#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k5o s GLN 3 N 0.00 1.78 0.27 0.00 -0.21 -0.25 -4.87 119.66 116.38 3k5o s GLN 3 Ca 0.00 -1.59 -0.16 0.00 0.02 0.00 0.00 55.36 53.63 3k5o s GLN 3 Cb 0.00 -1.90 -0.08 0.00 1.00 0.00 0.00 33.01 32.02 3k5o s GLN 3 CO 0.00 0.37 0.71 0.00 -2.12 0.00 0.00 175.29 174.25 3k5o s ALA 4 N -2.16 3.39 0.26 6.09 0.00 -1.26 -0.38 121.76 127.69 3k5o s ALA 4 Ca 0.27 0.06 -0.20 0.00 0.00 0.00 0.00 51.96 52.09 3k5o s ALA 4 Cb -0.06 -2.75 0.02 0.00 0.00 0.00 0.00 23.12 20.33 3k5o s ALA 4 CO 0.14 0.35 0.65 0.20 0.00 0.00 0.00 175.76 177.10 3k5o s GLY 5 N -2.01 -0.04 -0.10 0.00 0.00 -0.02 -4.60 107.32 100.55 3k5o s GLY 5 Ca 0.49 -0.31 -0.01 0.00 0.00 0.00 0.00 44.72 44.88 3k5o s GLY 5 CO 0.19 -0.17 -0.02 -0.12 0.00 0.00 0.00 173.10 172.98 3k5o s PHE 6 N -3.91 0.99 0.20 1.90 5.36 -0.44 -0.98 117.98 121.10 3k5o s PHE 6 Ca 0.12 -0.43 -0.31 0.00 -0.96 0.00 0.00 56.93 55.35 3k5o s PHE 6 Cb -0.04 -0.97 -0.11 0.00 -0.34 0.00 0.00 43.02 41.56 3k5o s PHE 6 CO 0.04 -0.42 1.58 0.42 -1.46 0.00 0.00 175.22 175.39 3k5o s ILE 7 N 1.87 2.46 -0.21 3.12 1.01 -0.33 -0.92 121.20 128.20 3k5o s ILE 7 Ca 0.04 0.34 -0.10 0.00 0.00 0.00 0.00 60.65 60.93 3k5o s ILE 7 Cb -0.13 -3.22 -0.09 0.00 0.01 0.00 0.00 42.46 39.04 3k5o s ILE 7 CO -0.06 0.03 -0.26 0.18 0.00 0.00 0.00 174.94 174.83 3k5o n LEU 8 N 3.53 1.46 -4.02 2.97 4.77 0.25 -4.90 117.00 121.06 3k5o n LEU 8 Ca 0.13 0.25 -0.10 0.00 -0.03 0.00 0.00 56.01 56.25 3k5o n LEU 8 Cb 0.38 -0.60 -0.11 0.00 -2.33 0.00 0.00 43.42 40.76 3k5o n LEU 8 CO 0.62 0.43 -0.38 0.42 -1.33 0.00 0.00 177.39 177.15 3k5o s THR 9 N -2.37 0.28 0.03 -5.08 -4.23 -1.18 -4.72 115.64 98.37 3k5o s THR 9 Ca -0.29 -1.05 0.07 0.00 -1.18 0.00 0.00 61.69 59.24 3k5o s THR 9 Cb 0.11 -0.49 -0.03 0.00 1.34 0.00 0.00 72.50 73.42 3k5o s THR 9 CO 0.36 -0.50 -0.18 -0.13 -0.54 0.00 0.00 174.62 173.63 3k5o s ARG 10 N -1.71 2.12 0.01 3.99 0.52 -1.26 -1.75 118.95 120.86 3k5o s ARG 10 Ca -0.12 -0.95 -0.12 0.00 -0.52 0.00 0.00 55.73 54.03 3k5o s ARG 10 Cb -0.09 -2.19 0.01 0.00 0.52 0.00 0.00 34.95 33.21 3k5o s ARG 10 CO -0.01 0.55 0.24 -1.01 0.02 0.00 0.00 175.30 175.09 3k5o s HIS 11 N -0.87 -0.06 -0.01 -0.53 3.76 0.05 -5.01 115.29 112.62 3k5o s HIS 11 Ca 0.14 -0.01 -0.14 0.00 -0.15 0.00 0.00 55.06 54.90 3k5o s HIS 11 Cb -0.10 0.03 0.02 0.00 1.11 0.00 0.00 32.58 33.64 3k5o s HIS 11 CO 0.04 -0.40 0.29 1.67 -0.85 0.00 0.00 174.74 175.49 3k5o s TRP 12 N -1.88 -0.15 -0.23 1.40 1.48 -1.26 -0.67 118.94 117.64 3k5o s TRP 12 Ca -0.10 0.19 -0.16 0.00 -1.06 0.00 0.00 56.10 54.97 3k5o s TRP 12 Cb -0.04 0.08 0.07 0.00 -1.16 0.00 0.00 33.47 32.42 3k5o s TRP 12 CO 0.00 -0.39 0.57 -0.98 -4.06 0.00 0.00 176.95 172.10 3k5o s ARG 13 N -1.45 0.61 0.28 3.25 1.70 -0.22 -4.97 118.95 118.14 3k5o s ARG 13 Ca -0.13 0.95 -0.29 0.00 -0.47 0.00 0.00 55.73 55.79 3k5o s ARG 13 Cb -0.05 0.16 -0.10 0.00 -0.57 0.00 0.00 34.95 34.40 3k5o s ARG 13 CO 0.03 -0.13 1.09 -0.51 -1.08 0.00 0.00 175.30 174.70 3k5o s ASP 14 N 1.10 7.29 0.19 -2.89 1.01 -1.26 -0.00 116.67 122.11 3k5o s ASP 14 Ca -0.06 2.25 -0.03 0.00 0.71 0.00 0.00 52.55 55.42 3k5o s ASP 14 Cb -0.06 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.21 3k5o s ASP 14 CO -0.11 -0.12 0.16 0.42 0.21 0.00 0.00 175.17 175.73 3k5o s THR 15 N -1.17 0.02 0.56 -1.27 -4.23 -1.00 -4.89 115.64 103.66 3k5o s THR 15 Ca 0.44 -1.89 0.38 0.00 -1.18 0.00 0.00 61.69 59.44 3k5o s THR 15 Cb -0.31 -2.36 0.40 0.00 1.34 0.00 0.00 72.50 71.57 3k5o s THR 15 CO 0.40 -0.09 2.27 -0.65 -0.54 0.00 0.00 174.62 176.01 3k5o h PRO 16 N 2.62 0.00 -0.48 3.99 0.11 -1.98 -0.67 132.00 135.59 3k5o h PRO 16 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3k5o h PRO 16 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3k5o h PRO 16 CO 0.52 0.02 0.00 1.04 -0.21 0.00 0.00 178.00 179.36 3k5o n GLN 17 N -3.35 2.33 0.00 1.05 1.13 -1.26 -5.05 117.38 112.23 3k5o n GLN 17 Ca -0.03 -2.04 0.00 0.00 -1.94 0.00 0.00 57.00 53.00 3k5o n GLN 17 Cb 0.12 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.00 3k5o n GLN 17 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k5o n GLY 18 N 1.42 1.57 3.70 1.08 0.00 -0.26 -4.78 105.19 107.91 3k5o n GLY 18 Ca 0.19 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 3k5o n GLY 18 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5o s THR 19 N -1.72 4.07 -0.25 2.61 2.01 -1.18 -2.37 115.64 118.80 3k5o s THR 19 Ca 0.00 1.44 -0.16 0.00 0.31 0.00 0.00 61.69 63.28 3k5o s THR 19 Cb 0.00 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 3k5o s THR 19 CO 0.00 0.03 0.42 -0.70 -0.69 0.00 0.00 174.62 173.68 3k5o s GLU 20 N 1.89 4.07 -0.13 4.92 2.12 1.00 -2.01 118.70 130.55 3k5o s GLU 20 Ca 0.58 0.16 -0.03 0.00 0.36 0.00 0.00 54.97 56.05 3k5o s GLU 20 Cb -0.28 -3.62 -0.03 0.00 0.26 0.00 0.00 34.13 30.46 3k5o s GLU 20 CO 0.25 -0.24 -0.03 0.08 -0.54 0.00 0.00 175.26 174.78 3k5o s VAL 21 N 1.94 3.98 0.08 3.70 1.01 -1.26 -1.06 120.40 128.79 3k5o s VAL 21 Ca 0.18 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.77 3k5o s VAL 21 Cb -0.15 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 3k5o s VAL 21 CO 0.09 0.53 0.08 -0.94 0.00 0.00 0.00 175.10 174.86 3k5o s SER 22 N -0.05 0.30 0.02 3.32 1.04 0.16 -0.69 113.70 117.80 3k5o s SER 22 Ca 0.02 -0.86 0.01 0.00 0.48 0.00 0.00 55.95 55.59 3k5o s SER 22 Cb -0.13 0.28 -0.02 0.00 0.10 0.00 0.00 66.02 66.25 3k5o s SER 22 CO 0.02 -0.68 -0.04 -0.36 0.98 0.00 0.00 173.24 173.17 3k5o s PHE 23 N -3.91 0.34 -0.19 5.02 0.08 0.57 -0.77 117.98 119.12 3k5o s PHE 23 Ca 0.08 -0.42 -0.04 0.00 0.12 0.00 0.00 56.93 56.67 3k5o s PHE 23 Cb 0.06 -0.22 -0.02 0.00 -0.57 0.00 0.00 43.02 42.28 3k5o s PHE 23 CO -0.09 -0.13 -0.04 -1.58 -0.10 0.00 0.00 175.22 173.28 3k5o s TRP 24 N -1.16 2.98 0.04 0.36 0.52 -0.72 -0.49 118.94 120.47 3k5o s TRP 24 Ca -0.11 -0.63 0.07 0.00 0.02 0.00 0.00 56.10 55.44 3k5o s TRP 24 Cb -0.08 -2.04 -0.03 0.00 -1.15 0.00 0.00 33.47 30.16 3k5o s TRP 24 CO -0.00 -0.32 -0.16 -0.51 0.02 0.00 0.00 176.95 175.97 3k5o s LEU 25 N 1.00 2.71 -0.22 2.99 1.43 0.36 -0.58 118.68 126.37 3k5o s LEU 25 Ca 0.01 -0.38 -0.16 0.00 -1.03 0.00 0.00 54.13 52.57 3k5o s LEU 25 Cb -0.15 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 3k5o s LEU 25 CO 0.01 0.26 0.40 0.00 0.23 0.00 0.00 176.35 177.24 3k5o s ALA 26 N -0.95 3.56 0.45 4.21 0.00 -0.10 -0.85 121.76 128.08 3k5o s ALA 26 Ca 0.15 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.55 3k5o s ALA 26 Cb -0.11 -2.67 -0.01 0.00 0.00 0.00 0.00 23.12 20.33 3k5o s ALA 26 CO 0.06 -0.40 0.10 0.95 0.00 0.00 0.00 175.76 176.47 3k5o s THR 27 N 1.53 0.67 -0.01 0.00 -4.23 -0.72 -1.32 115.64 111.56 3k5o s THR 27 Ca 0.18 -2.00 0.32 0.00 -1.18 0.00 0.00 61.69 59.01 3k5o s THR 27 Cb -0.15 -2.23 0.36 0.00 1.34 0.00 0.00 72.50 71.83 3k5o s THR 27 CO 0.08 0.00 1.93 0.44 -0.54 0.00 0.00 174.62 176.54 3k5o h ASP 28 N 1.61 0.00 -0.36 3.99 3.32 -1.94 -1.98 116.42 121.06 3k5o h ASP 28 Ca -0.37 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.67 3k5o h ASP 28 Cb 1.29 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 3k5o h ASP 28 CO 0.60 0.00 0.01 0.59 -1.72 0.00 0.00 179.24 178.72 3k5o n ASN 29 N -2.91 4.37 0.00 6.45 5.03 -1.26 -5.06 115.26 121.88 3k5o n ASN 29 Ca 0.01 -3.03 0.00 0.00 0.87 0.00 0.00 54.58 52.43 3k5o n ASN 29 Cb 0.29 -0.59 0.00 0.00 -1.02 0.00 0.00 39.78 38.45 3k5o n ASN 29 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3k5o n GLY 30 N -0.23 -1.78 3.75 7.41 0.00 -0.74 -4.98 105.19 108.62 3k5o n GLY 30 Ca 0.24 -1.90 -0.38 0.00 0.00 0.00 0.00 46.02 43.98 3k5o n GLY 30 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k5o s PRO 31 N 0.00 3.27 -0.08 1.61 0.04 -1.26 -1.75 135.00 136.83 3k5o s PRO 31 Ca 0.00 2.16 -0.03 0.00 0.04 0.00 0.00 61.00 63.16 3k5o s PRO 31 Cb 0.00 -2.30 0.05 0.00 0.04 0.00 0.00 34.50 32.29 3k5o s PRO 31 CO 0.00 -1.06 0.17 -1.17 0.04 0.00 0.00 177.00 174.98 3k5o s LEU 32 N -3.41 0.06 -0.00 -3.56 2.96 -0.03 -4.91 118.68 109.78 3k5o s LEU 32 Ca 0.70 0.35 -0.18 0.00 -0.22 0.00 0.00 54.13 54.78 3k5o s LEU 32 Cb -0.38 0.33 -0.06 0.00 0.50 0.00 0.00 46.19 46.59 3k5o s LEU 32 CO 0.46 -0.23 0.52 -1.58 -1.32 0.00 0.00 176.35 174.20 3k5o s GLN 33 N 2.08 4.20 -0.05 1.98 0.74 -1.26 -0.49 119.66 126.86 3k5o s GLN 33 Ca 0.00 0.61 0.02 0.00 0.05 0.00 0.00 55.36 56.04 3k5o s GLN 33 Cb -0.12 -3.31 0.01 0.00 1.10 0.00 0.00 33.01 30.70 3k5o s GLN 33 CO -0.06 0.47 -0.09 0.08 -0.55 0.00 0.00 175.29 175.14 3k5o s VAL 34 N -0.47 0.83 0.00 1.34 1.01 0.35 -1.70 120.40 121.76 3k5o s VAL 34 Ca 0.28 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 62.00 3k5o s VAL 34 Cb -0.18 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 3k5o s VAL 34 CO 0.15 0.28 -0.20 0.42 0.00 0.00 0.00 175.10 175.76 3k5o s THR 35 N 0.62 1.56 0.44 3.92 -4.23 -0.15 -0.31 115.64 117.49 3k5o s THR 35 Ca -0.11 -0.94 0.02 0.00 -1.18 0.00 0.00 61.69 59.48 3k5o s THR 35 Cb -0.13 -1.32 0.00 0.00 1.34 0.00 0.00 72.50 72.39 3k5o s THR 35 CO 0.02 0.36 0.65 -0.76 -0.54 0.00 0.00 174.62 174.34 3k5o s LEU 36 N -0.68 3.65 0.73 4.79 1.43 0.13 -1.48 118.68 127.25 3k5o s LEU 36 Ca 0.07 0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.19 3k5o s LEU 36 Cb -0.08 -3.03 0.03 0.00 0.03 0.00 0.00 46.19 43.14 3k5o s LEU 36 CO 0.00 -0.72 1.07 0.00 0.23 0.00 0.00 176.35 176.93 3k5o s ALA 37 N -2.51 2.54 0.13 4.21 0.00 -1.26 -4.46 121.76 120.41 3k5o s ALA 37 Ca 0.49 -0.01 -0.35 0.00 0.00 0.00 0.00 51.96 52.09 3k5o s ALA 37 Cb -0.10 -3.15 -0.16 0.00 0.00 0.00 0.00 23.12 19.71 3k5o s ALA 37 CO 0.37 -1.39 1.20 -2.30 0.00 0.00 0.00 175.76 173.64 3k5o n PRO 38 N -3.23 1.04 -4.93 0.00 -0.02 -1.26 -4.73 135.00 121.87 3k5o n PRO 38 Ca 0.07 0.37 -0.33 0.00 -2.02 0.00 0.00 63.50 61.60 3k5o n PRO 38 Cb 0.54 -1.91 -0.15 0.00 -0.02 0.00 0.00 33.50 31.97 3k5o n PRO 38 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3k5o s GLN 39 N -0.07 3.08 0.50 -0.52 -1.52 -0.85 -4.92 119.66 115.36 3k5o s GLN 39 Ca 0.78 -0.75 -0.18 0.00 -1.95 0.00 0.00 55.36 53.27 3k5o s GLN 39 Cb -0.92 -2.48 -0.08 0.00 -0.22 0.00 0.00 33.01 29.31 3k5o s GLN 39 CO 0.51 0.30 0.99 -1.21 -0.25 0.00 0.00 175.29 175.62 3k5o s GLU 40 N 0.10 3.94 -0.13 2.91 2.02 -1.26 -3.91 118.70 122.37 3k5o s GLU 40 Ca -0.08 1.06 -0.09 0.00 0.02 0.00 0.00 54.97 55.89 3k5o s GLU 40 Cb -0.15 -2.13 -0.04 0.00 0.10 0.00 0.00 34.13 31.90 3k5o s GLU 40 CO 0.05 -0.28 0.16 -1.12 0.02 0.00 0.00 175.26 174.10 3k5o s SER 41 N -2.71 6.38 0.07 -0.19 0.01 -0.51 -4.93 113.70 111.83 3k5o s SER 41 Ca 0.61 0.45 0.06 0.00 1.31 0.00 0.00 55.95 58.38 3k5o s SER 41 Cb -0.11 -2.09 -0.03 0.00 0.21 0.00 0.00 66.02 64.00 3k5o s SER 41 CO 0.26 0.33 -0.17 0.54 0.41 0.00 0.00 173.24 174.61 3k5o s VAL 42 N -0.62 1.35 0.16 3.43 0.11 -1.26 -1.36 120.40 122.22 3k5o s VAL 42 Ca 0.14 -1.29 -0.03 0.00 -2.93 0.00 0.00 61.98 57.87 3k5o s VAL 42 Cb -0.12 -1.24 -0.03 0.00 -1.53 0.00 0.00 36.38 33.45 3k5o s VAL 42 CO 0.03 -0.07 0.15 0.00 -3.33 0.00 0.00 175.10 171.88 3k5o s ALA 43 N -1.09 0.70 0.08 1.54 0.00 -0.76 -4.72 121.76 117.51 3k5o s ALA 43 Ca 0.02 -1.38 0.08 0.00 0.00 0.00 0.00 51.96 50.69 3k5o s ALA 43 Cb -0.09 1.01 -0.03 0.00 0.00 0.00 0.00 23.12 24.01 3k5o s ALA 43 CO 0.03 -0.57 -0.22 -0.06 0.00 0.00 0.00 175.76 174.93 3k5o s PHE 44 N -4.06 1.93 -0.01 0.00 0.08 -0.49 0.41 117.98 115.84 3k5o s PHE 44 Ca 0.26 -0.39 0.01 0.00 0.12 0.00 0.00 56.93 56.93 3k5o s PHE 44 Cb 0.06 -1.10 0.00 0.00 -0.57 0.00 0.00 43.02 41.41 3k5o s PHE 44 CO 0.04 0.17 -0.04 0.42 -0.10 0.00 0.00 175.22 175.71 3k5o s ILE 45 N -0.96 0.38 0.36 0.64 1.01 -0.39 0.00 121.20 122.24 3k5o s ILE 45 Ca 0.08 -0.18 -0.28 0.00 0.00 0.00 0.00 60.65 60.28 3k5o s ILE 45 Cb -0.10 -0.34 -0.12 0.00 0.01 0.00 0.00 42.46 41.92 3k5o s ILE 45 CO 0.03 0.12 1.40 -2.65 0.00 0.00 0.00 174.94 173.85 3k5o n PRO 46 N 3.14 2.44 -0.29 2.79 -0.02 -1.26 0.36 135.00 142.16 3k5o n PRO 46 Ca -0.15 0.86 0.03 0.00 -2.02 0.00 0.00 63.50 62.22 3k5o n PRO 46 Cb 0.57 -2.52 0.17 0.00 -0.02 0.00 0.00 33.50 31.70 3k5o n PRO 46 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k5o h ALA 47 N 2.79 1.17 0.00 3.55 0.00 -1.28 -1.53 119.26 123.95 3k5o h ALA 47 Ca -0.49 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3k5o h ALA 47 Cb 1.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3k5o h ALA 47 CO 0.63 0.07 0.00 -0.40 0.00 0.00 0.00 179.25 179.55 3k5o n ASP 48 N -4.77 0.00 -0.65 0.00 5.75 -1.26 -1.56 116.55 114.06 3k5o n ASP 48 Ca 0.14 0.23 0.08 0.00 -0.01 0.00 0.00 54.79 55.22 3k5o n ASP 48 Cb 0.29 -0.34 0.09 0.00 -1.03 0.00 0.00 41.12 40.13 3k5o n ASP 48 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k5o n GLN 49 N -1.34 1.37 -0.22 0.11 6.02 -0.58 -4.59 117.38 118.15 3k5o n GLN 49 Ca 0.04 -1.53 -0.05 0.00 -0.01 0.00 0.00 57.00 55.45 3k5o n GLN 49 Cb 0.09 -1.30 0.06 0.00 1.02 0.00 0.00 30.24 30.11 3k5o n GLN 49 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3k5o h VAL 50 N 2.95 1.11 -0.73 5.09 2.07 -1.25 -0.51 116.25 124.98 3k5o h VAL 50 Ca 0.00 -0.27 0.05 0.00 0.82 0.00 0.00 66.70 67.30 3k5o h VAL 50 Cb 0.66 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 3k5o h VAL 50 CO 0.00 0.14 0.43 -0.65 0.02 0.00 0.00 177.57 177.52 3k5o h PRO 51 N 0.79 0.78 -0.35 1.57 0.11 -1.81 0.65 132.00 133.74 3k5o h PRO 51 Ca 0.25 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.30 3k5o h PRO 51 Cb -0.02 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 30.90 3k5o h PRO 51 CO -0.09 0.52 0.17 -0.09 -0.21 0.00 0.00 178.00 178.31 3k5o h ARG 52 N 0.80 0.51 -0.52 1.05 9.65 -1.75 -0.58 114.38 123.54 3k5o h ARG 52 Ca 0.32 -0.07 -0.04 0.00 -1.10 0.00 0.00 59.98 59.09 3k5o h ARG 52 Cb 0.14 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.61 3k5o h ARG 52 CO -0.16 0.45 0.17 0.00 2.80 0.00 0.00 179.97 183.23 3k5o h ALA 53 N 1.03 1.33 -0.70 2.80 0.00 -0.23 -1.14 119.26 122.35 3k5o h ALA 53 Ca 0.12 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3k5o h ALA 53 Cb 0.11 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3k5o h ALA 53 CO -0.02 0.49 0.28 0.37 0.00 0.00 0.00 179.25 180.37 3k5o h GLN 54 N 0.75 1.04 -0.34 0.00 5.75 0.79 -1.72 115.11 121.40 3k5o h GLN 54 Ca 0.18 -0.19 -0.04 0.00 -0.15 0.00 0.00 58.65 58.45 3k5o h GLN 54 Cb 0.20 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.57 3k5o h GLN 54 CO -0.01 0.86 0.07 1.25 -2.65 0.00 0.00 178.83 178.35 3k5o h HIS 55 N 0.99 0.58 -0.35 3.99 2.76 -0.40 -1.04 115.15 121.69 3k5o h HIS 55 Ca 0.23 -0.08 -0.01 0.00 -2.20 0.00 0.00 60.37 58.31 3k5o h HIS 55 Cb 0.21 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 28.99 3k5o h HIS 55 CO 0.02 0.61 0.17 0.82 -1.30 0.00 0.00 177.93 178.24 3k5o h ILE 56 N 0.39 1.13 -0.60 6.26 2.04 -0.95 -2.63 117.51 123.15 3k5o h ILE 56 Ca 0.10 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.60 3k5o h ILE 56 Cb 0.33 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 3k5o h ILE 56 CO 0.00 0.15 0.00 0.18 0.00 0.00 0.00 178.15 178.48 3k5o n LEU 57 N -4.42 4.35 -0.13 1.44 4.77 -0.67 -4.67 117.00 117.68 3k5o n LEU 57 Ca 0.02 -2.36 0.14 0.00 -0.03 0.00 0.00 56.01 53.78 3k5o n LEU 57 Cb 0.12 -0.52 0.51 0.00 -2.33 0.00 0.00 43.42 41.20 3k5o n LEU 57 CO 0.36 0.82 1.20 -0.61 -1.33 0.00 0.00 177.39 177.84 3k5o h GLN 58 N 3.71 0.39 0.00 3.23 4.15 -0.79 -0.43 115.11 125.37 3k5o h GLN 58 Ca 0.00 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 3k5o h GLN 58 Cb 1.29 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.89 3k5o h GLN 58 CO 0.16 0.26 -0.13 0.78 -1.93 0.00 0.00 178.83 177.97 3k5o h GLY 59 N 0.40 0.00 -1.28 2.39 0.00 -1.84 -3.47 103.07 99.26 3k5o h GLY 59 Ca 0.33 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 47.15 3k5o h GLY 59 CO -0.10 0.00 0.34 -0.54 0.00 0.00 0.00 176.54 176.24 3k5o s GLU 60 N -3.17 2.50 0.23 4.80 0.41 -0.17 -5.10 118.70 118.20 3k5o s GLU 60 Ca 0.06 0.99 0.01 0.00 -0.41 0.00 0.00 54.97 55.62 3k5o s GLU 60 Cb 0.06 -1.94 -0.05 0.00 -1.78 0.00 0.00 34.13 30.42 3k5o s GLU 60 CO 0.69 -1.42 0.07 -0.65 -0.49 0.00 0.00 175.26 173.46 3k5o s GLN 61 N -5.00 1.30 -0.39 1.61 -0.21 -1.26 -4.87 119.66 110.83 3k5o s GLN 61 Ca 0.60 -1.68 0.00 0.00 0.02 0.00 0.00 55.36 54.30 3k5o s GLN 61 Cb -0.15 -0.20 0.00 0.00 1.00 0.00 0.00 33.01 33.66 3k5o s GLN 61 CO 0.55 -0.26 0.00 0.41 -2.12 0.00 0.00 175.29 173.87 3k5o n GLY 62 N -0.38 0.41 3.27 3.09 0.00 -1.26 -4.99 105.19 105.33 3k5o n GLY 62 Ca -0.02 -0.78 -0.09 0.00 0.00 0.00 0.00 46.02 45.13 3k5o n GLY 62 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3k5o s PHE 63 N -2.19 0.28 -0.01 1.61 -0.12 -1.26 -2.31 117.98 113.98 3k5o s PHE 63 Ca 0.00 -0.67 -0.17 0.00 -0.05 0.00 0.00 56.93 56.04 3k5o s PHE 63 Cb 0.00 -0.06 0.03 0.00 -0.63 0.00 0.00 43.02 42.36 3k5o s PHE 63 CO 0.00 -0.63 0.36 -0.98 -0.05 0.00 0.00 175.22 173.92 3k5o s ARG 64 N -3.91 0.73 -0.23 1.99 1.70 -0.58 -5.00 118.95 113.65 3k5o s ARG 64 Ca 0.11 -0.16 -0.01 0.00 -0.47 0.00 0.00 55.73 55.20 3k5o s ARG 64 Cb 0.04 0.33 0.02 0.00 -0.57 0.00 0.00 34.95 34.77 3k5o s ARG 64 CO -0.06 -0.21 -0.10 -0.51 -1.08 0.00 0.00 175.30 173.35 3k5o s LEU 65 N -1.38 2.92 -0.07 -1.89 1.43 -1.26 -1.33 118.68 117.11 3k5o s LEU 65 Ca -0.13 -0.81 0.05 0.00 -1.03 0.00 0.00 54.13 52.21 3k5o s LEU 65 Cb -0.04 -1.62 -0.00 0.00 0.03 0.00 0.00 46.19 44.56 3k5o s LEU 65 CO 0.04 -0.09 -0.22 -0.89 0.23 0.00 0.00 176.35 175.43 3k5o s THR 66 N 1.31 1.81 0.37 5.49 2.01 -0.31 -4.92 115.64 121.41 3k5o s THR 66 Ca 0.01 -0.91 -0.27 0.00 0.31 0.00 0.00 61.69 60.83 3k5o s THR 66 Cb -0.16 -1.56 -0.09 0.00 0.01 0.00 0.00 72.50 70.70 3k5o s THR 66 CO -0.06 0.51 1.21 -2.16 -0.69 0.00 0.00 174.62 173.42 3k5o s PRO 67 N 0.11 4.20 0.10 4.92 0.04 -1.26 0.53 135.00 143.65 3k5o s PRO 67 Ca -0.09 1.96 0.02 0.00 0.04 0.00 0.00 61.00 62.93 3k5o s PRO 67 Cb -0.15 -2.86 -0.04 0.00 0.04 0.00 0.00 34.50 31.50 3k5o s PRO 67 CO 0.05 -0.23 -0.07 -0.51 0.04 0.00 0.00 177.00 176.27 3k5o s LEU 68 N -2.17 2.50 -0.65 -3.56 1.43 -1.13 -4.84 118.68 110.26 3k5o s LEU 68 Ca 0.53 -0.98 -0.06 0.00 -1.03 0.00 0.00 54.13 52.59 3k5o s LEU 68 Cb -0.34 -0.13 -0.11 0.00 0.03 0.00 0.00 46.19 45.64 3k5o s LEU 68 CO 0.44 -0.42 3.14 0.00 0.23 0.00 0.00 176.35 179.73 3k5o n ALA 69 N 0.03 6.74 -2.41 4.21 0.00 -1.26 -4.52 120.51 123.30 3k5o n ALA 69 Ca -0.12 -2.78 -0.13 0.00 0.00 0.00 0.00 53.44 50.41 3k5o n ALA 69 Cb 0.60 -2.60 -0.11 0.00 0.00 0.00 0.00 19.45 17.35 3k5o n ALA 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3k5o s LEU 70 N -0.68 2.43 0.10 0.00 1.43 -1.26 -4.84 118.68 115.86 3k5o s LEU 70 Ca 0.64 -0.86 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 3k5o s LEU 70 Cb 0.28 -0.21 -0.04 0.00 0.03 0.00 0.00 46.19 46.25 3k5o s LEU 70 CO -0.07 -0.33 -0.09 -0.54 0.23 0.00 0.00 176.35 175.55 3k5o s LYS 71 N -3.05 0.85 0.67 1.70 1.02 -0.37 -1.97 119.74 118.59 3k5o s LYS 71 Ca 0.06 -1.21 -0.05 0.00 0.02 0.00 0.00 55.97 54.80 3k5o s LYS 71 Cb -0.01 -0.47 0.14 0.00 -0.52 0.00 0.00 37.83 36.98 3k5o s LYS 71 CO -0.01 0.06 0.92 -0.40 -0.92 0.00 0.00 175.35 174.99 3k5o n ASP 72 N 0.39 0.74 0.00 2.83 5.68 0.04 -1.64 116.55 124.60 3k5o n ASP 72 Ca -0.15 -1.74 0.06 0.00 -0.50 0.00 0.00 54.79 52.46 3k5o n ASP 72 Cb 0.58 -0.64 0.29 0.00 -1.14 0.00 0.00 41.12 40.21 3k5o n ASP 72 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3k5o n PHE 73 N -2.92 0.00 0.68 2.11 3.01 -1.26 -0.33 117.46 118.74 3k5o n PHE 73 Ca 0.14 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.71 3k5o n PHE 73 Cb 0.48 -0.32 0.22 0.00 -0.01 0.00 0.00 39.48 39.84 3k5o n PHE 73 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 3k5o n HIS 74 N -1.32 0.30 -1.99 1.38 8.25 -1.26 -4.93 115.22 115.64 3k5o n HIS 74 Ca 0.05 -0.15 -0.11 0.00 -0.26 0.00 0.00 57.72 57.25 3k5o n HIS 74 Cb 0.10 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.20 3k5o n HIS 74 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3k5o n ARG 75 N 1.25 -0.83 -3.69 -0.41 1.74 0.55 -5.01 116.66 110.26 3k5o n ARG 75 Ca 0.17 0.61 -0.37 0.00 -0.77 0.00 0.00 57.85 57.49 3k5o n ARG 75 Cb 0.56 -4.67 -0.06 0.00 -1.02 0.00 0.00 32.46 27.26 3k5o n ARG 75 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 3k5o s GLN 76 N -4.15 3.84 0.62 5.56 2.00 -1.26 -4.80 119.66 121.47 3k5o s GLN 76 Ca 0.00 0.05 -0.19 0.00 -2.00 0.00 0.00 55.36 53.22 3k5o s GLN 76 Cb 0.00 -3.28 -0.02 0.00 0.80 0.00 0.00 33.01 30.51 3k5o s GLN 76 CO 0.00 0.58 1.25 -2.30 -0.50 0.00 0.00 175.29 174.32 3k5o n PRO 77 N 2.49 1.19 -4.30 1.67 -0.02 -1.26 -0.78 135.00 133.98 3k5o n PRO 77 Ca -0.16 0.46 -0.16 0.00 -2.02 0.00 0.00 63.50 61.61 3k5o n PRO 77 Cb 0.53 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.43 3k5o n PRO 77 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3k5o s VAL 78 N -1.39 1.46 0.25 -1.45 -7.23 -0.83 -0.84 120.40 110.38 3k5o s VAL 78 Ca 0.80 -2.14 0.08 0.00 -1.81 0.00 0.00 61.98 58.91 3k5o s VAL 78 Cb -0.39 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 3k5o s VAL 78 CO 0.43 -0.67 0.07 -0.31 -0.31 0.00 0.00 175.10 174.31 3k5o s TYR 79 N -3.14 2.87 -0.14 2.82 4.12 0.16 -2.83 117.35 121.21 3k5o s TYR 79 Ca 0.20 -0.17 -0.07 0.00 0.02 0.00 0.00 57.07 57.05 3k5o s TYR 79 Cb 0.01 -1.30 -0.04 0.00 -1.52 0.00 0.00 41.96 39.11 3k5o s TYR 79 CO 0.04 0.57 0.10 0.20 0.02 0.00 0.00 175.55 176.48 3k5o s GLY 80 N -3.64 2.04 -0.37 0.71 0.00 0.19 -1.27 107.32 104.98 3k5o s GLY 80 Ca 0.31 -0.70 -0.10 0.00 0.00 0.00 0.00 44.72 44.24 3k5o s GLY 80 CO 0.22 -0.25 0.19 -2.27 0.00 0.00 0.00 173.10 170.98 3k5o s LEU 81 N -0.52 4.64 -0.18 0.66 2.96 0.17 -1.16 118.68 125.24 3k5o s LEU 81 Ca 0.11 -1.01 -0.07 0.00 -0.22 0.00 0.00 54.13 52.94 3k5o s LEU 81 Cb -0.12 -2.00 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 3k5o s LEU 81 CO 0.02 -0.37 0.06 -0.31 -1.32 0.00 0.00 176.35 174.43 3k5o s TYR 82 N 1.53 3.25 0.06 5.38 2.02 -0.44 -1.83 117.35 127.31 3k5o s TYR 82 Ca 0.01 0.06 0.07 0.00 -0.37 0.00 0.00 57.07 56.84 3k5o s TYR 82 Cb -0.19 -2.08 -0.03 0.00 -0.40 0.00 0.00 41.96 39.26 3k5o s TYR 82 CO 0.06 0.14 -0.19 0.00 -1.57 0.00 0.00 175.55 173.99 3k5o h ARG 84 N 4.69 0.00 -5.59 0.00 2.47 -1.78 -1.34 114.38 112.83 3k5o h ARG 84 Ca -0.42 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 57.76 3k5o h ARG 84 Cb 1.17 0.00 -0.29 0.00 -1.65 0.00 0.00 29.97 29.20 3k5o h ARG 84 CO 0.43 0.29 -0.83 0.00 0.56 0.00 0.00 179.97 180.42 3k5o s ALA 85 N -3.44 1.39 0.23 0.04 0.00 -1.26 -3.13 121.76 115.59 3k5o s ALA 85 Ca 0.02 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.27 3k5o s ALA 85 Cb 0.09 -0.36 0.22 0.00 0.00 0.00 0.00 23.12 23.08 3k5o s ALA 85 CO 0.67 0.34 1.56 1.25 0.00 0.00 0.00 175.76 179.58 3k5o h HIS 86 N 5.72 0.49 -0.08 0.00 2.76 -1.93 -2.15 115.15 119.97 3k5o h HIS 86 Ca -0.36 -0.17 -0.09 0.00 -2.20 0.00 0.00 60.37 57.55 3k5o h HIS 86 Cb 1.15 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 30.00 3k5o h HIS 86 CO 0.40 0.84 -0.35 -0.09 -1.30 0.00 0.00 177.93 177.44 3k5o h ARG 87 N 0.31 0.16 -0.31 5.26 2.43 -1.99 -1.41 114.38 118.83 3k5o h ARG 87 Ca 0.01 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 3k5o h ARG 87 Cb 1.04 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 3k5o h ARG 87 CO 0.09 0.49 0.04 0.37 -1.51 0.00 0.00 179.97 179.45 3k5o h GLN 88 N 0.14 0.52 -0.90 0.20 4.15 -1.90 -1.78 115.11 115.55 3k5o h GLN 88 Ca 0.02 -0.15 0.02 0.00 0.77 0.00 0.00 58.65 59.31 3k5o h GLN 88 Cb 0.68 -0.06 -0.05 0.00 0.21 0.00 0.00 27.48 28.27 3k5o h GLN 88 CO 0.05 0.63 0.60 1.25 -1.93 0.00 0.00 178.83 179.42 3k5o h LEU 89 N 0.34 1.02 -0.93 -2.39 5.85 -0.83 0.06 115.31 118.42 3k5o h LEU 89 Ca 0.09 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 3k5o h LEU 89 Cb 0.37 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 3k5o h LEU 89 CO 0.01 0.73 -0.04 -0.03 -0.34 0.00 0.00 178.44 178.77 3k5o h MET 90 N 1.20 0.74 -0.19 1.25 4.05 -0.94 0.14 114.93 121.18 3k5o h MET 90 Ca 0.34 -0.21 -0.05 0.00 -0.28 0.00 0.00 59.70 59.50 3k5o h MET 90 Cb -0.10 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.61 3k5o h MET 90 CO -0.08 0.78 -0.08 -0.97 0.23 0.00 0.00 176.91 176.79 3k5o h ASN 91 N 0.68 0.39 -0.71 1.39 -1.24 -0.44 -2.80 115.58 112.85 3k5o h ASN 91 Ca 0.13 -0.40 0.00 0.00 0.71 0.00 0.00 56.30 56.74 3k5o h ASN 91 Cb 0.48 -0.11 -0.04 0.00 0.73 0.00 0.00 38.32 39.39 3k5o h ASN 91 CO 0.02 0.70 0.45 1.88 -1.29 0.00 0.00 177.43 179.20 3k5o h TYR 92 N 0.08 0.92 -0.10 0.67 -1.99 -0.65 -1.70 116.97 114.21 3k5o h TYR 92 Ca 0.04 0.01 0.01 0.00 2.00 0.00 0.00 58.73 60.79 3k5o h TYR 92 Cb 0.55 -0.31 -0.01 0.00 2.00 0.00 0.00 36.73 38.96 3k5o h TYR 92 CO 0.06 0.60 0.04 1.49 -0.00 0.00 0.00 178.16 180.35 3k5o h GLU 93 N 0.98 0.09 -0.58 4.88 4.81 -0.59 0.22 114.58 124.40 3k5o h GLU 93 Ca 0.26 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.50 3k5o h GLU 93 Cb -0.07 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 3k5o h GLU 93 CO -0.05 0.06 0.37 0.87 -0.73 0.00 0.00 179.01 179.53 3k5o h LYS 94 N 0.09 0.72 -0.81 1.92 1.57 -1.18 -0.45 116.57 118.43 3k5o h LYS 94 Ca 0.04 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3k5o h LYS 94 Cb 0.02 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.13 3k5o h LYS 94 CO -0.04 0.48 0.36 0.00 -0.57 0.00 0.00 179.45 179.68 3k5o h ARG 95 N 0.74 1.19 -0.29 3.15 3.08 -0.94 -0.03 114.38 121.28 3k5o h ARG 95 Ca 0.22 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 59.99 3k5o h ARG 95 Cb -0.03 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 3k5o h ARG 95 CO -0.07 0.94 -0.19 -0.07 -1.07 0.00 0.00 179.97 179.50 3k5o h LEU 96 N 1.17 0.66 -0.37 3.04 3.38 -0.14 -2.03 115.31 121.02 3k5o h LEU 96 Ca 0.28 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 3k5o h LEU 96 Cb 0.16 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3k5o h LEU 96 CO -0.03 0.96 0.19 0.03 0.09 0.00 0.00 178.44 179.67 3k5o h ARG 97 N 0.37 0.52 -0.72 1.13 2.47 -0.92 0.33 114.38 117.57 3k5o h ARG 97 Ca 0.06 -0.07 