#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 3.05 0.12 0.00 -0.21 0.19 -4.84 119.66 117.96 3k5o s GLN 3 Ca 0.00 -0.48 -0.21 0.00 0.02 0.00 0.00 55.36 54.69 3k5o s GLN 3 Cb 0.00 -2.85 -0.07 0.00 1.00 0.00 0.00 33.01 31.09 3k5o s GLN 3 CO 0.00 0.65 0.65 0.00 -2.12 0.00 0.00 175.29 174.47 3k5o s ALA 4 N -1.16 3.53 0.22 6.09 0.00 -1.26 -0.21 121.76 128.96 3k5o s ALA 4 Ca 0.22 0.14 -0.19 0.00 0.00 0.00 0.00 51.96 52.12 3k5o s ALA 4 Cb -0.12 -2.74 0.03 0.00 0.00 0.00 0.00 23.12 20.29 3k5o s ALA 4 CO 0.13 0.36 0.58 0.20 0.00 0.00 0.00 175.76 177.04 3k5o s GLY 5 N -1.23 -0.13 -0.12 0.00 0.00 0.85 -4.60 107.32 102.10 3k5o s GLY 5 Ca 0.33 -0.19 -0.00 0.00 0.00 0.00 0.00 44.72 44.86 3k5o s GLY 5 CO 0.21 -0.18 -0.08 -0.12 0.00 0.00 0.00 173.10 172.93 3k5o s PHE 6 N -3.88 1.54 0.20 1.90 5.36 -0.36 -0.05 117.98 122.69 3k5o s PHE 6 Ca 0.09 -0.79 -0.31 0.00 -0.96 0.00 0.00 56.93 54.97 3k5o s PHE 6 Cb -0.02 -1.27 -0.10 0.00 -0.34 0.00 0.00 43.02 41.30 3k5o s PHE 6 CO -0.01 -0.53 1.45 0.42 -1.46 0.00 0.00 175.22 175.09 3k5o s ILE 7 N 1.69 2.82 -0.17 3.12 1.01 -0.78 -0.16 121.20 128.73 3k5o s ILE 7 Ca 0.05 0.64 -0.07 0.00 0.00 0.00 0.00 60.65 61.28 3k5o s ILE 7 Cb -0.13 -3.41 -0.08 0.00 0.01 0.00 0.00 42.46 38.85 3k5o s ILE 7 CO -0.08 0.08 -0.21 0.18 0.00 0.00 0.00 174.94 174.91 3k5o n LEU 8 N 3.09 1.57 -4.07 2.97 4.77 0.09 -4.90 117.00 120.52 3k5o n LEU 8 Ca 0.09 0.15 -0.12 0.00 -0.03 0.00 0.00 56.01 56.11 3k5o n LEU 8 Cb 0.40 -0.52 -0.11 0.00 -2.33 0.00 0.00 43.42 40.86 3k5o n LEU 8 CO 0.60 0.44 -0.39 0.42 -1.33 0.00 0.00 177.39 177.13 3k5o s THR 9 N -2.32 0.52 0.01 -5.08 -4.23 -1.18 -4.76 115.64 98.61 3k5o s THR 9 Ca -0.24 -1.24 0.09 0.00 -1.18 0.00 0.00 61.69 59.12 3k5o s THR 9 Cb 0.09 -0.79 -0.02 0.00 1.34 0.00 0.00 72.50 73.11 3k5o s THR 9 CO 0.32 -0.50 -0.26 -0.13 -0.54 0.00 0.00 174.62 173.51 3k5o s ARG 10 N -2.04 1.95 0.08 3.99 0.52 -1.26 -1.94 118.95 120.25 3k5o s ARG 10 Ca -0.06 -1.02 -0.07 0.00 -0.52 0.00 0.00 55.73 54.05 3k5o s ARG 10 Cb -0.07 -2.01 -0.01 0.00 0.52 0.00 0.00 34.95 33.39 3k5o s ARG 10 CO -0.01 0.53 0.15 -1.01 0.02 0.00 0.00 175.30 174.98 3k5o s HIS 11 N -0.71 0.21 -0.05 -0.53 3.76 -0.28 -5.02 115.29 112.67 3k5o s HIS 11 Ca 0.11 -0.65 -0.23 0.00 -0.15 0.00 0.00 55.06 54.14 3k5o s HIS 11 Cb -0.10 -0.12 0.05 0.00 1.11 0.00 0.00 32.58 33.52 3k5o s HIS 11 CO 0.01 -0.50 0.52 1.67 -0.85 0.00 0.00 174.74 175.58 3k5o s TRP 12 N -3.77 -0.47 -0.24 1.40 1.48 -1.26 -1.62 118.94 114.47 3k5o s TRP 12 Ca 0.05 0.83 -0.21 0.00 -1.06 0.00 0.00 56.10 55.71 3k5o s TRP 12 Cb 0.05 0.26 0.06 0.00 -1.16 0.00 0.00 33.47 32.69 3k5o s TRP 12 CO -0.10 -0.49 0.63 -0.98 -4.06 0.00 0.00 176.95 171.95 3k5o s ARG 13 N -1.07 0.72 0.21 3.25 1.70 -0.64 -4.98 118.95 118.13 3k5o s ARG 13 Ca -0.11 0.91 -0.28 0.00 -0.47 0.00 0.00 55.73 55.78 3k5o s ARG 13 Cb -0.02 0.32 -0.09 0.00 -0.57 0.00 0.00 34.95 34.59 3k5o s ARG 13 CO 0.07 -0.10 0.89 -0.51 -1.08 0.00 0.00 175.30 174.57 3k5o s ASP 14 N 0.53 7.56 0.18 -2.89 1.01 -1.26 -0.09 116.67 121.71 3k5o s ASP 14 Ca -0.02 1.85 0.02 0.00 0.71 0.00 0.00 52.55 55.11 3k5o s ASP 14 Cb -0.05 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.26 3k5o s ASP 14 CO -0.02 0.17 0.02 0.42 0.21 0.00 0.00 175.17 175.97 3k5o s THR 15 N -1.15 0.63 -0.53 -1.27 -4.23 -1.07 -4.91 115.64 103.11 3k5o s THR 15 Ca 0.39 -1.98 0.12 0.00 -1.18 0.00 0.00 61.69 59.05 3k5o s THR 15 Cb -0.25 -2.18 0.12 0.00 1.34 0.00 0.00 72.50 71.54 3k5o s THR 15 CO 0.30 -0.42 1.38 -0.81 -0.54 0.00 0.00 174.62 174.54 3k5o n PRO 16 N -0.26 0.08 0.00 3.99 -0.04 -1.26 -0.10 135.00 137.41 3k5o n PRO 16 Ca -0.06 0.58 0.12 0.00 -0.04 0.00 0.00 63.50 64.10 3k5o n PRO 16 Cb 0.64 -1.77 0.14 0.00 -0.04 0.00 0.00 33.50 32.46 3k5o n PRO 16 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 3k5o n GLN 17 N -1.94 1.82 0.00 0.54 -0.06 -1.26 -5.07 