day n TYR 538 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 3day n LYS 539 N -1.61 1.10 -2.19 -3.48 5.02 -0.52 -4.98 118.16 111.51 3day n LYS 539 Ca 0.06 -0.74 -0.38 0.00 -2.02 0.00 0.00 58.31 55.23 3day n LYS 539 Cb 0.30 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.82 3day n LYS 539 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 3day s TYR 540 N -2.41 2.89 -0.40 2.13 -0.85 -1.22 -4.90 117.35 112.59 3day s TYR 540 Ca 0.25 1.50 -0.28 0.00 -0.52 0.00 0.00 57.07 58.02 3day s TYR 540 Cb 0.19 -3.48 -0.01 0.00 0.38 0.00 0.00 41.96 39.05 3day s TYR 540 CO 0.50 -1.67 1.67 -1.25 -1.52 0.00 0.00 175.55 173.28 3day s PRO 541 N -2.47 3.32 0.44 -3.49 0.04 -1.26 -4.64 135.00 126.94 3day s PRO 541 Ca 0.60 1.12 0.25 0.00 0.04 0.00 0.00 61.00 63.01 3day s PRO 541 Cb -0.32 -4.17 0.88 0.00 0.04 0.00 0.00 34.50 30.94 3day s PRO 541 CO 0.40 -1.88 1.81 0.00 0.04 0.00 0.00 177.00 177.36 3day h ARG 542 N 12.38 0.00 -6.62 4.56 3.08 -1.30 -3.41 114.38 123.05 3day h ARG 542 Ca -0.30 0.00 -0.70 0.00 0.07 0.00 0.00 59.98 59.05 3day h ARG 542 Cb 1.14 0.00 -0.28 0.00 0.08 0.00 0.00 29.97 30.91 3day h ARG 542 CO 1.08 0.20 -0.87 0.15 -1.07 0.00 0.00 179.97 179.46 3day s LYS 543 N -3.58 2.05 -0.07 0.04 1.02 -1.10 -5.05 119.74 113.06 3day s LYS 543 Ca 0.01 -0.97 -0.01 0.00 0.02 0.00 0.00 55.97 55.03 3day s LYS 543 Cb 0.10 -2.06 0.03 0.00 -0.52 0.00 0.00 37.83 35.37 3day s LYS 543 CO 0.63 0.55 -0.02 0.42 -0.92 0.00 0.00 175.35 176.02 3day s ILE 544 N -0.70 0.47 -0.15 2.17 1.01 -1.26 -1.18 121.20 121.56 3day s ILE 544 Ca 0.11 0.02 -0.00 0.00 0.00 0.00 0.00 60.65 60.78 3day s ILE 544 Cb -0.10 -0.58 -0.01 0.00 0.01 0.00 0.00 42.46 41.78 3day s ILE 544 CO 0.00 0.26 -0.13 -0.70 0.00 0.00 0.00 174.94 174.37 3day s GLU 545 N 1.65 3.31 -0.03 2.79 2.12 -0.06 -4.99 118.70 123.49 3day s GLU 545 Ca 0.00 -0.70 -0.24 0.00 0.36 0.00 0.00 54.97 54.39 3day s GLU 545 Cb -0.13 -2.68 -0.04 0.00 0.26 0.00 0.00 34.13 31.54 3day s GLU 545 CO -0.04 0.08 0.73 -0.06 -0.54 0.00 0.00 175.26 175.43 3day s PHE 546 N 0.69 3.63 0.09 5.30 0.08 -1.26 -1.34 117.98 125.17 3day s PHE 546 Ca -0.06 1.34 0.00 0.00 0.12 0.00 0.00 56.93 58.33 3day s PHE 546 Cb -0.15 -2.82 -0.04 0.00 -0.57 0.00 0.00 43.02 39.44 3day s PHE 546 CO 0.02 0.15 -0.02 0.14 -0.10 0.00 0.00 175.22 175.41 3day s VAL 547 N 0.51 0.38 -0.52 -0.44 -7.23 -0.55 -4.91 120.40 107.64 3day s VAL 547 Ca 0.38 -1.88 0.23 0.00 -1.81 0.00 0.00 61.98 58.91 3day s VAL 547 Cb -0.19 -1.71 -0.07 0.00 0.56 0.00 0.00 36.38 34.97 3day s VAL 547 CO 0.20 -0.83 1.06 0.18 -0.31 0.00 0.00 175.10 175.40 3day n LEU 548 N -0.00 0.63 -3.47 1.32 4.77 -1.26 -3.96 117.00 115.03 3day n LEU 548 Ca -0.11 0.09 -0.13 0.00 -0.03 0.00 0.00 56.01 55.83 3day n LEU 548 Cb 0.62 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 3day n LEU 548 CO 0.30 -0.02 0.48 0.54 -1.33 