0.10 0.00 -1.26 0.00 0.00 59.98 58.81 3k5o h ARG 97 Cb 0.73 -0.10 -0.05 0.00 -1.65 0.00 0.00 29.97 28.91 3k5o h ARG 97 CO 0.05 0.45 0.48 1.49 0.56 0.00 0.00 179.97 183.00 3k5o h GLU 98 N 0.46 0.59 -0.36 0.04 4.81 -0.96 0.30 114.58 119.46 3k5o h GLU 98 Ca 0.13 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3k5o h GLU 98 Cb 0.09 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.34 3k5o h GLU 98 CO -0.02 0.39 0.00 0.41 -0.73 0.00 0.00 179.01 179.06 3k5o n GLY 99 N -1.47 0.72 1.84 1.92 0.00 -0.64 -4.92 105.19 102.64 3k5o n GLY 99 Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.73 3k5o n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5o n GLY 100 N 1.10 0.44 3.76 -0.02 0.00 0.09 -5.04 105.19 105.53 3k5o n GLY 100 Ca 0.13 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 44.89 3k5o n GLY 100 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k5o s VAL 101 N -2.00 5.40 0.07 1.61 1.01 0.11 -4.98 120.40 121.61 3k5o s VAL 101 Ca 0.00 0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 3k5o s VAL 101 Cb 0.00 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 3k5o s VAL 101 CO 0.00 0.47 1.11 -0.89 0.00 0.00 0.00 175.10 175.79 3k5o s THR 102 N 0.07 4.26 -0.06 3.92 2.01 -1.26 -3.70 115.64 120.88 3k5o s THR 102 Ca 0.11 1.69 0.02 0.00 0.31 0.00 0.00 61.69 63.83 3k5o s THR 102 Cb -0.12 -4.08 0.01 0.00 0.01 0.00 0.00 72.50 68.32 3k5o s THR 102 CO 0.01 0.17 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.31 3k5o s VAL 103 N 0.75 1.00 0.05 3.82 1.01 -1.26 -4.22 120.40 121.54 3k5o s VAL 103 Ca 0.54 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 62.16 3k5o s VAL 103 Cb -0.27 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 3k5o s VAL 103 CO 0.30 0.32 -0.06 -0.31 0.00 0.00 0.00 175.10 175.35 3k5o s TYR 104 N 0.66 2.88 -1.66 5.22 2.02 0.10 -4.73 117.35 121.84 3k5o s TYR 104 Ca -0.13 -0.06 0.00 0.00 -0.37 0.00 0.00 57.07 56.51 3k5o s TYR 104 Cb -0.15 -1.55 0.00 0.00 -0.40 0.00 0.00 41.96 39.86 3k5o s TYR 104 CO 0.03 0.41 0.00 0.39 -1.57 0.00 0.00 175.55 174.81 3k5o n GLU 105 N 1.13 -1.69 0.15 -0.62 1.02 -1.26 -1.40 120.64 117.97 3k5o n GLU 105 Ca -0.14 0.93 0.13 0.00 -0.02 0.00 0.00 57.16 58.06 3k5o n GLU 105 Cb 0.52 -5.45 0.49 0.00 -0.02 0.00 0.00 31.44 26.98 3k5o n GLU 105 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3k5o h ALA 106 N 0.73 1.00 0.00 0.62 0.00 -1.85 -2.97 119.26 116.79 3k5o h ALA 106 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3k5o h ALA 106 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3k5o h ALA 106 CO 0.51 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.36 3k5o n ASP 107 N -2.42 0.31 -4.66 0.00 5.68 -1.26 -4.76 116.55 109.44 3k5o n ASP 107 Ca 0.03 0.54 -0.43 0.00 -0.50 0.00 0.00 54.79 54.43 3k5o n ASP 107 Cb 0.30 -0.62 -0.02 0.00 -1.14 0.00 0.00 41.12 39.64 3k5o n ASP 107 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3k5o s VAL 108 N -3.07 4.67 0.53 2.12 1.01 -1.12 -5.03 120.40 119.51 3k5o s VAL 108 Ca 0.10 2.01 -0.13 0.00 0.00 0.00 0.00 61.98 63.96 3k5o s VAL 108 Cb 0.14 -4.30 -0.06 0.00 0.00 0.00 0.00 36.38 32.16 3k5o s VAL 108 CO 0.47 -0.17 0.96 -0.13 0.00 0.00 0.00 175.10 176.23 3k5o s ARG 109 N 3.13 3.80 0.25 2.72 1.81 -1.26 -4.84 118.95 124.56 3k5o s ARG 109 Ca 0.45 0.79 -0.05 0.00 -1.72 0.00 0.00 55.73 55.20 3k5o s ARG 109 Cb -0.15 -2.16 0.47 0.00 -0.45 0.00 0.00 34.95 32.66 3k5o s ARG 109 CO 0.07 -0.33 1.67 -1.35 -0.68 0.00 0.00 175.30 174.68 3k5o h PRO 110 N 0.53 0.23 -0.19 3.54 0.11 -1.97 -0.32 132.00 133.94 3k5o h PRO 110 Ca -0.46 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3k5o h PRO 110 Cb 1.19 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3k5o h PRO 110 CO 0.62 0.15 0.04 -1.35 -0.21 0.00 0.00 178.00 177.25 3k5o h PRO 111 N 0.23 0.30 -0.59 1.05 0.11 -1.95 -2.74 132.00 128.42 3k5o h PRO 111 Ca 0.42 -0.08 -0.05 0.00 0.11 0.00 0.00 66.00 66.41 3k5o h PRO 111 Cb 0.74 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.78 3k5o h PRO 111 CO -0.54 0.45 0.17 0.93 -0.21 0.00 0.00 178.00 178.79 3k5o h GLU 112 N 0.11 0.89 -0.17 1.05 3.07 -1.89 -1.79 114.58 115.85 3k5o h GLU 112 Ca 0.06 -0.18 0.02 0.00 -0.50 0.00 0.00 59.36 58.76 3k5o h GLU 112 Cb 0.28 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 3k5o h GLU 112 CO 0.00 0.78 0.06 -0.09 -1.40 0.00 0.00 179.01 178.37 3k5o h ARG 113 N 0.86 0.15 -0.13 2.33 9.65 -0.97 -0.19 114.38 126.08 3k5o h ARG 113 Ca 0.19 -0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 59.05 3k5o h ARG 113 Cb 0.28 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.82 3k5o h ARG 113 CO -0.01 0.10 0.02 -0.92 2.80 0.00 0.00 179.97 181.96 3k5o h TYR 114 N 0.15 0.23 -0.01 2.20 3.20 -1.25 -2.84 116.97 118.64 3k5o h TYR 114 Ca 0.07 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 3k5o h TYR 114 Cb 0.04 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.25 3k5o h TYR 114 CO -0.11 0.41 0.01 -0.07 -1.64 0.00 0.00 178.16 176.75 3k5o h LEU 115 N -0.01 0.02 -0.17 2.82 3.38 -1.24 -3.19 115.31 116.91 3k5o h LEU 115 Ca 0.04 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 57.94 3k5o h LEU 115 Cb 0.30 -0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.98 3k5o h LEU 115 CO 0.00 0.13 -0.38 0.24 0.09 0.00 0.00 178.44 178.52 3k5o h MET 116 N -0.10 -0.42 0.00 1.13 2.86 -1.07 -1.09 114.93 116.25 3k5o h MET 116 Ca 0.00 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 3k5o h MET 116 Cb 0.12 0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.87 3k5o h MET 116 CO -0.00 -0.28 0.00 0.39 1.06 0.00 0.00 176.91 178.08 3k5o n GLU 117 N -5.43 0.14 -0.50 1.72 -0.58 -1.07 -1.28 120.64 113.65 3k5o n GLU 117 Ca -0.03 0.56 0.08 0.00 -0.42 0.00 0.00 57.16 57.35 3k5o n GLU 117 Cb 0.35 -1.90 0.28 0.00 -0.57 0.00 0.00 31.44 29.60 3k5o n GLU 117 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3k5o n ARG 118 N -2.19 3.26 -3.02 3.49 1.74 -0.73 -4.96 116.66 114.24 3k5o n ARG 118 Ca -0.00 -2.82 -0.21 0.00 -0.77 0.00 0.00 57.85 54.04 3k5o n ARG 118 Cb 0.09 -1.86 0.01 0.00 -1.02 0.00 0.00 32.46 29.68 3k5o n ARG 118 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3k5o n PHE 119 N -0.18 -1.76 -4.06 -1.55 3.72 -0.40 -4.49 117.46 108.74 3k5o n PHE 119 Ca 0.22 0.40 -0.36 0.00 -0.05 0.00 0.00 57.45 57.65 3k5o n PHE 119 Cb 0.90 -3.66 -0.08 0.00 -0.94 0.00 0.00 39.48 35.69 3k5o n PHE 119 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3k5o s ILE 120 N -3.00 4.98 0.00 4.37 1.01 -0.49 -4.73 121.20 123.33 3k5o s ILE 120 Ca 0.28 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.94 3k5o s ILE 120 Cb -0.13 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.17 3k5o s ILE 120 CO 0.34 0.58 0.00 0.35 0.00 0.00 0.00 174.94 176.21 3k5o n THR 121 N 2.38 0.00 0.00 2.92 -2.24 -1.26 -4.27 114.28 111.81 3k5o n THR 121 Ca -0.19 0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3k5o n THR 121 Cb 0.54 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 3k5o n THR 121 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3k5o n SER 122 N -1.42 0.43 -4.73 3.42 7.64 -1.26 -4.83 113.62 112.87 3k5o n SER 122 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 3k5o n SER 122 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 3k5o n SER 122 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 3k5o s PRO 123 N -1.92 4.38 0.13 1.43 0.02 -1.26 -1.19 135.00 136.59 3k5o s PRO 123 Ca 0.00 2.02 -0.07 0.00 0.02 0.00 0.00 61.00 62.97 3k5o s PRO 123 Cb 0.00 -3.22 -0.01 0.00 0.02 0.00 0.00 34.50 31.28 3k5o s PRO 123 CO 0.00 -0.29 0.19 0.14 -0.33 0.00 0.00 177.00 176.71 3k5o s VAL 124 N 0.44 0.11 -0.13 3.83 -7.23 -0.15 -1.48 120.40 115.79 3k5o s VAL 124 Ca 0.59 -1.43 -0.02 0.00 -1.81 0.00 0.00 61.98 59.30 3k5o s VAL 124 Cb -0.36 -1.69 -0.02 0.00 0.56 0.00 0.00 36.38 34.87 3k5o s VAL 124 CO 0.35 -0.49 -0.07 0.26 -0.31 0.00 0.00 175.10 174.84 3k5o s TRP 125 N -3.94 2.95 -0.03 2.82 0.52 0.18 -0.84 118.94 120.58 3k5o s TRP 125 Ca 0.14 -0.34 0.05 0.00 0.02 0.00 0.00 56.10 55.96 3k5o s TRP 125 Cb 0.05 -1.88 -0.01 0.00 -1.15 0.00 0.00 33.47 30.48 3k5o s TRP 125 CO -0.04 -0.02 -0.18 0.54 0.02 0.00 0.00 176.95 177.26 3k5o s VAL 126 N 0.15 1.50 0.08 4.03 0.11 0.48 -1.33 120.40 125.43 3k5o s VAL 126 Ca -0.03 -0.77 0.04 0.00 -2.93 0.00 0.00 61.98 58.29 3k5o s VAL 126 Cb -0.14 -1.27 -0.03 0.00 -1.53 0.00 0.00 36.38 33.41 3k5o s VAL 126 CO 0.03 0.43 -0.12 -1.61 -3.33 0.00 0.00 175.10 170.50 3k5o s GLU 127 N -0.13 0.82 0.00 1.54 2.02 -0.29 -1.09 118.70 121.56 3k5o s GLU 127 Ca -0.00 -1.02 0.00 0.00 0.02 0.00 0.00 54.97 53.96 3k5o s GLU 127 Cb -0.10 -0.69 0.00 0.00 0.10 0.00 0.00 34.13 33.44 3k5o s GLU 127 CO 0.01 0.14 0.00 0.41 0.02 0.00 0.00 175.26 175.84 3k5o n GLY 128 N 1.00 -1.22 3.60 -1.39 0.00 -1.26 -0.40 105.19 105.52 3k5o n GLY 128 Ca -0.19 -1.13 -0.39 0.00 0.00 0.00 0.00 46.02 44.31 3k5o n GLY 128 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3k5o s ASP 129 N -4.00 6.23 -0.11 1.61 1.01 -0.77 -4.92 116.67 115.73 3k5o s ASP 129 Ca 0.00 0.21 -0.30 0.00 0.71 0.00 0.00 52.55 53.17 3k5o s ASP 129 Cb 0.00 -2.20 -0.02 0.00 1.01 0.00 0.00 42.92 41.70 3k5o s ASP 129 CO 0.00 -0.20 1.26 -0.32 0.21 0.00 0.00 175.17 176.12 3k5o s MET 130 N 2.05 4.28 -0.25 8.23 -2.45 -1.26 -0.82 119.30 129.09 3k5o s MET 130 Ca 0.14 1.70 -0.03 0.00 -1.25 0.00 0.00 55.69 56.25 3k5o s MET 130 Cb -0.16 -3.68 0.08 0.00 1.25 0.00 0.00 34.83 32.33 3k5o s MET 130 CO 0.10 -0.60 0.08 -1.58 1.05 0.00 0.00 175.02 174.08 3k5o s HIS 131 N 2.94 0.91 -1.30 4.11 5.04 0.20 -4.88 115.29 122.31 3k5o s HIS 131 Ca 0.56 -1.03 -0.01 0.00 -1.54 0.00 0.00 55.06 53.05 3k5o s HIS 131 Cb -0.24 -1.13 0.00 0.00 0.04 0.00 0.00 32.58 31.25 3k5o s HIS 131 CO 0.19 -0.73 0.77 0.09 -2.34 0.00 0.00 174.74 172.71 3k5o n ASN 132 N 5.08 -1.49 0.00 9.88 3.02 -1.26 -2.21 115.26 128.28 3k5o n ASN 132 Ca -0.06 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.71 3k5o n ASN 132 Cb 0.45 -4.24 0.00 0.00 -0.61 0.00 0.00 39.78 35.37 3k5o n ASN 132 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k5o n GLY 133 N -1.51 1.98 3.37 7.41 0.00 -1.26 -5.01 105.19 110.18 3k5o n GLY 133 Ca -0.28 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 3k5o n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5o s THR 134 N -3.42 2.22 -0.34 2.61 2.01 -0.94 -4.49 115.64 113.28 3k5o s THR 134 Ca 0.00 -1.64 -0.15 0.00 0.31 0.00 0.00 61.69 60.21 3k5o s THR 134 Cb 0.00 -1.94 -0.01 0.00 0.01 0.00 0.00 72.50 70.56 3k5o s THR 134 CO 0.00 0.17 0.35 -0.63 -0.69 0.00 0.00 174.62 173.82 3k5o s ILE 135 N -0.98 5.18 0.25 1.82 1.01 -0.69 0.60 121.20 128.40 3k5o s ILE 135 Ca 0.13 0.00 0.06 0.00 0.00 0.00 0.00 60.65 60.84 3k5o s ILE 135 Cb -0.10 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.53 3k5o s ILE 135 CO 0.05 -0.09 0.32 0.68 0.00 0.00 0.00 174.94 175.90 3k5o s VAL 136 N 1.98 4.91 -1.46 2.92 -7.23 0.00 -0.98 120.40 120.54 3k5o s VAL 136 Ca 0.11 -1.12 -0.08 0.00 -1.81 0.00 0.00 61.98 59.08 3k5o s VAL 136 Cb -0.17 -3.68 0.05 0.00 0.56 0.00 0.00 36.38 33.14 3k5o s VAL 136 CO 0.11 -0.32 0.79 0.59 -0.31 0.00 0.00 175.10 175.96 3k5o n ASN 137 N -1.35 -2.80 -4.81 4.85 5.03 -0.81 -1.84 115.26 113.53 3k5o n ASN 137 Ca -0.08 -0.85 -0.32 0.00 0.87 0.00 0.00 54.58 54.20 3k5o n ASN 137 Cb 0.57 -3.69 0.02 0.00 -1.02 0.00 0.00 39.78 35.67 3k5o n ASN 137 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3k5o s ALA 138 N -3.52 2.72 -0.06 5.41 0.00 -0.55 -4.51 121.76 121.25 3k5o s ALA 138 Ca 0.36 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.63 3k5o s ALA 138 Cb -0.18 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 19.74 3k5o s ALA 138 CO 0.84 -0.92 -0.04 0.50 0.00 0.00 0.00 175.76 176.15 3k5o s ARG 139 N -4.33 0.87 0.06 0.00 3.52 0.46 -4.69 118.95 114.85 3k5o s ARG 139 Ca 0.62 -0.07 0.09 0.00 -0.13 0.00 0.00 55.73 56.24 3k5o s ARG 139 Cb -0.15 -0.98 -0.03 0.00 -1.56 0.00 0.00 34.95 32.23 3k5o s ARG 139 CO 0.42 -0.16 -0.23 -0.51 -0.81 0.00 0.00 175.30 174.01 3k5o s LEU 140 N 1.29 2.39 0.04 -0.88 1.43 -1.26 -1.14 118.68 120.55 3k5o s LEU 140 Ca -0.05 -0.56 -0.05 0.00 -1.03 0.00 0.00 54.13 52.45 3k5o s LEU 140 Cb -0.14 -1.38 -0.01 0.00 0.03 0.00 0.00 46.19 44.69 3k5o s LEU 140 CO -0.02 0.24 0.08 -1.59 0.23 0.00 0.00 176.35 175.28 3k5o s LYS 141 N -1.52 0.56 0.35 1.70 -2.85 -0.44 -4.96 119.74 112.59 3k5o s LYS 141 Ca 0.14 -0.76 -0.28 0.00 -1.00 0.00 0.00 55.97 54.06 3k5o s LYS 141 Cb -0.10 0.22 -0.11 0.00 -2.06 0.00 0.00 37.83 35.78 3k5o s LYS 141 CO 0.04 -0.13 1.45 -1.25 0.10 0.00 0.00 175.35 175.56 3k5o s PRO 142 N -2.56 4.18 -0.19 1.78 0.04 -1.26 0.47 135.00 137.46 3k5o s PRO 142 Ca -0.05 2.47 -0.06 0.00 0.04 0.00 0.00 61.00 63.39 3k5o s PRO 142 Cb -0.02 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.49 3k5o s PRO 142 CO -0.04 -0.45 0.03 -1.58 0.04 0.00 0.00 177.00 175.00 3k5o s HIS 143 N -0.98 3.14 0.54 0.56 2.46 -0.55 -4.57 115.29 115.90 3k5o s HIS 143 Ca 0.53 -0.15 0.29 0.00 0.47 0.00 0.00 55.06 56.20 3k5o s HIS 143 Cb -0.45 -2.07 1.70 0.00 -0.13 0.00 0.00 32.58 31.64 3k5o s HIS 143 CO 0.58 -0.01 2.20 -1.00 -2.47 0.00 0.00 174.74 174.05 3k5o h PRO 144 N 7.00 0.00 0.00 2.88 0.13 -1.95 -3.40 132.00 136.66 3k5o h PRO 144 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3k5o h PRO 144 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3k5o h PRO 144 CO 0.65 0.04 0.00 -0.40 -0.23 0.00 0.00 178.00 178.06 3k5o n ASP 145 N -3.81 0.00 -4.75 1.44 5.68 -1.26 -5.12 116.55 108.72 3k5o n ASP 145 Ca -0.03 -1.00 -0.41 0.00 -0.50 0.00 0.00 54.79 52.85 3k5o n ASP 145 Cb 0.13 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.09 3k5o n ASP 145 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3k5o s TYR 146 N 0.00 2.89 -0.02 2.11 5.04 -1.26 -5.02 117.35 121.08 3k5o s TYR 146 Ca 0.00 0.92 0.02 0.00 -2.44 0.00 0.00 57.07 55.57 3k5o s TYR 146 Cb 0.00 -3.94 0.00 0.00 0.35 0.00 0.00 41.96 38.38 3k5o s TYR 146 CO 0.00 -3.09 -0.07 1.03 -1.34 0.00 0.00 175.55 172.08 3k5o s ARG 147 N -0.50 0.81 0.33 4.97 1.81 -1.26 -4.75 118.95 120.37 3k5o s ARG 147 Ca 0.61 -0.25 -0.10 0.00 -1.72 0.00 0.00 55.73 54.27 3k5o s ARG 147 Cb -0.45 -0.78 -0.07 0.00 -0.45 0.00 0.00 34.95 33.21 3k5o s ARG 147 CO 0.46 0.09 0.68 -1.25 -0.68 0.00 0.00 175.30 174.60 3k5o s PRO 148 N 0.23 3.81 0.15 3.54 0.04 -1.26 -5.03 135.00 136.48 3k5o s PRO 148 Ca -0.03 0.40 -0.24 0.00 0.04 0.00 0.00 61.00 61.18 3k5o s PRO 148 Cb -0.08 -2.49 -0.08 0.00 0.04 0.00 0.00 34.50 31.89 3k5o s PRO 148 CO 0.00 0.12 0.73 -1.25 0.04 0.00 0.00 177.00 176.65 3k5o s PRO 149 N -3.38 4.47 0.06 0.56 0.04 -1.26 -5.06 135.00 130.42 3k5o s PRO 149 Ca 0.50 1.05 0.03 0.00 0.04 0.00 0.00 61.00 62.62 3k5o s PRO 149 Cb -0.10 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 31.19 3k5o s PRO 149 CO 0.26 0.57 -0.09 -0.51 0.04 0.00 0.00 177.00 177.26 3k5o s LEU 150 N -1.23 2.32 -0.06 -3.56 1.43 -1.26 -4.81 118.68 111.51 3k5o s LEU 150 Ca 0.35 -0.67 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 3k5o s LEU 150 Cb -0.22 -0.23 -0.03 0.00 0.03 0.00 0.00 46.19 45.75 3k5o s LEU 150 CO 0.24 -0.23 -0.13 -0.54 0.23 0.00 0.00 176.35 175.92 3k5o s LYS 151 N -2.13 2.62 0.38 1.70 1.02 -1.26 -5.00 119.74 117.07 3k5o s LYS 151 Ca -0.03 -0.68 0.08 0.00 0.02 0.00 0.00 55.97 55.36 3k5o s LYS 151 Cb -0.07 -2.42 -0.07 0.00 -0.52 0.00 0.00 37.83 34.75 3k5o s LYS 151 CO -0.00 0.58 0.01 -1.58 -0.92 0.00 0.00 175.35 173.44 3k5o s TRP 152 N -0.62 2.51 -0.05 3.18 0.51 -1.26 -0.96 118.94 122.25 3k5o s TRP 152 Ca 0.09 -0.58 -0.02 0.00 -2.12 0.00 0.00 56.10 53.47 3k5o s TRP 152 Cb -0.11 -1.66 0.03 0.00 -0.81 0.00 0.00 33.47 30.93 3k5o s TRP 152 CO 0.01 0.45 0.09 0.54 -0.51 0.00 0.00 176.95 177.53 3k5o s VAL 153 N -2.64 -0.13 -0.31 4.03 0.11 -0.41 -1.88 120.40 119.16 3k5o s VAL 153 Ca 0.35 0.36 -0.14 0.00 -2.93 0.00 0.00 61.98 59.62 3k5o s VAL 153 Cb 0.06 -0.18 -0.02 0.00 -1.53 0.00 0.00 36.38 34.70 3k5o s VAL 153 CO 0.18 0.15 0.32 -0.55 -3.33 0.00 0.00 175.10 171.88 3k5o s SER 154 N 1.96 6.16 0.03 3.54 0.15 0.17 -1.07 113.70 124.65 3k5o s SER 154 Ca 0.01 -0.09 0.04 0.00 0.70 0.00 0.00 55.95 56.62 3k5o s SER 154 Cb -0.12 -2.18 -0.04 0.00 -1.71 0.00 0.00 66.02 61.97 3k5o s SER 154 CO -0.04 -0.24 -0.08 -0.51 1.20 0.00 0.00 173.24 173.57 3k5o s ILE 155 N 1.96 3.56 -0.18 6.45 2.07 -0.60 -1.65 121.20 132.81 3k5o s ILE 155 Ca 0.11 -0.92 -0.18 0.00 -1.41 0.00 0.00 60.65 58.25 3k5o s ILE 155 Cb -0.16 -2.58 0.05 0.00 0.13 0.00 0.00 42.46 39.89 3k5o s ILE 155 CO 0.11 0.31 0.51 -0.62 -1.91 0.00 0.00 174.94 173.34 3k5o s ASP 156 N -1.66 -0.52 0.16 4.50 2.15 -0.88 -4.63 116.67 115.79 3k5o s ASP 156 Ca 0.19 0.97 0.09 0.00 0.43 0.00 0.00 52.55 54.23 3k5o s ASP 156 Cb -0.11 0.99 -0.04 0.00 -0.30 0.00 0.00 42.92 43.46 3k5o s ASP 156 CO 0.10 -0.21 -0.20 0.27 -0.17 0.00 0.00 175.17 174.95 3k5o s ILE 157 N 0.13 1.93 -0.04 4.11 -4.36 -1.26 -0.27 121.20 121.44 3k5o s ILE 157 Ca -0.01 -1.86 0.06 0.00 -0.26 0.00 0.00 60.65 58.58 3k5o s ILE 157 Cb -0.04 -1.85 -0.01 0.00 1.25 0.00 0.00 42.46 41.81 3k5o s ILE 157 CO 0.01 -0.20 -0.22 -1.61 0.24 0.00 0.00 174.94 173.16 3k5o s GLU 158 N -2.55 2.06 0.30 0.37 0.41 -0.96 -5.00 118.70 113.32 3k5o s GLU 158 Ca 0.15 -0.80 0.06 0.00 -0.41 0.00 0.00 54.97 53.97 3k5o s GLU 158 Cb -0.07 -1.85 -0.02 0.00 -1.78 0.00 0.00 34.13 30.40 3k5o s GLU 158 CO 0.07 0.40 0.22 0.25 -0.49 0.00 0.00 175.26 175.71 3k5o n THR 159 N 2.79 0.00 -2.06 3.63 -2.24 -1.26 -0.40 114.28 114.74 3k5o n THR 159 Ca -0.17 -2.11 -0.29 0.00 -2.27 0.00 0.00 64.05 59.22 3k5o n THR 159 Cb 0.52 1.00 0.18 0.00 -2.10 0.00 0.00 70.33 69.93 3k5o n THR 159 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3k5o s THR 160 N -3.12 2.01 0.26 4.28 -4.23 0.28 -4.85 115.64 110.27 3k5o s THR 160 Ca 0.32 -0.12 -0.04 0.00 -1.18 0.00 0.00 61.69 60.67 3k5o s THR 160 Cb 0.02 -2.89 0.21 0.00 1.34 0.00 0.00 72.50 71.17 3k5o s THR 160 CO 0.22 0.00 1.87 0.03 -0.54 0.00 0.00 174.62 176.21 3k5o h ARG 161 N -1.51 1.09 -0.72 3.99 3.08 -2.02 -2.07 114.38 116.22 3k5o h ARG 161 Ca -0.42 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.49 3k5o h ARG 161 Cb 1.23 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 31.07 3k5o h ARG 161 CO 0.35 0.82 0.00 0.72 -1.07 0.00 0.00 179.97 180.79 3k5o n HIS 162 N -4.33 0.90 -0.93 3.04 8.25 -1.26 -4.89 115.22 116.00 3k5o n HIS 162 Ca 0.08 -0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.21 3k5o n HIS 162 Cb 0.12 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 30.99 3k5o n HIS 162 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k5o n GLY 163 N 0.44 0.60 3.71 -1.41 0.00 -0.78 -5.02 105.19 102.74 3k5o n GLY 163 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3k5o n GLY 163 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k5o s GLU 164 N -0.07 4.38 0.20 1.61 2.02 -1.26 -4.63 118.70 120.94 3k5o s GLU 164 Ca 0.00 1.90 -0.31 0.00 0.02 0.00 0.00 54.97 56.57 3k5o s GLU 164 Cb 0.00 -3.32 -0.11 0.00 0.10 0.00 0.00 34.13 30.80 3k5o s GLU 164 CO 0.00 -0.34 1.61 -1.17 0.02 0.00 0.00 175.26 175.38 3k5o s LEU 165 N 1.15 4.37 -0.17 1.80 2.96 -1.26 0.10 118.68 127.63 3k5o s LEU 165 Ca 0.61 2.73 -0.09 0.00 -0.22 0.00 0.00 54.13 57.17 3k5o s LEU 165 Cb -0.32 -3.60 -0.07 0.00 0.50 0.00 0.00 46.19 42.69 3k5o s LEU 165 CO 0.29 -0.87 -0.22 -1.22 -1.32 0.00 0.00 176.35 173.00 3k5o n TYR 166 N 3.71 0.00 -3.61 5.38 4.01 0.46 -4.87 117.16 122.24 3k5o n TYR 166 Ca 0.14 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.77 3k5o n TYR 166 Cb 0.37 -0.60 -0.03 0.00 -0.31 0.00 0.00 39.34 38.77 3k5o n TYR 166 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3k5o s ILE 168 N -3.82 1.43 -0.15 0.00 1.01 0.53 -2.27 121.20 117.93 3k5o s ILE 168 Ca 0.05 -0.59 -0.04 0.00 0.00 0.00 0.00 60.65 60.06 3k5o s ILE 168 Cb -0.01 -1.32 -0.03 0.00 0.01 0.00 0.00 42.46 41.12 3k5o s ILE 168 CO -0.08 0.43 -0.01 -0.83 0.00 0.00 0.00 174.94 174.44 3k5o s GLY 169 N 1.05 1.77 -0.13 6.18 0.00 0.63 -0.75 107.32 116.07 3k5o s GLY 169 Ca -0.06 -0.80 -0.00 0.00 0.00 0.00 0.00 44.72 43.86 3k5o s GLY 169 CO -0.02 -0.10 -0.09 1.08 0.00 0.00 0.00 173.10 173.97 3k5o s LEU 170 N 0.23 1.38 -0.09 0.66 1.43 -0.02 -2.07 118.68 120.21 3k5o s LEU 170 Ca -0.01 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 3k5o s LEU 170 Cb -0.13 -0.95 0.02 0.00 0.03 0.00 0.00 46.19 45.15 3k5o s LEU 170 CO 0.02 -0.11 -0.11 -0.70 0.23 0.00 0.00 176.35 175.68 3k5o s GLU 171 N 1.63 1.72 0.00 1.70 -6.30 -0.66 -1.74 118.70 115.06 3k5o s GLU 171 Ca 0.05 -0.38 0.00 0.00 -2.50 0.00 0.00 54.97 52.13 3k5o s GLU 171 Cb -0.13 -1.53 0.00 0.00 0.00 0.00 0.00 34.13 32.47 3k5o s GLU 171 CO -0.09 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.52 3k5o n GLY 172 N 4.22 1.01 2.98 -1.50 0.00 -0.48 0.44 105.19 111.86 3k5o n GLY 172 Ca -0.19 -1.96 -0.20 0.00 0.00 0.00 0.00 46.02 43.66 3k5o n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5o n GLY 174 N -1.20 0.62 3.54 0.00 0.00 -1.26 -5.01 105.19 101.88 3k5o n GLY 174 Ca -0.09 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 3k5o n GLY 174 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3k5o s GLN 175 N -1.69 1.57 -0.04 1.61 1.03 -0.53 -5.15 119.66 116.45 3k5o s GLN 175 Ca 0.00 -1.36 -0.01 0.00 0.04 0.00 0.00 55.36 54.03 3k5o s GLN 175 Cb 0.00 0.45 0.03 0.00 0.03 0.00 0.00 33.01 33.52 3k5o s GLN 175 CO 0.00 -0.64 0.08 1.03 -2.54 0.00 0.00 175.29 173.22 3k5o s ARG 176 N -3.88 0.00 -0.06 9.60 0.52 -1.26 -1.38 118.95 122.49 3k5o s ARG 176 Ca 0.25 0.31 -0.24 0.00 -0.52 0.00 0.00 55.73 55.53 3k5o s ARG 176 Cb 0.00 -0.27 0.05 0.00 0.52 0.00 0.00 34.95 35.26 3k5o s ARG 176 CO 0.11 -0.20 0.53 -1.50 0.02 0.00 0.00 175.30 174.25 3k5o s ILE 177 N 1.37 0.02 -0.11 1.52 2.07 -0.71 -3.13 121.20 122.23 3k5o s ILE 177 Ca -0.06 -0.17 0.01 0.00 -1.41 0.00 0.00 60.65 59.01 3k5o s ILE 177 Cb -0.12 -0.83 0.02 0.00 0.13 0.00 0.00 42.46 41.66 3k5o s ILE 177 CO -0.04 -0.10 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.08 3k5o s VAL 178 N -1.05 1.28 -0.28 4.00 1.01 -0.40 -0.84 120.40 124.12 3k5o s VAL 178 Ca -0.11 -0.48 -0.14 0.00 0.00 0.00 0.00 61.98 61.25 3k5o s VAL 178 Cb -0.02 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 3k5o s VAL 178 CO 0.07 0.40 0.33 -0.31 0.00 0.00 0.00 175.10 175.59 3k5o s TYR 179 N 1.30 3.23 -0.07 5.22 2.02 0.07 -1.52 117.35 127.61 3k5o s TYR 179 Ca -0.01 0.28 0.05 0.00 -0.37 0.00 0.00 57.07 57.02 3k5o s TYR 179 Cb -0.14 -2.54 -0.01 0.00 -0.40 0.00 0.00 41.96 38.88 3k5o s TYR 179 CO -0.05 -0.24 -0.24 1.41 -1.57 0.00 0.00 175.55 174.86 3k5o s MET 180 N 1.99 2.55 0.16 -0.62 -2.45 -0.51 -0.35 119.30 120.07 3k5o s MET 180 Ca 0.13 -0.85 -0.31 0.00 -1.25 0.00 0.00 55.69 53.40 3k5o s MET 180 Cb -0.16 -2.10 -0.10 0.00 1.25 0.00 0.00 34.83 33.71 3k5o s MET 180 CO 0.10 0.31 1.63 -1.17 1.05 0.00 0.00 175.02 176.94 3k5o s LEU 181 N -0.01 4.37 0.00 4.11 2.96 -0.32 -1.40 118.68 128.40 3k5o s LEU 181 Ca -0.07 2.66 -0.00 0.00 -0.22 0.00 0.00 54.13 56.49 3k5o s LEU 181 Cb -0.14 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 42.96 3k5o s LEU 181 CO 0.05 -0.87 0.04 0.61 -1.32 0.00 0.00 176.35 174.85 3k5o n GLY 182 N 3.86 -0.61 3.90 7.98 0.00 -0.21 -4.81 105.19 115.31 3k5o n GLY 182 Ca 0.15 -1.