117.38 111.41 3k5o n GLN 17 Ca -0.01 -1.44 0.00 0.00 -2.00 0.00 0.00 57.00 53.55 3k5o n GLN 17 Cb 0.02 -1.47 0.00 0.00 -4.06 0.00 0.00 30.24 24.73 3k5o n GLN 17 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3k5o n GLY 18 N 1.35 2.11 3.70 1.69 0.00 0.85 -4.79 105.19 110.10 3k5o n GLY 18 Ca 0.13 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.66 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 -2.10 2.51 -0.33 2.61 2.01 -1.00 -2.59 115.64 116.75 3k5o s THR 19 Ca 0.00 0.18 -0.15 0.00 0.31 0.00 0.00 61.69 62.04 3k5o s THR 19 Cb 0.00 -3.12 -0.02 0.00 0.01 0.00 0.00 72.50 69.38 3k5o s THR 19 CO 0.00 0.01 0.33 -0.70 -0.69 0.00 0.00 174.62 173.57 3k5o s GLU 20 N 2.09 3.61 -0.15 4.92 -6.30 0.88 -0.87 118.70 122.88 3k5o s GLU 20 Ca 0.76 -0.41 -0.04 0.00 -2.50 0.00 0.00 54.97 52.79 3k5o s GLU 20 Cb -0.45 -3.78 -0.03 0.00 0.00 0.00 0.00 34.13 29.86 3k5o s GLU 20 CO 0.34 -0.47 -0.02 0.08 0.02 0.00 0.00 175.26 175.20 3k5o s VAL 21 N 1.96 4.04 0.05 3.70 1.01 -1.26 -1.63 120.40 128.28 3k5o s VAL 21 Ca 0.11 -0.31 -0.00 0.00 0.00 0.00 0.00 61.98 61.77 3k5o s VAL 21 Cb -0.17 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 3k5o s VAL 21 CO 0.11 0.50 -0.04 -0.94 0.00 0.00 0.00 175.10 174.74 3k5o s SER 22 N 0.24 0.56 0.02 3.32 1.04 -0.64 -0.91 113.70 117.32 3k5o s SER 22 Ca -0.02 -0.94 0.01 0.00 0.48 0.00 0.00 55.95 55.49 3k5o s SER 22 Cb -0.14 0.17 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 3k5o s SER 22 CO 0.02 -0.54 -0.05 -0.36 0.98 0.00 0.00 173.24 173.29 3k5o s PHE 23 N -3.58 0.45 -0.22 5.02 0.08 0.86 -1.12 117.98 119.46 3k5o s PHE 23 Ca 0.05 -0.29 -0.05 0.00 0.12 0.00 0.00 56.93 56.76 3k5o s PHE 23 Cb 0.05 -0.28 -0.02 0.00 -0.57 0.00 0.00 43.02 42.20 3k5o s PHE 23 CO -0.08 -0.06 -0.00 -1.58 -0.10 0.00 0.00 175.22 173.40 3k5o s TRP 24 N -0.77 3.01 0.08 0.36 0.52 -0.82 -0.63 118.94 120.70 3k5o s TRP 24 Ca -0.05 -0.69 0.03 0.00 0.02 0.00 0.00 56.10 55.42 3k5o s TRP 24 Cb -0.06 -2.14 -0.04 0.00 -1.15 0.00 0.00 33.47 30.08 3k5o s TRP 24 CO -0.00 -0.43 0.05 -0.51 0.02 0.00 0.00 176.95 176.08 3k5o s LEU 25 N 1.42 3.67 -0.24 2.99 1.02 0.46 -0.73 118.68 127.28 3k5o s LEU 25 Ca 0.05 -0.06 -0.11 0.00 0.02 0.00 0.00 54.13 54.03 3k5o s LEU 25 Cb -0.15 -2.36 -0.05 0.00 0.02 0.00 0.00 46.19 43.66 3k5o s LEU 25 CO -0.00 0.18 0.16 0.00 0.02 0.00 0.00 176.35 176.71 3k5o s ALA 26 N -1.34 3.60 0.33 4.21 0.00 0.77 -1.07 121.76 128.27 3k5o s ALA 26 Ca 0.27 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.36 3k5o s ALA 26 Cb -0.12 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 3k5o s ALA 26 CO 0.20 -0.23 0.11 0.95 0.00 0.00 0.00 175.76 176.80 3k5o s THR 27 N 1.12 0.69 0.46 0.00 -4.23 -0.45 -1.23 115.64 111.99 3k5o s THR 27 Ca 0.07 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 58.89 3k5o s THR 27 Cb -0.14 -2.56 0.33 0.00 1.34 0.00 0.00 72.50 71.48 3k5o s THR 27 CO 0.05 0.00 2.14 0.44 -0.54 0.00 0.00 174.62 176.71 3k5o h ASP 28 N 2.08 0.00 -0.52 3.99 5.19 -1.94 -0.65 116.42 124.58 3k5o h ASP 28 Ca -0.37 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.04 3k5o h ASP 28 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 3k5o h ASP 28 CO 0.60 0.07 0.00 0.59 -3.12 0.00 0.00 179.24 177.38 3k5o n ASN 29 N -3.56 4.81 0.00 6.45 4.13 -1.26 -5.06 115.26 120.77 3k5o n ASN 29 Ca -0.02 -2.71 0.00 0.00 1.68 0.00 0.00 54.58 53.53 3k5o n ASN 29 Cb 0.19 -0.59 0.00 0.00 -1.54 0.00 0.00 39.78 37.84 3k5o n ASN 29 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3k5o n GLY 30 N 0.56 -1.82 3.77 7.41 0.00 -0.25 -4.98 105.19 109.87 3k5o n GLY 30 Ca 0.25 -2.03 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 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 4.32 -0.06 1.61 0.04 -1.26 -1.34 135.00 138.31 3k5o s PRO 31 Ca 0.00 2.16 -0.01 0.00 0.04 0.00 0.00 61.00 63.19 3k5o s PRO 31 Cb 0.00 -3.02 0.03 