0.00 0.00 177.39 177.36 3day s ASN 549 N -4.27 -0.55 0.05 -1.43 4.22 -1.26 -4.99 114.94 106.71 3day s ASN 549 Ca 0.03 0.22 0.03 0.00 -2.14 0.00 0.00 52.86 51.00 3day s ASN 549 Cb 0.13 0.53 -0.04 0.00 1.28 0.00 0.00 41.25 43.15 3day s ASN 549 CO 0.79 -0.78 0.02 -0.76 -2.04 0.00 0.00 177.10 174.33 3day s LEU 550 N -2.19 3.56 0.17 3.54 1.43 -1.26 -5.01 118.68 118.92 3day s LEU 550 Ca -0.02 -0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 52.70 3day s LEU 550 Cb -0.01 -2.19 -0.08 0.00 0.03 0.00 0.00 46.19 43.94 3day s LEU 550 CO -0.05 0.21 1.30 -2.16 0.23 0.00 0.00 176.35 175.88 3day s PRO 551 N -2.05 4.39 0.05 1.29 0.04 -1.26 -4.99 135.00 132.47 3day s PRO 551 Ca 0.24 2.01 0.03 0.00 0.04 0.00 0.00 61.00 63.32 3day s PRO 551 Cb -0.12 -3.22 -0.03 0.00 0.04 0.00 0.00 34.50 31.18 3day s PRO 551 CO 0.16 -0.27 -0.09 0.15 0.04 0.00 0.00 177.00 177.00 3day s LYS 552 N 0.20 0.58 0.96 4.56 1.02 -1.26 -0.86 119.74 124.94 3day s LYS 552 Ca 0.58 -0.81 -0.12 0.00 0.02 0.00 0.00 55.97 55.64 3day s LYS 552 Cb -0.36 -0.37 0.17 0.00 -0.52 0.00 0.00 37.83 36.75 3day s LYS 552 CO 0.36 0.07 1.11 0.95 -0.92 0.00 0.00 175.35 176.92 3day s THR 553 N -1.44 2.04 0.56 2.17 -4.23 -0.26 -4.84 115.64 109.64 3day s THR 553 Ca -0.08 0.01 0.30 0.00 -1.18 0.00 0.00 61.69 60.74 3day s THR 553 Cb -0.10 -2.62 0.44 0.00 1.34 0.00 0.00 72.50 71.56 3day s THR 553 CO 0.01 -0.02 1.88 1.62 -0.54 0.00 0.00 174.62 177.57 3day h VAL 554 N -1.72 0.48 -0.01 2.29 3.04 -1.92 0.21 116.25 118.62 3day h VAL 554 Ca -0.53 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.16 3day h VAL 554 Cb 1.33 0.57 0.00 0.00 -2.01 0.00 0.00 31.29 31.19 3day h VAL 554 CO 0.60 0.00 -0.17 0.35 -1.01 0.00 0.00 177.57 177.34 3day n THR 555 N -4.03 0.00 -0.43 3.17 -2.24 -1.26 -4.92 114.28 104.56 3day n THR 555 Ca 0.14 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 3day n THR 555 Cb 0.84 0.41 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 3day n THR 555 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3day n GLY 556 N 1.29 0.75 3.73 3.38 0.00 0.72 -5.06 105.19 110.00 3day n GLY 556 Ca 0.14 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 3day n GLY 556 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3day s LYS 557 N -0.75 4.40 0.12 1.61 1.02 -1.26 -4.75 119.74 120.14 3day s LYS 557 Ca 0.00 0.83 -0.31 0.00 0.02 0.00 0.00 55.97 56.51 3day s LYS 557 Cb 0.00 -3.41 -0.08 0.00 -0.52 0.00 0.00 37.83 33.82 3day s LYS 557 CO 0.00 0.19 1.49 0.42 -0.92 0.00 0.00 175.35 176.53 3day s ILE 558 N 0.39 3.07 -1.25 2.17 1.01 -1.26 -1.10 121.20 124.23 3day s ILE 558 Ca 0.35 0.72 -0.13 0.00 0.00 0.00 0.00 60.65 61.59 3day s ILE 558 Cb -0.18 -3.46 0.15 0.00 0.01 0.00 0.00 42.46 38.98 3day s ILE 558 CO 0.18 0.04 1.61 0.00 0.00 0.00 0.00 174.94 176.78 3day n GLN 559 N 4.31 3.39 -0.20 2.79 6.02 -0.04 -4.82 117.38 