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.12 3k5o n GLY 182 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k5o s PRO 183 N -2.92 1.64 0.76 1.61 0.04 -1.26 -5.00 135.00 129.88 3k5o s PRO 183 Ca 0.02 0.02 -0.14 0.00 0.04 0.00 0.00 61.00 60.94 3k5o s PRO 183 Cb -0.00 -1.92 0.06 0.00 0.04 0.00 0.00 34.50 32.67 3k5o s PRO 183 CO 0.02 -1.80 1.18 -1.83 0.04 0.00 0.00 177.00 174.60 3k5o s GLU 184 N -5.63 2.00 0.20 4.56 -1.05 -1.26 -5.05 118.70 112.48 3k5o s GLU 184 Ca 0.64 1.64 -0.22 0.00 -0.15 0.00 0.00 54.97 56.88 3k5o s GLU 184 Cb -0.10 -1.83 0.05 0.00 -0.44 0.00 0.00 34.13 31.81 3k5o s GLU 184 CO 0.50 -1.91 0.65 0.54 0.95 0.00 0.00 175.26 175.99 3k5o s ASN 185 N -2.31 -0.45 0.42 0.83 2.20 -1.26 -5.09 114.94 109.28 3k5o s ASN 185 Ca 0.71 -0.23 0.00 0.00 -0.94 0.00 0.00 52.86 52.40 3k5o s ASN 185 Cb -0.26 0.64 0.00 0.00 -2.00 0.00 0.00 41.25 39.63 3k5o s ASN 185 CO 0.48 -1.10 0.00 0.61 -2.94 0.00 0.00 177.10 174.15 3k5o n GLY 186 N -0.41 -0.43 2.93 0.45 0.00 -1.26 -4.33 105.19 102.15 3k5o n GLY 186 Ca -0.12 -1.10 -0.30 0.00 0.00 0.00 0.00 46.02 44.50 3k5o n GLY 186 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3k5o s ASP 187 N -4.00 4.07 -0.00 1.61 2.15 -1.26 -4.98 116.67 114.26 3k5o s ASP 187 Ca 0.00 -1.42 0.07 0.00 0.43 0.00 0.00 52.55 51.63 3k5o s ASP 187 Cb 0.00 -1.24 0.21 0.00 -0.30 0.00 0.00 42.92 41.59 3k5o s ASP 187 CO 0.00 -0.28 1.17 0.00 -0.17 0.00 0.00 175.17 175.89 3k5o n ALA 188 N 4.61 2.47 0.04 3.66 0.00 -1.26 -3.99 120.51 126.03 3k5o n ALA 188 Ca -0.08 -0.42 -0.04 0.00 0.00 0.00 0.00 53.44 52.90 3k5o n ALA 188 Cb 0.43 -0.98 0.18 0.00 0.00 0.00 0.00 19.45 19.08 3k5o n ALA 188 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3k5o h SER 189 N 1.40 0.42 0.17 0.00 4.64 -2.01 -3.20 113.55 114.97 3k5o h SER 189 Ca 0.00 -0.17 -0.09 0.00 -0.47 0.00 0.00 61.79 61.06 3k5o h SER 189 Cb 0.33 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 3k5o h SER 189 CO 0.00 0.76 -0.33 0.77 -0.87 0.00 0.00 176.83 177.17 3k5o h SER 190 N 0.34 0.24 -1.99 4.97 4.64 -2.02 -3.47 113.55 116.26 3k5o h SER 190 Ca 0.04 -0.09 -0.64 0.00 -0.47 0.00 0.00 61.79 60.63 3k5o h SER 190 Cb 0.81 -0.07 0.07 0.00 -0.31 0.00 0.00 62.40 62.90 3k5o h SER 190 CO 0.07 0.56 0.46 0.18 -0.87 0.00 0.00 176.83 177.23 3k5o n LEU 191 N -4.10 2.02 -1.51 5.97 4.77 -1.21 -4.91 117.00 118.03 3k5o n LEU 191 Ca -0.01 1.12 0.10 0.00 -0.03 0.00 0.00 56.01 57.19 3k5o n LEU 191 Cb 0.42 -1.27 0.34 0.00 -2.33 0.00 0.00 43.42 40.58 3k5o n LEU 191 CO 0.41 -0.94 0.80 -0.90 -1.33 0.00 0.00 177.39 175.42 3k5o n ASP 192 N 2.43 4.46 -4.05 -1.43 5.68 -1.26 -4.93 116.55 117.46 3k5o n ASP 192 Ca 0.16 -2.31 -0.10 0.00 -0.50 0.00 0.00 54.79 52.04 3k5o n ASP 192 Cb 0.24 -0.55 -0.08 0.00 -1.14 0.00 0.00 41.12 39.59 3k5o n ASP 192 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 3k5o s PHE 193 N -1.62 0.61 -0.22 2.11 -0.12 -1.26 -5.08 117.98 112.40 3k5o s PHE 193 Ca 0.50 -0.97 -0.29 0.00 -0.05 0.00 0.00 56.93 56.12 3k5o s PHE 193 Cb 0.30 -0.23 0.00 0.00 -0.63 0.00 0.00 43.02 42.46 3k5o s PHE 193 CO 0.27 -0.65 1.13 -2.00 -0.05 0.00 0.00 175.22 173.91 3k5o s GLU 194 N -4.01 4.21 -0.23 1.99 2.56 -1.18 -5.00 118.70 117.03 3k5o s GLU 194 Ca 0.21 1.42 -0.02 0.00 0.00 0.00 0.00 54.97 56.58 3k5o s GLU 194 Cb 0.05 -3.70 0.01 0.00 2.00 0.00 0.00 34.13 32.49 3k5o s GLU 194 CO 0.02 -0.71 -0.07 -1.17 -0.56 0.00 0.00 175.26 172.77 3k5o s LEU 195 N 3.42 2.95 -0.13 2.70 2.96 -1.26 -1.27 118.68 128.04 3k5o s LEU 195 Ca 0.48 -0.65 0.03 0.00 -0.22 0.00 0.00 54.13 53.77 3k5o s LEU 195 Cb -0.17 -1.67 0.01 0.00 0.50 0.00 0.00 46.19 44.86 3k5o s LEU 195 CO 0.11 -0.07 -0.22 -0.70 -1.32 0.00 0.00 176.35 174.15 3k5o s GLU 196 N 1.39 3.00 0.13 1.98 2.12 -0.58 -4.99 118.70 121.75 3k5o s GLU 196 Ca 0.03 -0.85 -0.22 0.00 0.36 0.00 0.00 54.97 54.30 3k5o s GLU 196 Cb -0.15 -2.41 -0.07 0.00 0.26 0.00 0.00 34.13 31.76 3k5o s GLU 196 CO -0.05 0.00 0.67 0.71 -0.54 0.00 0.00 175.26 176.05 3k5o s TYR 197 N 0.77 3.83 0.16 5.30 2.02 -1.26 -1.43 117.35 126.74 3k5o s TYR 197 Ca -0.08 1.42 0.11 0.00 -0.37 0.00 0.00 57.07 58.15 3k5o s TYR 197 Cb -0.16 -2.61 -0.04 0.00 -0.40 0.00 0.00 41.96 38.75 3k5o s TYR 197 CO -0.01 0.53 -0.25 0.14 -1.57 0.00 0.00 175.55 174.39 3k5o s VAL 198 N -1.18 2.33 0.20 0.71 -7.23 -0.49 -4.89 120.40 109.84 3k5o s VAL 198 Ca 0.33 -1.87 -0.09 0.00 -1.81 0.00 0.00 61.98 58.54 3k5o s VAL 198 Cb -0.21 -2.07 0.12 0.00 0.56 0.00 0.00 36.38 34.78 3k5o s VAL 198 CO 0.22 -0.00 1.74 0.00 -0.31 0.00 0.00 175.10 176.75 3k5o h ALA 199 N 3.56 0.93 -2.62 1.32 0.00 -1.95 -0.52 119.26 119.98 3k5o h ALA 199 Ca -0.49 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.02 3k5o h ALA 199 Cb 1.19 -0.28 -0.14 0.00 0.00 0.00 0.00 17.79 18.56 3k5o h ALA 199 CO 0.43 0.59 -0.52 -1.54 0.00 0.00 0.00 179.25 178.21 3k5o s SER 200 N -6.32 0.12 0.20 0.00 1.04 -1.26 -4.74 113.70 102.75 3k5o s SER 200 Ca -0.12 -1.27 -0.08 0.00 0.48 0.00 0.00 55.95 54.95 3k5o s SER 200 Cb 0.15 0.41 0.13 0.00 0.10 0.00 0.00 66.02 66.81 3k5o s SER 200 CO 0.83 -0.88 1.72 0.03 0.98 0.00 0.00 173.24 175.91 3k5o h ARG 201 N 2.58 1.12 -0.30 4.02 3.08 -1.93 -1.86 114.38 121.09 3k5o h ARG 201 Ca -0.34 -0.28 0.01 0.00 0.07 0.00 0.00 59.98 59.44 3k5o h ARG 201 Cb 1.24 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 3k5o h ARG 201 CO 0.50 1.00 0.20 -1.35 -1.07 0.00 0.00 179.97 179.25 3k5o h PRO 202 N 1.06 0.38 0.00 0.04 0.11 -1.96 -0.06 132.00 131.56 3k5o h PRO 202 Ca 0.22 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.23 3k5o h PRO 202 Cb 0.39 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 3k5o h PRO 202 CO 0.01 0.25 -0.36 0.37 -0.21 0.00 0.00 178.00 178.06 3k5o h GLN 203 N 0.39 0.00 -0.90 1.05 4.15 -1.75 -1.42 115.11 116.62 3k5o h GLN 203 Ca 0.11 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.54 3k5o h GLN 203 Cb -0.02 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.62 3k5o h GLN 203 CO -0.02 0.36 0.59 -0.07 -1.93 0.00 0.00 178.83 177.75 3k5o h LEU 204 N 0.00 1.04 -0.41 -2.39 3.38 -0.69 -0.11 115.31 116.13 3k5o h LEU 204 Ca -0.00 -0.03 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 3k5o h LEU 204 Cb 0.66 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3k5o h LEU 204 CO 0.05 0.75 -0.42 -0.07 0.09 0.00 0.00 178.44 178.84 3k5o h LEU 205 N 1.22 0.94 -0.64 1.67 4.07 -1.18 -2.37 115.31 119.02 3k5o h LEU 205 Ca 0.33 -0.45 -0.06 0.00 0.08 0.00 0.00 57.88 57.79 3k5o h LEU 205 Cb -0.14 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 41.31 3k5o h LEU 205 CO -0.07 1.23 0.18 -0.33 -1.08 0.00 0.00 178.44 178.37 3k5o h GLU 206 N 0.71 1.01 -0.10 1.13 5.08 -0.56 -1.55 114.58 120.31 3k5o h GLU 206 Ca 0.05 -0.23 -0.10 0.00 -1.00 0.00 0.00 59.36 58.08 3k5o h GLU 206 Cb 1.01 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 3k5o h GLU 206 CO 0.10 0.90 -0.39 0.87 -1.00 0.00 0.00 179.01 179.48 3k5o h LYS 207 N 0.93 0.21 -0.48 2.33 1.79 -1.01 -1.61 116.57 118.72 3k5o h LYS 207 Ca 0.20 -0.09 -0.06 0.00 -2.18 0.00 0.00 60.65 58.53 3k5o h LYS 207 Cb 0.33 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.95 3k5o h LYS 207 CO -0.00 0.57 0.09 1.25 -1.08 0.00 0.00 179.45 180.28 3k5o h LEU 208 N 0.17 0.76 -0.83 2.94 5.85 -0.92 0.17 115.31 123.45 3k5o h LEU 208 Ca 0.02 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.46 3k5o h LEU 208 Cb 0.78 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 3k5o h LEU 208 CO 0.06 0.82 0.43 0.78 -0.34 0.00 0.00 178.44 180.19 3k5o h ASN 209 N 0.67 1.06 -0.45 1.25 2.35 -0.96 -1.71 115.58 117.79 3k5o h ASN 209 Ca 0.15 -0.12 -0.14 0.00 -0.55 0.00 0.00 56.30 55.64 3k5o h ASN 209 Cb 0.38 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 3k5o h ASN 209 CO 0.01 0.88 -0.26 0.00 -1.65 0.00 0.00 177.43 176.41 3k5o h ALA 210 N 1.23 0.64 -0.18 -0.83 0.00 -0.88 -2.44 119.26 116.80 3k5o h ALA 210 Ca 0.29 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.81 3k5o h ALA 210 Cb 0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3k5o h ALA 210 CO -0.04 0.66 0.05 2.35 0.00 0.00 0.00 179.25 182.27 3k5o h TRP 211 N 0.82 0.10 -0.98 0.00 7.01 -0.31 -2.25 115.95 120.34 3k5o h TRP 211 Ca 0.10 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.13 3k5o h TRP 211 Cb 0.84 -0.02 -0.05 0.00 -2.10 0.00 0.00 29.16 27.83 3k5o h TRP 211 CO 0.06 0.04 0.64 0.74 -2.79 0.00 0.00 178.44 177.13 3k5o h PHE 212 N 0.14 1.21 -0.74 2.65 0.04 -1.22 0.82 116.94 119.83 3k5o h PHE 212 Ca 0.08 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.84 3k5o h PHE 212 Cb 0.06 -0.41 -0.03 0.00 2.20 0.00 0.00 35.95 37.77 3k5o h PHE 212 CO -0.12 0.72 0.33 0.00 -0.60 0.00 0.00 178.31 178.64 3k5o h ALA 213 N 1.41 0.96 0.22 2.45 0.00 -1.05 -0.91 119.26 122.35 3k5o h ALA 213 Ca 0.38 -0.17 -0.34 0.00 0.00 0.00 0.00 54.91 54.78 3k5o h ALA 213 Cb -0.06 -0.29 0.03 0.00 0.00 0.00 0.00 17.79 17.46 3k5o h ALA 213 CO -0.10 0.55 -1.58 -0.91 0.00 0.00 0.00 179.25 177.21 3k5o h ASN 214 N 1.05 0.74 0.92 0.00 2.35 -0.90 -3.37 115.58 116.36 3k5o h ASN 214 Ca 0.25 -0.93 -0.12 0.00 -0.55 0.00 0.00 56.30 54.96 3k5o h ASN 214 Cb 0.16 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 3k5o h ASN 214 CO -0.03 1.74 -1.15 1.88 -1.65 0.00 0.00 177.43 178.22 3k5o h TYR 215 N 0.10 0.00 -6.50 1.19 0.05 -0.91 -3.49 116.97 107.42 3k5o h TYR 215 Ca -0.29 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.02 3k5o h TYR 215 Cb 2.12 0.00 0.03 0.00 1.01 0.00 0.00 36.73 39.89 3k5o h TYR 215 CO 0.12 0.42 -0.92 -3.47 -1.05 0.00 0.00 178.16 173.26 3k5o n ASP 216 N -2.90 -5.07 -4.79 3.88 2.03 -0.35 -4.94 116.55 104.42 3k5o n ASP 216 Ca -0.05 -1.02 -0.34 0.00 0.52 0.00 0.00 54.79 53.90 3k5o n ASP 216 Cb 0.75 -2.62 -0.00 0.00 -0.72 0.00 0.00 41.12 38.53 3k5o n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3k5o s PRO 217 N -5.97 3.42 0.02 -0.67 0.04 -1.26 -4.95 135.00 125.63 3k5o s PRO 217 Ca 0.34 1.37 0.08 0.00 0.04 0.00 0.00 61.00 62.82 3k5o s PRO 217 Cb -0.15 -2.04 -0.23 0.00 0.04 0.00 0.00 34.50 32.12 3k5o s PRO 217 CO 0.90 -0.75 0.89 -0.44 0.04 0.00 0.00 177.00 177.64 3k5o h ASP 218 N 0.92 0.07 -4.10 6.66 3.32 -1.37 -3.46 116.42 118.47 3k5o h ASP 218 Ca -0.48 -0.11 -0.50 0.00 0.02 0.00 0.00 57.03 55.95 3k5o h ASP 218 Cb 1.23 -0.02 -0.30 0.00 0.22 0.00 0.00 39.33 40.46 3k5o h ASP 218 CO 0.57 1.10 -0.82 -0.69 -1.72 0.00 0.00 179.24 177.68 3k5o s VAL 219 N -2.64 1.18 -0.20 -1.35 1.01 -0.62 -0.71 120.40 117.07 3k5o s VAL 219 Ca -0.04 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 3k5o s VAL 219 Cb 0.08 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.46 3k5o s VAL 219 CO 0.83 0.34 -0.06 -0.63 0.00 0.00 0.00 175.10 175.57 3k5o s ILE 220 N -0.18 3.27 0.20 2.22 1.01 0.94 -1.29 121.20 127.37 3k5o s ILE 220 Ca 0.02 -0.54 0.10 0.00 0.00 0.00 0.00 60.65 60.24 3k5o s ILE 220 Cb -0.07 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.89 3k5o s ILE 220 CO 0.00 0.45 -0.21 0.27 0.00 0.00 0.00 174.94 175.45 3k5o s ILE 221 N 1.26 2.17 0.05 2.92 -4.36 -0.23 -0.92 121.20 122.08 3k5o s ILE 221 Ca 0.03 -2.05 -0.17 0.00 -0.26 0.00 0.00 60.65 58.20 3k5o s ILE 221 Cb -0.14 -2.05 0.06 0.00 1.25 0.00 0.00 42.46 41.57 3k5o s ILE 221 CO -0.02 -0.24 0.77 0.61 0.24 0.00 0.00 174.94 176.29 3k5o n GLY 222 N 0.13 0.59 3.21 6.27 0.00 -1.09 -1.56 105.19 112.74 3k5o n GLY 222 Ca -0.12 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.53 3k5o n GLY 222 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3k5o s TRP 223 N -2.89 3.15 -1.41 1.61 -0.11 -1.26 -0.45 118.94 117.57 3k5o s TRP 223 Ca 0.18 -1.58 -0.09 0.00 1.22 0.00 0.00 56.10 55.82 3k5o s TRP 223 Cb -0.01 -2.11 0.04 0.00 -1.50 0.00 0.00 33.47 29.89 3k5o s TRP 223 CO 0.02 -0.73 1.03 -1.71 -4.62 0.00 0.00 176.95 170.93 3k5o n ASN 224 N 4.68 -4.67 -0.13 5.86 5.15 -1.26 -4.83 115.26 120.07 3k5o n ASN 224 Ca -0.15 -0.68 0.01 0.00 -0.60 0.00 0.00 54.58 53.15 3k5o n ASN 224 Cb 0.46 -4.44 0.29 0.00 -0.53 0.00 0.00 39.78 35.56 3k5o n ASN 224 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 3k5o h VAL 225 N -2.27 1.18 0.00 3.44 3.04 -1.90 -1.64 116.25 118.09 3k5o h VAL 225 Ca -0.58 -0.42 -0.03 0.00 -1.01 0.00 0.00 66.70 64.65 3k5o h VAL 225 Cb 1.37 0.37 -0.00 0.00 -2.01 0.00 0.00 31.29 31.01 3k5o h VAL 225 CO 0.60 0.19 -0.21 0.58 -1.01 0.00 0.00 177.57 177.72 3k5o h VAL 226 N 0.82 0.95 0.00 1.51 2.07 -1.95 0.16 116.25 119.81 3k5o h VAL 226 Ca 0.21 -1.78 -0.06 0.00 0.82 0.00 0.00 66.70 65.89 3k5o h VAL 226 Cb 0.00 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 3k5o h VAL 226 CO -0.04 0.32 -0.30 1.56 0.02 0.00 0.00 177.57 179.14 3k5o h GLN 227 N -1.00 0.00 0.00 1.57 1.08 -1.89 -1.90 115.11 112.97 3k5o h GLN 227 Ca -0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 3k5o h GLN 227 Cb 0.68 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.11 3k5o h GLN 227 CO -0.03 0.30 0.00 0.34 -0.95 0.00 0.00 178.83 178.49 3k5o n PHE 228 N -4.09 0.00 -0.02 2.96 7.35 -0.62 -4.50 117.46 118.54 3k5o n PHE 228 Ca -0.02 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.54 3k5o n PHE 228 Cb 0.35 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.10 3k5o n PHE 228 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 3k5o h ASP 229 N 0.00 -1.46 -0.25 -2.13 5.19 -1.60 0.24 116.42 116.41 3k5o h ASP 229 Ca 0.00 0.17 -0.06 0.00 -0.62 0.00 0.00 57.03 56.52 3k5o h ASP 229 Cb 0.00 0.57 -0.02 0.00 0.18 0.00 0.00 39.33 40.06 3k5o h ASP 229 CO 0.00 -0.40 -0.04 -0.07 -3.12 0.00 0.00 179.24 175.61 3k5o h LEU 230 N -0.48 0.57 -0.25 1.55 3.38 -0.78 -1.18 115.31 118.12 3k5o h LEU 230 Ca 0.03 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 3k5o h LEU 230 Cb 0.56 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3k5o h LEU 230 CO -0.38 0.66 -0.06 -0.09 0.09 0.00 0.00 178.44 178.67 3k5o h ARG 231 N 0.56 0.49 -0.79 1.13 2.43 -1.07 -1.15 114.38 115.97 3k5o h ARG 231 Ca 0.11 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 3k5o h ARG 231 Cb 0.42 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 3k5o h ARG 231 CO 0.02 0.71 0.44 0.52 -1.51 0.00 0.00 179.97 180.14 3k5o h MET 232 N 0.23 1.09 -0.64 0.20 2.86 -0.73 -0.33 114.93 117.61 3k5o h MET 232 Ca 0.06 -0.12 -0.09 0.00 -2.06 0.00 0.00 59.70 57.50 3k5o h MET 232 Cb 0.52 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 3k5o h MET 232 CO 0.02 0.79 0.06 -0.07 1.06 0.00 0.00 176.91 178.78 3k5o h LEU 233 N 1.10 1.05 -0.69 1.22 3.38 -1.03 -1.90 115.31 118.44 3k5o h LEU 233 Ca 0.28 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3k5o h LEU 233 Cb 0.02 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 3k5o h LEU 233 CO -0.05 1.06 0.35 -0.61 0.09 0.00 0.00 178.44 179.29 3k5o h GLN 234 N 1.01 0.99 -0.46 1.13 5.75 -0.48 -0.44 115.11 122.60 3k5o h GLN 234 Ca 0.19 -0.14 0.02 0.00 -0.15 0.00 0.00 58.65 58.58 3k5o h GLN 234 Cb 0.49 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.82 3k5o h GLN 234 CO 0.02 0.77 0.27 -0.22 -2.65 0.00 0.00 178.83 177.02 3k5o h LYS 235 N 0.96 0.53 -0.51 1.69 1.63 -0.65 -0.69 116.57 119.54 3k5o h LYS 235 Ca 0.24 -0.03 -0.11 0.00 -0.85 0.00 0.00 60.65 59.90 3k5o h LYS 235 Cb 0.09 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.59 3k5o h LYS 235 CO -0.03 0.35 -0.11 0.45 -3.45 0.00 0.00 179.45 176.66 3k5o h HIS 236 N 0.55 1.05 -0.04 1.91 3.86 -0.98 -2.65 115.15 118.84 3k5o h HIS 236 Ca 0.19 -0.21 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 3k5o h HIS 236 Cb 0.02 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 28.22 3k5o h HIS 236 CO -0.07 0.99 0.02 0.00 0.86 0.00 0.00 177.93 179.73 3k5o h ALA 237 N 1.02 0.05 -0.19 2.45 0.00 -0.60 -0.67 119.26 121.32 3k5o h ALA 237 Ca 0.13 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.06 3k5o h ALA 237 Cb 0.65 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 3k5o h ALA 237 CO 0.04 -0.43 -0.03 0.93 0.00 0.00 0.00 179.25 179.76 3k5o h GLU 238 N 0.01 0.02 -0.91 0.00 5.08 -1.09 0.15 114.58 117.84 3k5o h GLU 238 Ca 0.01 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.41 3k5o h GLU 238 Cb 0.04 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 3k5o h GLU 238 CO -0.00 0.01 0.59 -0.09 -1.00 0.00 0.00 179.01 178.52 3k5o h ARG 239 N 0.02 1.11 -0.09 2.33 2.43 -1.33 -0.58 114.38 118.27 3k5o h ARG 239 Ca 0.09 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3k5o h ARG 239 Cb 0.13 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 3k5o h ARG 239 CO -0.18 0.74 0.00 0.66 -1.51 0.00 0.00 179.97 179.67 3k5o n TYR 240 N -4.51 0.11 -3.88 2.20 4.01 -0.27 -4.89 117.16 109.93 3k5o n TYR 240 Ca 0.11 -0.05 -0.29 0.00 -0.16 0.00 0.00 57.90 57.51 3k5o n TYR 240 Cb 0.08 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.14 3k5o n TYR 240 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3k5o n ARG 241 N 0.09 -5.48 -4.72 -0.72 1.74 0.19 -4.96 116.66 102.79 3k5o n ARG 241 Ca 0.17 0.60 -0.33 0.00 -0.77 0.00 0.00 57.85 57.53 3k5o n ARG 241 Cb 0.30 -5.44 -0.16 0.00 -1.02 0.00 0.00 32.46 26.14 3k5o n ARG 241 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3k5o s LEU 242 N -7.20 2.28 0.12 0.55 2.96 0.27 -5.02 118.68 112.65 3k5o s LEU 242 Ca 0.56 -0.53 -0.31 0.00 -0.22 0.00 0.00 54.13 53.63 3k5o s LEU 242 Cb -0.28 -1.49 -0.09 0.00 0.50 0.00 0.00 46.19 44.83 3k5o s LEU 242 CO 0.83 0.10 1.57 -2.84 -1.32 0.00 0.00 176.35 174.68 3k5o s PRO 243 N 0.70 4.23 -0.84 0.98 0.02 -1.26 -4.41 135.00 134.41 3k5o s PRO 243 Ca -0.09 2.30 -0.16 0.00 0.02 0.00 0.00 61.00 63.07 3k5o s PRO 243 Cb -0.16 -3.33 0.17 0.00 0.02 0.00 0.00 34.50 31.20 3k5o s PRO 243 CO 0.01 -0.63 0.90 -1.17 -0.33 0.00 0.00 177.00 175.78 3k5o s LEU 244 N 1.69 5.99 -0.98 -5.54 2.96 -1.26 -4.98 118.68 116.56 3k5o s LEU 244 Ca 0.70 -2.33 -0.13 0.00 -0.22 0.00 0.00 54.13 52.16 3k5o s LEU 244 Cb -0.41 -2.29 0.23 0.00 0.50 0.00 0.00 46.19 44.22 3k5o s LEU 244 CO 0.31 -0.81 1.00 0.00 -1.32 0.00 0.00 176.35 175.54 3k5o s ARG 245 N 1.35 3.88 0.00 1.98 1.70 -1.26 -1.27 118.95 125.33 3k5o s ARG 245 Ca 0.23 -2.68 0.23 0.00 -0.47 0.00 0.00 55.73 53.03 3k5o s ARG 245 Cb -0.10 -4.59 0.53 0.00 -0.57 0.00 0.00 34.95 30.22 3k5o s ARG 245 CO -0.08 -1.37 1.45 1.28 -1.08 0.00 0.00 175.30 175.50 3k5o n LEU 246 N 3.95 2.75 -4.90 -1.89 4.77 -1.18 -4.76 117.00 115.75 3k5o n LEU 246 Ca 0.21 -1.15 -0.25 0.00 -0.03 0.00 0.00 56.01 54.79 3k5o n LEU 246 Cb 0.44 -0.17 -0.04 0.00 -2.33 0.00 0.00 43.42 41.32 3k5o n LEU 246 CO 0.43 0.57 -0.13 -0.83 -1.33 0.00 0.00 177.39 176.10 3k5o s GLY 247 N -1.57 1.63 0.81 -0.72 0.00 -0.67 -4.79 107.32 102.01 3k5o s GLY 247 Ca 0.35 -1.13 -0.11 0.00 0.00 0.00 0.00 44.72 43.83 3k5o s GLY 247 CO 0.30 -1.14 1.12 0.50 0.00 0.00 0.00 173.10 173.88 3k5o s ARG 248 N -3.32 1.83 -1.57 2.90 0.52 0.87 -2.08 118.95 118.09 3k5o s ARG 248 Ca 0.33 1.36 0.00 0.00 -0.52 0.00 0.00 55.73 56.91 3k5o s ARG 248 Cb -0.10 -1.83 0.00 0.00 0.52 0.00 0.00 34.95 33.53 3k5o s ARG 248 CO 0.27 -1.99 0.00 -3.47 0.02 0.00 0.00 175.30 170.13 3k5o n ASP 249 N -3.65 -5.29 -3.93 0.23 2.03 -1.26 -2.86 116.55 101.81 3k5o n ASP 249 Ca 0.10 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.12 3k5o n ASP 249 Cb 0.52 -4.35 -0.01 0.00 -0.72 0.00 0.00 41.12 36.56 3k5o n ASP 249 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3k5o n ASN 250 N -1.45 -1.72 -4.95 1.67 3.02 -1.05 -4.97 115.26 105.80 3k5o n ASN 250 Ca -0.21 -1.06 -0.24 0.00 -0.03 0.00 0.00 54.58 53.04 3k5o n ASN 250 Cb 0.66 -2.87 -0.02 0.00 -0.61 0.00 0.00 39.78 36.93 3k5o n ASN 250 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3k5o s SER 251 N -4.09 6.33 0.54 6.41 1.04 -0.88 -4.95 113.70 118.09 3k5o s SER 251 Ca 0.16 0.18 -0.10 0.00 0.48 0.00 0.00 55.95 56.67 3k5o s SER 251 Cb -0.07 -1.91 -0.05 0.00 0.10 0.00 0.00 66.02 64.09 3k5o s SER 251 CO 0.90 -0.05 0.91 -1.61 0.98 0.00 0.00 173.24 174.37 3k5o s GLU 252 N -3.70 3.65 0.23 4.02 2.02 -1.26 -1.66 118.70 121.99 3k5o s GLU 252 Ca 0.35 0.57 -0.30 0.00 0.02 0.00 0.00 54.97 55.61 3k5o s GLU 252 Cb -0.10 -2.22 -0.09 0.00 0.10 0.00 0.00 34.13 31.82 3k5o s GLU 252 CO 0.30 -0.35 1.28 -1.17 0.02 0.00 0.00 175.26 175.33 3k5o s LEU 253 N -4.73 4.43 0.05 1.80 2.96 -0.39 -4.65 118.68 118.16 3k5o s LEU 253 Ca 0.53 2.41 0.03 0.00 -0.22 0.00 0.00 54.13 56.88 3k5o s LEU 253 Cb -0.11 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 3k5o s LEU 253 CO 0.45 -0.47 0.04 -1.61 -1.32 0.00 0.00 176.35 173.44 3k5o s GLU 254 N -0.52 2.78 0.06 1.98 0.41 -0.14 -4.98 118.70 118.30 3k5o s GLU 254 Ca 0.54 -0.69 0.06 0.00 -0.41 0.00 0.00 54.97 54.47 3k5o s GLU 254 Cb -0.36 -2.68 -0.03 0.00 -1.78 0.00 0.00 34.13 29.29 3k5o s GLU 254 CO 0.41 0.58 -0.17 -1.58 -0.49 0.00 0.00 175.26 174.01 3k5o s TRP 255 N -1.28 1.43 -0.00 1.61 0.52 -1.26 -1.18 118.94 118.79 3k5o s TRP 255 Ca 0.25 -0.40 -0.00 0.00 0.02 0.00 0.00 56.10 55.97 3k5o s TRP 255 Cb -0.12 -0.82 0.00 0.00 -1.15 0.00 0.00 33.47 31.38 3k5o s TRP 255 CO 0.17 0.09 0.01 1.03 0.02 0.00 0.00 176.95 178.27 3k5o s ARG 256 N -1.49 -0.00 0.15 4.98 1.81 -0.11 -4.95 118.95 119.34 3k5o s ARG 256 Ca 0.02 0.03 -0.13 0.00 -1.72 0.00 0.00 55.73 53.93 3k5o s ARG 256 Cb -0.09 -0.04 -0.07 0.00 -0.45 0.00 0.00 34.95 34.30 3k5o s ARG 256 CO 0.02 -0.03 0.54 -2.00 -0.68 0.00 0.00 175.30 173.16 3k5o s GLU 257 N 0.17 3.95 0.02 3.54 2.12 -1.26 -0.69 118.70 126.54 3k5o s GLU 257 Ca -0.01 0.45 -0.00 0.00 0.36 0.00 0.00 54.97 55.76 3k5o s GLU 257 Cb -0.02 -2.89 -0.02 0.00 0.26 0.00 0.00 34.13 31.46 3k5o s GLU 257 CO -0.00 0.46 -0.02 -1.01 -0.54 0.00 0.00 175.26 174.14 3k5o s HIS 258 N -1.51 0.24 0.00 5.30 3.76 -0.40 -4.96 115.29 117.72 3k5o s HIS 258 Ca 0.39 -0.50 0.00 0.00 -0.15 0.00 0.00 55.06 54.80 3k5o s HIS 258 Cb -0.14 -0.18 0.00 0.00 1.11 0.00 0.00 32.58 33.37 3k5o s HIS 258 CO 0.19 -0.19 0.00 0.41 -0.85 0.00 0.00 174.74 174.31 3k5o n GLY 259 N 1.65 3.06 0.00 -2.22 0.00 -1.26 -1.12 105.19 105.30 3k5o n GLY 259 Ca -0.24 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 43.99 3k5o n GLY 259 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3k5o n PHE 260 N -0.23 0.00 -0.02 1.61 7.35 -1.26 -4.65 117.46 120.25 3k5o n PHE 260 Ca 0.00 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.53 3k5o n PHE 260 Cb 0.00 -0.08 -0.10 0.00 0.35 0.00 0.00 39.48 39.65 3k5o n PHE 260 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 3k5o h LYS 261 N 0.00 0.34 -4.83 -4.13 3.64 -2.07 -3.42 116.57 106.10 3k5o h LYS 261 Ca 0.00 -0.30 -0.68 0.00 -1.27 0.00 0.00 60.65 58.40 3k5o h LYS 261 Cb 0.00 0.07 -0.30 0.00 -0.41 0.00 0.00 32.23 31.59 3k5o h LYS 261 CO 0.00 0.96 -0.69 -0.80 -2.27 0.00 0.00 179.45 176.65 3k5o s ASN 262 N -6.47 4.75 0.25 4.20 0.02 -1.26 -5.09 114.94 111.34 3k5o s ASN 262 Ca -0.14 -0.95 -0.30 0.00 -1.02 0.00 0.00 52.86 50.45 3k5o s ASN 262 Cb 0.03 -1.75 -0.09 0.00 0.02 0.00 0.00 41.25 39.46 3k5o s ASN 262 CO 0.78 -0.19 0.96 -0.83 0.02 0.00 0.00 177.10 177.84 3k5o s GLY 263 N 1.36 3.10 0.05 0.66 0.00 -1.26 -4.40 107.32 106.84 3k5o s GLY 263 Ca -0.01 0.64 0.04 0.00 0.00 0.00 0.00 44.72 45.40 3k5o s GLY 263 CO -0.01 1.21 -0.13 -1.34 0.00 0.00 0.00 173.10 172.84 3k5o s VAL 264 N -1.19 0.98 -0.17 1.40 -7.23 -0.27 -4.96 120.40 108.96 3k5o s VAL 264 Ca 0.42 -1.09 -0.04 0.00 -1.81 0.00 0.00 61.98 59.46 3k5o s VAL 264 Cb -0.26 -0.93 -0.02 0.00 0.56 0.00 0.00 36.38 35.72 3k5o s VAL 264 CO 0.33 -0.14 -0.04 -0.36 -0.31 0.00 0.00 175.10 174.58 3k5o s PHE 265 N -1.06 3.00 -0.05 2.82 0.08 -1.26 -1.28 117.98 120.23 3k5o s PHE 265 Ca -0.02 -0.40 -0.01 0.00 0.12 0.00 0.00 56.93 56.62 3k5o s PHE 265 Cb -0.09 -1.99 -0.04 0.00 -0.57 0.00 0.00 43.02 40.34 3k5o s PHE 265 CO 0.01 -0.13 0.03 -0.06 -0.10 0.00 0.00 175.22 174.97 3k5o s PHE 266 N 0.57 3.20 -0.02 0.36 0.08 0.13 -4.84 117.98 117.47 3k5o s PHE 266 Ca -0.03 0.20 0.01 0.00 0.12 0.00 0.00 56.93 57.23 3k5o s PHE 266 Cb -0.14 -1.76 -0.03 0.00 -0.57 0.00 0.00 43.02 40.51 3k5o s PHE 266 CO 0.03 0.51 -0.01 0.00 -0.10 0.00 0.00 175.22 175.64 3k5o s ALA 267 N -1.01 3.23 -0.01 5.36 0.00 -1.26 -0.94 121.76 127.14 3k5o s ALA 267 Ca 0.17 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.19 3k5o s ALA 267 Cb -0.12 -1.33 0.00 0.00 0.00 0.00 0.00 23.12 21.67 3k5o s ALA 267 CO 0.07 0.63 0.02 1.14 0.00 0.00 0.00 175.76 177.62 3k5o s GLN 268 N -1.35 0.08 -0.07 0.00 -2.07 -0.32 -4.94 119.66 110.98 3k5o s GLN 268 Ca 0.17 -0.05 0.01 0.00 -1.82 0.00 0.00 55.36 53.68 3k5o s GLN 268 Cb -0.11 0.03 0.02 0.00 -1.09 0.00 0.00 33.01 31.85 3k5o s GLN 268 CO 0.08 -0.01 -0.10 0.00 -1.32 0.00 0.00 175.29 173.94 3k5o s ALA 269 N -0.19 1.16 0.18 2.60 0.00 -1.26 -0.97 121.76 123.27 3k5o s ALA 269 Ca -0.02 -0.37 -0.33 0.00 0.00 0.00 0.00 51.96 51.24 3k5o s ALA 269 Cb -0.02 -0.61 -0.14 0.00 0.00 0.00 0.00 23.12 22.36 3k5o s ALA 269 CO -0.00 -0.02 1.56 1.17 0.00 0.00 0.00 175.76 178.47 3k5o n LYS 270 N 4.09 2.16 -1.11 0.00 4.81 -1.26 -2.26 118.16 124.59 3k5o n LYS 270 Ca -0.21 0.78 -0.04 0.00 -0.87 0.00 0.00 58.31 57.97 3k5o n LYS 270 Cb 0.51 -2.53 -0.02 0.00 0.02 0.00 0.00 35.03 33.01 3k5o n LYS 270 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3k5o n GLY 271 N 3.21 0.63 3.10 3.14 0.00 -1.26 -0.09 105.19 113.90 3k5o n GLY 271 Ca 0.16 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 3k5o n GLY 271 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k5o s ARG 272 N -1.64 0.51 -0.12 1.61 0.52 -0.96 -4.83 118.95 114.03 3k5o s ARG 272 Ca 0.00 -0.56 -0.06 0.00 -0.52 0.00 0.00 55.73 54.59 3k5o s ARG 272 Cb 0.00 0.20 -0.04 0.00 0.52 0.00 0.00 34.95 35.63 3k5o s ARG 272 CO 0.00 -0.12 0.12 -0.51 0.02 0.00 0.00 175.30 174.81 3k5o s LEU 273 N -1.68 4.26 -0.29 2.53 1.43 0.11 -4.51 118.68 120.54 3k5o s LEU 273 Ca -0.11 0.41 -0.00 0.00 -1.03 0.00 0.00 54.13 53.39 3k5o s LEU 273 Cb -0.05 -2.04 0.05 0.00 0.03 0.00 0.00 46.19 44.18 3k5o s LEU 273 CO -0.01 0.39 -0.04 -0.63 0.23 0.00 0.00 176.35 176.29 3k5o s ILE 274 N -0.91 2.70 -0.30 -0.59 1.01 -1.26 -0.04 121.20 121.82 3k5o s ILE 274 Ca 0.14 -1.48 -0.02 0.00 0.00 0.00 0.00 60.65 59.29 3k5o s ILE 274 Cb -0.12 -2.57 0.04 0.00 0.01 0.00 0.00 42.46 39.83 3k5o s ILE 274 CO 0.03 -0.08 0.00 -0.63 0.00 0.00 0.00 174.94 174.26 3k5o s ILE 275 N 1.20 3.10 -0.16 2.92 -1.09 -0.10 -4.79 121.20 122.28 3k5o s ILE 275 Ca -0.06 -1.26 -0.27 0.00 -2.23 0.00 0.00 60.65 56.82 3k5o s ILE 275 Cb -0.20 -2.74 -0.01 0.00 -1.58 0.00 0.00 42.46 37.94 3k5o s ILE 275 CO -0.02 -0.05 0.92 -0.62 -1.23 0.00 0.00 174.94 173.93 3k5o s ASP 276 N 1.29 7.07 0.29 3.58 2.15 -1.26 -2.67 116.67 127.13 3k5o s ASP 276 Ca -0.04 1.32 0.00 0.00 0.43 0.00 0.00 52.55 54.27 3k5o s ASP 276 Cb -0.19 -2.50 0.51 0.00 -0.30 0.00 0.00 42.92 40.44 3k5o s ASP 276 CO -0.01 -0.45 1.89 1.23 -0.17 0.00 0.00 175.17 177.66 3k5o h GLY 277 N 8.37 1.41 0.80 2.66 0.00 -1.14 -2.51 103.07 112.66 3k5o h GLY 277 Ca -0.28 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.60 3k5o h GLY 277 CO 0.86 0.29 -0.18 -2.22 0.00 0.00 0.00 176.54 175.29 3k5o h ILE 278 N 1.05 0.63 -0.64 2.60 2.04 -1.92 -0.46 117.51 120.82 3k5o h ILE 278 Ca 0.42 -0.36 0.05 0.00 1.00 0.00 0.00 64.86 65.97 3k5o h ILE 278 Cb 0.25 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 3k5o h ILE 278 CO -0.17 0.07 0.35 -0.08 0.00 0.00 0.00 178.15 178.32 3k5o h GLU 279 N -0.70 0.64 -0.61 2.37 4.57 -1.96 -1.12 114.58 117.76 3k5o h GLU 279 Ca -0.05 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.06 3k5o h GLU 279 Cb 0.49 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.91 3k5o h GLU 279 CO 0.08 0.43 0.27 0.00 -1.18 0.00 0.00 179.01 178.61 3k5o h ALA 280 N 1.33 0.79 -0.20 2.92 0.00 -1.38 -1.37 119.26 121.35 3k5o h ALA 280 Ca 0.28 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 3k5o h ALA 280 Cb 0.16 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3k5o h ALA 280 CO -0.17 0.38 -0.53 -0.07 0.00 0.00 0.00 179.25 178.86 3k5o h LEU 281 N 0.85 0.64 -0.88 0.00 3.38 -0.71 -2.68 115.31 115.90 3k5o h LEU 281 Ca 0.21 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 3k5o h LEU 281 Cb 0.16 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3k5o h LEU 281 CO -0.02 1.05 0.30 0.11 0.09 0.00 0.00 178.44 179.97 3k5o h LYS 282 N 0.45 1.12 0.00 1.13 1.57 -1.05 -0.27 116.57 119.52 3k5o h LYS 282 Ca 0.01 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3k5o h LYS 282 Cb 1.08 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.20 3k5o h LYS 282 CO 0.10 0.90 0.00 0.66 -0.57 0.00 0.00 179.45 180.55 3k5o h SER 283 N 1.09 0.00 -0.72 0.86 4.64 -1.10 -1.71 113.55 116.60 3k5o h SER 283 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3k5o h SER 283 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 3k5o h SER 283 CO -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.94 