0.00 0.04 0.00 0.00 34.50 31.54 3k5o s PRO 31 CO 0.00 -0.20 -0.00 -1.17 0.04 0.00 0.00 177.00 175.67 3k5o s LEU 32 N -1.88 0.75 -0.03 -3.56 2.96 -0.23 -4.93 118.68 111.76 3k5o s LEU 32 Ca 0.50 -0.07 -0.19 0.00 -0.22 0.00 0.00 54.13 54.15 3k5o s LEU 32 Cb -0.39 -0.39 -0.05 0.00 0.50 0.00 0.00 46.19 45.87 3k5o s LEU 32 CO 0.51 -0.16 0.53 -1.58 -1.32 0.00 0.00 176.35 174.32 3k5o s GLN 33 N 1.69 4.25 -0.04 1.98 0.74 -1.26 -0.40 119.66 126.62 3k5o s GLN 33 Ca 0.00 0.60 0.03 0.00 0.05 0.00 0.00 55.36 56.04 3k5o s GLN 33 Cb -0.13 -3.34 0.00 0.00 1.10 0.00 0.00 33.01 30.65 3k5o s GLN 33 CO -0.04 0.38 -0.12 0.08 -0.55 0.00 0.00 175.29 175.05 3k5o s VAL 34 N -0.18 1.02 0.03 1.34 1.01 0.20 -1.12 120.40 122.71 3k5o s VAL 34 Ca 0.28 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.81 3k5o s VAL 34 Cb -0.17 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.29 3k5o s VAL 34 CO 0.15 0.31 -0.10 0.42 0.00 0.00 0.00 175.10 175.88 3k5o s THR 35 N 0.21 0.75 0.46 3.92 -4.23 0.47 -0.10 115.64 117.12 3k5o s THR 35 Ca -0.05 -0.90 0.02 0.00 -1.18 0.00 0.00 61.69 59.59 3k5o s THR 35 Cb -0.10 -0.73 0.01 0.00 1.34 0.00 0.00 72.50 73.02 3k5o s THR 35 CO 0.01 -0.14 0.66 -0.76 -0.54 0.00 0.00 174.62 173.85 3k5o s LEU 36 N -1.15 3.59 0.73 4.79 1.43 -0.09 -1.92 118.68 126.06 3k5o s LEU 36 Ca -0.03 0.07 -0.12 0.00 -1.03 0.00 0.00 54.13 53.01 3k5o s LEU 36 Cb -0.08 -2.97 0.04 0.00 0.03 0.00 0.00 46.19 43.21 3k5o s LEU 36 CO 0.01 -0.79 1.10 0.00 0.23 0.00 0.00 176.35 176.89 3k5o s ALA 37 N -2.54 2.33 0.03 4.21 0.00 -1.26 -4.54 121.76 120.00 3k5o s ALA 37 Ca 0.51 0.36 -0.37 0.00 0.00 0.00 0.00 51.96 52.46 3k5o s ALA 37 Cb -0.10 -3.29 -0.16 0.00 0.00 0.00 0.00 23.12 19.58 3k5o s ALA 37 CO 0.37 -1.60 1.47 -2.30 0.00 0.00 0.00 175.76 173.70 3k5o n PRO 38 N -3.15 1.37 -3.97 0.00 -0.02 -1.26 -4.74 135.00 123.23 3k5o n PRO 38 Ca 0.09 0.50 -0.35 0.00 -2.02 0.00 0.00 63.50 61.72 3k5o n PRO 38 Cb 0.53 -2.18 -0.09 0.00 -0.02 0.00 0.00 33.50 31.74 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 1.22 3.93 0.15 -0.52 -1.52 -0.05 -4.88 119.66 118.00 3k5o s GLN 39 Ca 0.86 -0.31 -0.20 0.00 -1.95 0.00 0.00 55.36 53.76 3k5o s GLN 39 Cb -0.91 -3.23 -0.07 0.00 -0.22 0.00 0.00 33.01 28.57 3k5o s GLN 39 CO 0.48 0.33 0.66 -2.00 -0.25 0.00 0.00 175.29 174.52 3k5o s GLU 40 N 0.21 4.29 0.16 2.91 2.12 -1.26 -3.50 118.70 123.62 3k5o s GLU 40 Ca 0.05 0.86 -0.02 0.00 0.36 0.00 0.00 54.97 56.22 3k5o s GLU 40 Cb -0.12 -3.11 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 3k5o s GLU 40 CO 0.00 0.53 0.35 -1.12 -0.54 0.00 0.00 175.26 174.49 3k5o s SER 41 N -1.34 6.42 -0.03 -1.70 0.01 0.01 -4.94 113.70 112.12 3k5o s SER 41 Ca 0.36 0.44 -0.06 0.00 1.31 0.00 0.00 55.95 58.00 3k5o s SER 41 Cb -0.19 -2.03 0.01 0.00 0.21 0.00 0.00 66.02 64.02 3k5o s SER 41 CO 0.21 0.03 0.14 0.54 0.41 0.00 0.00 173.24 174.57 3k5o s VAL 42 N -1.73 0.04 0.22 3.43 0.11 -1.26 -1.99 120.40 119.22 3k5o s VAL 42 Ca 0.39 -0.32 0.01 0.00 -2.93 0.00 0.00 61.98 59.13 3k5o s VAL 42 Cb -0.12 -0.30 -0.05 0.00 -1.53 0.00 0.00 36.38 34.38 3k5o s VAL 42 CO 0.27 -0.17 0.07 0.00 -3.33 0.00 0.00 175.10 171.94 3k5o s ALA 43 N -0.58 1.53 0.11 1.54 0.00 -1.01 -4.86 121.76 118.48 3k5o s ALA 43 Ca -0.07 -1.76 0.09 0.00 0.00 0.00 0.00 51.96 50.23 3k5o s ALA 43 Cb -0.04 0.93 -0.04 0.00 0.00 0.00 0.00 23.12 23.97 3k5o s ALA 43 CO 0.01 -0.43 -0.23 -0.06 0.00 0.00 0.00 175.76 175.04 3k5o s PHE 44 N -3.78 2.01 -0.01 0.00 0.08 -0.32 0.09 117.98 116.05 3k5o s PHE 44 Ca 0.33 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.99 3k5o s PHE 44 Cb 0.07 -1.11 0.00 0.00 -0.57 0.00 0.00 43.02 41.41 3k5o s PHE 44 CO 0.10 0.24 -0.03 0.42 -0.10 0.00 0.00 175.22 175.85 3k5o s ILE 45 N -1.08 0.27 0.48 0.64 1.01 -0.18 0.24 121.20 122.58 3k5o s ILE 45 Ca 0.10 -0.13 -0.24 0.00 0.00 0.00 0.00 60.65 60.38 3k5o s ILE 45 Cb -0.10 -0.24 -0.08 0.00 0.01 0.00 0.00 42.46 42.05 3k5o s ILE 45 CO 0.05 0.09 1.33 -2.65 0.00 0.00 0.00 174.94 173.75 3k5o n PRO 46 N 3.11 1.90 -0.01 2.79 -0.02 -1.26 0.44 135.00 141.95 3k5o n PRO 46 Ca -0.14 0.68 -0.10 0.00 -2.02 0.00 0.00 63.50 61.92 3k5o n PRO 46 Cb 0.58 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.51 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 1.87 0.15 0.00 3.55 0.00 -1.13 -1.93 119.26 121.77 3k5o h ALA 47 Ca -0.50 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3k5o h ALA 47 Cb 1.29 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3k5o h ALA 47 CO 0.59 -0.38 0.06 -0.40 0.00 0.00 0.00 179.25 179.11 3k5o n ASP 48 N -5.04 0.12 -0.98 0.00 3.85 -1.26 -0.93 116.55 112.31 3k5o n ASP 48 Ca -0.04 0.51 0.09 0.00 -0.71 0.00 0.00 54.79 54.64 3k5o n ASP 48 Cb 0.05 -0.52 0.20 0.00 -1.35 0.00 0.00 41.12 39.50 3k5o n ASP 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3k5o n GLN 49 N -1.63 2.41 -0.20 0.11 6.02 -0.73 -4.60 117.38 118.77 3k5o n GLN 49 Ca -0.00 -2.17 -0.08 0.00 -0.01 0.00 0.00 57.00 54.74 3k5o n GLN 49 Cb 0.07 -1.43 0.02 0.00 1.02 0.00 0.00 30.24 29.92 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 3.53 1.23 -0.51 5.09 2.07 -1.06 -2.41 116.25 124.19 3k5o h VAL 50 Ca 0.00 -0.75 0.06 0.00 0.82 0.00 0.00 66.70 66.83 3k5o h VAL 50 Cb 0.86 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 3k5o h VAL 50 CO 0.00 0.28 0.21 -0.65 0.02 0.00 0.00 177.57 177.43 3k5o h PRO 51 N 0.77 0.40 -0.82 1.57 0.11 -1.81 0.18 132.00 132.41 3k5o h PRO 51 Ca 0.18 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 3k5o h PRO 51 Cb 0.24 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.22 3k5o h PRO 51 CO -0.01 0.26 0.43 -0.09 -0.21 0.00 0.00 178.00 178.39 3k5o h ARG 52 N 0.41 1.15 -0.69 1.05 9.65 -1.85 -1.92 114.38 122.19 3k5o h ARG 52 Ca 0.24 -0.14 -0.07 0.00 -1.10 0.00 0.00 59.98 58.90 3k5o h ARG 52 Cb 0.22 -0.22 -0.03 0.00 -1.39 0.00 0.00 29.97 28.55 3k5o h ARG 52 CO -0.22 0.86 0.16 0.00 2.80 0.00 0.00 179.97 183.57 3k5o h ALA 53 N 1.23 0.91 -0.73 2.80 0.00 -0.77 -1.83 119.26 120.87 3k5o h ALA 53 Ca 0.29 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3k5o h ALA 53 Cb 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3k5o h ALA 53 CO -0.04 0.64 0.35 1.96 0.00 0.00 0.00 179.25 182.16 3k5o h GLN 54 N 1.04 1.05 -0.35 0.00 1.08 -0.28 -1.44 115.11 116.19 3k5o h GLN 54 Ca 0.21 -0.15 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 3k5o h GLN 54 Cb 0.38 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 3k5o h GLN 54 CO 0.00 0.82 0.16 1.25 -0.95 0.00 0.00 178.83 180.12 3k5o h HIS 55 N 1.02 0.52 -0.43 2.96 -0.00 -1.07 0.28 115.15 118.43 3k5o h HIS 55 Ca 0.25 -0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.59 3k5o h HIS 55 Cb 0.11 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.34 3k5o h HIS 55 CO 0.01 0.45 0.24 0.82 -0.00 0.00 0.00 177.93 179.44 3k5o h ILE 56 N 0.43 1.13 -0.60 6.26 2.04 -1.01 -2.63 117.51 123.13 3k5o h ILE 56 Ca 0.12 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.66 3k5o h ILE 56 Cb 0.13 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 3k5o h ILE 56 CO -0.01 0.14 0.00 0.18 0.00 0.00 0.00 178.15 178.46 3k5o n LEU 57 N -4.43 3.62 -0.19 1.44 4.77 -0.57 -4.55 117.00 117.09 3k5o n LEU 57 Ca 0.03 -1.96 0.18 0.00 -0.03 0.00 0.00 56.01 54.23 3k5o n LEU 57 Cb 0.09 -0.40 0.53 0.00 -2.33 0.00 0.00 43.42 41.31 3k5o n LEU 57 CO 0.36 0.90 1.22 -0.61 -1.33 0.00 0.00 177.39 177.92 3k5o h GLN 58 N 3.64 0.36 0.00 3.23 4.15 -0.06 0.59 115.11 127.03 3k5o h GLN 58 Ca 0.00 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 3k5o h GLN 58 Cb 0.91 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.52 3k5o h GLN 58 CO 0.00 0.24 -0.13 0.78 -1.93 0.00 0.00 178.83 177.79 3k5o h GLY 59 N 0.37 0.00 -1.53 2.39 0.00 -1.81 -3.47 103.07 99.03 3k5o h GLY 