128.83 3day n GLN 559 Ca 0.13 -3.65 0.03 0.00 -0.01 0.00 0.00 57.00 53.50 3day n GLN 559 Cb 0.41 -3.08 0.30 0.00 1.02 0.00 0.00 30.24 28.89 3day n GLN 559 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3day h ARG 560 N 6.80 0.86 -0.68 -1.09 3.08 -1.86 -2.75 114.38 118.73 3day h ARG 560 Ca 0.36 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.44 3day h ARG 560 Cb 0.80 -0.19 -0.06 0.00 0.08 0.00 0.00 29.97 30.60 3day h ARG 560 CO 1.39 0.57 0.35 0.00 -1.07 0.00 0.00 179.97 181.21 3day h ALA 561 N 1.58 0.92 -0.12 0.04 0.00 -1.87 0.87 119.26 120.68 3day h ALA 561 Ca 0.29 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3day h ALA 561 Cb 0.07 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3day h ALA 561 CO -0.08 -0.01 0.07 -0.22 0.00 0.00 0.00 179.25 179.01 3day h LYS 562 N 0.63 0.16 -0.24 0.00 3.64 -1.79 0.56 116.57 119.54 3day h LYS 562 Ca 0.32 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.70 3day h LYS 562 Cb 0.27 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 3day h LYS 562 CO -0.22 0.13 0.13 -0.07 -2.27 0.00 0.00 179.45 177.14 3day h LEU 563 N 0.14 0.21 -0.48 5.20 3.38 -1.34 -2.24 115.31 120.17 3day h LEU 563 Ca 0.04 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.04 3day h LEU 563 Cb 0.01 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3day h LEU 563 CO -0.01 0.15 0.28 -0.09 0.09 0.00 0.00 178.44 178.86 3day h ARG 564 N 0.27 0.54 -0.51 1.13 2.43 -0.49 0.16 114.38 117.90 3day h ARG 564 Ca 0.09 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3day h ARG 564 Cb 0.01 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 3day h ARG 564 CO -0.05 0.35 0.27 -0.44 -1.51 0.00 0.00 179.97 178.59 3day h ASP 565 N 0.55 0.65 -0.38 -3.80 3.32 0.33 -1.85 116.42 115.24 3day h ASP 565 Ca 0.19 -0.11 -0.11 0.00 0.02 0.00 0.00 57.03 57.03 3day h ASP 565 Cb 0.03 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 3day h ASP 565 CO -0.10 0.57 -0.17 0.50 -1.72 0.00 0.00 179.24 178.33 3day h LYS 566 N 0.68 0.85 -0.68 3.56 3.64 -1.19 0.24 116.57 123.67 3day h LYS 566 Ca 0.18 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 3day h LYS 566 Cb 0.08 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 3day h LYS 566 CO -0.03 0.96 0.44 1.49 -2.27 0.00 0.00 179.45 180.04 3day h GLU 567 N 0.75 0.90 0.00 1.90 4.57 -0.36 -2.32 114.58 120.01 3day h GLU 567 Ca 0.11 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 3day h GLU 567 Cb 0.69 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.08 3day h GLU 567 CO 0.05 0.61 -0.75 0.91 -1.18 0.00 0.00 179.01 178.65 3day n TRP 568 N -4.42 0.29 -0.88 0.92 7.02 -0.75 -4.70 117.44 114.92 3day n TRP 568 Ca 0.07 0.09 0.00 0.00 -1.02 0.00 0.00 57.50 56.64 3day n TRP 568 Cb 0.05 -0.45 0.00 0.00 -2.42 0.00 0.00 31.31 28.48 3day n TRP 568 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30