3k5o n ALA 284 N -1.85 2.55 -2.94 5.18 0.00 -0.67 -4.94 120.51 117.84 3k5o n ALA 284 Ca 0.02 -1.38 -0.19 0.00 0.00 0.00 0.00 53.44 51.90 3k5o n ALA 284 Cb 0.28 -0.95 0.03 0.00 0.00 0.00 0.00 19.45 18.81 3k5o n ALA 284 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3k5o n PHE 285 N 1.55 -1.71 -2.45 0.00 3.72 -0.64 -4.96 117.46 112.97 3k5o n PHE 285 Ca 0.25 0.48 -0.38 0.00 -0.05 0.00 0.00 57.45 57.75 3k5o n PHE 285 Cb 0.69 -3.95 -0.04 0.00 -0.94 0.00 0.00 39.48 35.25 3k5o n PHE 285 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3k5o s TRP 286 N -3.09 3.32 -1.16 1.38 0.52 -0.20 -4.98 118.94 114.73 3k5o s TRP 286 Ca 0.28 1.64 -0.16 0.00 0.02 0.00 0.00 56.10 57.87 3k5o s TRP 286 Cb -0.12 -3.26 0.14 0.00 -1.15 0.00 0.00 33.47 29.08 3k5o s TRP 286 CO 0.34 -0.80 1.42 0.54 0.02 0.00 0.00 176.95 178.47 3k5o s ASN 287 N -1.19 6.92 0.02 2.95 2.20 -1.26 -4.77 114.94 119.80 3k5o s ASN 287 Ca 0.53 -2.64 0.05 0.00 -0.94 0.00 0.00 52.86 49.86 3k5o s ASN 287 Cb -0.28 -2.44 -0.02 0.00 -2.00 0.00 0.00 41.25 36.51 3k5o s ASN 287 CO 0.36 -0.92 -0.16 -0.36 -2.94 0.00 0.00 177.10 173.08 3k5o s PHE 288 N 2.39 1.42 0.13 1.54 0.08 -1.26 -5.02 117.98 117.26 3k5o s PHE 288 Ca 0.43 -0.31 -0.20 0.00 0.12 0.00 0.00 56.93 56.97 3k5o s PHE 288 Cb -0.02 -0.88 -0.02 0.00 -0.57 0.00 0.00 43.02 41.53 3k5o s PHE 288 CO -0.01 0.02 1.71 1.03 -0.10 0.00 0.00 175.22 177.87 3k5o h SER 289 N 5.32 -0.14 -5.13 1.36 0.87 -1.96 -3.44 113.55 110.44 3k5o h SER 289 Ca -0.38 0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.13 3k5o h SER 289 Cb 1.16 0.10 -0.16 0.00 -0.44 0.00 0.00 62.40 63.07 3k5o h SER 289 CO 0.46 -0.04 -0.48 -0.94 -0.53 0.00 0.00 176.83 175.30 3k5o s SER 290 N -5.22 0.19 -0.27 6.23 1.04 -1.26 -2.96 113.70 111.45 3k5o s SER 290 Ca -0.13 -0.63 0.11 0.00 0.48 0.00 0.00 55.95 55.77 3k5o s SER 290 Cb 0.10 0.27 0.73 0.00 0.10 0.00 0.00 66.02 67.22 3k5o s SER 290 CO 0.69 -0.60 1.71 0.49 0.98 0.00 0.00 173.24 176.51 3k5o n PHE 291 N 0.37 2.18 -2.17 5.02 3.72 -1.26 -4.44 117.46 120.88 3k5o n PHE 291 Ca -0.17 -0.94 -0.41 0.00 -0.05 0.00 0.00 57.45 55.88 3k5o n PHE 291 Cb 0.60 -0.59 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 3k5o n PHE 291 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3k5o s SER 292 N -0.82 6.85 0.28 4.37 1.04 -1.26 -4.86 113.70 119.29 3k5o s SER 292 Ca 0.51 2.58 0.01 0.00 0.48 0.00 0.00 55.95 59.54 3k5o s SER 292 Cb 0.40 -2.64 0.62 0.00 0.10 0.00 0.00 66.02 64.50 3k5o s SER 292 CO 0.14 -0.49 1.74 0.25 0.98 0.00 0.00 173.24 175.85 3k5o h LEU 293 N 3.90 0.46 -0.38 2.42 5.85 -2.00 -1.87 115.31 123.69 3k5o h LEU 293 Ca -0.48 0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.39 3k5o h LEU 293 Cb 1.22 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 3k5o h LEU 293 CO 0.69 0.13 0.18 -0.33 -0.34 0.00 0.00 178.44 178.76 3k5o h GLU 294 N 0.54 0.35 -0.10 1.25 3.07 -1.98 -1.32 114.58 116.39 3k5o h GLU 294 Ca 0.51 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 59.32 3k5o h GLU 294 Cb 0.83 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.66 3k5o h GLU 294 CO -0.43 0.23 -0.05 1.15 -1.40 0.00 0.00 179.01 178.52 3k5o h THR 295 N 0.37 1.32 -0.60 1.13 2.02 -1.69 -0.99 112.91 114.46 3k5o h THR 295 Ca 0.16 -1.07 0.01 0.00 0.77 0.00 0.00 66.41 66.29 3k5o h THR 295 Cb 0.08 1.81 -0.03 0.00 -1.74 0.00 0.00 68.15 68.27 3k5o h THR 295 CO -0.12 0.30 0.39 0.58 0.37 0.00 0.00 175.52 177.04 3k5o h VAL 296 N -0.14 1.13 -0.51 3.16 2.07 -1.38 0.97 116.25 121.55 3k5o h VAL 296 Ca 0.02 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.32 3k5o h VAL 296 Cb 0.50 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 3k5o h VAL 296 CO 0.01 0.14 0.26 0.00 0.02 0.00 0.00 177.57 178.01 3k5o h ALA 297 N 1.24 0.65 -0.28 1.67 0.00 -1.19 0.58 119.26 121.92 3k5o h ALA 297 Ca 0.23 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 3k5o h ALA 297 Cb -0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3k5o h ALA 297 CO -0.07 -0.08 -0.41 -0.56 0.00 0.00 0.00 179.25 178.13 3k5o h GLN 298 N 0.51 0.77 -0.30 0.00 3.07 0.04 -0.09 115.11 119.12 3k5o h GLN 298 Ca 0.22 -0.46 -0.07 0.00 0.09 0.00 0.00 58.65 58.43 3k5o h GLN 298 Cb 0.12 0.04 -0.01 0.00 0.08 0.00 0.00 27.48 27.71 3k5o h GLN 298 CO -0.15 1.08 -0.09 0.93 0.09 0.00 0.00 178.83 180.70 3k5o h GLU 299 N 0.53 0.58 0.13 0.06 5.08 0.14 -2.40 114.58 118.71 3k5o h GLU 299 Ca 0.03 -0.23 -0.33 0.00 -1.00 0.00 0.00 59.36 57.83 3k5o h GLU 299 Cb 1.00 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 3k5o h GLU 299 CO 0.10 0.79 -1.71 1.25 -1.00 0.00 0.00 179.01 178.43 3k5o h LEU 300 N 0.34 0.43 -1.70 1.33 5.85 0.07 -3.39 115.31 118.25 3k5o h LEU 300 Ca 0.07 -0.89 0.00 0.00 0.84 0.00 0.00 57.88 57.90 3k5o h LEU 300 Cb 0.58 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3k5o h LEU 300 CO 0.03 1.75 -0.05 0.18 -0.34 0.00 0.00 178.44 180.02 3k5o n LEU 301 N -3.71 2.69 -3.63 2.25 4.77 -0.07 -4.97 117.00 114.33 3k5o n LEU 301 Ca -0.28 -0.90 -0.21 0.00 -0.03 0.00 0.00 56.01 54.58 3k5o n LEU 301 Cb 0.99 -0.00 0.06 0.00 -2.33 0.00 0.00 43.42 42.13 3k5o n LEU 301 CO 0.43 0.45 0.05 0.61 -1.33 0.00 0.00 177.39 177.60 3k5o n GLY 302 N 1.33 -0.37 3.20 -0.72 0.00 -0.90 -4.96 105.19 102.77 3k5o n GLY 302 Ca 0.14 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 46.00 3k5o n GLY 302 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3k5o s GLU 303 N -5.90 2.73 -0.01 1.61 -1.05 -1.18 -4.99 118.70 109.90 3k5o s GLU 303 Ca 0.16 -0.81 -0.16 0.00 -0.15 0.00 0.00 54.97 54.01 3k5o s GLU 303 Cb -0.07 -2.12 -0.06 0.00 -0.44 0.00 0.00 34.13 31.44 3k5o s GLU 303 CO 0.78 0.20 0.44 0.20 0.95 0.00 0.00 175.26 177.82 3k5o s GLY 304 N 0.28 2.49 0.00 -3.83 0.00 -1.26 -3.31 107.32 101.69 3k5o s GLY 304 Ca -0.15 -0.18 0.00 0.00 0.00 0.00 0.00 44.72 44.39 3k5o s GLY 304 CO 0.07 0.28 0.00 1.34 0.00 0.00 0.00 173.10 174.79 3k5o n ASP 315 N 2.10 0.00 0.22 1.64 2.03 -1.26 -4.96 116.55 116.32 3k5o n ASP 315 Ca -0.12 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.28 3k5o n ASP 315 Cb 0.52 0.00 0.43 0.00 -0.72 0.00 0.00 41.12 41.35 3k5o n ASP 315 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 3k5o h GLU 316 N 0.00 0.00 -0.53 -0.67 3.07 -2.03 -2.88 114.58 111.55 3k5o h GLU 316 Ca 0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 3k5o h GLU 316 Cb 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 3k5o h GLU 316 CO 0.00 0.24 0.17 0.82 -1.40 0.00 0.00 179.01 178.84 3k5o h ILE 317 N 0.00 1.23 -0.51 3.13 5.03 -1.98 0.28 117.51 124.69 3k5o h ILE 317 Ca -0.00 -0.76 -0.09 0.00 -0.12 0.00 0.00 64.86 63.89 3k5o h ILE 317 Cb 0.78 0.73 -0.02 0.00 -3.03 0.00 0.00 36.82 35.28 3k5o h ILE 317 CO 0.03 0.28 -0.04 0.44 -0.68 0.00 0.00 178.15 178.18 3k5o h ASP 318 N 0.72 0.87 -0.11 1.72 3.32 -1.84 -1.94 116.42 119.15 3k5o h ASP 318 Ca 0.17 -0.24 -0.18 0.00 0.02 0.00 0.00 57.03 56.80 3k5o h ASP 318 Cb 0.26 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3k5o h ASP 318 CO -0.01 0.95 -0.58 -0.09 -1.72 0.00 0.00 179.24 177.80 3k5o h ARG 319 N 0.81 0.71 0.00 3.56 2.43 -1.30 -1.88 114.38 118.71 3k5o h ARG 319 Ca 0.15 -0.47 -0.09 0.00 -0.81 0.00 0.00 59.98 58.76 3k5o h ARG 319 Cb 0.54 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 3k5o h ARG 319 CO 0.03 1.09 -0.44 0.00 -1.51 0.00 0.00 179.97 179.14 3k5o h ARG 320 N 0.54 0.00 -0.28 0.20 3.08 -0.32 -0.52 114.38 117.08 3k5o h ARG 320 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 3k5o h ARG 320 Cb 1.16 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.20 3k5o h ARG 320 CO 0.12 0.44 -0.50 0.35 -1.07 0.00 0.00 179.97 179.31 3k5o h PHE 321 N 0.00 0.99 -0.13 3.04 3.57 -1.21 0.56 116.94 123.75 3k5o h PHE 321 Ca -0.00 -0.33 -0.12 0.00 3.53 0.00 0.00 57.97 61.04 3k5o h PHE 321 Cb 0.79 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 3k5o h PHE 321 CO 0.00 1.13 -0.43 0.00 -2.23 0.00 0.00 178.31 176.78 3k5o h ALA 322 N 0.80 1.02 0.00 2.41 0.00 -0.98 -3.40 119.26 119.11 3k5o h ALA 322 Ca 0.02 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3k5o h ALA 322 Cb 1.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3k5o h ALA 322 CO 0.11 0.62 -0.96 0.39 0.00 0.00 0.00 179.25 179.40 3k5o n GLU 323 N -4.01 2.82 -3.17 0.00 1.02 -0.24 -4.96 120.64 112.10 3k5o n GLU 323 Ca -0.02 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.91 3k5o n GLU 323 Cb 0.50 -0.98 -0.06 0.00 -0.02 0.00 0.00 31.44 30.88 3k5o n GLU 323 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3k5o n ASP 324 N -1.80 -0.82 -0.14 1.62 2.03 0.19 -4.12 116.55 113.51 3k5o n ASP 324 Ca 0.00 -2.66 0.06 0.00 0.52 0.00 0.00 54.79 52.70 3k5o n ASP 324 Cb 0.34 -0.07 0.37 0.00 -0.72 0.00 0.00 41.12 41.04 3k5o n ASP 324 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 3k5o h LYS 325 N 4.74 0.70 -0.40 -0.67 1.57 -1.67 -1.28 116.57 119.54 3k5o h LYS 325 Ca 0.12 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 3k5o h LYS 325 Cb 0.93 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 3k5o h LYS 325 CO 0.36 0.46 0.13 -1.35 -0.57 0.00 0.00 179.45 178.48 3k5o h PRO 326 N 0.72 0.58 -0.08 3.15 0.11 -1.88 0.91 132.00 135.52 3k5o h PRO 326 Ca 0.27 -0.09 -0.15 0.00 0.11 0.00 0.00 66.00 66.14 3k5o h PRO 326 Cb 0.16 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 3k5o h PRO 326 CO -0.08 0.52 -0.61 0.00 -0.21 0.00 0.00 178.00 177.62 3k5o h ALA 327 N 1.56 0.83 -0.15 -0.75 0.00 -1.61 -1.50 119.26 117.65 3k5o h ALA 327 Ca 0.14 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 3k5o h ALA 327 Cb 0.18 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3k5o h ALA 327 CO -0.01 0.73 -0.10 1.25 0.00 0.00 0.00 179.25 181.12 3k5o h LEU 328 N 0.20 0.34 -0.86 0.00 5.85 -0.56 -2.31 115.31 117.95 3k5o h LEU 328 Ca -0.01 -0.44 0.02 0.00 0.84 0.00 0.00 57.88 58.29 3k5o h LEU 328 Cb 1.12 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.01 3k5o h LEU 328 CO 0.10 0.70 0.57 0.00 -0.34 0.00 0.00 178.44 179.47 3k5o h ALA 329 N 0.64 1.11 -0.66 1.25 0.00 -0.82 -0.32 119.26 120.46 3k5o h ALA 329 Ca 0.03 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3k5o h ALA 329 Cb 0.59 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3k5o h ALA 329 CO 0.03 0.47 0.41 1.15 0.00 0.00 0.00 179.25 181.30 3k5o h THR 330 N 1.14 1.08 -0.37 0.00 2.02 -1.17 -0.05 112.91 115.57 3k5o h THR 330 Ca 0.32 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 67.19 3k5o h THR 330 Cb -0.09 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.52 3k5o h THR 330 CO -0.08 0.15 0.07 0.22 0.37 0.00 0.00 175.52 176.24 3k5o h TYR 331 N 0.80 0.63 0.02 3.16 3.20 -0.77 -1.38 116.97 122.63 3k5o h TYR 331 Ca 0.27 -0.08 0.01 0.00 3.14 0.00 0.00 58.73 62.06 3k5o h TYR 331 Cb 0.03 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 3k5o h TYR 331 CO -0.05 0.64 -0.04 -0.97 -1.64 0.00 0.00 178.16 176.09 3k5o h ASN 332 N 0.44 -0.12 0.05 -2.11 -0.73 -0.61 -1.95 115.58 110.55 3k5o h ASN 332 Ca 0.11 0.02 -0.05 0.00 1.87 0.00 0.00 56.30 58.25 3k5o h ASN 332 Cb 0.34 0.05 -0.01 0.00 0.27 0.00 0.00 38.32 38.96 3k5o h ASN 332 CO 0.00 -0.07 -0.14 0.25 -0.37 0.00 0.00 177.43 177.11 3k5o h LEU 333 N -0.09 0.19 -1.05 0.34 5.85 -0.98 -1.99 115.31 117.59 3k5o h LEU 333 Ca 0.01 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 3k5o h LEU 333 Cb 0.10 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 3k5o h LEU 333 CO -0.03 0.36 -0.24 0.50 -0.34 0.00 0.00 178.44 178.69 3k5o h LYS 334 N 0.19 0.39 -0.52 1.25 1.63 -0.80 -1.78 116.57 116.94 3k5o h LYS 334 Ca 0.04 -0.14 -0.12 0.00 -0.85 0.00 0.00 60.65 59.58 3k5o h LYS 334 Cb 0.37 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.96 3k5o h LYS 334 CO 0.02 0.61 -0.13 -0.91 -3.45 0.00 0.00 179.45 175.59 3k5o h ASN 335 N 0.35 1.01 0.01 4.20 2.35 -0.61 -1.83 115.58 121.06 3k5o h ASN 335 Ca 0.06 -0.34 -0.00 0.00 -0.55 0.00 0.00 56.30 55.46 3k5o h ASN 335 Cb 0.61 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.70 3k5o h ASN 335 CO 0.04 1.13 -0.00 0.00 -1.65 0.00 0.00 177.43 176.95 3k5o h GLU 337 N -0.04 1.14 -0.42 0.00 5.08 -1.26 -1.64 114.58 117.44 3k5o h GLU 337 Ca -0.00 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3k5o h GLU 337 Cb 0.04 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.02 3k5o h GLU 337 CO 0.00 0.79 0.23 1.25 -1.00 0.00 0.00 179.01 180.28 3k5o h LEU 338 N 1.16 0.36 -0.33 1.33 5.85 -1.14 0.17 115.31 122.71 3k5o h LEU 338 Ca 0.31 0.01 0.01 0.00 0.84 0.00 0.00 57.88 59.05 3k5o h LEU 338 Cb -0.07 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 3k5o h LEU 338 CO -0.06 0.26 0.21 0.58 -0.34 0.00 0.00 178.44 179.08 3k5o h VAL 339 N 0.46 1.06 -0.91 1.05 2.07 -0.87 -0.14 116.25 118.97 3k5o h VAL 339 Ca 0.17 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.55 3k5o h VAL 339 Cb 0.04 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 3k5o h VAL 339 CO -0.10 0.08 0.59 0.74 0.02 0.00 0.00 177.57 178.90 3k5o h THR 340 N 0.42 1.24 -0.64 2.57 2.02 -0.69 -0.62 112.91 117.21 3k5o h THR 340 Ca 0.13 -0.46 -0.08 0.00 0.77 0.00 0.00 66.41 66.77 3k5o h THR 340 Cb -0.02 -0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 66.27 3k5o h THR 340 CO -0.05 0.24 0.08 1.56 0.37 0.00 0.00 175.52 177.72 3k5o h GLN 341 N 1.24 1.07 -0.40 6.66 4.20 -0.19 -1.78 115.11 125.91 3k5o h GLN 341 Ca 0.33 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 3k5o h GLN 341 Cb -0.12 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.52 3k5o h GLN 341 CO -0.07 1.00 0.18 0.82 -0.67 0.00 0.00 178.83 180.09 3k5o h ILE 342 N 1.00 1.18 -0.67 2.54 2.04 -0.41 -0.61 117.51 122.58 3k5o h ILE 342 Ca 0.19 -0.53 0.03 0.00 1.00 0.00 0.00 64.86 65.55 3k5o h ILE 342 Cb 0.47 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 3k5o h ILE 342 CO 0.02 0.20 0.42 -0.26 0.00 0.00 0.00 178.15 178.52 3k5o h PHE 343 N 0.51 0.78 -0.21 1.37 0.05 -0.85 -1.18 116.94 117.40 3k5o h PHE 343 Ca 0.14 0.02 -0.03 0.00 3.82 0.00 0.00 57.97 61.92 3k5o h PHE 343 Cb 0.14 -0.25 -0.01 0.00 2.00 0.00 0.00 35.95 37.83 3k5o h PHE 343 CO -0.01 0.45 0.01 0.45 -0.18 0.00 0.00 178.31 179.03 3k5o h HIS 344 N 0.82 0.40 0.01 -0.55 3.86 -1.06 -1.57 115.15 117.06 3k5o h HIS 344 Ca 0.27 -0.07 0.01 0.00 -1.16 0.00 0.00 60.37 59.42 3k5o h HIS 344 Cb 0.02 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 3k5o h HIS 344 CO -0.05 0.54 -0.04 -0.22 0.86 0.00 0.00 177.93 179.02 3k5o h LYS 345 N 0.15 -0.08 0.00 2.45 1.63 -0.89 -2.77 116.57 117.05 3k5o h LYS 345 Ca 0.06 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 3k5o h LYS 345 Cb 0.37 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 3k5o h LYS 345 CO 0.01 -0.05 0.00 1.79 -3.45 0.00 0.00 179.45 177.74 3k5o h THR 346 N -0.08 0.00 -5.36 1.00 1.35 -1.24 -3.46 112.91 105.11 3k5o h THR 346 Ca 0.01 -0.34 -0.41 0.00 -0.55 0.00 0.00 66.41 65.13 3k5o h THR 346 Cb 0.10 1.18 -0.03 0.00 -1.73 0.00 0.00 68.15 67.67 3k5o h THR 346 CO -0.04 0.00 -0.62 -0.62 -0.25 0.00 0.00 175.52 174.00 3k5o n GLU 347 N -2.35 -4.36 -0.23 4.72 1.02 -0.60 -4.88 120.64 113.96 3k5o n GLU 347 Ca 0.03 0.63 -0.05 0.00 -0.02 0.00 0.00 57.16 57.76 3k5o n GLU 347 Cb 0.30 -5.43 0.12 0.00 -0.02 0.00 0.00 31.44 26.40 3k5o n GLU 347 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 3k5o h ILE 348 N -1.36 1.25 -0.56 -3.67 6.09 -1.85 -2.99 117.51 114.42 3k5o h ILE 348 Ca -0.49 -0.81 -0.01 0.00 -1.37 0.00 0.00 64.86 62.17 3k5o h ILE 348 Cb 1.33 0.43 -0.03 0.00 0.47 0.00 0.00 36.82 39.03 3k5o h ILE 348 CO 0.57 0.32 0.29 0.24 -3.07 0.00 0.00 178.15 176.51 3k5o h MET 349 N 1.03 0.79 -0.97 2.19 2.86 -1.90 0.03 114.93 118.96 3k5o h MET 349 Ca 0.23 -0.10 0.04 0.00 -2.06 0.00 0.00 59.70 57.82 3k5o h MET 349 Cb 0.24 -0.15 -0.06 0.00 0.06 0.00 0.00 31.60 31.69 3k5o h MET 349 CO -0.01 0.62 0.63 -1.35 1.06 0.00 0.00 176.91 177.86 3k5o h PRO 350 N 0.75 1.16 -0.28 -0.22 0.11 -1.93 -0.18 132.00 131.42 3k5o h PRO 350 Ca 0.20 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 3k5o h PRO 350 Cb 0.07 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 30.91 3k5o h PRO 350 CO -0.03 0.77 0.09 0.35 -0.21 0.00 0.00 178.00 178.97 3k5o h PHE 351 N 1.20 0.46 -0.25 0.65 3.57 -1.25 -1.92 116.94 119.39 3k5o h PHE 351 Ca 0.39 -0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.77 3k5o h PHE 351 Cb 0.05 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 3k5o h PHE 351 CO -0.00 0.49 -0.16 -0.07 -2.23 0.00 0.00 178.31 176.34 3k5o h LEU 352 N 0.30 0.42 -0.45 0.59 3.38 -0.46 -1.36 115.31 117.73 3k5o h LEU 352 Ca 0.09 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.79 3k5o h LEU 352 Cb 0.25 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3k5o h LEU 352 CO -0.00 0.61 -0.38 -0.07 0.09 0.00 0.00 178.44 178.69 3k5o h LEU 353 N 0.40 0.93 -0.54 1.67 3.38 -0.87 -2.09 115.31 118.20 3k5o h LEU 353 Ca 0.07 -0.42 -0.15 0.00 0.09 0.00 0.00 57.88 57.47 3k5o h LEU 353 Cb 0.52 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3k5o h LEU 353 CO 0.03 1.20 -0.39 -0.33 0.09 0.00 0.00 178.44 179.05 3k5o h GLU 354 N 0.72 0.76 -0.54 1.13 4.39 -1.13 -1.36 114.58 118.55 3k5o h GLU 354 Ca 0.06 -0.39 -0.04 0.00 0.34 0.00 0.00 59.36 59.33 3k5o h GLU 354 Cb 0.96 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.60 3k5o h GLU 354 CO 0.09 1.01 0.18 -0.09 -1.16 0.00 0.00 179.01 179.05 3k5o h ARG 355 N 0.62 0.82 -0.37 2.33 2.43 -1.18 -1.26 114.38 117.76 3k5o h ARG 355 Ca 0.05 -0.17 -0.12 0.00 -0.81 0.00 0.00 59.98 58.93 3k5o h ARG 355 Cb 0.94 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 3k5o h ARG 355 CO 0.09 0.74 -0.26 0.00 -1.51 0.00 0.00 179.97 179.02 3k5o h ALA 356 N 1.04 0.84 -0.34 2.80 0.00 -1.29 -0.13 119.26 122.18 3k5o h ALA 356 Ca 0.17 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 3k5o h ALA 356 Cb 0.25 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3k5o h ALA 356 CO -0.01 0.64 0.11 1.15 0.00 0.00 0.00 179.25 181.14 3k5o h THR 357 N 0.66 1.15 0.21 0.00 2.02 -0.88 -2.28 112.91 113.79 3k5o h THR 357 Ca 0.08 -0.48 -0.31 0.00 0.77 0.00 0.00 66.41 66.47 3k5o h THR 357 Cb 0.78 0.77 0.03 0.00 -1.74 0.00 0.00 68.15 67.99 3k5o h THR 357 CO 0.06 0.18 -1.43 0.58 0.37 0.00 0.00 175.52 175.28 3k5o h VAL 358 N 0.48 1.21 -0.01 3.16 2.07 -0.81 -3.40 116.25 118.95 3k5o h VAL 358 Ca 0.12 -2.60 0.00 0.00 0.82 0.00 0.00 66.70 65.04 3k5o h VAL 358 Cb 0.14 2.97 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 3k5o h VAL 358 CO -0.01 0.80 -0.51 -0.46 0.02 0.00 0.00 177.57 177.40 3k5o n ASN 359 N -3.78 1.09 0.00 0.57 0.23 -0.10 -4.96 115.26 108.31 3k5o n ASN 359 Ca -0.19 -0.87 0.00 0.00 -0.53 0.00 0.00 54.58 52.99 3k5o n ASN 359 Cb 1.03 0.41 0.00 0.00 -2.08 0.00 0.00 39.78 39.14 3k5o n ASN 359 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3k5o n GLY 360 N 1.43 0.58 3.98 4.83 0.00 -0.86 -4.50 105.19 110.65 3k5o n GLY 360 Ca 0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 3k5o n GLY 360 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k5o s LEU 361 N 0.00 4.04 0.67 0.99 1.43 -1.26 -4.88 118.68 119.68 3k5o s LEU 361 Ca 0.00 -0.14 -0.16 0.00 -1.03 0.00 0.00 54.13 52.80 3k5o s LEU 361 Cb 0.00 -2.77 0.01 0.00 0.03 0.00 0.00 46.19 43.46 3k5o s LEU 361 CO 0.00 -0.35 1.21 -2.84 0.23 0.00 0.00 176.35 174.59 3k5o s PRO 362 N -4.13 2.49 0.34 1.29 0.02 -1.26 -4.68 135.00 129.07 3k5o s PRO 362 Ca 0.43 1.77 0.02 0.00 0.02 0.00 0.00 61.00 63.24 3k5o s PRO 362 Cb -0.09 -1.87 0.60 0.00 0.02 0.00 0.00 34.50 33.16 3k5o s PRO 362 CO 0.31 -1.57 1.99 0.28 -0.33 0.00 0.00 177.00 177.67 3k5o h VAL 363 N 0.17 1.17 0.00 3.83 2.07 -1.89 -2.49 116.25 119.11 3k5o h VAL 363 Ca -0.49 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 66.64 3k5o h VAL 363 Cb 1.30 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 3k5o h VAL 363 CO 0.52 0.18 -0.10 0.44 0.02 0.00 0.00 177.57 178.62 3k5o h ASP 364 N 0.85 0.00 -2.40 0.57 5.19 -1.91 -3.46 116.42 115.25 3k5o h ASP 364 Ca 0.22 0.00 -0.56 0.00 -0.62 0.00 0.00 57.03 56.07 3k5o h ASP 364 Cb -0.04 0.00 0.06 0.00 0.18 0.00 0.00 39.33 39.52 3k5o h ASP 364 CO -0.04 0.10 0.87 -1.14 -3.12 0.00 0.00 179.24 175.91 3k5o n ARG 365 N -3.24 2.36 -3.62 3.56 3.00 -0.94 -4.99 116.66 112.79 3k5o n ARG 365 Ca 0.00 0.85 -0.36 0.00 -0.00 0.00 0.00 57.85 58.35 3k5o n ARG 365 Cb 0.36 -2.65 -0.07 0.00 0.00 0.00 0.00 32.46 30.10 3k5o n ARG 365 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 3k5o s HIS 366 N 0.99 3.44 0.00 -0.14 5.65 -1.26 -4.90 115.29 119.07 3k5o s HIS 366 Ca 0.77 0.48 0.00 0.00 0.25 0.00 0.00 55.06 56.56 3k5o s HIS 366 Cb -0.62 -2.27 0.00 0.00 -1.18 0.00 0.00 32.58 28.51 3k5o s HIS 366 CO 0.36 0.25 0.00 0.41 -0.65 0.00 0.00 174.74 175.11 3k5o n GLY 367 N 3.47 3.11 1.97 1.59 0.00 -1.26 -4.91 105.19 109.15 3k5o n GLY 367 Ca -0.14 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.71 3k5o n GLY 367 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5o n GLY 368 N 0.00 0.39 0.37 -0.02 0.00 -1.26 -4.97 105.19 99.71 3k5o n GLY 368 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 3k5o n GLY 368 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3k5o h SER 369 N 0.00 1.08 -0.16 1.61 0.02 -1.99 -0.26 113.55 113.85 3k5o h SER 369 Ca 0.00 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.87 3k5o h SER 369 Cb 0.53 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 3k5o h SER 369 CO 0.00 0.74 -0.15 0.58 -1.14 0.00 0.00 176.83 176.86 3k5o h VAL 370 N 1.25 1.34 -0.34 2.27 2.07 -1.95 -2.10 116.25 118.79 3k5o h VAL 370 Ca 0.39 -1.30 -0.06 0.00 0.82 0.00 0.00 66.70 66.56 3k5o h VAL 370 Cb 0.00 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 3k5o h VAL 370 CO -0.12 0.39 -0.03 0.00 0.02 0.00 0.00 177.57 177.82 3k5o h ALA 371 N 0.63 1.32 -0.28 1.67 0.00 -1.92 -1.89 119.26 118.79 3k5o h ALA 371 Ca 0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 3k5o h ALA 371 Cb 0.68 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3k5o h ALA 371 CO 0.04 0.46 -0.01 0.00 0.00 0.00 0.00 179.25 179.74 3k5o h ALA 372 N 1.47 0.38 -0.70 0.00 0.00 -0.99 -0.97 119.26 118.45 3k5o h ALA 372 Ca 0.11 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.82 3k5o h ALA 372 Cb 0.38 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 3k5o h ALA 372 CO 0.02 0.14 0.42 0.35 0.00 0.00 0.00 179.25 180.18 3k5o h PHE 373 N 0.29 0.79 -0.72 0.00 3.57 -1.03 -1.79 116.94 118.05 3k5o h PHE 373 Ca 0.08 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.53 3k5o h PHE 373 Cb 0.44 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 3k5o h PHE 373 CO 0.04 0.43 0.17 0.78 -2.23 0.00 0.00 178.31 177.50 3k5o h GLY 374 N 0.81 1.23 0.87 2.40 0.00 -1.12 0.12 103.07 107.39 3k5o h GLY 374 Ca 0.29 -0.77 0.03 0.00 0.00 0.00 0.00 47.33 46.88 3k5o h GLY 374 CO -0.13 0.72 0.33 0.84 0.00 0.00 0.00 176.54 178.29 3k5o h HIS 375 N 1.08 0.61 0.03 5.60 -0.00 -0.50 0.92 115.15 122.89 3k5o h HIS 375 Ca 0.22 0.02 -0.23 0.00 -0.00 0.00 0.00 60.37 60.39 3k5o h HIS 375 Cb 0.37 -0.20 -0.00 0.00 -0.00 0.00 0.00 27.41 27.58 3k5o h HIS 375 CO 0.03 0.35 -1.00 -0.07 -0.00 0.00 0.00 177.93 177.24 3k5o h LEU 376 N 0.65 0.39 -0.03 0.26 3.38 -1.19 -3.37 115.31 115.39 3k5o h LEU 376 Ca 0.22 -0.34 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 3k5o h LEU 376 Cb 0.03 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 40.66 3k5o h LEU 376 CO -0.10 1.17 -0.33 0.22 0.09 0.00 0.00 178.44 179.49 3k5o h TYR 377 N 0.14 0.40 -0.70 1.13 3.20 -0.37 -3.39 116.97 117.38 3k5o h TYR 377 Ca -0.08 -0.19 0.14 0.00 3.14 0.00 0.00 58.73 61.74 3k5o h TYR 377 Cb 1.66 -0.05 -0.13 0.00 1.54 0.00 0.00 36.73 39.74 3k5o h TYR 377 CO 0.05 0.96 -0.22 0.74 -1.64 0.00 0.00 178.16 178.05 3k5o h PHE 378 N -0.28 -0.52 -0.91 -3.82 0.05 -0.99 -0.28 116.94 110.19 3k5o h PHE 378 Ca -0.03 0.07 0.01 0.00 3.82 0.00 0.00 57.97 61.84 3k5o h PHE 378 Cb 1.03 0.34 -0.05 0.00 2.00 0.00 0.00 35.95 39.27 3k5o h PHE 378 CO 0.15 -0.33 0.60 -1.00 -0.18 0.00 0.00 178.31 177.55 3k5o h PRO 379 N -0.04 1.18 -0.28 1.51 0.13 -1.78 0.40 132.00 133.13 3k5o h PRO 379 Ca 0.32 -0.07 -0.15 0.00 -0.87 0.00 0.00 66.00 65.23 3k5o h PRO 379 Cb 0.54 -0.27 -0.00 0.00 0.13 0.00 0.00 31.00 31.40 3k5o h PRO 379 CO -0.73 0.78 -0.42 0.00 -0.23 0.00 0.00 178.00 177.40 3k5o h ARG 380 N 1.22 0.77 -0.41 0.86 3.08 -1.60 -1.91 114.38 116.38 3k5o h ARG 380 Ca 0.34 -0.46 0.04 0.00 0.07 0.00 0.00 59.98 59.97 3k5o h ARG 380 Cb -0.12 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 29.93 3k5o h ARG 380 CO -0.08 1.09 0.17 1.98 -1.07 0.00 0.00 179.97 182.07 3k5o h MET 381 N 0.52 0.35 -0.46 0.04 4.05 -0.58 -0.59 114.93 118.26 3k5o h MET 381 Ca 0.03 -0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 59.38 3k5o h MET 381 Cb 1.02 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.72 3k5o h MET 381 CO 0.10 0.23 0.13 0.45 0.23 0.00 0.00 176.91 178.05 3k5o h HIS 382 N 0.36 0.76 0.00 1.39 3.86 -0.87 -1.47 115.15 119.18 3k5o h HIS 382 Ca 0.19 -0.08 -0.04 0.00 -1.16 0.00 0.00 60.37 59.28 3k5o h HIS 382 Cb 0.14 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.39 3k5o h HIS 382 CO -0.13 0.68 -0.17 0.00 0.86 0.00 0.00 177.93 179.17 3k5o h ARG 383 N 0.62 0.00 0.00 2.45 3.08 -0.99 0.24 114.38 119.77 3k5o h ARG 383 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 3k5o h ARG 383 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3k5o h ARG 383 CO -0.00 0.17 0.00 0.00 -1.07 0.00 0.00 179.97 179.07 3k5o n ALA 384 N -2.46 2.34 -0.04 0.04 0.00 -0.26 -4.90 120.51 115.23 3k5o n ALA 384 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3k5o n ALA 384 Cb 0.24 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.25 3k5o n ALA 384 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k5o n GLY 385 N 1.07 0.98 3.40 0.00 0.00 0.83 -5.06 105.19 106.40 3k5o n GLY 385 Ca 0.12 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 3k5o n GLY 385 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k5o s TYR 386 N -2.00 2.10 0.19 1.61 2.02 -0.59 -1.24 117.35 119.44 3k5o s TYR 386 Ca 0.00 -0.40 0.08 0.00 -0.37 0.00 0.00 57.07 56.38 3k5o s TYR 386 Cb 0.00 -1.00 -0.04 0.00 -0.40 0.00 0.00 41.96 40.52 3k5o s TYR 386 CO 0.00 0.49 -0.04 0.14 -1.57 0.00 0.00 175.55 174.57 3k5o s VAL 387 N -2.10 3.48 0.37 0.71 -7.23 -0.65 -3.31 120.40 111.66 3k5o s VAL 387 Ca 0.22 -1.58 -0.27 0.00 -1.81 0.00 0.00 61.98 58.55 3k5o s VAL 387 Cb -0.06 -2.75 -0.09 0.00 0.56 0.00 0.00 36.38 34.04 3k5o s VAL 387 CO 0.10 -0.14 1.20 0.00 -0.31 0.00 0.00 175.10 175.94 3k5o s ALA 388 N -1.79 3.27 0.61 1.32 0.00 -1.26 -4.25 121.76 119.65 3k5o s ALA 388 Ca 0.27 1.04 -0.15 0.00 0.00 0.00 0.00 51.96 53.12 3k5o s ALA 388 Cb -0.09 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 3k5o s ALA 388 CO 0.17 -0.52 1.06 -1.25 0.00 0.00 0.00 175.76 175.21 3k5o s PRO 389 N -2.06 3.25 0.60 0.00 0.04 -1.26 -4.37 135.00 131.20 3k5o s PRO 389 Ca 0.53 1.14 -0.07 0.00 0.04 0.00 0.00 61.00 62.65 3k5o s PRO 389 Cb -0.33 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.18 3k5o s PRO 389 CO 0.43 -0.86 0.93 -0.80 0.04 0.00 0.00 177.00 176.74 3k5o s ASN 390 N -3.01 5.64 0.55 6.66 0.02 -1.26 -4.81 114.94 118.73 3k5o s ASN 390 Ca 0.62 0.82 -0.19 0.00 -1.02 0.00 0.00 52.86 53.10 3k5o s ASN 390 Cb -0.15 -1.81 -0.05 0.00 0.02 0.00 0.00 41.25 39.25 3k5o s ASN 390 CO 0.41 -1.07 1.09 -0.22 0.02 0.00 0.00 177.10 177.33 3k5o s LEU 391 N -5.04 3.69 -1.37 0.60 2.96 -1.26 -4.31 118.68 113.95 3k5o s LEU 391 Ca 0.54 2.04 -0.07 0.00 -0.22 0.00 0.00 54.13 56.41 3k5o s LEU 391 Cb -0.11 -4.56 0.05 0.00 0.50 0.00 0.00 46.19 42.07 3k5o s LEU 391 CO 0.47 -1.15 0.51 0.61 -1.32 0.00 0.00 176.35 175.47 3k5o n GLY 392 N -0.20 -0.50 0.62 7.98 0.00 -1.26 -4.87 105.19 106.95 3k5o n GLY 392 Ca 0.10 0.10 0.06 0.00 0.00 0.00 0.00 46.02 46.28 3k5o n GLY 392 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k5o n GLU 393 N -3.80 2.44 -3.94 1.61 1.02 -1.26 -4.87 120.64 111.83 3k5o n GLU 393 Ca -0.05 -1.90 -0.30 0.00 -0.02 0.00 0.00 57.16 54.88 3k5o n GLU 393 Cb 0.57 -1.27 -0.15 0.00 -0.02 0.00 0.00 31.44 30.57 3k5o n GLU 393 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3k5o s VAL 394 N -0.99 1.59 0.32 2.62 1.01 -1.26 -5.11 120.40 118.58 3k5o s VAL 394 Ca 0.22 -1.34 -0.29 0.00 0.00 0.00 0.00 61.98 60.57 3k5o s VAL 394 Cb 0.12 -1.89 -0.11 0.00 0.00 0.00 0.00 36.38 34.51 3k5o s VAL 394 CO 0.16 -0.16 1.45 -2.84 0.00 0.00 0.00 175.10 173.71 3k5o s PRO 395 N 1.35 4.21 0.66 2.72 0.02 -1.26 -4.95 135.00 137.74 3k5o s PRO 395 Ca -0.04 2.42 -0.14 0.00 0.02 0.00 0.00 61.00 63.26 3k5o s PRO 395 Cb -0.19 -3.03 -0.00 0.00 0.02 0.00 0.00 34.50 31.29 3k5o s PRO 395 CO -0.07 -0.44 1.08 -1.25 -0.33 0.00 0.00 177.00 175.99 3k5o s PRO 396 N -1.37 2.93 0.35 5.54 0.04 -1.26 -4.79 135.00 136.44 3k5o s PRO 396 Ca 0.55 1.24 0.09 0.00 0.04 0.00 0.00 61.00 62.92 3k5o s PRO 396 Cb -0.44 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.06 3k5o s PRO 396 CO 0.54 -1.13 -0.03 -1.01 0.04 0.00 0.00 177.00 175.41 3k5o s HIS 397 N -2.54 2.48 0.25 0.56 3.76 -1.26 -5.07 115.29 113.47 3k5o s HIS 397 Ca 0.64 -0.50 -0.31 0.00 -0.15 0.00 0.00 55.06 54.74 3k5o s HIS 397 Cb -0.18 -1.50 -0.13 0.00 1.11 0.00 0.00 32.58 31.88 3k5o s HIS 397 CO 0.44 0.51 1.35 0.00 -0.85 0.00 0.00 174.74 176.18 3k5o n ALA 398 N -0.90 0.93 -3.21 -1.40 0.00 -1.26 -4.94 120.51 109.73 3k5o n ALA 398 Ca -0.04 0.41 -0.33 0.00 0.00 0.00 0.00 53.44 53.47 3k5o n ALA 398 Cb 0.64 -2.24 -0.15 0.00 0.00 0.00 0.00 19.45 17.69 3k5o n ALA 398 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3k5o s SER 399 N 0.13 3.67 0.46 0.00 1.04 -1.26 -5.08 113.70 112.66 3k5o s SER 399 Ca 0.66 -0.43 -0.25 0.00 0.48 0.00 0.00 55.95 56.42 3k5o s SER 399 Cb -0.65 -1.54 -0.08 0.00 0.10 0.00 0.00 66.02 63.85 3k5o s SER 399 CO 0.52 0.14 1.37 -2.84 0.98 0.00 0.00 173.24 173.42 3k5o s PRO 400 N 0.47 3.64 0.52 4.02 0.02 -1.26 -5.04 135.00 137.37 3k5o s PRO 400 Ca -0.12 2.29 0.03 0.00 0.02 0.00 0.00 61.00 63.21 3k5o s PRO 400 Cb -0.16 -2.59 0.03 0.00 0.02 0.00 0.00 34.50 31.80 3k5o s PRO 400 CO 0.05 -0.80 0.21 0.41 -0.33 0.00 0.00 177.00 176.54 3k5o n GLY 401 N 0.62 3.15 3.67 0.52 0.00 -1.26 -4.96 105.19 106.92 3k5o n GLY 401 Ca 0.06 -2.33 -0.36 0.00 0.00 0.00 0.00 46.02 43.39 3k5o n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5o n GLY 402 N -1.27 -0.02 3.77 -0.02 0.00 -1.26 -4.94 105.19 101.44 3k5o n GLY 402 Ca -0.11 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.23 3k5o n GLY 402 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3k5o s TYR 403 N -1.68 2.49 -0.29 1.61 5.04 -1.26 -4.84 117.35 118.42 3k5o s TYR 403 Ca 0.77 1.25 0.00 0.00 -2.44 0.00 0.00 57.07 56.65 3k5o s TYR 403 Cb -0.36 -3.93 0.18 0.00 0.35 0.00 0.00 41.96 38.21 3k5o s TYR 403 CO 0.46 -2.92 0.56 0.08 -1.34 0.00 0.00 175.55 172.40 3k5o s VAL 404 N -1.19 -0.93 0.48 3.14 1.01 -1.26 -2.65 120.40 119.00 3k5o s VAL 404 Ca 0.59 -0.02 -0.06 0.00 0.00 0.00 0.00 61.98 62.49 3k5o s VAL 404 Cb -0.44 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 3k5o s VAL 404 CO 0.57 -0.03 0.80 0.00 0.00 0.00 0.00 175.10 176.44 3k5o s MET 405 N 2.80 3.58 0.33 2.72 0.23 -1.17 -5.03 119.30 122.76 3k5o s MET 405 Ca 0.17 0.27 -0.28 0.00 -1.03 0.00 0.00 55.69 54.83 3k5o s MET 405 Cb -0.14 -2.36 -0.09 0.00 -1.53 0.00 0.00 34.83 30.71 3k5o s MET 405 CO -0.22 -0.20 1.11 -0.51 -2.03 0.00 0.00 175.02 173.17 3k5o s ASP 406 N -3.98 7.02 0.78 -1.18 1.01 -1.26 -4.55 116.67 114.51 3k5o s ASP 406 Ca 0.48 2.26 -0.12 0.00 0.71 0.00 0.00 52.55 55.89 3k5o s ASP 406 Cb -0.10 -2.62 0.06 0.00 1.01 0.00 0.00 42.92 41.27 3k5o s ASP 406 CO 0.44 -0.32 1.12 -0.55 0.21 0.00 0.00 175.17 176.07 3k5o s SER 407 N -1.03 4.24 -0.65 0.27 0.15 -1.15 -4.75 113.70 110.79 3k5o s SER 407 Ca 0.49 2.00 0.05 0.00 0.70 0.00 0.00 55.95 59.19 3k5o s SER 407 Cb -0.30 -2.54 0.16 0.00 -1.71 0.00 0.00 66.02 61.63 3k5o s SER 407 CO 0.39 -2.21 0.44 -0.13 1.20 0.00 0.00 173.24 172.93 3k5o s ARG 408 N -4.58 2.23 0.61 5.44 0.52 -0.71 -4.79 118.95 117.67 3k5o s ARG 408 Ca 0.65 -3.11 -0.19 0.00 -0.52 0.00 0.00 55.73 52.57 3k5o s ARG 408 Cb -0.20 -3.20 -0.04 0.00 0.52 0.00 0.00 34.95 32.03 3k5o s ARG 408 CO 0.52 -1.27 1.08 -0.35 0.02 0.00 0.00 175.30 175.30 3k5o n PRO 409 N 2.24 1.02 -4.00 3.54 -0.04 -1.26 -4.88 135.00 131.63 3k5o n PRO 409 Ca 0.18 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 64.04 3k5o n PRO 409 Cb 0.36 -2.29 0.00 0.00 -0.04 0.00 0.00 33.50 31.53 3k5o n PRO 409 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3k5o n GLY 410 N 1.15 -2.08 3.23 0.55 0.00 0.16 -4.95 105.19 103.26 3k5o n GLY 410 Ca 0.14 -1.27 -0.32 0.00 0.00 0.00 0.00 46.02 44.56 3k5o n GLY 410 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k5o s LEU 411 N 0.00 2.19 0.23 0.99 2.96 -1.26 0.32 118.68 124.12 3k5o s LEU 411 Ca 0.00 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.40 3k5o s LEU 411 Cb 0.00 -1.45 -0.05 0.00 0.50 0.00 0.00 46.19 45.19 3k5o s LEU 411 CO 0.00 0.15 0.05 -0.31 -1.32 0.00 0.00 176.35 174.91 3k5o s TYR 412 N 0.44 1.48 -0.16 5.38 2.02 0.11 -4.98 117.35 121.64 3k5o s TYR 412 Ca -0.16 -1.07 -0.00 0.00 -0.37 0.00 0.00 57.07 55.47 3k5o s TYR 412 Cb -0.17 -0.87 -0.00 0.00 -0.40 0.00 0.00 41.96 40.52 3k5o s TYR 412 CO 0.07 -0.22 -0.14 -0.51 -1.57 0.00 0.00 175.55 173.17 3k5o s ASP 413 N -3.29 3.71 -0.17 2.29 1.01 -1.26 -1.21 116.67 117.76 3k5o s ASP 413 Ca 0.32 -0.47 -0.05 0.00 0.71 0.00 0.00 52.55 53.07 3k5o s ASP 413 Cb 0.07 -1.58 0.02 0.00 1.01 0.00 0.00 42.92 42.44 3k5o s ASP 413 CO 0.10 0.07 0.10 -1.20 0.21 0.00 0.00 175.17 174.46 3k5o n SER 414 N 4.15 -3.13 -4.02 0.27 7.64 0.10 -3.97 113.62 114.65 3k5o n SER 414 Ca -0.19 0.97 -0.24 0.00 1.01 0.00 0.00 58.87 60.42 3k5o n SER 414 Cb 0.52 -4.02 -0.16 0.00 -1.01 0.00 0.00 64.21 59.53 3k5o n SER 414 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3k5o s VAL 415 N -0.76 1.09 -0.05 0.44 1.01 -0.47 -1.79 120.40 119.87 3k5o s VAL 415 Ca -0.12 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.38 3k5o s VAL 415 Cb 0.01 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 3k5o s VAL 415 CO 0.56 0.34 0.05 -0.76 0.00 0.00 0.00 175.10 175.29 3k5o s LEU 416 N 0.57 3.81 -0.15 3.92 1.43 0.22 -0.93 118.68 127.56 3k5o s LEU 416 Ca -0.12 0.18 -0.03 0.00 -1.03 0.00 0.00 54.13 53.12 3k5o s LEU 416 Cb -0.15 -2.05 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 3k5o s LEU 416 CO 0.03 0.33 -0.05 -0.69 0.23 0.00 0.00 176.35 176.20 3k5o s VAL 417 N -1.04 3.79 -0.07 -1.59 1.01 0.17 0.13 120.40 122.80 3k5o s VAL 417 Ca 0.18 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.77 3k5o s VAL 417 Cb -0.12 -2.64 0.02 0.00 0.00 0.00 0.00 36.38 33.64 3k5o s VAL 417 CO 0.08 0.50 -0.08 -0.76 0.00 0.00 0.00 175.10 174.84 3k5o s LEU 418 N 0.28 1.37 0.06 3.92 1.43 -0.35 -1.34 118.68 124.04 3k5o s LEU 418 Ca -0.04 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 3k5o s LEU 418 Cb -0.14 -0.68 -0.03 0.00 0.03 0.00 0.00 46.19 45.37 3k5o s LEU 418 CO 0.03 -0.04 -0.08 1.51 0.23 0.00 0.00 176.35 178.00 3k5o s ASP 419 N 1.06 0.98 0.19 2.29 1.47 -0.51 -0.49 116.67 121.68 3k5o s ASP 419 Ca -0.08 -0.71 -0.30 0.00 1.18 0.00 0.00 52.55 52.64 3k5o s ASP 419 Cb -0.14 0.05 -0.08 0.00 -0.34 0.00 0.00 42.92 42.41 3k5o s ASP 419 CO -0.01 -0.29 1.18 -0.31 0.68 0.00 0.00 175.17 176.42 3k5o s TYR 420 N -2.16 3.46 -0.19 2.11 2.02 0.03 -0.89 117.35 121.73 3k5o s TYR 420 Ca -0.02 1.47 -0.29 0.00 -0.37 0.00 0.00 57.07 57.86 3k5o s TYR 420 Cb -0.05 -3.40 -0.01 0.00 -0.40 0.00 0.00 41.96 38.11 3k5o s TYR 420 CO -0.01 -1.06 1.21 0.21 -1.57 0.00 0.00 175.55 174.32 3k5o s LYS 421 N -0.38 4.22 -1.05 -0.62 2.20 -0.35 -4.04 119.74 119.72 3k5o s LYS 421 Ca 0.51 1.56 -0.22 0.00 -0.36 0.00 0.00 55.97 57.47 3k5o s LYS 421 Cb -0.32 -3.74 0.03 0.00 -1.51 0.00 0.00 37.83 32.29 3k5o s LYS 421 CO 0.37 -0.71 0.64 0.43 -0.36 0.00 0.00 175.35 175.72 3k5o n SER 422 N 6.59 -4.29 0.03 1.43 7.64 -1.26 -4.69 113.62 119.05 3k5o n SER 422 Ca 0.13 -1.18 -0.11 0.00 1.01 0.00 0.00 58.87 58.73 3k5o n SER 422 Cb 0.45 -1.56 -0.04 0.00 -1.01 0.00 0.00 64.21 62.05 3k5o n SER 422 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3k5o h LEU 423 N -1.71 -0.96 -0.57 -3.43 5.85 -1.96 -0.74 115.31 111.79 3k5o h LEU 423 Ca -0.68 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.17 3k5o h LEU 423 Cb 1.39 0.40 -0.03 0.00 0.37 0.00 0.00 40.66 42.79 3k5o h LEU 423 CO 0.46 -0.36 0.37 1.88 -0.34 0.00 0.00 178.44 180.44 3k5o h TYR 424 N -0.42 0.74 -0.62 1.25 0.05 -1.96 0.09 116.97 116.10 3k5o h TYR 424 Ca 0.08 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.82 3k5o h TYR 424 Cb 0.54 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 38.01 3k5o h TYR 424 CO -0.38 0.49 0.17 -1.35 -1.05 0.00 0.00 178.16 176.04 3k5o h PRO 425 N 0.78 0.96 -0.08 4.88 0.11 -1.81 -0.67 132.00 136.18 3k5o h PRO 425 Ca 0.21 -0.20 -0.06 0.00 0.11 0.00 0.00 66.00 66.06 3k5o h PRO 425 Cb -0.06 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 30.90 3k5o h PRO 425 CO -0.04 0.84 -0.22 0.66 -0.21 0.00 0.00 178.00 179.03 3k5o h SER 426 N 0.92 0.12 -0.02 -2.05 4.64 -0.40 -1.00 113.55 115.78 3k5o h SER 426 Ca 0.20 -0.03 -0.21 0.00 -0.47 0.00 0.00 61.79 61.28 3k5o h SER 426 Cb 0.30 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3k5o h SER 426 CO -0.00 0.35 -0.75 0.40 -0.87 0.00 0.00 176.83 175.96 3k5o h ILE 427 N 0.12 1.31 -0.75 0.95 2.04 -0.26 -1.05 117.51 119.88 3k5o h ILE 427 Ca 0.02 -2.01 -0.02 0.00 1.00 0.00 0.00 64.86 63.85 3k5o h ILE 427 Cb 0.46 2.00 -0.03 0.00 -0.74 0.00 0.00 36.82 38.51 3k5o h ILE 427 CO 0.03 0.63 0.38 0.40 0.00 0.00 0.00 178.15 179.59 3k5o h ILE 428 N 0.46 1.23 -0.22 -0.67 2.04 -0.49 0.72 117.51 120.58 3k5o h ILE 428 Ca -0.04 -0.63 -0.09 0.00 1.00 0.00 0.00 64.86 65.10 3k5o h ILE 428 Cb 1.36 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.71 3k5o h ILE 428 CO 0.15 0.27 -0.20 0.03 0.00 0.00 0.00 178.15 178.40 3k5o h ARG 429 N 1.04 0.53 -0.08 2.37 3.08 -1.14 -2.19 114.38 117.99 3k5o h ARG 429 Ca 0.26 -0.27 -0.11 0.00 0.07 0.00 0.00 59.98 59.92 3k5o h ARG 429 Cb 0.08 0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.14 3k5o h ARG 429 CO -0.04 0.85 -0.40 1.15 -1.07 0.00 0.00 179.97 180.46 3k5o h THR 430 N 0.22 1.41 -0.72 2.04 2.02 -1.02 -3.32 112.91 113.53 3k5o h THR 430 Ca 0.04 -1.78 0.00 0.00 0.77 0.00 0.00 66.41 65.44 3k5o h THR 430 Cb 0.74 2.30 0.00 0.00 -1.74 0.00 0.00 68.15 69.45 3k5o h THR 430 CO 0.05 0.52 0.00 0.49 0.37 0.00 0.00 175.52 176.95 3k5o n PHE 431 N -4.35 1.09 -3.70 3.16 3.72 0.23 -4.55 117.46 113.07 3k5o n PHE 431 Ca -0.08 -0.51 -0.28 0.00 -0.05 0.00 0.00 57.45 56.53 3k5o n PHE 431 Cb 0.55 -0.05 0.03 0.00 -0.94 0.00 0.00 39.48 39.06 3k5o n PHE 431 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3k5o n LEU 432 N 1.56 -2.49 -4.69 4.37 4.77 -0.84 -4.92 117.00 114.75 3k5o n LEU 432 Ca 0.25 -0.64 -0.42 0.00 -0.03 0.00 0.00 56.01 55.17 3k5o n LEU 432 Cb 0.68 -2.59 -0.03 0.00 -2.33 0.00 0.00 43.42 39.15 3k5o n LEU 432 CO 0.18 0.41 1.21 -0.63 -1.33 0.00 0.00 177.39 177.24 3k5o s ILE 433 N -3.23 3.35 -0.20 -0.08 -1.09 -1.09 -4.80 121.20 114.05 3k5o s ILE 433 Ca 0.58 0.79 -0.27 0.00 -2.23 0.00 0.00 60.65 59.52 3k5o s ILE 433 Cb -0.29 -3.51 0.09 0.00 -1.58 0.00 0.00 42.46 37.18 3k5o s ILE 433 CO 0.71 0.00 0.84 -0.62 -1.23 0.00 0.00 174.94 174.65 3k5o s ASP 434 N 2.03 -0.59 0.05 3.58 2.15 -1.26 -4.43 116.67 118.21 3k5o s ASP 434 Ca 0.69 0.96 -0.25 0.00 0.43 0.00 0.00 52.55 54.38 3k5o s ASP 434 Cb -0.36 0.91 -0.17 0.00 -0.30 0.00 0.00 42.92 43.01 3k5o s ASP 434 CO 0.29 -0.32 1.57 -0.65 -0.17 0.00 0.00 175.17 175.89 3k5o h PRO 435 N 3.94 -0.09 -0.66 4.34 0.11 -1.93 -0.56 132.00 137.16 3k5o h PRO 435 Ca -0.27 0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.76 3k5o h PRO 435 Cb 1.16 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 3k5o h PRO 435 CO 0.18 0.09 0.07 0.28 -0.21 0.00 0.00 178.00 178.41 3k5o h VAL 436 N -0.24 1.27 -0.47 3.15 2.07 -1.97 -2.83 116.25 117.22 3k5o h VAL 436 Ca -0.01 -1.09 0.01 0.00 0.82 0.00 0.00 66.70 66.44 3k5o h VAL 436 Cb 0.21 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 3k5o h VAL 436 CO 0.01 0.40 0.31 1.23 0.02 0.00 0.00 177.57 179.55 3k5o h GLY 437 N 1.03 0.65 0.96 2.17 0.00 -1.65 -0.92 103.07 105.31 3k5o h GLY 437 Ca 0.19 -0.24 -0.11 0.00 0.00 0.00 0.00 47.33 47.18 3k5o h GLY 437 CO 0.02 0.22 -0.24 -2.00 0.00 0.00 0.00 176.54 174.54 3k5o h LEU 438 N 0.61 0.73 -0.50 3.11 5.85 -0.86 0.48 115.31 124.73 3k5o h LEU 438 Ca 0.18 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.44 3k5o h LEU 438 Cb -0.02 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 3k5o h LEU 438 CO -0.04 1.03 0.27 0.58 -0.34 0.00 0.00 178.44 179.94 3k5o h VAL 439 N 0.44 1.17 -0.30 1.05 2.07 -1.23 0.03 116.25 119.49 3k5o h VAL 439 Ca 0.05 -0.44 -0.17 0.00 0.82 0.00 0.00 66.70 66.97 3k5o h VAL 439 Cb 0.80 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 3k5o h VAL 439 CO 0.06 0.18 -0.47 -0.33 0.02 0.00 0.00 177.57 177.03 3k5o h GLU 440 N 0.66 0.85 -0.72 1.57 4.39 -1.11 -3.22 114.58 117.01 3k5o h GLU 440 Ca 0.18 -0.51 -0.04 0.00 0.34 0.00 0.00 59.36 59.32 3k5o h GLU 440 Cb 0.05 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.72 3k5o h GLU 440 CO -0.03 1.15 0.30 0.78 -1.16 0.00 0.00 179.01 180.05 3k5o h GLY 441 N 0.63 1.14 2.00 -3.84 0.00 0.19 -2.56 103.07 100.63 3k5o h GLY 441 Ca 0.03 -0.61 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 3k5o h GLY 441 CO 0.11 0.58 -0.13 -0.33 0.00 0.00 0.00 176.54 176.76 3k5o h MET 442 N 1.02 0.00 -0.19 4.80 2.86 -0.97 -1.85 114.93 120.60 3k5o h MET 442 Ca 0.24 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.75 3k5o h MET 442 Cb 0.19 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 3k5o h MET 442 CO -0.02 0.13 -0.42 0.00 1.06 0.00 0.00 176.91 177.66 3k5o h ALA 443 N 1.87 0.91 -2.21 6.32 0.00 -1.47 -3.33 119.26 121.35 3k5o h ALA 443 Ca -0.00 -0.44 -0.59 0.00 0.00 0.00 0.00 54.91 53.88 3k5o h ALA 443 Cb 0.32 -0.10 -0.41 0.00 0.00 0.00 0.00 17.79 17.60 3k5o h ALA 443 CO 0.02 0.64 -0.82 1.04 0.00 0.00 0.00 179.25 180.13 3k5o n GLN 444 N -4.02 1.58 -1.23 0.00 6.02 -0.76 -5.03 117.38 113.95 3k5o n GLN 444 Ca -0.02 -3.98 -0.36 0.00 -0.01 0.00 0.00 57.00 52.63 3k5o n GLN 444 Cb 0.52 -1.81 -0.02 0.00 1.02 0.00 0.00 30.24 29.94 3k5o n GLN 444 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 3k5o n PRO 445 N 1.32 2.76 -4.17 -1.09 -0.04 -0.82 -4.18 135.00 128.79 3k5o n PRO 445 Ca 0.26 -2.04 -0.11 0.00 -0.04 0.00 0.00 63.50 61.57 3k5o n PRO 445 Cb 0.46 -2.84 -0.10 0.00 -0.04 0.00 0.00 33.50 30.98 3k5o n PRO 445 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 3k5o s ASP 446 N 3.14 1.16 0.63 3.54 1.47 -1.26 -5.03 116.67 120.33 3k5o s ASP 446 Ca 0.55 -0.99 0.40 0.00 1.18 0.00 0.00 52.55 53.69 3k5o s ASP 446 Cb 0.14 0.09 2.16 0.00 -0.34 0.00 0.00 42.92 44.97 3k5o s ASP 446 CO -0.03 -0.45 2.29 -0.65 0.68 0.00 0.00 175.17 177.01 3k5o h PRO 447 N 3.01 0.00 0.15 2.11 0.11 -1.90 0.87 132.00 136.35 3k5o h PRO 447 Ca -0.35 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.54 3k5o h PRO 447 Cb 1.17 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.30 3k5o h PRO 447 CO 0.64 0.01 -0.99 1.49 -0.21 0.00 0.00 178.00 178.93 3k5o h GLU 448 N 0.00 0.31 0.00 1.05 4.81 -1.97 -3.37 114.58 115.41 3k5o h GLU 448 Ca -0.00 -0.53 -0.12 0.00 -0.13 0.00 0.00 59.36 58.58 3k5o h GLU 448 Cb 0.09 0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 3k5o h GLU 448 CO 0.00 1.25 -1.50 0.72 -0.73 0.00 0.00 179.01 178.75 3k5o n HIS 449 N -4.05 0.74 -4.28 0.92 8.25 -1.19 -4.93 115.22 110.68 3k5o n HIS 449 Ca -0.16 0.24 -0.17 0.00 -0.26 0.00 0.00 57.72 57.36 3k5o n HIS 449 Cb 0.86 -0.96 -0.09 0.00 1.12 0.00 0.00 29.99 30.92 3k5o n HIS 449 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3k5o s SER 450 N -5.47 1.24 -0.04 0.41 0.01 0.29 -1.04 113.70 109.11 3k5o s SER 450 Ca -0.04 -1.59 0.02 0.00 1.31 0.00 0.00 55.95 55.65 3k5o s SER 450 Cb 0.09 0.45 0.01 0.00 0.21 0.00 0.00 66.02 66.79 3k5o s SER 450 CO 0.82 -0.94 -0.09 0.28 0.41 0.00 0.00 173.24 173.72 3k5o s THR 451 N -3.69 0.80 0.02 1.44 -1.32 0.12 -3.96 115.64 109.05 3k5o s THR 451 Ca 0.38 -0.33 -0.25 0.00 -1.21 0.00 0.00 61.69 60.28 3k5o s THR 451 Cb 0.04 -0.73 -0.05 0.00 -1.51 0.00 0.00 72.50 70.25 3k5o s THR 451 CO 0.20 0.26 0.76 -0.70 -2.21 0.00 0.00 174.62 172.93 3k5o s GLU 452 N 0.41 4.48 0.00 7.08 2.12 -1.26 -0.81 118.70 130.72 3k5o s GLU 452 Ca -0.07 1.04 0.00 0.00 0.36 0.00 0.00 54.97 56.30 3k5o s GLU 452 Cb -0.11 -3.38 0.00 0.00 0.26 0.00 0.00 34.13 30.90 3k5o s GLU 452 CO 0.01 0.23 0.00 0.41 -0.54 0.00 0.00 175.26 175.37 3k5o n GLY 453 N 2.53 1.01 3.65 -1.50 0.00 -0.14 -4.98 105.19 105.75 3k5o n GLY 453 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 3k5o n GLY 453 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3k5o n PHE 454 N 0.00 1.05 -1.60 1.61 7.35 -1.26 -4.68 117.46 119.93 3k5o n PHE 454 Ca 0.00 0.41 -0.64 0.00 -0.76 0.00 0.00 57.45 56.46 3k5o n PHE 454 Cb 0.00 -2.14 -0.10 0.00 0.35 0.00 0.00 39.48 37.59 3k5o n PHE 454 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 3k5o n LEU 455 N -1.60 1.09 0.00 -2.13 7.94 -1.26 -0.34 117.00 120.70 3k5o n LEU 455 Ca 0.14 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 56.10 3k5o n LEU 455 Cb 0.49 -0.86 0.00 0.00 0.53 0.00 0.00 43.42 43.58 3k5o n LEU 455 CO 0.48 -0.80 0.00 0.47 -1.11 0.00 0.00 177.39 176.43 3k5o n ASP 456 N 4.55 -1.42 -4.62 1.96 8.00 -1.26 -4.99 116.55 118.76 3k5o n ASP 456 Ca 0.35 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.44 3k5o n ASP 456 Cb -0.05 -1.28 -0.06 0.00 -0.02 0.00 0.00 41.12 39.70 3k5o n ASP 456 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k5o s ALA 457 N -2.36 3.60 -0.10 2.24 0.00 0.54 -5.00 121.76 120.68 3k5o s ALA 457 Ca 0.00 -0.48 0.01 0.00 0.00 0.00 0.00 51.96 51.49 3k5o s ALA 457 Cb 0.00 -3.03 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 3k5o s ALA 457 CO 0.00 -0.84 -0.11 -1.58 0.00 0.00 0.00 175.76 173.22 3k5o s TRP 458 N 2.51 2.82 -0.16 0.00 0.52 -1.26 -0.97 118.94 122.40 3k5o s TRP 458 Ca 0.26 -0.35 -0.01 0.00 0.02 0.00 0.00 56.10 56.02 3k5o s TRP 458 Cb -0.15 -1.77 -0.01 0.00 -1.15 0.00 0.00 33.47 30.39 3k5o s TRP 458 CO 0.09 0.02 -0.13 -0.06 0.02 0.00 0.00 176.95 176.89 3k5o s PHE 459 N -0.17 2.83 0.33 -1.98 0.08 0.01 -3.27 117.98 115.81 3k5o s PHE 459 Ca 0.00 -0.86 -0.29 0.00 0.12 0.00 0.00 56.93 55.90 3k5o s PHE 459 Cb -0.13 -1.91 -0.11 0.00 -0.57 0.00 0.00 43.02 40.30 3k5o s PHE 459 CO 0.03 -0.38 1.50 0.45 -0.10 0.00 0.00 175.22 176.72 3k5o s SER 460 N 0.74 6.43 0.04 1.36 0.15 -0.58 0.10 113.70 121.94 3k5o s SER 460 Ca -0.05 2.94 0.10 0.00 0.70 0.00 0.00 55.95 59.63 3k5o s SER 460 Cb -0.15 -2.65 -0.22 0.00 -1.71 0.00 0.00 66.02 61.29 3k5o s SER 460 CO 0.01 -0.83 0.98 0.03 1.20 0.00 0.00 173.24 174.63 3k5o h ARG 461 N 3.83 0.00 0.01 5.44 3.08 -1.42 -3.39 114.38 121.94 3k5o h ARG 461 Ca -0.49 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.26 3k5o h ARG 461 Cb 1.23 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.23 3k5o h ARG 461 CO 0.70 0.75 -1.79 0.39 -1.07 0.00 0.00 179.97 178.95 3k5o n GLU 462 N -3.20 0.65 -3.86 0.04 4.71 -1.26 -4.87 120.64 112.86 3k5o n GLU 462 Ca -0.08 0.27 -0.29 0.00 -0.01 0.00 0.00 57.16 57.05 3k5o n GLU 462 Cb 0.99 -1.77 -0.16 0.00 -1.01 0.00 0.00 31.44 29.50 3k5o n GLU 462 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 3k5o s LYS 463 N -2.59 1.23 0.21 3.49 2.20 -1.26 -5.10 119.74 117.92 3k5o s LYS 463 Ca -0.07 -0.73 -0.20 0.00 -0.36 0.00 0.00 55.97 54.62 3k5o s LYS 463 Cb 0.08 -2.35 0.04 0.00 -1.51 0.00 0.00 37.83 34.08 3k5o s LYS 463 CO 0.82 -0.60 0.60 -3.38 -0.36 0.00 0.00 175.35 172.43 3k5o s HIS 464 N 1.60 -0.23 0.00 4.03 -3.43 -1.26 -3.93 115.29 112.06 3k5o s HIS 464 Ca -0.03 -0.11 0.00 0.00 -0.80 0.00 0.00 55.06 54.12 3k5o s HIS 464 Cb -0.18 0.52 0.00 0.00 -1.43 0.00 0.00 32.58 31.49 3k5o s HIS 464 CO -0.07 -0.99 0.00 0.00 -2.00 0.00 0.00 174.74 171.68 3k5o h LEU 466 N 0.00 0.82 -0.91 0.00 5.85 -1.97 -2.42 115.31 116.69 3k5o h LEU 466 Ca 0.00 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.63 3k5o h LEU 466 Cb 0.89 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.65 3k5o h LEU 466 CO 0.00 0.78 0.59 -0.65 -0.34 0.00 0.00 178.44 178.82 3k5o h PRO 467 N 0.86 1.09 -0.36 5.25 0.11 -1.80 0.90 132.00 138.06 3k5o h PRO 467 Ca 0.19 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.18 3k5o h PRO 467 Cb 0.25 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 3k5o h PRO 467 CO -0.01 0.72 0.01 0.93 -0.21 0.00 0.00 178.00 179.44 3k5o h GLU 468 N 1.12 0.63 -0.50 1.05 3.07 -1.81 -1.16 114.58 116.99 3k5o h GLU 468 Ca 0.37 -0.20 -0.02 0.00 -0.50 0.00 0.00 59.36 59.02 3k5o h GLU 468 Cb 0.04 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.87 3k5o h GLU 468 CO -0.13 0.74 0.25 0.82 -1.40 0.00 0.00 179.01 179.28 3k5o h ILE 469 N 0.45 1.19 -0.41 3.13 2.04 -0.94 -1.21 117.51 121.75 3k5o h ILE 469 Ca 0.10 -0.53 -0.10 0.00 1.00 0.00 0.00 64.86 65.33 3k5o h ILE 469 Cb 0.45 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3k5o h ILE 469 CO 0.02 0.21 -0.13 0.58 0.00 0.00 0.00 178.15 178.83 3k5o h VAL 470 N 0.67 1.28 -0.12 1.67 2.07 -0.79 -2.01 116.25 119.01 3k5o h VAL 470 Ca 0.17 -1.24 0.01 0.00 0.82 0.00 0.00 66.70 66.46 3k5o h VAL 470 Cb 0.11 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3k5o h VAL 470 CO -0.02 0.42 0.06 0.74 0.02 0.00 0.00 177.57 178.79 3k5o h THR 471 N 0.63 1.00 -0.24 2.57 2.02 -0.96 0.86 112.91 118.79 3k5o h THR 471 Ca 0.10 -0.05 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 3k5o h THR 471 Cb 0.67 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 3k5o h THR 471 CO 0.05 0.02 0.03 0.78 0.37 0.00 0.00 175.52 176.77 3k5o h ASN 472 N 0.13 0.31 -0.25 4.18 2.35 -1.17 0.65 115.58 121.78 3k5o h ASN 472 Ca 0.05 -0.04 -0.16 0.00 -0.55 0.00 0.00 56.30 55.60 3k5o h ASN 472 Cb 0.01 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.30 3k5o h ASN 472 CO -0.03 0.35 -0.48 0.40 -1.65 0.00 0.00 177.43 176.01 3k5o h ILE 473 N 0.34 1.30 -0.23 2.81 2.04 -0.67 0.10 117.51 123.21 3k5o h ILE 473 Ca 0.08 -1.68 -0.01 0.00 1.00 0.00 0.00 64.86 64.25 3k5o h ILE 473 Cb 0.18 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 3k5o h ILE 473 CO 0.00 0.54 0.11 -0.25 0.00 0.00 0.00 178.15 178.55 3k5o h TRP 474 N 0.51 0.32 -0.53 1.37 2.91 -0.32 0.18 115.95 120.40 3k5o h TRP 474 Ca 0.01 -0.01 -0.08 0.00 1.13 0.00 0.00 58.89 59.94 3k5o h TRP 474 Cb 1.09 -0.10 -0.02 0.00 -0.51 0.00 0.00 29.16 29.61 3k5o h TRP 474 CO 0.08 0.31 0.01 0.45 -1.03 0.00 0.00 178.44 178.27 3k5o h HIS 475 N 0.24 0.96 -0.67 2.65 3.86 -0.90 -0.73 115.15 120.55 3k5o h HIS 475 Ca 0.08 -0.14 -0.07 0.00 -1.16 0.00 0.00 60.37 59.08 3k5o h HIS 475 Cb 0.11 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.29 3k5o h HIS 475 CO -0.03 0.86 0.16 0.78 0.86 0.00 0.00 177.93 180.56 3k5o h GLY 476 N 0.99 1.16 1.14 2.45 0.00 -0.54 -1.40 103.07 106.87 3k5o h GLY 476 Ca 0.16 -0.74 -0.12 0.00 0.00 0.00 0.00 47.33 46.63 3k5o h GLY 476 CO 0.02 0.68 -0.15 -0.09 0.00 0.00 0.00 176.54 177.00 3k5o h ARG 477 N 1.01 1.00 -0.59 4.80 2.43 -0.18 -0.61 114.38 122.24 3k5o h ARG 477 Ca 0.21 -0.39 -0.09 0.00 -0.81 0.00 0.00 59.98 58.90 3k5o h ARG 477 Cb 0.38 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 3k5o h ARG 477 CO 0.00 1.07 -0.00 -0.44 -1.51 0.00 0.00 179.97 179.09 3k5o h ASP 478 N 0.87 1.00 -0.51 -3.80 3.32 -0.93 0.24 116.42 116.62 3k5o h ASP 478 Ca 0.13 -0.28 -0.08 0.00 0.02 0.00 0.00 57.03 56.81 3k5o h ASP 478 Cb 0.72 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 3k5o h ASP 478 CO 0.06 1.06 0.01 -0.08 -1.72 0.00 0.00 179.24 178.57 3k5o h GLU 479 N 0.94 0.94 -0.59 3.56 4.57 -1.07 -0.54 114.58 122.39 3k5o h GLU 479 Ca 0.17 -0.27 -0.04 0.00 -1.18 0.00 0.00 59.36 58.03 3k5o h GLU 479 Cb 0.54 