59 Ca 0.41 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 47.27 3k5o h GLY 59 CO -0.13 0.00 0.14 -0.54 0.00 0.00 0.00 176.54 176.01 3k5o s GLU 60 N -3.19 2.69 0.38 4.80 0.41 0.20 -5.12 118.70 118.86 3k5o s GLU 60 Ca 0.06 -0.20 0.03 0.00 -0.41 0.00 0.00 54.97 54.45 3k5o s GLU 60 Cb 0.06 -2.29 -0.04 0.00 -1.78 0.00 0.00 34.13 30.08 3k5o s GLU 60 CO 0.68 -0.82 0.10 -0.65 -0.49 0.00 0.00 175.26 174.08 3k5o s GLN 61 N -5.00 1.82 -1.23 1.61 -1.52 -1.26 -4.93 119.66 109.15 3k5o s GLN 61 Ca 0.56 -2.07 -0.07 0.00 -1.95 0.00 0.00 55.36 51.82 3k5o s GLN 61 Cb -0.11 -0.71 0.01 0.00 -0.22 0.00 0.00 33.01 31.98 3k5o s GLN 61 CO 0.44 -0.36 0.92 0.41 -0.25 0.00 0.00 175.29 176.45 3k5o n GLY 62 N -0.82 -0.36 3.35 3.09 0.00 -1.26 -5.02 105.19 104.17 3k5o n GLY 62 Ca -0.05 0.11 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.24 0.56 0.04 1.61 -0.12 -1.26 -4.19 117.98 111.38 3k5o s PHE 63 Ca 0.46 -0.90 -0.17 0.00 -0.05 0.00 0.00 56.93 56.26 3k5o s PHE 63 Cb -0.20 -0.13 0.03 0.00 -0.63 0.00 0.00 43.02 42.09 3k5o s PHE 63 CO 0.57 -0.74 0.39 -0.98 -0.05 0.00 0.00 175.22 174.41 3k5o s ARG 64 N -4.02 0.89 -0.15 1.99 1.70 -0.42 -4.98 118.95 113.95 3k5o s ARG 64 Ca 0.23 -0.35 0.00 0.00 -0.47 0.00 0.00 55.73 55.13 3k5o s ARG 64 Cb 0.04 0.39 0.02 0.00 -0.57 0.00 0.00 34.95 34.83 3k5o s ARG 64 CO 0.04 -0.30 -0.14 -0.51 -1.08 0.00 0.00 175.30 173.31 3k5o s LEU 65 N -1.94 1.75 -0.03 -1.89 1.43 -1.26 -1.10 118.68 115.65 3k5o s LEU 65 Ca -0.06 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 52.56 3k5o s LEU 65 Cb -0.01 -1.21 -0.01 0.00 0.03 0.00 0.00 46.19 45.00 3k5o s LEU 65 CO -0.02 -0.06 -0.15 -0.89 0.23 0.00 0.00 176.35 175.47 3k5o s THR 66 N 1.47 1.19 0.45 5.49 2.01 -0.85 -4.94 115.64 120.45 3k5o s THR 66 Ca 0.05 -0.61 -0.23 0.00 0.31 0.00 0.00 61.69 61.21 3k5o s THR 66 Cb -0.13 -1.01 -0.08 0.00 0.01 0.00 0.00 72.50 71.29 3k5o s THR 66 CO -0.11 0.34 1.13 -2.16 -0.69 0.00 0.00 174.62 173.13 3k5o s PRO 67 N -0.11 3.84 0.12 4.92 0.04 -1.26 0.23 135.00 142.78 3k5o s PRO 67 Ca 0.01 1.68 0.02 0.00 0.04 0.00 0.00 61.00 62.75 3k5o s PRO 67 Cb -0.08 -2.40 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 3k5o s PRO 67 CO 0.01 -0.46 -0.06 -0.51 0.04 0.00 0.00 177.00 176.02 3k5o s LEU 68 N -3.00 2.42 -0.55 -3.56 1.43 -1.08 -4.83 118.68 109.51 3k5o s LEU 68 Ca 0.63 -1.05 -0.06 0.00 -1.03 0.00 0.00 54.13 52.62 3k5o s LEU 68 Cb -0.26 -0.11 -0.07 0.00 0.03 0.00 0.00 46.19 45.77 3k5o s LEU 68 CO 0.32 -0.47 3.06 0.00 0.23 0.00 0.00 176.35 179.49 3k5o n ALA 69 N -0.12 6.62 -2.55 4.21 0.00 -1.26 -4.55 120.51 122.86 3k5o n ALA 69 Ca -0.10 -2.80 -0.20 0.00 0.00 0.00 0.00 53.44 50.34 3k5o n ALA 69 Cb 0.61 -2.45 -0.12 0.00 0.00 0.00 0.00 19.45 17.50 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 -1.08 2.36 0.15 0.00 1.43 -1.26 -4.84 118.68 115.43 3k5o s LEU 70 Ca 0.63 -0.75 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 3k5o s LEU 70 Cb 0.31 -0.64 -0.04 0.00 0.03 0.00 0.00 46.19 45.85 3k5o s LEU 70 CO -0.10 -0.08 -0.14 -0.54 0.23 0.00 0.00 176.35 175.72 3k5o s LYS 71 N -2.31 1.11 0.73 1.70 1.02 -0.18 -2.21 119.74 119.59 3k5o s LYS 71 Ca 0.07 -1.36 -0.02 0.00 0.02 0.00 0.00 55.97 54.68 3k5o s LYS 71 Cb -0.07 -0.93 0.13 0.00 -0.52 0.00 0.00 37.83 36.43 3k5o s LYS 71 CO 0.03 0.17 1.01 0.16 -0.92 0.00 0.00 175.35 175.80 3k5o s ASP 72 N -2.77 4.29 0.00 2.83 1.47 -0.33 -1.37 116.67 120.79 3k5o s ASP 72 Ca 0.13 -0.29 0.08 0.00 1.18 0.00 0.00 52.55 53.66 3k5o s ASP 72 Cb -0.03 -0.09 0.38 0.00 -0.34 0.00 0.00 42.92 42.84 3k5o s ASP 72 CO 0.04 -1.90 1.16 0.49 0.68 0.00 0.00 175.17 175.64 3k5o n PHE 73 N -2.89 0.00 0.67 2.11 3.01 -1.26 -0.18 117.46 118.92 3k5o n PHE 73 Ca 0.15 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.71 3k5o n PHE 73 Cb 0.60 -0.35 0.28 0.00 -0.01 0.00 0.00 39.48 40.00 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 -1.35 0.42 -1.99 1.38 8.25 -1.26 -4.90 115.22 115.76 3k5o n HIS 74 Ca 0.03 -0.21 -0.13 0.00 -0.26 0.00 0.00 57.72 57.16 3k5o n HIS 74 Cb 0.07 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.16 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 0.98 -0.97 -4.21 -0.41 1.74 0.75 -5.01 116.66 109.52 3k5o n ARG 75 Ca 0.18 0.71 -0.35 0.00 -0.77 0.00 0.00 57.85 57.62 3k5o n ARG 75 Cb 0.48 -4.86 -0.09 0.00 -1.02 0.00 0.00 32.46 26.96 3k5o n ARG 75 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3k5o s GLN 76 N -4.19 3.39 0.51 5.56 -1.52 -1.25 -4.82 119.66 117.35 3k5o s GLN 76 Ca 0.00 -0.36 -0.21 0.00 -1.95 0.00 0.00 55.36 52.84 3k5o s GLN 76 Cb 0.00 -2.98 -0.08 0.00 -0.22 0.00 0.00 33.01 29.73 3k5o s GLN 76 CO 0.00 0.55 0.88 -2.30 -0.25 0.00 0.00 175.29 174.17 3k5o n PRO 77 N 2.65 1.00 -4.42 2.91 -0.02 -1.26 -1.19 135.00 134.67 3k5o n PRO 77 Ca -0.18 0.37 -0.21 0.00 -2.02 0.00 0.00 63.50 61.46 3k5o n PRO 77 Cb 0.53 -1.99 -0.10 0.00 -0.02 0.00 0.00 33.50 31.92 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 -1.45 1.71 0.21 -1.45 -7.23 -0.94 -0.57 120.40 110.68 3k5o s VAL 78 Ca 0.68 -2.15 0.11 0.00 -1.81 0.00 0.00 61.98 58.81 3k5o s VAL 78 Cb -0.49 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.02 3k5o s VAL 78 CO 0.53 -0.35 -0.18 -0.31 -0.31 0.00 0.00 175.10 174.49 3k5o s TYR 79 N -2.97 2.42 -0.15 2.82 4.12 0.17 -2.63 117.35 121.12 3k5o s TYR 79 Ca 0.29 -0.31 -0.07 0.00 0.02 0.00 0.00 57.07 56.99 3k5o s TYR 79 Cb 0.03 -1.16 -0.04 0.00 -1.52 0.00 0.00 41.96 39.27 3k5o s TYR 79 CO 0.11 0.55 0.10 0.20 0.02 0.00 0.00 175.55 176.54 3k5o s GLY 80 N -2.92 2.03 -0.48 0.71 0.00 0.13 -1.01 107.32 105.79 3k5o s GLY 80 Ca 0.24 -0.70 -0.14 0.00 0.00 0.00 0.00 44.72 44.12 3k5o s GLY 80 CO 0.13 -0.16 0.40 -2.27 0.00 0.00 0.00 173.10 171.20 3k5o s LEU 81 N -0.31 5.69 -0.09 0.66 2.96 0.11 -2.00 118.68 125.70 3k5o s LEU 81 Ca 0.10 -1.50 -0.10 0.00 -0.22 0.00 0.00 54.13 52.41 3k5o s LEU 81 Cb -0.12 -2.15 -0.05 0.00 0.50 0.00 0.00 46.19 44.38 3k5o s LEU 81 CO 0.01 -0.68 0.23 -0.31 -1.32 0.00 0.00 176.35 174.27 3k5o s TYR 82 N 1.58 3.62 0.03 5.38 2.02 -0.25 -2.40 117.35 127.32 3k5o s TYR 82 Ca 0.04 0.65 0.00 0.00 -0.37 0.00 0.00 57.07 57.40 3k5o s TYR 82 Cb -0.26 -2.08 -0.02 0.00 -0.40 0.00 0.00 41.96 39.20 3k5o s TYR 82 CO 0.05 0.65 -0.04 0.00 -1.57 0.00 0.00 175.55 174.64 3k5o n ARG 84 N 1.49 0.87 -4.50 0.00 1.74 -1.26 -0.81 116.66 114.19 3k5o n ARG 84 Ca -0.23 -0.60 -0.28 0.00 -0.77 0.00 0.00 57.85 55.97 3k5o n ARG 84 Cb 0.55 -1.49 -0.17 0.00 -1.02 0.00 0.00 32.46 30.34 3k5o n ARG 84 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k5o s ALA 85 N -2.54 1.60 0.14 7.54 0.00 -1.26 -2.38 121.76 124.85 3k5o s ALA 85 Ca 0.21 -0.66 -0.08 0.00 0.00 0.00 0.00 51.96 51.42 3k5o s ALA 85 Cb 0.19 -0.78 -0.06 0.00 0.00 0.00 0.00 23.12 22.47 3k5o s ALA 85 CO 0.56 -0.03 1.38 1.25 0.00 0.00 0.00 175.76 178.92 3k5o h HIS 86 N 7.32 0.89 -0.10 0.00 2.76 -1.92 -1.88 115.15 122.23 3k5o h HIS 86 Ca -0.30 -0.38 -0.05 0.00 -2.20 0.00 0.00 60.37 57.44 3k5o h HIS 86 Cb 1.18 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.98 3k5o h HIS 86 CO 0.48 1.18 -0.18 -0.09 -1.30 0.00 0.00 177.93 178.01 3k5o h ARG 87 N 0.48 0.16 -0.03 5.26 9.65 -1.99 -0.34 114.38 127.55 3k5o h ARG 87 Ca -0.03 -0.04 -0.24 0.00 -1.10 0.00 0.00 59.98 58.57 3k5o h ARG 87 Cb 1.31 -0.02 0.01 0.00 -1.39 0.00 0.00 29.97 29.88 3k5o h ARG 87 CO 0.14 0.34 -0.95 -0.56 2.80 0.00 0.00 179.97 181.74 3k5o h GLN 88 N 0.15 0.62 -0.76 0.20 3.07 -1.97 -2.66 115.11 113.77 3k5o h GLN 88 Ca 0.03 -0.63 -0.04 0.00 0.09 0.00 0.00 58.65 58.10 3k5o h GLN 88 Cb 0.42 0.17 -0.03 0.00 0.08 0.00 0.00 27.48 28.11 3k5o h GLN 88 CO 0.03 1.23 0.32 1.25 0.09 0.00 0.00 178.83 181.75 3k5o h LEU 89 N 0.37 1.03 -0.60 0.06 5.85 -0.78 -2.28 115.31 118.97 3k5o h LEU 89 Ca -0.10 