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.01 3k5o h GLU 479 CO 0.03 0.92 0.20 0.00 -1.18 0.00 0.00 179.01 178.98 3k5o h ALA 480 N 1.14 0.77 -0.36 2.92 0.00 -0.74 -2.04 119.26 120.95 3k5o h ALA 480 Ca 0.16 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3k5o h ALA 480 Cb 0.49 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3k5o h ALA 480 CO 0.02 0.43 0.21 -0.22 0.00 0.00 0.00 179.25 179.69 3k5o h LYS 481 N 0.83 0.50 -0.30 0.00 3.64 -0.61 -1.31 116.57 119.32 3k5o h LYS 481 Ca 0.19 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 3k5o h LYS 481 Cb 0.26 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 3k5o h LYS 481 CO -0.01 0.39 0.16 -0.09 -2.27 0.00 0.00 179.45 177.63 3k5o h ARG 482 N 0.47 0.41 -0.29 1.90 2.43 -0.84 -1.83 114.38 116.63 3k5o h ARG 482 Ca 0.13 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 3k5o h ARG 482 Cb 0.03 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 3k5o h ARG 482 CO -0.02 0.32 0.00 1.04 -1.51 0.00 0.00 179.97 179.79 3k5o n GLN 483 N -4.45 1.81 -1.77 0.20 6.02 -0.79 -4.92 117.38 113.49 3k5o n GLN 483 Ca 0.01 -1.24 -0.17 0.00 -0.01 0.00 0.00 57.00 55.59 3k5o n GLN 483 Cb 0.10 -1.33 -0.05 0.00 1.02 0.00 0.00 30.24 29.98 3k5o n GLN 483 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3k5o n GLY 484 N 1.11 0.98 3.44 1.08 0.00 -0.69 -4.91 105.19 106.19 3k5o n GLY 484 Ca 0.14 -0.22 -0.44 0.00 0.00 0.00 0.00 46.02 45.50 3k5o n GLY 484 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3k5o s ASN 485 N -2.63 6.79 0.08 1.61 3.84 -0.55 -4.89 114.94 119.18 3k5o s ASN 485 Ca 0.00 -2.42 -0.23 0.00 0.21 0.00 0.00 52.86 50.42 3k5o s ASN 485 Cb 0.00 -2.37 -0.14 0.00 -0.55 0.00 0.00 41.25 38.19 3k5o s ASN 485 CO 0.00 -0.90 1.67 0.50 -2.79 0.00 0.00 177.10 175.58 3k5o h LYS 486 N 8.20 0.06 -0.86 0.43 3.64 -1.91 -1.89 116.57 124.24 3k5o h LYS 486 Ca 0.19 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 3k5o h LYS 486 Cb 0.98 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.75 3k5o h LYS 486 CO 1.10 0.12 0.47 -1.00 -2.27 0.00 0.00 179.45 177.88 3k5o h PRO 487 N -0.02 1.20 -0.43 1.90 0.13 -1.94 0.60 132.00 133.44 3k5o h PRO 487 Ca 0.01 -0.14 -0.05 0.00 -0.87 0.00 0.00 66.00 64.96 3k5o h PRO 487 Cb 0.08 -0.24 -0.02 0.00 0.13 0.00 0.00 31.00 30.96 3k5o h PRO 487 CO -0.00 0.87 0.07 1.25 -0.23 0.00 0.00 178.00 179.96 3k5o h LEU 488 N 1.20 0.68 -1.08 1.56 5.85 -1.90 -1.44 115.31 120.18 3k5o h LEU 488 Ca 0.30 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.77 3k5o h LEU 488 Cb 0.02 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 3k5o h LEU 488 CO -0.05 0.77 0.62 -1.28 -0.34 0.00 0.00 178.44 178.16 3k5o h SER 489 N 0.56 1.08 0.05 1.25 0.87 -0.90 -0.08 113.55 116.38 3k5o h SER 489 Ca 0.13 -0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.66 3k5o h SER 489 Cb 0.38 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 3k5o h SER 489 CO 0.01 0.78 -0.03 -0.61 -0.53 0.00 0.00 176.83 176.45 3k5o h GLN 490 N 1.27 -0.07 -0.60 2.24 4.15 -0.69 -1.95 115.11 119.47 3k5o h GLN 490 Ca 0.34 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.79 3k5o h GLN 490 Cb -0.15 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.52 3k5o h GLN 490 CO -0.07 0.23 0.37 0.00 -1.93 0.00 0.00 178.83 177.43 3k5o h ALA 491 N 0.55 0.77 -0.69 3.38 0.00 -0.98 -0.33 119.26 121.97 3k5o h ALA 491 Ca -0.01 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3k5o h ALA 491 Cb 0.33 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3k5o h ALA 491 CO 0.01 0.12 0.25 -0.07 0.00 0.00 0.00 179.25 179.56 3k5o h LEU 492 N 0.74 0.95 -0.29 0.00 3.38 -1.00 -2.41 115.31 116.67 3k5o h LEU 492 Ca 0.24 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 3k5o h LEU 492 Cb -0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 3k5o h LEU 492 CO -0.09 0.87 -0.03 0.50 0.09 0.00 0.00 178.44 179.77 3k5o h LYS 493 N 1.00 0.54 -0.45 1.13 3.64 -0.80 -2.74 116.57 118.90 3k5o h LYS 493 Ca 0.23 -0.19 0.02 0.00 -1.27 0.00 0.00 60.65 59.43 3k5o h LYS 493 Cb 0.23 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 3k5o h LYS 493 CO -0.01 0.71 0.28 0.82 -2.27 0.00 0.00 179.45 178.97 3k5o h ILE 494 N 0.32 1.07 -0.46 2.00 2.04 -0.86 -2.31 117.51 119.31 3k5o h ILE 494 Ca 0.08 -0.19 -0.11 0.00 1.00 0.00 0.00 64.86 65.63 3k5o h ILE 494 Cb 0.49 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 3k5o h ILE 494 CO 0.02 0.10 -0.17 -0.29 0.00 0.00 0.00 178.15 177.81 3k5o h ILE 495 N 0.56 1.27 -0.45 -0.67 2.10 -1.47 -2.52 117.51 116.33 3k5o h ILE 495 Ca 0.17 -1.30 0.01 0.00 1.08 0.00 0.00 64.86 64.82 3k5o h ILE 495 Cb -0.01 1.10 -0.02 0.00 -1.09 0.00 0.00 36.82 36.79 3k5o h ILE 495 CO -0.07 0.45 0.29 -0.03 -1.08 0.00 0.00 178.15 177.71 3k5o h MET 496 N 0.78 0.57 -0.03 2.19 4.05 -1.28 -2.00 114.93 119.22 3k5o h MET 496 Ca 0.11 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.50 3k5o h MET 496 Cb 0.71 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.38 3k5o h MET 496 CO 0.05 0.38 0.00 0.09 0.23 0.00 0.00 176.91 177.66 3k5o n ASN 497 N -4.79 0.50 0.07 1.39 3.02 -0.89 -2.89 115.26 111.66 3k5o n ASN 497 Ca 0.02 -1.32 0.12 0.00 -0.03 0.00 0.00 54.58 53.36 3k5o n ASN 497 Cb 0.03 -0.02 0.09 0.00 -0.61 0.00 0.00 39.78 39.28 3k5o n ASN 497 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k5o n ALA 498 N -0.54 2.88 -0.30 5.41 0.00 -0.76 -4.31 120.51 122.90 3k5o n ALA 498 Ca 0.19 -0.27 -0.03 0.00 0.00 0.00 0.00 53.44 53.32 3k5o n ALA 498 Cb 0.17 -1.11 0.12 0.00 0.00 0.00 0.00 19.45 18.63 3k5o n ALA 498 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3k5o h PHE 499 N 0.00 1.16 0.09 0.00 0.04 -1.46 -2.09 116.94 114.67 3k5o h PHE 499 Ca 0.00 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.75 3k5o h PHE 499 Cb 0.83 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 38.60 3k5o h PHE 499 CO 0.00 0.80 -0.09 -0.92 -0.60 0.00 0.00 178.31 177.50 3k5o h TYR 500 N 1.18 -0.24 -0.89 -0.55 3.20 -1.81 -1.23 116.97 116.63 3k5o h TYR 500 Ca 0.30 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.22 3k5o h TYR 500 Cb 0.04 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.34 3k5o h TYR 500 CO 0.01 -0.14 0.58 0.78 -1.64 0.00 0.00 178.16 177.75 3k5o h GLY 501 N -0.20 1.28 0.82 1.82 0.00 -1.76 -1.86 103.07 103.17 3k5o h GLY 501 Ca 0.01 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 3k5o h GLY 501 CO -0.03 0.33 0.02 -2.08 0.00 0.00 0.00 176.54 174.78 3k5o h VAL 502 N 1.05 1.23 0.00 4.60 2.07 -1.00 -2.89 116.25 121.30 3k5o h VAL 502 Ca 0.37 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 3k5o h VAL 502 Cb 0.12 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 3k5o h VAL 502 CO -0.13 0.23 -0.10 -0.07 0.02 0.00 0.00 177.57 177.52 3k5o h LEU 503 N 0.08 0.00 -1.32 2.57 3.38 -0.92 -2.87 115.31 116.23 3k5o h LEU 503 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3k5o h LEU 503 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3k5o h LEU 503 CO 0.00 0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.24 3k5o n GLY 504 N -0.52 0.51 3.53 0.83 0.00 -0.73 -4.30 105.19 104.51 3k5o n GLY 504 Ca -0.01 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.19 3k5o n GLY 504 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3k5o s THR 505 N -1.77 3.39 -1.04 2.61 -1.32 -1.08 -4.97 115.64 111.45 3k5o s THR 505 Ca 0.34 -0.60 0.13 0.00 -1.21 0.00 0.00 61.69 60.35 3k5o s THR 505 Cb 0.19 -2.36 0.12 0.00 -1.51 0.00 0.00 72.50 68.94 3k5o s THR 505 CO 0.28 0.59 1.41 0.35 -2.21 0.00 0.00 174.62 175.04 3k5o n THR 506 N 2.30 1.07 0.53 5.08 -2.24 -1.26 -1.87 114.28 117.89 3k5o n THR 506 Ca -0.18 0.27 0.11 0.00 -2.27 0.00 0.00 64.05 61.98 3k5o n THR 506 Cb 0.53 -1.04 0.44 0.00 -2.10 0.00 0.00 70.33 68.16 3k5o n THR 506 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k5o n ALA 507 N -1.48 1.85 -2.79 6.98 0.00 -1.26 -4.29 120.51 119.52 3k5o n ALA 507 Ca 0.03 0.01 -0.35 0.00 0.00 0.00 0.00 53.44 53.14 3k5o n ALA 507 Cb 0.15 -1.37 -0.09 0.00 0.00 0.00 0.00 19.45 18.13 3k5o n ALA 507 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k5o h ARG 509 N 6.59 0.00 -0.01 0.00 0.11 -1.87 -1.54 114.38 117.67 3k5o h ARG 509 Ca -0.39 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.69 3k5o h ARG 509 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 3k5o h ARG 509 CO 0.72 0.00 -0.02 1.19 0.10 0.00 0.00 179.97 181.96 3k5o n PHE 510 N -3.37 0.00 -1.67 4.08 3.72 -1.26 -4.66 117.46 114.30 3k5o n PHE 510 Ca -0.03 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 56.92 3k5o n PHE 510 Cb 0.08 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.56 3k5o n PHE 510 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3k5o n PHE 511 N -0.27 2.20 -3.66 1.38 7.35 -0.58 -4.94 117.46 118.93 3k5o n PHE 511 Ca 0.20 0.37 -0.07 0.00 -0.76 0.00 0.00 57.45 57.19 3k5o n PHE 511 Cb 0.28 -2.49 -0.08 0.00 0.35 0.00 0.00 39.48 37.54 3k5o n PHE 511 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3k5o s ASP 512 N 0.54 -0.74 0.47 -2.13 2.15 -1.26 -4.84 116.67 110.87 3k5o s ASP 512 Ca 0.73 1.27 0.27 0.00 0.43 0.00 0.00 52.55 55.25 3k5o s ASP 512 Cb -0.67 1.44 1.33 0.00 -0.30 0.00 0.00 42.92 44.72 3k5o s ASP 512 CO 0.45 -0.22 1.81 -0.65 -0.17 0.00 0.00 175.17 176.39 3k5o h PRO 513 N 7.51 0.18 0.00 4.34 0.11 -1.90 -0.84 132.00 141.40 3k5o h PRO 513 Ca -0.26 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.81 3k5o h PRO 513 Cb 1.16 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3k5o h PRO 513 CO 0.17 0.12 -0.12 0.00 -0.21 0.00 0.00 178.00 177.96 3k5o h ARG 514 N 0.19 0.00 0.31 1.05 3.08 -1.97 -2.25 114.38 114.78 3k5o h ARG 514 Ca 0.54 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.58 3k5o h ARG 514 Cb 1.78 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.83 3k5o h ARG 514 CO -0.14 0.12 -0.15 -0.07 -1.07 0.00 0.00 179.97 178.67 3k5o h LEU 515 N 0.00 -0.35 -0.81 3.04 3.38 -1.50 -2.24 115.31 116.83 3k5o h LEU 515 Ca -0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3k5o h LEU 515 Cb 0.43 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3k5o h LEU 515 CO 0.02 0.11 0.05 0.00 0.09 0.00 0.00 178.44 178.70 3k5o h ALA 516 N -1.07 1.01 -0.96 1.53 0.00 -1.69 -2.56 119.26 115.53 3k5o h ALA 516 Ca -0.04 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.60 3k5o h ALA 516 Cb 0.34 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3k5o h ALA 516 CO 0.07 0.62 0.62 0.77 0.00 0.00 0.00 179.25 181.33 3k5o h SER 517 N 0.88 1.11 -0.42 0.00 0.02 -1.52 0.51 113.55 114.13 3k5o h SER 517 Ca 0.17 -0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 61.03 3k5o h SER 517 Cb 0.45 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 3k5o h SER 517 CO 0.02 0.82 0.09 0.28 -1.14 0.00 0.00 176.83 176.89 3k5o h SER 518 N 1.31 0.71 -0.03 3.07 0.02 -1.06 -0.13 113.55 117.43 3k5o h SER 518 Ca 0.35 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 3k5o h SER 518 Cb -0.13 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.23 3k5o h SER 518 CO -0.07 0.72 -0.09 0.40 -1.14 0.00 0.00 176.83 176.65 3k5o h ILE 519 N 0.73 1.46 -0.35 3.27 2.04 -0.94 -2.43 117.51 121.29 3k5o h ILE 519 Ca 0.16 -1.49 -0.00 0.00 1.00 0.00 0.00 64.86 64.52 3k5o h ILE 519 Cb 0.32 2.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.75 3k5o h ILE 519 CO 0.00 0.40 0.20 0.74 0.00 0.00 0.00 178.15 179.50 3k5o h THR 520 N -0.44 1.13 -0.29 -0.27 2.02 -0.80 0.02 112.91 114.27 3k5o h THR 520 Ca -0.00 -0.30 -0.09 0.00 0.77 0.00 0.00 66.41 66.79 3k5o h THR 520 Cb 0.70 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 3k5o h THR 520 CO 0.02 0.13 -0.20 0.24 0.37 0.00 0.00 175.52 176.08 3k5o h MET 521 N 0.45 0.54 -0.46 6.66 2.86 -1.12 -1.24 114.93 122.62 3k5o h MET 521 Ca 0.12 -0.19 -0.11 0.00 -2.06 0.00 0.00 59.70 57.47 3k5o h MET 521 Cb 0.02 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 3k5o h MET 521 CO -0.02 0.71 -0.14 -0.09 1.06 0.00 0.00 176.91 178.43 3k5o h ARG 522 N 0.48 0.86 -0.76 1.72 9.65 -1.12 -2.10 114.38 123.11 3k5o h ARG 522 Ca 0.08 -0.31 -0.01 0.00 -1.10 0.00 0.00 59.98 58.64 3k5o h ARG 522 Cb 0.61 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.10 3k5o h ARG 522 CO 0.04 0.94 0.43 0.78 2.80 0.00 0.00 179.97 184.97 3k5o h GLY 523 N 0.96 1.12 0.95 2.80 0.00 -0.32 -0.12 103.07 108.46 3k5o h GLY 523 Ca 0.12 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 3k5o h GLY 523 CO 0.05 0.47 0.16 0.45 0.00 0.00 0.00 176.54 177.67 3k5o h HIS 524 N 1.04 0.68 -0.43 5.60 3.86 -1.02 -1.29 115.15 123.59 3k5o h HIS 524 Ca 0.27 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 3k5o h HIS 524 Cb 0.00 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.25 3k5o h HIS 524 CO -0.00 0.60 0.27 0.37 0.86 0.00 0.00 177.93 180.03 3k5o h GLN 525 N 0.56 0.58 -0.71 2.45 4.15 -1.04 0.56 115.11 121.66 3k5o h GLN 525 Ca 0.14 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.50 3k5o h GLN 525 Cb 0.22 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 3k5o h GLN 525 CO -0.01 0.41 0.37 0.82 -1.93 0.00 0.00 178.83 178.49 3k5o h ILE 526 N 0.58 1.22 -0.52 2.39 2.04 -0.86 0.15 117.51 122.51 3k5o h ILE 526 Ca 0.16 -0.59 -0.11 0.00 1.00 0.00 0.00 64.86 65.31 3k5o h ILE 526 Cb -0.03 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.35 3k5o h ILE 526 CO -0.03 0.25 -0.12 0.24 0.00 0.00 0.00 178.15 178.50 3k5o h MET 527 N 0.98 0.98 -0.32 2.37 2.86 -0.82 0.43 114.93 121.41 3k5o h MET 527 Ca 0.25 -0.36 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 3k5o h MET 527 Cb 0.07 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 3k5o h MET 527 CO -0.04 1.03 0.07 0.00 1.06 0.00 0.00 176.91 179.04 3k5o h ARG 528 N 0.87 0.51 -0.65 1.72 3.08 -0.57 -2.06 114.38 117.29 3k5o h ARG 528 Ca 0.14 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 3k5o h ARG 528 Cb 0.67 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.62 3k5o h ARG 528 CO 0.05 0.58 0.29 0.37 -1.07 0.00 0.00 179.97 180.19 3k5o h GLN 529 N 0.36 0.93 -0.69 0.04 5.75 -0.81 -2.52 115.11 118.17 3k5o h GLN 529 Ca 0.10 -0.13 -0.04 0.00 -0.15 0.00 0.00 58.65 58.43 3k5o h GLN 529 Cb 0.31 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 3k5o h GLN 529 CO 0.00 0.73 0.28 1.15 -2.65 0.00 0.00 178.83 178.35 3k5o h THR 530 N 0.92 1.24 -0.67 2.39 2.02 -0.65 -1.47 112.91 116.69 3k5o h THR 530 Ca 0.22 -0.75 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 3k5o h THR 530 Cb 0.13 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 3k5o h THR 530 CO -0.03 0.30 0.36 0.50 0.37 0.00 0.00 175.52 177.03 3k5o h LYS 531 N 0.97 0.93 -0.70 6.66 3.64 -1.01 -2.07 116.57 124.99 3k5o h LYS 531 Ca 0.23 -0.11 -0.05 0.00 -1.27 0.00 0.00 60.65 59.45 3k5o h LYS 531 Cb 0.20 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 3k5o h LYS 531 CO -0.02 0.70 0.23 0.00 -2.27 0.00 0.00 179.45 178.10 3k5o h ALA 532 N 1.18 0.91 -0.76 5.00 0.00 -1.05 -1.10 119.26 123.45 3k5o h ALA 532 Ca 0.23 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3k5o h ALA 532 Cb 0.04 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3k5o h ALA 532 CO -0.04 0.58 0.37 -0.07 0.00 0.00 0.00 179.25 180.09 3k5o h LEU 533 N 1.02 0.99 -0.31 0.00 3.38 -1.01 -0.58 115.31 118.80 3k5o h LEU 533 Ca 0.23 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 3k5o h LEU 533 Cb 0.28 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3k5o h LEU 533 CO -0.01 0.84 -0.12 0.40 0.09 0.00 0.00 178.44 179.64 3k5o h ILE 534 N 1.06 1.29 -0.02 1.22 2.04 -1.12 -2.72 117.51 119.27 3k5o h ILE 534 Ca 0.26 -1.21 -0.07 0.00 1.00 0.00 0.00 64.86 64.84 3k5o h ILE 534 Cb 0.11 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 3k5o h ILE 534 CO -0.03 0.39 -0.31 -0.33 0.00 0.00 0.00 178.15 177.86 3k5o h GLU 535 N 0.39 0.03 0.00 2.37 5.08 -1.04 -0.68 114.58 120.74 3k5o h GLU 535 Ca 0.07 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3k5o h GLU 535 Cb 0.64 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 3k5o h GLU 535 CO 0.04 0.34 -0.09 0.00 -1.00 0.00 0.00 179.01 178.30 3k5o h ALA 536 N 1.66 1.04 -0.05 3.43 0.00 -0.94 -0.82 119.26 123.59 3k5o h ALA 536 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3k5o h ALA 536 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3k5o h ALA 536 CO 0.04 0.11 0.00 1.04 0.00 0.00 0.00 179.25 180.44 3k5o n GLN 537 N -3.26 1.42 -0.27 0.00 1.13 -0.27 -4.91 117.38 111.22 3k5o n GLN 537 Ca -0.00 -0.63 0.00 0.00 -1.94 0.00 0.00 57.00 54.43 3k5o n GLN 537 Cb 0.32 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 29.24 3k5o n GLN 537 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k5o n GLY 538 N 1.06 0.86 3.70 1.08 0.00 -0.31 -5.09 105.19 106.49 3k5o n GLY 538 Ca 0.19 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 3k5o n GLY 538 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k5o s TYR 539 N -2.00 2.64 -0.14 1.61 2.02 -1.14 -4.97 117.35 115.37 3k5o s TYR 539 Ca 0.00 -0.43 -0.04 0.00 -0.37 0.00 0.00 57.07 56.23 3k5o s TYR 539 Cb 0.00 -1.63 -0.03 0.00 -0.40 0.00 0.00 41.96 39.90 3k5o s TYR 539 CO 0.00 0.37 0.02 -0.51 -1.57 0.00 0.00 175.55 173.86 3k5o s ASP 540 N -3.81 5.33 -0.35 2.29 1.01 -1.15 -3.79 116.67 116.20 3k5o s ASP 540 Ca 0.37 0.08 -0.16 0.00 0.71 0.00 0.00 52.55 53.55 3k5o s ASP 540 Cb -0.01 -1.75 -0.01 0.00 1.01 0.00 0.00 42.92 42.17 3k5o s ASP 540 CO 0.22 0.26 0.38 -0.69 0.21 0.00 0.00 175.17 175.54 3k5o s VAL 541 N -0.17 5.15 -1.44 -1.27 1.01 -1.26 -0.54 120.40 121.88 3k5o s VAL 541 Ca 0.06 0.01 0.23 0.00 0.00 0.00 0.00 61.98 62.28 3k5o s VAL 541 Cb -0.12 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.39 3k5o s VAL 541 CO 0.02 -0.14 1.21 2.30 0.00 0.00 0.00 175.10 178.48 3k5o n ILE 542 N 5.27 0.00 -3.55 2.22 -5.35 -0.43 -4.91 119.36 112.62 3k5o n ILE 542 Ca -0.09 -0.10 -0.07 0.00 -0.27 0.00 0.00 62.75 62.23 3k5o n ILE 542 Cb 0.49 0.78 -0.02 0.00 -1.74 0.00 0.00 39.64 39.15 3k5o n ILE 542 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 3k5o s TYR 543 N -2.75 -0.25 -0.28 4.28 5.04 -1.22 -1.73 117.35 120.44 3k5o s TYR 543 Ca 0.15 0.17 -0.24 0.00 -2.44 0.00 0.00 57.07 54.72 3k5o s TYR 543 Cb 0.18 0.52 0.10 0.00 0.35 0.00 0.00 41.96 43.11 3k5o s TYR 543 CO 0.68 -0.39 0.86 0.20 -1.34 0.00 0.00 175.55 175.56 3k5o s GLY 544 N -2.29 -0.36 0.00 8.97 0.00 -1.26 -0.85 107.32 111.54 3k5o s GLY 544 Ca 0.07 2.40 0.00 0.00 0.00 0.00 0.00 44.72 47.18 3k5o s GLY 544 CO -0.07 1.89 0.00 2.09 0.00 0.00 0.00 173.10 177.02 3k5o n ASP 545 N 2.70 0.32 -0.17 1.64 5.68 -0.21 -3.03 116.55 123.48 3k5o n ASP 545 Ca -0.14 0.00 -0.01 0.00 -0.50 0.00 0.00 54.79 54.13 3k5o n ASP 545 Cb 0.56 0.00 0.07 0.00 -1.14 0.00 0.00 41.12 40.61 3k5o n ASP 545 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 3k5o h THR 546 N 0.00 0.63 0.00 2.12 2.02 -1.83 -3.34 112.91 112.51 3k5o h THR 546 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.12 3k5o h THR 546 Cb 0.00 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 3k5o h THR 546 CO 0.00 0.03 0.00 -0.90 0.37 0.00 0.00 175.52 175.02 3k5o n ASP 547 N -5.19 0.41 -4.27 4.18 5.68 -1.26 -4.70 116.55 111.40 3k5o n ASP 547 Ca 0.06 -1.20 -0.30 0.00 -0.50 0.00 0.00 54.79 52.86 3k5o n ASP 547 Cb 0.28 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 40.10 3k5o n ASP 547 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3k5o s SER 548 N -0.20 2.82 -0.07 -1.12 0.01 -1.25 -0.79 113.70 113.10 3k5o s SER 548 Ca 0.00 -0.44 0.04 0.00 1.31 0.00 0.00 55.95 56.86 3k5o s SER 548 Cb 0.00 -0.42 -0.00 0.00 0.21 0.00 0.00 66.02 65.81 3k5o s SER 548 CO 0.00 0.28 -0.22 -0.89 0.41 0.00 0.00 173.24 172.82 3k5o s THR 549 N -0.47 1.82 -0.26 1.44 2.01 0.36 -1.04 115.64 119.51 3k5o s THR 549 Ca 0.06 -0.91 -0.07 0.00 0.31 0.00 0.00 61.69 61.08 3k5o s THR 549 Cb -0.10 -1.57 -0.02 0.00 0.01 0.00 0.00 72.50 70.82 3k5o s THR 549 CO -0.00 0.51 0.07 -0.36 -0.69 0.00 0.00 174.62 174.15 3k5o s PHE 550 N 0.17 3.09 -0.17 4.92 0.08 -0.03 -1.21 117.98 124.84 3k5o s PHE 550 Ca -0.11 -0.49 -0.02 0.00 0.12 0.00 0.00 56.93 56.43 3k5o s PHE 550 Cb -0.15 -2.25 -0.01 0.00 -0.57 0.00 0.00 43.02 40.04 3k5o s PHE 550 CO 0.05 -0.39 -0.10 0.08 -0.10 0.00 0.00 175.22 174.77 3k5o s VAL 551 N 1.60 3.16 -0.14 -0.44 1.01 0.12 -1.31 120.40 124.41 3k5o s VAL 551 Ca 0.06 -0.60 -0.19 0.00 0.00 0.00 0.00 61.98 61.25 3k5o s VAL 551 Cb -0.15 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 3k5o s VAL 551 CO 0.04 0.49 0.54 0.86 0.00 0.00 0.00 175.10 177.02 3k5o s TRP 552 N 0.81 3.48 -1.18 5.22 -0.00 0.30 0.69 118.94 128.26 3k5o s TRP 552 Ca -0.03 0.92 0.04 0.00 -0.00 0.00 0.00 56.10 57.03 3k5o s TRP 552 Cb -0.15 -2.64 0.19 0.00 -0.00 0.00 0.00 33.47 30.87 3k5o s TRP 552 CO 0.01 0.06 0.92 1.28 -0.00 0.00 0.00 176.95 179.22 3k5o n LEU 553 N 4.07 1.83 -3.01 5.86 4.77 -0.74 -2.91 117.00 126.87 3k5o n LEU 553 Ca -0.05 -0.92 -0.21 0.00 -0.03 0.00 0.00 56.01 54.80 3k5o n LEU 553 Cb 0.51 -0.42 0.01 0.00 -2.33 0.00 0.00 43.42 41.20 3k5o n LEU 553 CO 0.44 0.32 -0.06 0.29 -1.33 0.00 0.00 177.39 177.04 3k5o n LYS 554 N 0.12 -3.62 0.00 3.23 5.02 -1.26 -4.84 118.16 116.82 3k5o n LYS 554 Ca 0.07 0.69 0.00 0.00 -2.02 0.00 0.00 58.31 57.05 3k5o n LYS 554 Cb 0.39 -5.43 0.00 0.00 -0.02 0.00 0.00 35.03 29.96 3k5o n LYS 554 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k5o n GLY 555 N -1.22 3.40 3.71 0.72 0.00 -1.25 -5.11 105.19 105.44 3k5o n GLY 555 Ca -0.09 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 3k5o n GLY 555 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5o s ALA 556 N -2.00 3.59 0.14 4.61 0.00 -1.26 -4.44 121.76 122.40 3k5o s ALA 556 Ca 0.00 1.09 0.09 0.00 0.00 0.00 0.00 51.96 53.14 3k5o s ALA 556 Cb 0.00 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 3k5o s ALA 556 CO 0.00 -0.68 -0.21 -1.01 0.00 0.00 0.00 175.76 173.85 3k5o s HIS 557 N 1.39 1.93 0.70 0.00 3.76 -1.26 -5.03 115.29 116.78 3k5o s HIS 557 Ca 0.65 -0.42 -0.13 0.00 -0.15 0.00 0.00 55.06 55.01 3k5o s HIS 557 Cb -0.36 -1.02 0.02 0.00 1.11 0.00 0.00 32.58 32.33 3k5o s HIS 557 CO 0.30 0.30 1.09 -1.54 -0.85 0.00 0.00 174.74 174.03 3k5o s SER 558 N -2.25 5.02 0.22 1.40 1.04 -1.26 -4.79 113.70 113.07 3k5o s SER 558 Ca 0.12 1.83 -0.09 0.00 0.48 0.00 0.00 55.95 58.30 3k5o s SER 558 Cb -0.08 -2.53 0.23 0.00 0.10 0.00 0.00 66.02 63.74 3k5o s SER 558 CO 0.06 -1.69 1.85 -0.33 0.98 0.00 0.00 173.24 174.11 3k5o h GLU 559 N -0.50 0.88 -0.14 4.02 4.39 -1.99 0.64 114.58 121.89 3k5o h GLU 559 Ca -0.45 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.19 3k5o h GLU 559 Cb 1.23 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.67 3k5o h GLU 559 CO 0.54 0.58 0.06 1.49 -1.16 0.00 0.00 179.01 180.53 3k5o h GLU 560 N 0.91 0.20 -0.21 2.33 4.81 -2.00 -2.58 114.58 118.04 3k5o h GLU 560 Ca 0.31 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.35 3k5o h GLU 560 Cb 0.05 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 3k5o h GLU 560 CO -0.13 0.27 -0.52 1.49 -0.73 0.00 0.00 179.01 179.40 3k5o h GLU 561 N 0.09 0.59 -0.51 1.92 4.81 -1.87 -2.62 114.58 116.99 3k5o h GLU 561 Ca 0.05 -0.36 -0.06 0.00 -0.13 0.00 0.00 59.36 58.86 3k5o h GLU 561 Cb 0.14 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 3k5o h GLU 561 CO -0.01 0.97 0.10 0.00 -0.73 0.00 0.00 179.01 179.34 3k5o h ALA 562 N 0.97 0.68 -0.48 2.92 0.00 -0.85 -1.30 119.26 121.19 3k5o h ALA 562 Ca 0.02 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 3k5o h ALA 562 Cb 1.06 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3k5o h ALA 562 CO 0.10 0.40 -0.00 0.00 0.00 0.00 0.00 179.25 179.75 3k5o h ALA 563 N 0.98 1.09 -0.62 0.00 0.00 -1.47 -0.35 119.26 118.90 3k5o h ALA 563 Ca 0.16 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3k5o h ALA 563 Cb 0.38 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3k5o h ALA 563 CO 0.01 0.58 0.24 0.87 0.00 0.00 0.00 179.25 180.95 3k5o h LYS 564 N 0.75 0.93 -0.40 0.00 1.57 -1.10 -1.61 116.57 116.71 3k5o h LYS 564 Ca 0.14 -0.17 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 3k5o h LYS 564 Cb 0.46 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 3k5o h LYS 564 CO 0.02 0.79 -0.12 0.82 -0.57 0.00 0.00 179.45 180.39 3k5o h ILE 565 N 0.87 1.28 -0.38 1.86 2.04 -0.90 -1.71 117.51 120.57 3k5o h ILE 565 Ca 0.21 -1.22 0.02 0.00 1.00 0.00 0.00 64.86 64.86 3k5o h ILE 565 Cb 0.21 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 3k5o h ILE 565 CO -0.02 0.41 0.22 1.23 0.00 0.00 0.00 178.15 179.99 3k5o h GLY 566 N 0.59 0.52 1.20 5.37 0.00 -0.89 0.53 103.07 110.39 3k5o h GLY 566 Ca 0.10 -0.17 -0.07 0.00 0.00 0.00 0.00 47.33 47.19 3k5o h GLY 566 CO 0.04 0.15 0.12 3.21 0.00 0.00 0.00 176.54 180.06 3k5o h ARG 567 N 0.45 0.99 -0.28 4.80 3.08 -1.24 -2.49 114.38 119.69 3k5o h ARG 567 Ca 0.15 -0.24 -0.12 0.00 0.07 0.00 0.00 59.98 59.84 3k5o h ARG 567 Cb 0.00 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 3k5o h ARG 567 CO -0.07 0.90 -0.31 0.00 -1.07 0.00 0.00 179.97 179.43 3k5o h ALA 568 N 1.19 0.93 -0.62 0.04 0.00 -0.74 -2.48 119.26 117.58 3k5o h ALA 568 Ca 0.19 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 3k5o h ALA 568 Cb 0.38 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3k5o h ALA 568 CO 0.01 0.61 0.03 -0.07 0.00 0.00 0.00 179.25 179.83 3k5o h LEU 569 N 0.51 1.04 -0.38 0.00 3.38 -0.63 -2.28 115.31 116.96 3k5o h LEU 569 Ca 0.06 -0.28 -0.19 0.00 0.09 0.00 0.00 57.88 57.56 3k5o h LEU 569 Cb 0.79 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 3k5o h LEU 569 CO 0.06 1.08 -0.72 -0.37 0.09 0.00 0.00 178.44 178.58 3k5o h VAL 570 N 0.98 1.35 -0.39 1.22 -1.51 -1.35 -1.76 116.25 114.80 3k5o h VAL 570 Ca 0.18 -2.07 -0.09 0.00 -1.23 0.00 0.00 66.70 63.49 3k5o h VAL 570 Cb 0.53 2.05 -0.02 0.00 -2.13 0.00 0.00 31.29 31.72 3k5o h VAL 570 CO 0.03 0.63 -0.12 -0.61 -1.23 0.00 0.00 177.57 176.26 3k5o h GLN 571 N 0.34 0.69 -0.40 5.19 -0.00 -1.40 -0.81 115.11 118.71 3k5o h GLN 571 Ca -0.03 -0.22 -0.14 0.00 -0.00 0.00 0.00 58.65 58.26 3k5o h GLN 571 Cb 1.30 -0.06 -0.01 0.00 