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 3k5o h LEU 89 Cb 1.59 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 3k5o h LEU 89 CO 0.18 0.91 0.31 0.24 -0.34 0.00 0.00 178.44 179.74 3k5o h MET 90 N 1.09 0.84 -0.28 1.25 2.86 -1.00 -2.06 114.93 117.62 3k5o h MET 90 Ca 0.25 -0.11 -0.07 0.00 -2.06 0.00 0.00 59.70 57.71 3k5o h MET 90 Cb 0.19 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 3k5o h MET 90 CO -0.02 0.66 -0.14 -0.97 1.06 0.00 0.00 176.91 177.50 3k5o h ASN 91 N 0.81 0.47 -0.58 1.22 -1.24 -1.22 -1.60 115.58 113.42 3k5o h ASN 91 Ca 0.21 -0.12 -0.07 0.00 0.71 0.00 0.00 56.30 57.03 3k5o h ASN 91 Cb 0.08 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 38.98 3k5o h ASN 91 CO -0.03 0.64 0.12 1.88 -1.29 0.00 0.00 177.43 178.74 3k5o h TYR 92 N 0.44 1.03 -0.70 0.67 0.05 -1.04 0.44 116.97 117.86 3k5o h TYR 92 Ca 0.08 -0.12 -0.06 0.00 0.05 0.00 0.00 58.73 58.68 3k5o h TYR 92 Cb 0.51 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.93 3k5o h TYR 92 CO 0.02 0.87 0.22 0.93 -1.05 0.00 0.00 178.16 179.15 3k5o h GLU 93 N 0.93 1.09 -0.05 4.88 5.08 -0.86 0.42 114.58 126.09 3k5o h GLU 93 Ca 0.19 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 3k5o h GLU 93 Cb 0.38 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3k5o h GLU 93 CO 0.01 0.94 -0.08 -0.22 -1.00 0.00 0.00 179.01 178.66 3k5o h LYS 94 N 1.04 -0.11 -0.42 2.33 3.64 -0.63 0.13 116.57 122.54 3k5o h LYS 94 Ca 0.23 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.63 3k5o h LYS 94 Cb 0.30 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3k5o h LYS 94 CO -0.01 -0.07 0.27 -0.09 -2.27 0.00 0.00 179.45 177.27 3k5o h ARG 95 N -0.12 0.52 -0.44 1.90 2.43 -0.37 -1.33 114.38 116.98 3k5o h ARG 95 Ca 0.05 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 3k5o h ARG 95 Cb 0.18 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 3k5o h ARG 95 CO -0.12 0.35 0.02 -0.07 -1.51 0.00 0.00 179.97 178.64 3k5o h LEU 96 N 0.54 0.74 -0.68 3.80 3.38 0.17 -1.92 115.31 121.34 3k5o h LEU 96 Ca 0.16 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3k5o h LEU 96 Cb -0.03 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 3k5o h LEU 96 CO -0.05 0.86 0.43 -0.09 0.09 0.00 0.00 178.44 179.67 3k5o h ARG 97 N 0.61 0.90 -0.49 1.13 2.43 -0.61 0.22 114.38 118.57 3k5o h ARG 97 Ca 0.13 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 3k5o h ARG 97 Cb 0.46 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 3k5o h ARG 97 CO 0.02 0.62 0.22 1.49 -1.51 0.00 0.00 179.97 180.81 3k5o h GLU 98 N 0.92 0.70 -0.40 0.20 4.81 -1.03 -1.57 114.58 118.21 3k5o h GLU 98 Ca 0.25 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 3k5o h GLU 98 Cb -0.07 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.18 3k5o h GLU 98 CO -0.05 0.56 0.00 0.41 -0.73 0.00 0.00 179.01 179.20 3k5o n GLY 99 N -1.18 0.74 1.95 1.92 0.00 -0.66 -4.91 105.19 103.06 3k5o n GLY 99 Ca 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 0.88 0.50 3.77 -0.02 0.00 -0.59 -5.03 105.19 104.70 3k5o n GLY 100 Ca 0.11 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 4.54 -0.10 1.61 1.01 0.70 -4.98 120.40 121.17 3k5o s VAL 101 Ca 0.00 1.60 -0.27 0.00 0.00 0.00 0.00 61.98 63.31 3k5o s VAL 101 Cb 0.00 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 3k5o s VAL 101 CO 0.00 0.48 0.90 -0.89 0.00 0.00 0.00 175.10 175.59 3k5o s THR 102 N -0.79 4.87 -0.08 3.92 2.01 -1.26 -3.99 115.64 120.32 3k5o s THR 102 Ca 0.35 1.83 0.04 0.00 0.31 0.00 0.00 61.69 64.22 3k5o s THR 102 Cb -0.22 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.08 3k5o s THR 102 CO 0.24 0.07 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.36 3k5o s VAL 103 N 1.71 1.68 -0.00 3.82 1.01 -1.26 -4.18 120.40 123.18 3k5o s VAL 103 Ca 0.44 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.62 3k5o s VAL 103 Cb -0.18 