0.00 0.00 0.00 27.48 28.71 3k5o h GLN 571 CO 0.13 0.79 -0.30 1.25 0.00 0.00 0.00 178.83 180.70 3k5o h HIS 572 N 0.63 1.08 -0.31 3.99 2.76 -1.33 -0.89 115.15 121.08 3k5o h HIS 572 Ca 0.11 -0.30 -0.10 0.00 -2.20 0.00 0.00 60.37 57.88 3k5o h HIS 572 Cb 0.57 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 3k5o h HIS 572 CO 0.03 1.11 -0.19 0.28 -1.30 0.00 0.00 177.93 177.86 3k5o h VAL 573 N 0.74 1.29 -0.46 5.26 2.07 -1.06 -1.42 116.25 122.67 3k5o h VAL 573 Ca 0.08 -1.32 -0.11 0.00 0.82 0.00 0.00 66.70 66.17 3k5o h VAL 573 Cb 0.88 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 32.11 3k5o h VAL 573 CO 0.08 0.42 -0.14 0.78 0.02 0.00 0.00 177.57 178.73 3k5o h ASN 574 N 0.43 0.86 -0.54 0.57 2.35 -1.12 -1.23 115.58 116.90 3k5o h ASN 574 Ca 0.06 -0.28 -0.07 0.00 -0.55 0.00 0.00 56.30 55.46 3k5o h ASN 574 Cb 0.73 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.84 3k5o h ASN 574 CO 0.05 1.01 0.07 0.00 -1.65 0.00 0.00 177.43 176.91 3k5o h ALA 575 N 1.06 1.03 -0.26 -0.83 0.00 -1.12 -1.29 119.26 117.85 3k5o h ALA 575 Ca 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3k5o h ALA 575 Cb 0.66 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3k5o h ALA 575 CO 0.05 0.62 0.11 2.35 0.00 0.00 0.00 179.25 182.37 3k5o h TRP 576 N 0.89 0.38 -0.77 0.00 7.01 -0.79 -1.86 115.95 120.81 3k5o h TRP 576 Ca 0.18 -0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.13 3k5o h TRP 576 Cb 0.42 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 27.33 3k5o h TRP 576 CO 0.03 0.39 0.38 -1.49 -2.79 0.00 0.00 178.44 174.95 3k5o h TRP 577 N 0.27 1.08 0.24 2.65 4.06 -1.00 -0.62 115.95 122.64 3k5o h TRP 577 Ca 0.09 -0.04 -0.01 0.00 2.06 0.00 0.00 58.89 60.98 3k5o h TRP 577 Cb 0.16 -0.34 0.00 0.00 -1.00 0.00 0.00 29.16 27.98 3k5o h TRP 577 CO -0.01 0.78 -0.12 0.00 -3.56 0.00 0.00 178.44 175.53 3k5o h ALA 578 N 1.33 -0.33 -0.35 1.49 0.00 -0.92 -0.82 119.26 119.67 3k5o h ALA 578 Ca 0.27 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 3k5o h ALA 578 Cb 0.09 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3k5o h ALA 578 CO -0.04 -0.64 -0.29 0.93 0.00 0.00 0.00 179.25 179.21 3k5o h GLU 579 N -0.40 0.81 0.04 0.00 4.39 -1.26 -3.01 114.58 115.14 3k5o h GLU 579 Ca -0.03 -0.41 -0.00 0.00 0.34 0.00 0.00 59.36 59.26 3k5o h GLU 579 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 3k5o h GLU 579 CO 0.05 1.04 -0.02 1.15 -1.16 0.00 0.00 179.01 180.08 3k5o h THR 580 N 0.60 1.01 0.00 1.13 2.02 -1.12 -2.96 112.91 113.59 3k5o h THR 580 Ca 0.06 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.07 3k5o h THR 580 Cb 0.86 1.11 -0.00 0.00 -1.74 0.00 0.00 68.15 68.38 3k5o h THR 580 CO 0.07 0.04 -0.12 -0.07 0.37 0.00 0.00 175.52 175.81 3k5o h LEU 581 N -0.12 0.00 -1.73 2.58 3.38 -1.20 -1.97 115.31 116.26 3k5o h LEU 581 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3k5o h LEU 581 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3k5o h LEU 581 CO 0.01 0.12 -0.16 1.56 0.09 0.00 0.00 178.44 180.06 3k5o h GLN 582 N 0.00 0.00 0.00 1.13 1.08 -1.37 -0.77 115.11 115.18 3k5o h GLN 582 Ca -0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3k5o h GLN 582 Cb 0.39 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.82 3k5o h GLN 582 CO 0.02 0.16 -0.01 0.87 -0.95 0.00 0.00 178.83 178.92 3k5o h LYS 583 N 0.00 0.00 -0.54 1.46 1.57 -1.40 0.19 116.57 117.85 3k5o h LYS 583 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k5o h LYS 583 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 3k5o h LYS 583 CO 0.02 0.01 0.00 1.04 -0.57 0.00 0.00 179.45 179.95 3k5o n GLN 584 N -3.82 2.57 -2.86 3.15 6.02 -0.37 -4.94 117.38 117.13 3k5o n GLN 584 Ca -0.03 -2.41 -0.15 0.00 -0.01 0.00 0.00 57.00 54.40 3k5o n GLN 584 Cb 0.09 -1.54 0.03 0.00 1.02 0.00 0.00 30.24 29.85 3k5o n GLN 584 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3k5o n ARG 585 N 1.53 -3.73 -4.40 -1.09 1.74 0.67 -5.02 116.66 106.36 3k5o n ARG 585 Ca 0.22 0.61 -0.28 0.00 -0.77 0.00 0.00 57.85 57.62 3k5o n ARG 585 Cb 0.60 -4.86 -0.12 0.00 -1.02 0.00 0.00 32.46 27.06 3k5o n ARG 585 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3k5o s LEU 586 N -4.79 2.38 -0.32 0.55 1.43 -0.75 -5.00 118.68 112.18 3k5o s LEU 586 Ca 0.24 -0.78 -0.09 0.00 -1.03 0.00 0.00 54.13 52.46 3k5o s LEU 586 Cb -0.11 -1.22 0.00 0.00 0.03 0.00 0.00 46.19 44.90 3k5o s LEU 586 CO 0.30 0.16 0.15 -0.89 0.23 0.00 0.00 176.35 176.29 3k5o s THR 587 N -1.29 4.45 0.15 5.49 2.01 -1.26 -3.23 115.64 121.97 3k5o s THR 587 Ca 0.17 -0.57 -0.31 0.00 0.31 0.00 0.00 61.69 61.29 3k5o s THR 587 Cb -0.09 -3.32 -0.08 0.00 0.01 0.00 0.00 72.50 69.01 3k5o s THR 587 CO 0.08 0.01 1.36 -0.55 -0.69 0.00 0.00 174.62 174.82 3k5o s SER 588 N 1.58 6.85 0.00 3.53 0.15 -1.26 -4.56 113.70 119.98 3k5o s SER 588 Ca 0.04 2.36 0.03 0.00 0.70 0.00 0.00 55.95 59.08 3k5o s SER 588 Cb -0.17 -2.60 0.05 0.00 -1.71 0.00 0.00 66.02 61.59 3k5o s SER 588 CO 0.05 -0.61 0.79 0.00 1.20 0.00 0.00 173.24 174.68 3k5o n ALA 589 N 3.39 2.32 -1.77 5.45 0.00 -1.26 -4.94 120.51 123.69 3k5o n ALA 589 Ca 0.09 -0.73 -0.42 0.00 0.00 0.00 0.00 53.44 52.38 3k5o n ALA 589 Cb 0.42 -0.12 -0.02 0.00 0.00 0.00 0.00 19.45 19.74 3k5o n ALA 589 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3k5o s LEU 590 N -0.57 4.35 -0.29 0.00 1.43 -1.26 -4.89 118.68 117.45 3k5o s LEU 590 Ca 0.05 2.90 -0.02 0.00 -1.03 0.00 0.00 54.13 56.04 3k5o s LEU 590 Cb 0.03 -3.63 0.12 0.00 0.03 0.00 0.00 46.19 42.75 3k5o s LEU 590 CO 0.04 -0.91 0.24 -0.70 0.23 0.00 0.00 176.35 175.25 3k5o s GLU 591 N -0.08 0.29 0.32 1.70 2.12 -1.26 -4.89 118.70 116.90 3k5o s GLU 591 Ca 0.66 -0.34 -0.25 0.00 0.36 0.00 0.00 54.97 55.39 3k5o s GLU 591 Cb -0.48 -0.86 -0.10 0.00 0.26 0.00 0.00 34.13 32.96 3k5o s GLU 591 CO 0.44 -1.04 0.93 -1.17 -0.54 0.00 0.00 175.26 173.87 3k5o s LEU 592 N 2.19 4.32 0.02 2.70 2.96 -1.26 -1.21 118.68 128.41 3k5o s LEU 592 Ca 0.10 1.79 0.05 0.00 -0.22 0.00 0.00 54.13 55.85 3k5o s LEU 592 Cb -0.15 -4.00 -0.02 0.00 0.50 0.00 0.00 46.19 42.52 3k5o s LEU 592 CO -0.32 -0.07 -0.15 -1.61 -1.32 0.00 0.00 176.35 172.88 3k5o s GLU 593 N -2.10 1.05 -0.31 1.98 2.02 -0.07 -4.88 118.70 116.39 3k5o s GLU 593 Ca 0.50 -0.70 -0.25 0.00 0.02 0.00 0.00 54.97 54.54 3k5o s GLU 593 Cb -0.18 -1.05 0.01 0.00 0.10 0.00 0.00 34.13 33.00 3k5o s GLU 593 CO 0.23 0.27 0.87 -0.47 0.02 0.00 0.00 175.26 176.18 3k5o s TYR 594 N -0.68 3.20 -0.21 1.61 5.04 -1.26 -1.42 117.35 123.62 3k5o s TYR 594 Ca 0.03 0.94 -0.03 0.00 -2.44 0.00 0.00 57.07 55.57 3k5o s TYR 594 Cb -0.07 -3.34 -0.12 0.00 0.35 0.00 0.00 41.96 38.78 3k5o s TYR 594 CO 0.01 -0.61 -0.22 0.39 -1.34 0.00 0.00 175.55 173.77 3k5o n GLU 595 N 6.38 0.49 -3.69 4.97 -0.58 -0.45 -4.99 120.64 122.76 3k5o n GLU 595 Ca 0.06 0.15 -0.15 0.00 -0.42 0.00 0.00 57.16 56.81 3k5o n GLU 595 Cb 0.48 -1.35 -0.08 0.00 -0.57 0.00 0.00 31.44 29.92 3k5o n GLU 595 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3k5o s THR 596 N -2.40 0.04 -0.22 2.62 2.01 -1.11 -4.98 115.64 111.60 3k5o s THR 596 Ca -0.29 -0.31 0.01 0.00 0.31 0.00 0.00 61.69 61.41 3k5o s THR 596 Cb 0.09 -0.72 0.05 0.00 0.01 0.00 0.00 72.50 71.93 3k5o s THR 596 CO 0.43 -0.17 -0.10 -2.28 -0.69 0.00 0.00 174.62 171.81 3k5o s HIS 597 N -1.18 2.63 -0.31 4.92 2.46 -1.26 -0.66 115.29 121.89 3k5o s HIS 597 Ca -0.12 -1.80 -0.14 0.00 0.47 0.00 0.00 55.06 53.48 3k5o s HIS 597 Cb -0.04 -1.71 -0.03 0.00 -0.13 0.00 0.00 32.58 30.68 3k5o s HIS 597 CO 0.06 -0.79 0.30 -0.06 -2.47 0.00 0.00 174.74 171.78 3k5o s PHE 598 N 1.32 3.22 0.36 3.88 0.08 -0.10 -4.65 117.98 122.09 3k5o s PHE 598 Ca -0.04 0.09 0.14 0.00 0.12 0.00 0.00 56.93 57.24 3k5o s PHE 598 Cb -0.17 -2.54 0.76 0.00 -0.57 0.00 0.00 43.02 40.49 3k5o s PHE 598 CO -0.07 -0.30 1.83 0.00 -0.10 0.00 0.00 175.22 176.58 3k5o s ARG 600 N -4.14 1.50 -0.02 0.00 1.81 -1.18 -0.72 118.95 116.20 3k5o s ARG 600 Ca -0.03 -0.45 0.00 0.00 -1.72 0.00 0.00 55.73 53.54 3k5o s ARG 600 Cb 0.14 -1.30 0.02 0.00 -0.45 0.00 0.00 34.95 33.37 3k5o s ARG 600 CO 0.71 0.13 0.01 0.12 -0.68 0.00 0.00 175.30 175.60 3k5o s PHE 601 N 0.30 0.15 -0.25 -0.53 5.36 -0.35 0.07 117.98 122.72 3k5o s PHE 601 Ca -0.07 0.06 -0.05 0.00 -0.96 0.00 0.00 56.93 55.91 3k5o s PHE 601 Cb -0.12 -0.28 -0.00 0.00 -0.34 0.00 0.00 43.02 42.28 3k5o s PHE 601 CO 0.02 -0.09 0.00 -1.17 -1.46 0.00 0.00 175.22 172.52 3k5o s LEU 602 N 0.90 3.27 -0.23 6.12 2.96 0.74 0.10 118.68 132.54 3k5o s LEU 602 Ca -0.08 -0.54 -0.04 0.00 -0.22 0.00 0.00 54.13 53.25 3k5o s LEU 602 Cb -0.12 -1.79 -0.01 0.00 0.50 0.00 0.00 46.19 44.78 3k5o s LEU 602 CO -0.02 -0.09 -0.02 -0.32 -1.32 0.00 0.00 176.35 174.58 3k5o s MET 603 N 1.48 3.37 0.75 1.98 -2.45 0.15 -2.39 119.30 122.19 3k5o s MET 603 Ca 0.04 -0.64 -0.12 0.00 -1.25 0.00 0.00 55.69 53.73 3k5o s MET 603 Cb -0.16 -3.06 0.04 0.00 1.25 0.00 0.00 34.83 32.91 3k5o s MET 603 CO -0.01 -0.22 1.13 -2.14 1.05 0.00 0.00 175.02 174.83 3k5o s PRO 604 N 1.49 2.44 -0.28 4.11 0.02 -1.26 0.37 135.00 141.89 3k5o s PRO 604 Ca 0.05 0.32 -0.27 0.00 0.02 0.00 0.00 61.00 61.13 3k5o s PRO 604 Cb -0.15 -1.99 0.01 0.00 0.02 0.00 0.00 34.50 32.40 3k5o s PRO 604 CO -0.02 -1.31 0.96 0.95 -0.33 0.00 0.00 177.00 177.26 3k5o s THR 605 N -3.44 4.67 0.00 0.99 -4.23 -1.26 -4.23 115.64 108.14 3k5o s THR 605 Ca 0.60 1.68 0.00 0.00 -1.18 0.00 0.00 61.69 62.78 3k5o s THR 605 Cb -0.11 -4.28 0.00 0.00 1.34 0.00 0.00 72.50 69.45 3k5o s THR 605 CO 0.51 -0.28 0.00 -0.38 -0.54 0.00 0.00 174.62 173.93 3k5o n ILE 606 N 5.54 0.00 -3.72 2.99 5.41 -1.26 -5.02 119.36 123.31 3k5o n ILE 606 Ca 0.09 0.00 -0.03 0.00 1.00 0.00 0.00 62.75 63.81 3k5o n ILE 606 Cb 0.47 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.39 3k5o n ILE 606 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3k5o s TYR 617 N 4.05 -0.13 0.05 1.39 -0.85 -1.26 -2.92 117.35 117.68 3k5o s TYR 617 Ca 0.00 -0.13 0.04 0.00 -0.52 0.00 0.00 57.07 56.46 3k5o s TYR 617 Cb 0.00 0.62 -0.03 0.00 0.38 0.00 0.00 41.96 42.93 3k5o s TYR 617 CO 0.00 -0.73 -0.11 0.00 -1.52 0.00 0.00 175.55 173.18 3k5o s ALA 618 N -3.15 0.93 0.06 9.51 0.00 -1.01 -0.35 121.76 127.75 3k5o s ALA 618 Ca 0.12 -0.86 -0.24 0.00 0.00 0.00 0.00 51.96 50.98 3k5o s ALA 618 Cb -0.01 -0.06 0.06 0.00 0.00 0.00 0.00 23.12 23.12 3k5o s ALA 618 CO 0.01 0.10 0.57 0.20 0.00 0.00 0.00 175.76 176.64 3k5o s GLY 619 N -1.54 -0.51 -0.16 0.00 0.00 0.27 -0.19 107.32 105.20 3k5o s GLY 619 Ca -0.04 0.70 -0.02 0.00 0.00 0.00 0.00 44.72 45.35 3k5o s GLY 619 CO 0.01 0.38 -0.07 -2.27 0.00 0.00 0.00 173.10 171.16 3k5o s LEU 620 N -2.05 3.00 -0.16 0.66 2.96 0.11 -0.69 118.68 122.52 3k5o s LEU 620 Ca -0.04 -0.24 -0.02 0.00 -0.22 0.00 0.00 54.13 53.60 3k5o s LEU 620 Cb -0.01 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 3k5o s LEU 620 CO -0.03 0.13 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.42 3k5o s ILE 621 N 0.55 3.31 -0.52 6.68 1.01 -0.08 -1.10 121.20 131.05 3k5o s ILE 621 Ca -0.05 -0.56 -0.18 0.00 0.00 0.00 0.00 60.65 59.87 3k5o s ILE 621 Cb -0.15 -2.43 0.08 0.00 0.01 0.00 0.00 42.46 39.97 3k5o s ILE 621 CO 0.03 0.49 0.58 -1.58 0.00 0.00 0.00 174.94 174.47 3k5o s GLN 622 N 0.62 3.06 -0.63 2.79 2.00 -1.26 -1.28 119.66 124.96 3k5o s GLN 622 Ca -0.05 -1.16 -0.07 0.00 -2.00 0.00 0.00 55.36 52.07 3k5o s GLN 622 Cb -0.15 -4.16 0.16 0.00 0.80 0.00 0.00 33.01 29.66 3k5o s GLN 622 CO 0.03 -1.26 0.50 -1.21 -0.50 0.00 0.00 175.29 172.84 3k5o s GLU 623 N 2.34 2.80 7.86 1.67 2.02 -0.74 -4.99 118.70 129.66 3k5o s GLU 623 Ca 0.11 -2.30 0.00 0.00 0.02 0.00 0.00 54.97 52.80 3k5o s GLU 623 Cb -0.22 -3.96 0.00 0.00 0.10 0.00 0.00 34.13 30.05 3k5o s GLU 623 CO 0.09 -1.21 0.00 0.41 0.02 0.00 0.00 175.26 174.57 3k5o n GLY 624 N 4.00 3.47 0.25 -1.39 0.00 -1.26 -2.69 105.19 107.58 3k5o n GLY 624 Ca 0.05 -0.11 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 3k5o n GLY 624 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3k5o h ASP 625 N 0.00 0.79 -2.31 1.61 3.58 -2.01 -3.46 116.42 114.62 3k5o h ASP 625 Ca 0.00 -0.19 -0.44 0.00 0.42 0.00 0.00 57.03 56.82 3k5o h ASP 625 Cb 0.00 -0.21 0.04 0.00 1.72 0.00 0.00 39.33 40.89 3k5o h ASP 625 CO 0.00 0.77 -0.07 -0.75 -2.88 0.00 0.00 179.24 176.31 3k5o s LYS 626 N -5.47 2.56 0.02 0.28 2.47 -1.09 -5.12 119.74 113.38 3k5o s LYS 626 Ca -0.13 -0.88 0.07 0.00 -1.56 0.00 0.00 55.97 53.47 3k5o s LYS 626 Cb 0.12 -2.53 -0.02 0.00 -1.46 0.00 0.00 37.83 33.94 3k5o s LYS 626 CO 0.79 -0.67 -0.20 -0.65 0.16 0.00 0.00 175.35 174.79 3k5o s GLN 627 N -4.71 1.46 -0.06 4.03 -0.21 -1.26 -1.78 119.66 117.12 3k5o s GLN 627 Ca 0.57 -0.82 0.03 0.00 0.02 0.00 0.00 55.36 55.16 3k5o s GLN 627 Cb -0.10 -1.49 0.01 0.00 1.00 0.00 0.00 33.01 32.42 3k5o s GLN 627 CO 0.38 0.39 -0.16 0.50 -2.12 0.00 0.00 175.29 174.28 3k5o s ARG 628 N -0.85 1.96 -0.09 2.91 3.52 -0.40 -4.97 118.95 121.03 3k5o s ARG 628 Ca 0.07 -0.56 -0.13 0.00 -0.13 0.00 0.00 55.73 54.99 3k5o s ARG 628 Cb -0.08 -1.60 -0.05 0.00 -1.56 0.00 0.00 34.95 31.66 3k5o s ARG 628 CO 0.01 0.12 0.31 1.41 -0.81 0.00 0.00 175.30 176.34 3k5o s MET 629 N 0.40 3.97 -0.10 5.12 -2.45 -1.26 -0.90 119.30 124.08 3k5o s MET 629 Ca -0.12 0.18 0.03 0.00 -1.25 0.00 0.00 55.69 54.54 3k5o s MET 629 Cb -0.15 -3.30 0.01 0.00 1.25 0.00 0.00 34.83 32.64 3k5o s MET 629 CO 0.04 0.51 -0.20 0.08 1.05 0.00 0.00 175.02 176.50 3k5o s VAL 630 N -0.40 1.83 -0.04 10.11 1.01 0.13 -4.98 120.40 128.06 3k5o s VAL 630 Ca 0.19 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.37 3k5o s VAL 630 Cb -0.14 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 3k5o s VAL 630 CO 0.08 0.51 -0.23 -0.36 0.00 0.00 0.00 175.10 175.09 3k5o s PHE 631 N 0.58 2.21 -0.40 5.22 0.08 -1.26 -0.56 117.98 123.86 3k5o s PHE 631 Ca -0.14 -0.57 0.07 0.00 0.12 0.00 0.00 56.93 56.41 3k5o s PHE 631 Cb -0.17 -1.45 0.23 0.00 -0.57 0.00 0.00 43.02 41.07 3k5o s PHE 631 CO 0.04 -0.14 0.49 1.17 -0.10 0.00 0.00 175.22 176.68 3k5o n LYS 632 N 2.80 0.59 0.00 0.44 3.00 0.53 -4.97 118.16 120.55 3k5o n LYS 632 Ca -0.17 -3.17 0.00 0.00 -0.00 0.00 0.00 58.31 54.97 3k5o n LYS 632 Cb 0.52 -1.32 0.00 0.00 0.00 0.00 0.00 35.03 34.23 3k5o n LYS 632 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.40 178.31 3k5o n TRP 641 N 1.74 0.00 -1.41 5.64 5.03 -1.26 -4.47 117.44 122.72 3k5o n TRP 641 Ca 0.23 0.00 -0.31 0.00 3.03 0.00 0.00 57.50 60.45 3k5o n TRP 641 Cb 0.52 0.00 0.08 0.00 -1.03 0.00 0.00 31.31 30.88 3k5o n TRP 641 CO 0.00 0.00 0.00 0.95 -0.03 0.00 0.00 177.69 178.61 3k5o s THR 642 N 0.00 3.55 0.57 -0.99 -4.23 -1.26 -4.75 115.64 108.53 3k5o s THR 642 Ca 0.00 0.50 0.25 0.00 -1.18 0.00 0.00 61.69 61.26 3k5o s THR 642 Cb 0.00 -3.12 0.33 0.00 1.34 0.00 0.00 72.50 71.06 3k5o s THR 642 CO 0.00 -0.66 2.19 -0.65 -0.54 0.00 0.00 174.62 174.96 3k5o h PRO 643 N -0.99 0.00 -0.18 3.99 0.11 -1.71 0.54 132.00 133.75 3k5o h PRO 643 Ca -0.44 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.67 3k5o h PRO 643 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3k5o h PRO 643 CO 0.54 0.00 0.11 1.25 -0.21 0.00 0.00 178.00 179.69 3k5o h LEU 644 N 0.00 0.22 -0.36 2.35 5.85 -1.53 -0.10 115.31 121.74 3k5o h LEU 644 Ca 0.03 -0.05 -0.17 0.00 0.84 0.00 0.00 57.88 58.52 3k5o h LEU 644 Cb 0.13 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 3k5o h LEU 644 CO -0.00 0.21 -0.50 0.00 -0.34 0.00 0.00 178.44 177.81 3k5o h ALA 645 N 1.02 0.54 0.20 1.25 0.00 -1.36 -1.31 119.26 119.61 3k5o h ALA 645 Ca 0.07 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 3k5o h ALA 645 Cb 0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3k5o h ALA 645 CO -0.01 0.68 -0.13 0.37 0.00 0.00 0.00 179.25 180.16 3k5o h GLN 646 N 0.66 -0.31 -0.46 0.00 5.75 -0.80 0.33 115.11 120.28 3k5o h GLN 646 Ca 0.03 0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 3k5o h GLN 646 Cb 1.10 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.70 3k5o h GLN 646 CO 0.11 -0.21 0.12 0.37 -2.65 0.00 0.00 178.83 176.57 3k5o h GLN 647 N -0.32 0.73 -0.26 1.69 4.15 -1.05 0.22 115.11 120.27 3k5o h GLN 647 Ca -0.02 -0.17 -0.00 0.00 0.77 0.00 0.00 58.65 59.22 3k5o h GLN 647 Cb 0.27 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 3k5o h GLN 647 CO 0.02 0.72 0.15 0.35 -1.93 0.00 0.00 178.83 178.15 3k5o h PHE 648 N 0.62 0.35 0.08 3.99 3.57 -1.06 0.92 116.94 125.41 3k5o h PHE 648 Ca 0.15 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.64 3k5o h PHE 648 Cb 0.31 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.94 3k5o h PHE 648 CO 0.02 0.28 -0.04 0.37 -2.23 0.00 0.00 178.31 176.71 3k5o h GLN 649 N 0.33 -0.11 -0.67 1.11 4.15 -0.16 0.39 115.11 120.15 3k5o h GLN 649 Ca 0.09 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.63 3k5o h GLN 649 Cb 0.03 0.02 -0.08 0.00 0.21 0.00 0.00 27.48 27.67 3k5o h GLN 649 CO -0.02 0.13 0.28 1.96 -1.93 0.00 0.00 178.83 179.25 3k5o h GLN 650 N -0.33 0.46 0.13 1.69 1.08 -0.43 -0.17 115.11 117.54 3k5o h GLN 650 Ca -0.01 -0.03 -0.30 0.00 -1.45 0.00 0.00 58.65 56.86 3k5o h GLN 650 Cb 0.28 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 3k5o h GLN 650 CO 0.02 0.30 -1.42 1.49 -0.95 0.00 0.00 178.83 178.27 3k5o h GLU 651 N 0.47 0.28 -0.14 1.46 4.81 -0.68 -2.82 114.58 117.96 3k5o h GLU 651 Ca 0.35 -0.48 -0.06 0.00 -0.13 0.00 0.00 59.36 59.04 3k5o h GLU 651 Cb 0.44 0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.99 3k5o h GLU 651 CO -0.32 1.18 -0.13 1.25 -0.73 0.00 0.00 179.01 180.26 3k5o h LEU 652 N 0.08 0.36 -1.12 1.64 5.85 -0.04 -2.58 115.31 119.50 3k5o h LEU 652 Ca -0.20 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.05 3k5o h LEU 652 Cb 2.01 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.90 3k5o h LEU 652 CO 0.19 0.76 0.55 1.88 -0.34 0.00 0.00 178.44 181.47 3k5o h TYR 653 N -0.03 1.10 -0.59 1.25 0.99 -1.15 -2.05 116.97 116.48 3k5o h TYR 653 Ca 0.02 0.01 -0.09 0.00 2.00 0.00 0.00 58.73 60.68 3k5o h TYR 653 Cb 0.65 -0.37 -0.02 0.00 1.00 0.00 0.00 36.73 37.99 3k5o h TYR 653 CO 0.08 0.71 0.02 1.25 -0.00 0.00 0.00 178.16 180.22 3k5o h LEU 654 N 1.17 1.00 -0.27 3.88 5.85 -1.47 0.42 115.31 125.89 3k5o h LEU 654 Ca 0.31 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 3k5o h LEU 654 Cb -0.10 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.65 3k5o h LEU 654 CO -0.06 1.05 0.16 0.03 -0.34 0.00 0.00 178.44 179.28 3k5o h ARG 655 N 0.91 0.36 -0.48 1.25 3.08 -1.02 -1.42 114.38 117.07 3k5o h ARG 655 Ca 0.17 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 60.09 3k5o h ARG 655 Cb 0.53 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 3k5o h ARG 655 CO 0.03 0.28 -0.09 0.82 -1.07 0.00 0.00 179.97 179.93 3k5o h ILE 656 N 0.34 1.26 -0.51 2.04 2.04 -1.25 0.56 117.51 121.99 3k5o h ILE 656 Ca 0.10 -1.19 -0.03 0.00 1.00 0.00 0.00 64.86 64.74 3k5o h ILE 656 Cb 0.01 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 3k5o h ILE 656 CO -0.02 0.41 0.20 -0.26 0.00 0.00 0.00 178.15 178.48 3k5o h PHE 657 N 0.78 0.74 -0.01 1.37 0.04 -0.64 -1.41 116.94 117.82 3k5o h PHE 657 Ca 0.13 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.87 3k5o h PHE 657 Cb 0.60 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.52 3k5o h PHE 657 CO 0.03 0.58 -0.13 0.54 -0.60 0.00 0.00 178.31 178.73 3k5o n ARG 658 N -4.34 1.12 -3.27 1.51 1.74 -0.56 -4.93 116.66 107.92 3k5o n ARG 658 Ca 0.04 -0.61 -0.17 0.00 -0.77 0.00 0.00 57.85 56.35 3k5o n ARG 658 Cb 0.16 -1.49 0.07 0.00 -1.02 0.00 0.00 32.46 30.18 3k5o n ARG 658 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3k5o n ASN 659 N -0.41 -3.83 -4.78 0.55 3.02 -0.12 -5.03 115.26 104.66 3k5o n ASN 659 Ca 0.15 -0.47 -0.23 0.00 -0.03 0.00 0.00 54.58 54.00 3k5o n ASN 659 Cb 0.33 -4.21 -0.05 0.00 -0.61 0.00 0.00 39.78 35.24 3k5o n ASN 659 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3k5o s GLU 660 N -5.59 2.79 0.45 3.52 2.02 0.18 -5.00 118.70 117.06 3k5o s GLU 660 Ca 0.24 -1.08 -0.25 0.00 0.02 0.00 0.00 54.97 53.91 3k5o s GLU 660 Cb -0.11 -2.51 -0.08 0.00 0.10 0.00 0.00 34.13 31.54 3k5o s GLU 660 CO 0.59 0.41 1.31 -1.25 0.02 0.00 0.00 175.26 176.35 3k5o s PRO 661 N -3.62 3.75 0.00 0.39 0.05 -1.26 -4.34 135.00 129.96 3k5o s PRO 661 Ca 0.32 2.16 0.00 0.00 0.05 0.00 0.00 61.00 63.53 3k5o s PRO 661 Cb -0.08 -2.60 0.00 0.00 0.05 0.00 0.00 34.50 31.87 3k5o s PRO 661 CO 0.23 -0.68 0.00 2.48 0.05 0.00 0.00 177.00 179.09 3k5o n TYR 662 N -0.21 0.00 -0.19 0.56 0.18 -1.26 -4.91 117.16 111.33 3k5o n TYR 662 Ca 0.06 0.00 -0.01 0.00 1.88 0.00 0.00 57.90 59.83 3k5o n TYR 662 Cb 0.44 0.00 0.09 0.00 -0.38 0.00 0.00 39.34 39.50 3k5o n TYR 662 CO 0.00 0.00 0.00 1.96 -2.08 0.00 0.00 176.86 176.74 3k5o h GLN 663 N 0.00 0.33 -0.05 -3.48 4.20 -2.01 -1.47 115.11 112.64 3k5o h GLN 663 Ca 0.00 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.62 3k5o h GLN 663 Cb 0.00 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 3k5o h GLN 663 CO 0.00 0.22 -0.30 1.49 -0.67 0.00 0.00 178.83 179.57 3k5o h GLU 664 N 0.34 0.08 -0.50 1.46 4.57 -1.99 -2.42 114.58 116.12 3k5o h GLU 664 Ca 0.29 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.38 3k5o h GLU 664 Cb 0.37 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 3k5o h GLU 664 CO -0.32 0.38 0.05 -0.92 -1.18 0.00 0.00 179.01 177.02 3k5o h TYR 665 N 0.08 0.91 -0.58 0.92 3.20 -1.64 -0.51 116.97 119.33 3k5o h TYR 665 Ca 0.01 -0.14 -0.05 0.00 3.14 0.00 0.00 58.73 61.69 3k5o h TYR 665 Cb 0.57 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 3k5o h TYR 665 CO 0.00 0.84 0.16 0.28 -1.64 0.00 0.00 178.16 177.80 3k5o h VAL 666 N 0.71 1.25 -0.20 1.81 2.07 -1.05 -0.29 116.25 120.55 3k5o h VAL 666 Ca 0.15 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 3k5o h VAL 666 Cb 0.44 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 3k5o h VAL 666 CO 0.02 0.32 0.11 0.03 0.02 0.00 0.00 177.57 178.06 3k5o h ARG 667 N 0.83 0.29 -0.67 1.57 3.08 -1.24 0.85 114.38 119.08 3k5o h ARG 667 Ca 0.18 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.14 3k5o h ARG 667 Cb 0.32 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 3k5o h ARG 667 CO -0.00 0.29 0.18 0.93 -1.07 0.00 0.00 179.97 180.29 3k5o h GLU 668 N 0.21 1.05 0.02 0.04 4.39 -0.96 0.24 114.58 119.58 3k5o h GLU 668 Ca 0.07 -0.23 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 3k5o h GLU 668 Cb 0.09 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 3k5o h GLU 668 CO -0.01 0.92 -0.01 1.15 -1.16 0.00 0.00 179.01 179.90 3k5o h THR 669 N 1.01 1.06 -0.59 1.13 2.02 -0.70 0.18 112.91 117.01 3k5o h THR 669 Ca 0.21 -0.23 0.01 0.00 0.77 0.00 0.00 66.41 67.17 3k5o h THR 669 Cb 0.33 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 3k5o h THR 669 CO -0.00 0.06 0.39 0.40 0.37 0.00 0.00 175.52 176.74 3k5o h ILE 670 N -0.13 1.15 -0.54 3.11 2.04 -0.59 0.17 117.51 122.73 3k5o h ILE 670 Ca -0.00 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 3k5o h ILE 670 Cb 0.12 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 3k5o h ILE 670 CO 0.00 0.15 0.26 -0.78 0.00 0.00 0.00 178.15 177.79 3k5o h ASP 671 N 0.80 0.70 -0.45 1.72 3.58 -0.24 -2.05 116.42 120.48 3k5o h ASP 671 Ca 0.22 -0.12 -0.14 0.00 0.42 0.00 0.00 57.03 57.40 3k5o h ASP 671 Cb -0.09 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 40.77 3k5o h ASP 671 CO -0.05 0.63 -0.28 0.11 -2.88 0.00 0.00 179.24 176.77 3k5o h LYS 672 N 0.72 0.98 -0.04 0.28 1.57 -0.40 -2.53 116.57 117.15 3k5o h LYS 672 Ca 0.19 -0.46 0.01 0.00 -1.87 0.00 0.00 60.65 58.52 3k5o h LYS 672 Cb 0.11 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 3k5o h LYS 672 CO -0.02 1.13 -0.02 1.25 -0.57 0.00 0.00 179.45 181.21 3k5o h LEU 673 N 0.83 -0.08 -1.57 2.94 5.85 -0.77 -1.97 115.31 120.53 3k5o h LEU 673 Ca 0.09 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 3k5o h LEU 673 Cb 0.87 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.94 3k5o h LEU 673 CO 0.08 -0.03 -0.06 0.24 -0.34 0.00 0.00 178.44 178.33 3k5o h MET 674 N -0.02 0.00 0.00 1.25 2.86 -1.38 -2.14 114.93 115.49 3k5o h MET 674 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 3k5o h MET 674 Cb 0.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.72 3k5o h MET 674 CO -0.06 0.06 -0.14 0.00 1.06 0.00 0.00 176.91 177.82 3k5o n ALA 675 N -2.13 2.67 -0.78 6.32 0.00 -0.96 -4.92 120.51 120.71 3k5o n ALA 675 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3k5o n ALA 675 Cb 0.30 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.38 3k5o n ALA 675 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k5o n GLY 676 N 1.49 0.56 0.45 0.00 0.00 -0.81 -4.95 105.19 101.94 3k5o n GLY 676 Ca 0.07 -0.46 0.14 0.00 0.00 0.00 0.00 46.02 45.76 3k5o n GLY 676 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k5o n GLU 677 N -2.78 1.62 -0.26 1.61 1.02 -0.78 -3.88 120.64 117.19 3k5o n GLU 677 Ca 0.00 -0.90 0.08 0.00 -0.02 0.00 0.00 57.16 56.32 3k5o n GLU 677 Cb 0.00 -1.48 0.17 0.00 -0.02 0.00 0.00 31.44 30.12 3k5o n GLU 677 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3k5o n LEU 678 N 0.10 2.70 0.09 -4.62 4.77 -1.25 -4.78 117.00 114.01 3k5o n LEU 678 Ca 0.19 -3.28 0.20 0.00 -0.03 0.00 0.00 56.01 53.09 3k5o n LEU 678 Cb 0.34 -0.47 0.75 0.00 -2.33 0.00 0.00 43.42 41.70 3k5o n LEU 678 CO 0.16 0.87 1.18 0.44 -1.33 0.00 0.00 177.39 178.71 3k5o h ASP 679 N 0.47 0.00 0.27 -1.43 3.32 -1.92 -0.66 116.42 116.47 3k5o h ASP 679 Ca 0.01 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 3k5o h ASP 679 Cb 1.09 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 3k5o h ASP 679 CO 0.05 0.00 -0.23 0.00 -1.72 0.00 0.00 179.24 177.34 3k5o h ALA 680 N 1.63 1.53 -0.41 3.45 0.00 -1.92 -2.54 119.26 121.00 3k5o h ALA 680 Ca 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3k5o h ALA 680 Cb 0.93 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3k5o h ALA 680 CO -0.00 0.29 0.00 0.54 0.00 0.00 0.00 179.25 180.08 3k5o n ARG 681 N -4.14 2.06 -0.70 0.00 1.74 -0.26 -4.35 116.66 111.01 3k5o n ARG 681 Ca -0.02 -1.64 0.07 0.00 -0.77 0.00 0.00 57.85 55.49 3k5o n ARG 681 Cb 0.29 -1.38 0.34 0.00 -1.02 0.00 0.00 32.46 30.70 3k5o n ARG 681 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3k5o n LEU 682 N 0.83 4.82 -4.72 0.55 4.32 -0.96 -1.30 117.00 120.55 3k5o n LEU 682 Ca 0.16 -2.44 -0.37 0.00 -0.02 0.00 0.00 56.01 53.34 3k5o n LEU 682 Cb 0.40 -0.62 -0.07 0.00 -1.62 0.00 0.00 43.42 41.51 3k5o n LEU 682 CO 0.11 0.63 0.06 -0.69 -1.22 0.00 0.00 177.39 176.29 3k5o s VAL 683 N -2.27 5.26 -0.14 4.08 1.01 -1.26 -4.56 120.40 122.51 3k5o s VAL 683 Ca 0.47 0.71 -0.13 0.00 0.00 0.00 0.00 61.98 63.02 3k5o s VAL 683 Cb 0.34 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.96 3k5o s VAL 683 CO 0.17 0.36 0.28 -0.31 0.00 0.00 0.00 175.10 175.60 3k5o s TYR 684 N 0.55 3.50 -0.16 5.22 2.02 0.12 -4.17 117.35 124.43 3k5o s TYR 684 Ca 0.20 0.62 0.00 0.00 -0.37 0.00 0.00 57.07 57.52 3k5o s TYR 684 Cb -0.14 -2.29 0.03 0.00 -0.40 0.00 0.00 41.96 39.16 3k5o s TYR 684 CO 0.06 0.33 -0.12 0.50 -1.57 0.00 0.00 175.55 174.75 3k5o s ARG 685 N 0.16 2.13 -0.03 -0.62 3.52 -1.26 -0.39 118.95 122.46 3k5o s ARG 685 Ca 0.17 -0.63 0.03 0.00 -0.13 0.00 0.00 55.73 55.16 3k5o s ARG 685 Cb -0.13 -2.17 0.00 0.00 -1.56 0.00 0.00 34.95 31.09 3k5o s ARG 685 CO 0.05 -0.31 -0.10 0.21 -0.81 0.00 0.00 175.30 174.33 3k5o s LYS 686 N 1.48 1.12 0.30 5.12 2.20 -0.71 -4.93 119.74 124.32 3k5o s LYS 686 Ca 0.03 -0.36 -0.29 0.00 -0.36 0.00 0.00 55.97 54.99 3k5o s LYS 686 Cb -0.14 -1.02 -0.10 0.00 -1.51 0.00 0.00 37.83 35.06 3k5o s LYS 686 CO -0.10 0.13 1.20 0.50 -0.36 0.00 0.00 175.35 176.72 3k5o s ARG 687 N 0.18 4.50 -0.29 4.03 3.52 -1.26 -1.22 118.95 128.41 3k5o s ARG 687 Ca -0.04 2.00 -0.21 0.00 -0.13 0.00 0.00 55.73 57.36 3k5o s ARG 687 Cb -0.09 -3.14 -0.01 0.00 -1.56 0.00 0.00 34.95 30.15 3k5o s ARG 687 CO 0.01 0.02 0.65 -0.48 -0.81 0.00 0.00 175.30 174.69 3k5o s LEU 688 N -1.57 4.12 -0.05 -0.88 0.05 -1.26 -4.91 118.68 114.16 3k5o s LEU 688 Ca 0.47 0.54 -0.25 0.00 0.05 0.00 0.00 54.13 54.93 3k5o s LEU 688 Cb -0.36 -2.86 -0.20 0.00 -2.05 0.00 0.00 46.19 40.72 3k5o s LEU 688 CO 0.46 -0.47 1.07 0.03 -0.55 0.00 0.00 176.35 176.90 3k5o h ARG 689 N 8.10 -0.05 -6.30 1.48 2.47 -1.98 -3.47 114.38 114.63 3k5o h ARG 689 Ca -0.26 0.00 -0.48 0.00 -1.26 0.00 0.00 59.98 57.98 3k5o h ARG 689 Cb 1.12 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.44 3k5o h ARG 689 CO 0.80 0.52 -0.30 1.03 0.56 0.00 0.00 179.97 182.59 3k5o s ARG 690 N -3.64 2.57 0.59 0.04 0.52 -1.26 -5.08 118.95 112.69 3k5o s ARG 690 Ca -0.16 -1.50 -0.19 0.00 -0.52 0.00 0.00 55.73 53.36 3k5o s ARG 690 Cb 0.00 -2.51 -0.04 0.00 0.52 0.00 0.00 34.95 32.93 3k5o s ARG 690 CO 0.63 -0.35 1.23 -1.25 0.02 0.00 0.00 175.30 175.58 3k5o s PRO 691 N -4.29 2.97 0.02 3.54 0.04 -1.26 -4.85 135.00 131.18 3k5o s PRO 691 Ca 0.51 1.90 -0.30 0.00 0.04 0.00 0.00 61.00 63.14 3k5o s PRO 691 Cb -0.06 -1.97 -0.08 0.00 0.04 0.00 0.00 34.50 32.43 3k5o s PRO 691 CO 0.30 -1.22 1.93 -1.17 0.04 0.00 0.00 177.00 176.88 3k5o s LEU 692 N -4.00 4.41 0.00 -3.56 1.98 -0.04 -1.52 118.68 115.95 3k5o s LEU 692 Ca 0.77 2.60 0.00 0.00 -2.89 0.00 0.00 54.13 54.61 3k5o s LEU 692 Cb -0.32 -3.53 0.00 0.00 0.66 0.00 0.00 46.19 43.00 3k5o s LEU 692 CO 0.35 -1.04 0.00 -0.24 -1.89 0.00 0.00 176.35 173.53 3k5o n SER 693 N 7.52 0.00 0.01 3.68 2.88 -1.26 -4.90 113.62 121.54 3k5o n SER 693 Ca 0.20 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.73 3k5o n SER 693 Cb 0.41 0.00 0.28 0.00 -0.75 0.00 0.00 64.21 64.15 3k5o n SER 693 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3k5o h GLU 694 N 3.75 0.50 -6.99 -1.46 4.57 -1.61 -3.41 114.58 109.93 3k5o h GLU 694 Ca 0.00 -0.12 -0.46 0.00 -1.18 0.00 0.00 59.36 57.60 3k5o h GLU 694 Cb 0.00 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 3k5o h GLU 694 CO 0.00 0.57 0.35 0.71 -1.18 0.00 0.00 179.01 179.46 3k5o s TYR 695 N -4.85 3.44 0.00 0.92 1.51 -1.26 -4.96 117.35 112.14 3k5o s TYR 695 Ca -0.07 1.68 0.00 0.00 -1.01 0.00 0.00 57.07 57.67 3k5o s TYR 695 Cb 0.15 -2.91 0.00 0.00 -0.11 0.00 0.00 41.96 39.09 3k5o s TYR 695 CO 0.77 -0.06 0.00 0.00 -1.11 0.00 0.00 175.55 175.15 3k5o n GLN 696 N -0.15 0.00 0.07 -0.62 10.64 -1.26 -4.98 117.38 121.08 3k5o n GLN 696 Ca 0.05 0.00 -0.17 0.00 -1.83 0.00 0.00 57.00 55.05 3k5o n GLN 696 Cb 0.52 0.00 -0.08 0.00 -0.86 0.00 0.00 30.24 29.82 3k5o n GLN 696 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.06 175.14 3k5o h ARG 697 N 0.00 0.50 0.00 2.61 9.65 -1.99 -3.41 114.38 121.75 3k5o h ARG 697 Ca 0.00 -0.58 0.00 0.00 -1.10 0.00 0.00 59.98 58.30 3k5o h ARG 697 Cb 0.00 0.17 0.00 0.00 -1.39 0.00 0.00 29.97 28.75 3k5o h ARG 697 CO 0.00 1.21 0.00 0.09 2.80 0.00 0.00 179.97 184.07 3k5o n ASN 698 N -3.76 0.00 -2.28 -3.80 4.13 -1.26 -5.09 115.26 103.19 3k5o n ASN 698 Ca -0.09 0.32 -0.02 0.00 1.68 0.00 0.00 54.58 56.47 3k5o n ASN 698 Cb 0.88 -0.26 -0.02 0.00 -1.54 0.00 0.00 39.78 38.85 3k5o n ASN 698 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 3k5o n VAL 699 N -1.27-11.69 -1.52 2.41 0.31 -1.26 -5.03 118.33 100.28 3k5o n VAL 699 Ca 0.00 2.57 -0.31 0.00 -0.01 0.00 0.00 64.34 66.60 3k5o n VAL 699 Cb 0.00 -5.88 0.07 0.00 -0.91 0.00 0.00 33.84 27.12 3k5o n VAL 699 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 3k5o s PRO 700 N -0.78 2.49 0.24 5.55 0.02 -1.26 -4.84 135.00 136.43 3k5o s PRO 700 Ca -0.12 0.85 -0.06 0.00 0.02 0.00 0.00 61.00 61.70 3k5o s PRO 700 Cb 0.01 -1.95 0.28 0.00 0.02 0.00 0.00 34.50 32.86 3k5o s PRO 700 CO 0.32 -1.39 1.89 -1.35 -0.33 0.00 0.00 177.00 176.14 3k5o h PRO 701 N -0.93 1.15 -0.41 5.54 0.11 -1.99 -1.90 132.00 133.58 3k5o h PRO 701 Ca -0.45 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 3k5o h PRO 701 Cb 1.24 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 3k5o h PRO 701 CO 0.57 0.76 -0.04 1.12 -0.21 0.00 0.00 178.00 180.20 3k5o h HIS 702 N 1.18 0.71 -0.49 0.65 2.07 -1.96 0.29 115.15 117.61 3k5o h HIS 702 Ca 0.37 -0.10 -0.06 0.00 -2.85 0.00 0.00 60.37 57.73 3k5o h HIS 702 Cb -0.02 -0.20 -0.02 0.00 2.57 0.00 0.00 27.41 29.75 3k5o h HIS 702 CO -0.01 0.70 0.08 0.28 -3.07 0.00 0.00 177.93 175.91 3k5o h VAL 703 N 0.63 1.25 -0.10 6.12 2.07 -1.81 -0.56 116.25 123.85 3k5o h VAL 703 Ca 0.12 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 3k5o h VAL 703 Cb 0.45 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3k5o h VAL 703 CO 0.02 0.33 0.05 0.03 0.02 0.00 0.00 177.57 178.02 3k5o h ARG 704 N 0.69 0.14 -0.41 1.57 3.08 -0.89 -1.76 114.38 116.80 3k5o h ARG 704 Ca 0.15 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.11 3k5o h ARG 704 Cb 0.40 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 3k5o h ARG 704 CO 0.01 0.18 -0.03 0.00 -1.07 0.00 0.00 179.97 179.06 3k5o h ALA 705 N 0.95 1.17 -0.27 0.04 0.00 -0.87 -2.63 119.26 117.67 3k5o h ALA 705 Ca 0.03 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3k5o h ALA 705 Cb 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3k5o h ALA 705 CO -0.01 0.53 0.05 0.00 0.00 0.00 0.00 179.25 179.83 3k5o h ALA 706 N 1.33 0.35 -1.00 0.00 0.00 -0.90 -2.47 119.26 116.57 3k5o h ALA 706 Ca 0.13 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.94 3k5o h ALA 706 Cb 0.44 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 3k5o h ALA 706 CO 0.02 0.02 0.64 0.00 0.00 0.00 0.00 179.25 179.93 3k5o h ARG 707 N 0.26 1.09 -0.48 0.00 3.08 -1.15 -0.36 114.38 116.81 3k5o h ARG 707 Ca 0.08 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 3k5o h ARG 707 Cb 0.31 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3k5o h ARG 707 CO 0.00 0.72 0.15 -0.07 -1.07 0.00 0.00 179.97 179.70 3k5o h LEU 708 N 1.12 0.66 -1.17 3.04 3.38 -1.23 -2.27 115.31 118.85 3k5o h LEU 708 Ca 0.45 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 58.25 3k5o h LEU 708 Cb 0.26 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3k5o h LEU 708 CO -0.20 0.63 -0.26 0.00 0.09 0.00 0.00 178.44 178.70 3k5o h ALA 709 N 1.46 1.30 0.19 1.53 0.00 -0.61 -2.98 119.26 120.16 3k5o h ALA 709 Ca 0.16 -0.31 -0.31 0.00 0.00 0.00 0.00 54.91 54.46 3k5o h ALA 709 Cb 0.22 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 17.94 3k5o h ALA 709 CO -0.01 0.47 -1.37 -0.44 0.00 0.00 0.00 179.25 177.91 3k5o h ASP 710 N 0.22 0.63 0.00 0.00 3.32 -1.09 -2.97 116.42 116.54 3k5o h ASP 710 Ca 0.04 -0.68 0.00 0.00 0.02 0.00 0.00 57.03 56.41 3k5o h ASP 710 Cb 0.59 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3k5o h ASP 710 CO 0.04 1.53 0.11 -0.62 -1.72 0.00 0.00 179.24 178.59 3k5o n GLU 711 N -3.62 0.00 -3.87 3.56 1.02 -0.89 -4.97 120.64 111.88 3k5o n GLU 711 Ca -0.13 0.27 -0.30 0.00 -0.02 0.00 0.00 57.16 56.98 3k5o n GLU 711 Cb 1.07 -1.61 -0.14 0.00 -0.02 0.00 0.00 31.44 30.73 3k5o n GLU 711 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3k5o s GLU 712 N -2.46 1.42 -0.06 3.49 2.02 -1.13 -5.11 118.70 116.87 3k5o s GLU 712 Ca 0.00 -1.95 -0.01 0.00 0.02 0.00 0.00 54.97 53.04 3k5o s GLU 712 Cb 0.00 -2.80 -0.02 0.00 0.10 0.00 0.00 34.13 31.41 3k5o s GLU 712 CO 0.00 -1.05 0.25 0.54 0.02 0.00 0.00 175.26 175.02 3k5o n ARG 718 N 3.90 0.00 0.00 1.61 1.74 -1.26 -5.06 116.66 117.59 3k5o n ARG 718 Ca 0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 3k5o n ARG 718 Cb 0.38 -0.18 0.00 0.00 -1.02 0.00 0.00 32.46 31.63 3k5o n ARG 718 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 3k5o n PRO 719 N 0.87 2.80 -0.08 5.56 -0.02 -1.26 -5.21 135.00 137.66 3k5o n PRO 719 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 3k5o n PRO 719 Cb 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.55 3k5o n PRO 719 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3k5o n TYR 722 N 0.00 0.00 0.00 6.00 4.01 -1.26 -5.17 117.16 120.74 3k5o n TYR 722 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3k5o n TYR 722 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 3k5o n TYR 722 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3k5o n GLN 723 N -2.00 0.00 -1.97 -0.72 3.00 -1.26 -4.23 117.38 110.20 3k5o n GLN 723 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.63 3k5o n GLN 723 Cb 0.00 -0.86 0.04 0.00 0.00 0.00 0.00 30.24 29.42 3k5o n GLN 723 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 3k5o s THR 727 N -0.76 2.52 -0.11 5.09 2.01 -1.16 -0.86 115.64 122.38 3k5o s THR 727 Ca 0.00 0.33 -0.01 0.00 0.31 0.00 0.00 61.69 62.32 3k5o s THR 727 Cb 0.00 -3.13 0.03 0.00 0.01 0.00 0.00 72.50 69.40 3k5o s THR 727 CO 0.00 -0.07 -0.06 -0.51 -0.69 0.00 0.00 174.62 173.29 3k5o s ILE 728 N -1.55 0.90 0.02 1.82 1.10 -0.36 -4.92 121.20 118.21 3k5o s ILE 728 Ca 0.78 -0.21 -0.18 0.00 -0.51 0.00 0.00 60.65 60.53 3k5o s ILE 728 Cb -0.32 -0.95 -0.06 0.00 0.15 0.00 0.00 42.46 41.29 3k5o s ILE 728 CO 0.34 0.34 0.51 -0.54 -2.11 0.00 0.00 174.94 173.48 3k5o s LYS 729 N 1.76 4.13 0.25 3.50 1.02 -1.25 -1.73 119.74 127.42 3k5o s LYS 729 Ca 0.05 0.59 -0.22 0.00 0.02 0.00 0.00 55.97 56.41 3k5o s LYS 729 Cb -0.12 -3.27 0.03 0.00 -0.52 0.00 0.00 37.83 33.95 3k5o s LYS 729 CO -0.08 0.57 0.75 1.52 -0.92 0.00 0.00 175.35 177.19 3k5o s TYR 730 N -0.78 -0.20 0.11 3.18 -0.85 0.48 -2.08 117.35 117.22 3k5o s TYR 730 Ca 0.27 -0.22 0.04 0.00 -0.52 0.00 0.00 57.07 56.64 3k5o s TYR 730 Cb -0.18 0.69 -0.04 0.00 0.38 0.00 0.00 41.96 42.81 3k5o s TYR 730 CO 0.16 -1.15 -0.10 0.14 -1.52 0.00 0.00 175.55 173.08 3k5o s VAL 731 N -3.81 1.00 -0.29 -3.49 -7.23 -0.06 0.13 120.40 106.66 3k5o s VAL 731 Ca 0.11 -1.80 -0.17 0.00 -1.81 0.00 0.00 61.98 58.31 3k5o s VAL 731 Cb -0.05 -1.55 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 3k5o s VAL 731 CO 0.05 -0.64 0.45 0.86 -0.31 0.00 0.00 175.10 175.51 3k5o s TRP 732 N -2.81 3.24 0.45 2.82 -0.11 -1.26 -1.52 118.94 119.74 3k5o s TRP 732 Ca 0.10 0.42 0.06 0.00 1.22 0.00 0.00 56.10 57.89 3k5o s TRP 732 Cb -0.01 -2.70 -0.04 0.00 -1.50 0.00 0.00 33.47 29.22 3k5o s TRP 732 CO -0.00 -0.32 0.15 0.95 -4.62 0.00 0.00 176.95 173.11 3k5o s THR 733 N 2.22 1.97 0.54 5.86 -4.23 0.10 -1.75 115.64 120.36 3k5o s THR 733 Ca 0.18 -1.77 -0.20 0.00 -1.18 0.00 0.00 61.69 58.72 3k5o s THR 733 Cb -0.16 -2.74 -0.05 0.00 1.34 0.00 0.00 72.50 70.89 3k5o s THR 733 CO 0.10 0.00 1.20 0.28 -0.54 0.00 0.00 174.62 175.67 3k5o s THR 734 N -2.69 2.78 -0.86 3.99 -1.32 0.83 -1.29 115.64 117.08 3k5o s THR 734 Ca 0.33 0.52 -0.00 0.00 -1.21 0.00 0.00 61.69 61.33 3k5o s THR 734 Cb 0.04 -3.23 0.00 0.00 -1.51 0.00 0.00 72.50 67.79 3k5o s THR 734 CO 0.18 -0.07 0.06 0.59 -2.21 0.00 0.00 174.62 173.17 3k5o n ASN 735 N -1.18 -3.49 -0.23 8.08 5.03 -1.26 -4.66 115.26 117.55 3k5o n ASN 735 Ca 0.11 -0.03 0.00 0.00 0.87 0.00 0.00 54.58 55.53 3k5o n ASN 735 Cb 0.49 -2.68 0.00 0.00 -1.02 0.00 0.00 39.78 36.57 3k5o n ASN 735 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3k5o n GLY 736 N -1.03 -1.33 3.76 7.41 0.00 -0.41 -4.92 105.19 108.66 3k5o n GLY 736 Ca -0.11 -1.23 -0.41 0.00 0.00 0.00 0.00 46.02 44.27 3k5o n GLY 736 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3k5o s PRO 737 N 0.00 4.35 -0.01 1.61 0.02 -1.26 -0.72 135.00 138.99 3k5o s PRO 737 Ca 0.00 2.19 -0.08 0.00 0.02 0.00 0.00 61.00 63.13 3k5o s PRO 737 Cb 0.00 -3.10 0.01 0.00 0.02 0.00 0.00 34.50 31.42 3k5o s PRO 737 CO 0.00 -0.23 0.17 -1.21 -0.33 0.00 0.00 177.00 175.40 3k5o s GLU 738 N -1.21 0.45 0.50 5.54 2.02 -0.57 -4.53 118.70 120.90 3k5o s GLU 738 Ca 0.52 -0.25 -0.22 0.00 0.02 0.00 0.00 54.97 55.05 3k5o s GLU 738 Cb -0.39 0.19 -0.06 0.00 0.10 0.00 0.00 34.13 33.97 3k5o s GLU 738 CO 0.48 -0.11 1.21 -1.25 0.02 0.00 0.00 175.26 175.62 3k5o s PRO 739 N -1.09 3.48 0.22 0.39 0.04 -1.25 -0.88 135.00 135.92 3k5o s PRO 739 Ca -0.12 1.88 -0.08 0.00 0.04 0.00 0.00 61.00 62.72 3k5o s PRO 739 Cb -0.06 -2.28 0.36 0.00 0.04 0.00 0.00 34.50 32.56 3k5o s PRO 739 CO 0.02 -0.81 1.69 1.25 0.04 0.00 0.00 177.00 179.19 3k5o h LEU 740 N 1.70 -0.04 -9.69 -3.56 5.85 -1.73 -3.01 115.31 104.82 3k5o h LEU 740 Ca -0.50 0.13 -0.53 0.00 0.84 0.00 0.00 57.88 57.82 3k5o h LEU 740 Cb 1.27 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.45 3k5o h LEU 740 CO 0.59 -0.03 0.15 -1.81 -0.34 0.00 0.00 178.44 177.00 3k5o s ASP 741 N -5.27 7.33 -0.01 1.25 1.01 -1.26 -3.48 116.67 116.24 3k5o s ASP 741 Ca -0.13 1.57 0.00 0.00 0.71 0.00 0.00 52.55 54.70 3k5o s ASP 741 Cb 0.19 -2.48 0.00 0.00 1.01 0.00 0.00 42.92 41.64 3k5o s ASP 741 CO 0.75 0.19 0.00 -1.22 0.21 0.00 0.00 175.17 175.09 3k5o n TYR 742 N 1.79 0.00 -1.66 4.23 4.01 -1.26 -4.87 117.16 119.40 3k5o n TYR 742 Ca -0.06 0.00 -0.47 0.00 -0.16 0.00 0.00 57.90 57.21 3k5o n TYR 742 Cb 0.49 -0.21 -0.04 0.00 -0.31 0.00 0.00 39.34 39.27 3k5o n TYR 742 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 3k5o n GLN 743 N -2.96 2.24 -0.08 -0.72 7.27 -1.14 -4.81 117.38 117.17 3k5o n GLN 743 Ca -0.00 0.81 -0.17 0.00 0.07 0.00 0.00 57.00 57.70 3k5o n GLN 743 Cb 0.01 -2.74 -0.13 0.00 2.41 0.00 0.00 30.24 29.79 3k5o n GLN 743 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 3k5o n ARG 744 N 7.02 0.68 -3.81 3.69 0.63 -1.26 -5.02 116.66 118.59 3k5o n ARG 744 Ca 0.24 0.16 -0.21 0.00 -0.92 0.00 0.00 57.85 57.12 3k5o n ARG 744 Cb 0.32 -1.59 -0.03 0.00 0.45 0.00 0.00 32.46 31.61 3k5o n ARG 744 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 3k5o s SER 745 N -6.46 5.38 0.39 6.15 0.01 -1.26 -5.10 113.70 112.81 3k5o s SER 745 Ca -0.26 -0.44 -0.26 0.00 1.31 0.00 0.00 55.95 56.30 3k5o s SER 745 Cb 0.08 -1.04 -0.09 0.00 0.21 0.00 0.00 66.02 65.18 3k5o s SER 745 CO 0.69 -0.33 1.19 -2.16 0.41 0.00 0.00 173.24 173.03 3k5o s PRO 746 N -4.00 4.11 0.56 12.44 0.04 -1.26 -4.78 135.00 142.10 3k5o s PRO 746 Ca 0.41 1.89 -0.21 0.00 0.04 0.00 0.00 61.00 63.13 3k5o s PRO 746 Cb -0.06 -2.75 -0.05 0.00 0.04 0.00 0.00 34.50 31.68 3k5o s PRO 746 CO 0.27 -0.29 1.25 1.28 0.04 0.00 0.00 177.00 179.55 3k5o n LEU 747 N 0.21 5.01 -4.22 -3.56 4.32 -1.26 -0.12 117.00 117.38 3k5o n LEU 747 Ca 0.04 0.94 -0.41 0.00 -0.02 0.00 0.00 56.01 56.55 3k5o n LEU 747 Cb 0.46 -1.52 -0.08 0.00 -1.62 0.00 0.00 43.42 40.66 3k5o n LEU 747 CO 0.52 -0.93 0.02 -0.62 -1.22 0.00 0.00 177.39 175.16 3k5o s ASP 748 N -1.01 5.78 0.30 -1.43 -1.08 -0.72 -4.44 116.67 114.08 3k5o s ASP 748 Ca 0.73 -1.99 0.07 0.00 -0.52 0.00 0.00 52.55 50.84 3k5o s ASP 748 Cb -0.42 -2.03 0.47 0.00 -1.46 0.00 0.00 42.92 39.47 3k5o s ASP 748 CO 0.48 -0.69 1.71 1.88 0.52 0.00 0.00 175.17 179.07 3k5o h TYR 749 N 8.39 0.26 -0.78 -5.34 0.05 -1.93 -2.84 116.97 114.78 3k5o h TYR 749 Ca -0.19 -0.07 0.03 0.00 0.05 0.00 0.00 58.73 58.55 3k5o h TYR 749 Cb 1.07 -0.06 -0.05 0.00 1.01 0.00 0.00 36.73 38.70 3k5o h TYR 749 CO 0.67 0.60 0.49 1.49 -1.05 0.00 0.00 178.16 180.37 3k5o h GLU 750 N 0.19 0.93 -0.23 4.88 4.57 -1.98 -0.35 114.58 122.59 3k5o h GLU 750 Ca 0.02 -0.06 0.03 0.00 -1.18 0.00 0.00 59.36 58.17 3k5o h GLU 750 Cb 0.81 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 29.17 3k5o h GLU 750 CO 0.06 0.62 0.07 1.25 -1.18 0.00 0.00 179.01 179.83 3k5o h HIS 751 N 0.96 0.13 -0.34 0.92 2.76 -1.91 -0.20 115.15 117.48 3k5o h HIS 751 Ca 0.31 0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.40 3k5o h HIS 751 Cb 0.02 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 28.94 3k5o h HIS 751 CO -0.03 0.06 -0.19 1.88 -1.30 0.00 0.00 177.93 178.34 3k5o h TYR 752 N 0.17 0.70 -0.21 5.26 0.05 -1.41 0.19 116.97 121.73 3k5o h TYR 752 Ca 0.10 -0.14 -0.02 0.00 0.05 0.00 0.00 58.73 58.72 3k5o h TYR 752 Cb 0.08 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 3k5o h TYR 752 CO -0.13 0.78 0.04 1.25 -1.05 0.00 0.00 178.16 179.05 3k5o h LEU 753 N 0.56 0.33 0.01 3.88 5.85 -0.59 -0.60 115.31 124.76 3k5o h LEU 753 Ca 0.09 -0.25 -0.26 0.00 0.84 0.00 0.00 57.88 58.29 3k5o h LEU 753 Cb 0.64 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 3k5o h LEU 753 CO 0.05 0.50 -1.43 0.71 -0.34 0.00 0.00 178.44 177.93 3k5o h THR 754 N 0.15 1.19 -0.01 1.05 1.35 -1.01 -1.69 112.91 113.94 3k5o h THR 754 Ca 0.07 -2.98 0.00 0.00 -0.55 0.00 0.00 66.41 62.94 3k5o h THR 754 Cb 0.31 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 3k5o h THR 754 CO 0.00 0.69 -0.66 0.54 -0.25 0.00 0.00 175.52 175.84 3k5o n ARG 755 N -3.18 0.92 0.05 4.72 5.12 0.67 -4.41 116.66 120.55 3k5o n ARG 755 Ca -0.10 -0.55 0.00 0.00 -1.93 0.00 0.00 57.85 55.27 3k5o n ARG 755 Cb 1.01 -1.44 0.00 0.00 -1.16 0.00 0.00 32.46 30.87 3k5o n ARG 755 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3k5o n GLN 756 N -0.66 0.00 -0.03 5.56 1.13 -0.31 -4.78 117.38 118.29 3k5o n GLN 756 Ca 0.07 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 55.01 3k5o n GLN 756 Cb 0.39 -0.26 -0.06 0.00 0.11 0.00 0.00 30.24 30.42 3k5o n GLN 756 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 3k5o h LEU 757 N 0.00 0.18 -0.60 1.08 3.38 -1.40 -3.19 115.31 114.75 3k5o h LEU 757 Ca 0.00 -0.18 0.08 0.00 0.09 0.00 0.00 57.88 57.87 3k5o h LEU 757 Cb 0.00 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 3k5o h LEU 757 CO 0.00 0.31 0.26 -0.61 0.09 0.00 0.00 178.44 178.48 3k5o h GLN 758 N 0.03 0.45 -0.22 1.13 4.15 -1.51 -1.45 115.11 117.68 3k5o h GLN 758 Ca 0.04 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.44 3k5o h GLN 758 Cb 0.19 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 3k5o h GLN 758 CO -0.00 0.30 0.15 -1.35 -1.93 0.00 0.00 178.83 175.99 3k5o h PRO 759 N 0.47 0.30 0.02 -2.39 0.11 -1.77 0.12 132.00 128.86 3k5o h PRO 759 Ca 0.29 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.39 3k5o h PRO 759 Cb 0.31 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 3k5o h PRO 759 CO -0.26 0.21 -0.09 0.28 -0.21 0.00 0.00 178.00 177.93 3k5o h VAL 760 N 0.30 0.78 -0.24 3.15 2.07 -1.48 -1.28 116.25 119.55 3k5o h VAL 760 Ca 0.08 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 3k5o h VAL 760 Cb -0.02 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3k5o h VAL 760 CO -0.02 0.00 0.13 0.00 0.02 0.00 0.00 177.57 177.71 3k5o h ALA 761 N 0.80 0.31 0.00 1.67 0.00 -1.09 -2.47 119.26 118.49 3k5o h ALA 761 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3k5o h ALA 761 Cb 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3k5o h ALA 761 CO -0.08 -0.16 0.00 -1.91 0.00 0.00 0.00 179.25 177.11 3k5o n GLU 762 N -4.86 0.19 0.22 0.00 4.07 0.41 -0.12 120.64 120.56 3k5o n GLU 762 Ca -0.03 0.12 0.14 0.00 -0.06 0.00 0.00 57.16 57.33 3k5o n GLU 762 Cb 0.07 -1.50 0.40 0.00 -0.06 0.00 0.00 31.44 30.35 3k5o n GLU 762 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 3k5o h GLY 763 N 3.33 0.00 0.00 8.31 0.00 -0.74 -3.40 103.07 110.57 3k5o h GLY 763 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3k5o h GLY 763 CO 0.00 0.00 -0.40 4.51 0.00 0.00 0.00 176.54 180.65 3k5o n ILE 764 N -2.94 0.00 -0.34 2.60 3.06 -0.60 -4.87 119.36 116.27 3k5o n ILE 764 Ca 0.03 0.00 0.17 0.00 -2.50 0.00 0.00 62.75 60.45 3k5o n ILE 764 Cb 0.42 -0.31 0.40 0.00 0.54 0.00 0.00 39.64 40.68 3k5o n ILE 764 CO 0.00 0.00 0.00 -0.07 -2.50 0.00 0.00 176.55 173.98 3k5o h LEU 765 N 0.00 0.65 -1.17 9.51 3.38 -0.74 -2.09 115.31 124.86 3k5o h LEU 765 Ca 0.00 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3k5o h LEU 765 Cb 0.40 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 3k5o h LEU 765 CO 0.00 0.16 0.43 -0.65 0.09 0.00 0.00 178.44 178.47 3k5o h PRO 766 N 0.59 1.00 0.00 1.13 0.11 -1.80 0.50 132.00 133.54 3k5o h PRO 766 Ca 0.61 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 66.62 3k5o h PRO 766 Cb 1.18 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3k5o h PRO 766 CO -0.39 0.71 0.00 1.19 -0.21 0.00 0.00 178.00 179.30 3k5o n PHE 767 N -4.38 0.71 -1.12 0.65 3.72 -0.78 -1.40 117.46 114.85 3k5o n PHE 767 Ca 0.08 0.31 0.08 0.00 -0.05 0.00 0.00 57.45 57.87 3k5o n PHE 767 Cb 0.08 -1.00 0.19 0.00 -0.94 0.00 0.00 39.48 37.81 3k5o n PHE 767 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 3k5o n ILE 768 N -2.18 2.11 -1.93 4.37 -5.35 -0.78 -4.86 119.36 110.75 3k5o n ILE 768 Ca 0.01 -2.26 -0.11 0.00 -0.27 0.00 0.00 62.75 60.12 3k5o n ILE 768 Cb 0.16 -0.25 -0.02 0.00 -1.74 0.00 0.00 39.64 37.79 3k5o n ILE 768 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3k5o n GLU 769 N -1.08 -0.84 -4.50 6.28 -0.58 -0.50 -5.01 120.64 114.41 3k5o n GLU 769 Ca 0.19 0.65 -0.25 0.00 -0.42 0.00 0.00 57.16 57.33 3k5o n GLU 769 Cb 0.76 -4.71 -0.10 0.00 -0.57 0.00 0.00 31.44 26.82 3k5o n GLU 769 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3k5o s ASP 770 N -2.62 3.65 -0.07 1.62 -1.08 0.10 -5.00 116.67 113.26 3k5o s ASP 770 Ca 0.00 -1.11 0.02 0.00 -0.52 0.00 0.00 52.55 50.94 3k5o s ASP 770 Cb 0.00 -0.32 0.01 0.00 -1.46 0.00 0.00 42.92 41.15 3k5o s ASP 770 CO 0.00 -0.08 -0.12 0.21 0.52 0.00 0.00 175.17 175.70 3k5o s ASN 771 N -3.56 1.91 0.10 -0.34 3.84 -1.26 -3.15 114.94 112.49 3k5o s ASN 771 Ca 0.31 -0.32 -0.17 0.00 0.21 0.00 0.00 52.86 52.89 3k5o s ASN 771 Cb -0.01 -0.87 -0.06 0.00 -0.55 0.00 0.00 41.25 39.76 3k5o s ASN 771 CO 0.16 0.02 1.55 0.15 -2.79 0.00 0.00 177.10 176.19 3k5o h PHE 772 N 7.10 0.58 -0.82 0.43 3.57 -1.94 -2.99 116.94 122.87 3k5o h PHE 772 Ca -0.30 -0.10 0.07 0.00 3.53 0.00 0.00 57.97 61.17 3k5o h PHE 772 Cb 1.18 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.72 3k5o h PHE 772 CO 0.48 0.66 0.53 0.00 -2.23 0.00 0.00 178.31 177.75 3k5o h ALA 773 N 0.85 1.63 0.16 2.41 0.00 -1.97 -0.41 119.26 121.93 3k5o h ALA 773 Ca 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3k5o h ALA 773 Cb 0.42 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3k5o h ALA 773 CO 0.01 0.23 -0.08 1.15 0.00 0.00 0.00 179.25 180.57 3k5o h THR 774 N 0.86 0.92 0.00 0.00 2.02 -1.96 0.27 112.91 115.03 3k5o h THR 774 Ca 0.36 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 67.17 3k5o h THR 774 Cb 0.28 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 3k5o h THR 774 CO -0.13 0.09 0.00 0.17 0.37 0.00 0.00 175.52 176.02 3k5o h LEU 775 N -0.39 0.00 -0.27 2.58 -0.00 -1.41 -0.74 115.31 115.07 3k5o h LEU 775 Ca -0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 57.88 57.71 3k5o h LEU 775 Cb 0.31 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.97 3k5o h LEU 775 CO 0.04 0.00 -0.41 -0.03 -0.00 0.00 0.00 178.44 178.04 3k5o h MET 776 N 0.00 0.76 -0.40 0.17 4.05 -0.75 -2.75 114.93 116.00 3k5o h MET 776 Ca 0.00 -0.45 -0.10 0.00 -0.28 0.00 0.00 59.70 58.87 3k5o h MET 776 Cb 0.70 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.53 3k5o h MET 776 CO 0.00 1.08 -0.14 1.15 0.23 0.00 0.00 176.91 179.23 3k5o h THR 777 N 0.51 1.28 -0.02 -0.77 2.02 -0.09 0.13 112.91 115.96 3k5o h THR 777 Ca 0.03 -1.26 0.01 0.00 0.77 0.00 0.00 66.41 65.95 3k5o h THR 777 Cb 1.01 1.24 -0.00 0.00 -1.74 0.00 0.00 68.15 68.66 3k5o h THR 777 CO 0.09 0.42 0.02 1.23 0.37 0.00 0.00 175.52 177.65 3k5o h GLY 778 N 0.62 0.00 0.40 2.16 0.00 -1.10 0.54 103.07 105.69 3k5o h GLY 778 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.14 3k5o h GLY 778 CO 0.05 0.00 -1.53 -1.61 0.00 0.00 0.00 176.54 173.45 3k5o h GLN 779 N 0.00 0.18 0.00 4.80 5.75 -1.18 -3.41 115.11 121.24 3k5o h GLN 779 Ca 0.01 -0.30 0.00 0.00 -0.15 0.00 0.00 58.65 58.21 3k5o h GLN 779 Cb 0.04 0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.70 3k5o h GLN 779 CO -0.00 1.14 -0.89 1.28 -2.65 0.00 0.00 178.83 177.72 3k5o n LEU 780 N -3.95 0.67 0.00 -2.39 4.77 0.01 -5.02 117.00 111.08 3k5o n LEU 780 Ca -0.29 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.25 3k5o n LEU 780 Cb 0.88 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.97 3k5o n LEU 780 CO 0.35 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 3k5o n GLY 781 N 1.40 -2.55 0.87 -0.72 0.00 0.19 -4.54 105.19 99.84 3k5o n GLY 781 Ca 0.02 -1.68 0.11 0.00 0.00 0.00 0.00 46.02 44.47 3k5o n GLY 781 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k5o n LEU 782 N 0.00 2.60 0.00 0.99 4.77 -1.26 -4.70 117.00 119.40 3k5o n LEU 782 Ca 0.00 -1.14 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 3k5o n LEU 782 Cb 0.00 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 3k5o n LEU 782 CO 0.00 0.57 0.00 2.22 -1.33 0.00 0.00 177.39 178.85