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 3k5o s VAL 103 CO 0.18 0.48 0.04 -0.31 0.00 0.00 0.00 175.10 175.49 3k5o s TYR 104 N 0.40 3.19 -1.49 5.22 2.02 0.14 -4.66 117.35 122.17 3k5o s TYR 104 Ca -0.15 0.15 -0.12 0.00 -0.37 0.00 0.00 57.07 56.58 3k5o s TYR 104 Cb -0.16 -1.71 0.07 0.00 -0.40 0.00 0.00 41.96 39.75 3k5o s TYR 104 CO 0.06 0.51 0.93 0.39 -1.57 0.00 0.00 175.55 175.87 3k5o n GLU 105 N 1.29 -5.63 0.03 -0.62 1.02 -1.26 -1.18 120.64 114.28 3k5o n GLU 105 Ca -0.14 0.65 0.13 0.00 -0.02 0.00 0.00 57.16 57.78 3k5o n GLU 105 Cb 0.53 -5.55 0.35 0.00 -0.02 0.00 0.00 31.44 26.75 3k5o n GLU 105 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3k5o n ALA 106 N -4.51 2.92 0.79 0.62 0.00 -1.26 -3.45 120.51 115.63 3k5o n ALA 106 Ca 0.02 -0.22 0.13 0.00 0.00 0.00 0.00 53.44 53.37 3k5o n ALA 106 Cb 0.54 -1.27 0.47 0.00 0.00 0.00 0.00 19.45 19.20 3k5o n ALA 106 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3k5o n ASP 107 N -1.74 0.46 -4.61 0.00 5.75 -1.26 -4.80 116.55 110.35 3k5o n ASP 107 Ca 0.05 0.49 -0.43 0.00 -0.01 0.00 0.00 54.79 54.89 3k5o n ASP 107 Cb 0.37 -0.58 -0.02 0.00 -1.03 0.00 0.00 41.12 39.86 3k5o n ASP 107 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3k5o s VAL 108 N -3.06 4.07 0.64 2.12 1.01 -1.22 -5.03 120.40 118.93 3k5o s VAL 108 Ca 0.12 1.11 -0.11 0.00 0.00 0.00 0.00 61.98 63.10 3k5o s VAL 108 Cb 0.15 -4.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 3k5o s VAL 108 CO 0.58 -0.80 1.04 -0.13 0.00 0.00 0.00 175.10 175.79 3k5o s ARG 109 N 4.61 3.40 0.22 2.72 1.81 -1.26 -4.84 118.95 125.61 3k5o s ARG 109 Ca 0.55 0.76 -0.09 0.00 -1.72 0.00 0.00 55.73 55.24 3k5o s ARG 109 Cb -0.12 -2.06 0.33 0.00 -0.45 0.00 0.00 34.95 32.66 3k5o s ARG 109 CO 0.30 -0.72 1.70 -1.35 -0.68 0.00 0.00 175.30 174.56 3k5o h PRO 110 N -0.43 0.27 -0.22 3.54 0.11 -1.96 -0.43 132.00 132.87 3k5o h PRO 110 Ca -0.44 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 3k5o h PRO 110 Cb 1.20 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3k5o h PRO 110 CO 0.61 0.18 0.09 -1.35 -0.21 0.00 0.00 178.00 177.32 3k5o h PRO 111 N 0.28 0.34 -0.33 1.05 0.11 -1.94 -2.56 132.00 128.94 3k5o h PRO 111 Ca 0.34 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.32 3k5o h PRO 111 Cb 0.51 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.55 3k5o h PRO 111 CO -0.42 0.38 -0.07 0.93 -0.21 0.00 0.00 178.00 178.62 3k5o h GLU 112 N 0.21 0.53 -0.10 1.05 3.07 -1.90 -1.68 114.58 115.76 3k5o h GLU 112 Ca 0.08 -0.14 0.01 0.00 -0.50 0.00 0.00 59.36 58.81 3k5o h GLU 112 Cb 0.17 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 3k5o h GLU 112 CO -0.01 0.61 0.04 -0.09 -1.40 0.00 0.00 179.01 178.16 3k5o h ARG 113 N 0.50 0.08 -0.28 2.33 9.65 -0.90 0.47 114.38 126.24 3k5o h ARG 113 Ca 0.10 -0.01 -0.04 0.00 -1.10 0.00 0.00 59.98 58.94 3k5o h ARG 113 Cb 0.43 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 3k5o h ARG 113 CO 0.02 0.06 0.03 -0.92 2.80 0.00 0.00 179.97 181.95 3k5o h TYR 114 N 0.09 0.51 -0.28 2.20 3.20 -1.20 -3.05 116.97 118.43 3k5o h TYR 114 Ca 0.04 -0.08 -0.06 0.00 3.14 0.00 0.00 58.73 61.77 3k5o h TYR 114 Cb 0.02 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 3k5o h TYR 114 CO -0.10 0.59 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.87 3k5o h LEU 115 N 0.27 0.55 -0.25 2.82 3.38 -1.21 -3.25 115.31 117.62 3k5o h LEU 115 Ca 0.08 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.73 3k5o h LEU 115 Cb 0.37 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3k5o h LEU 115 CO 0.01 0.79 -0.02 0.24 0.09 0.00 0.00 178.44 179.55 3k5o h MET 116 N 0.30 0.04 0.00 1.13 2.86 -0.95 -1.58 114.93 116.73 3k5o h MET 116 Ca 0.07 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3k5o h MET 116 Cb 0.55 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.21 3k5o h MET 116 CO 0.03 0.03 0.00 0.39 1.06 0.00 0.00 176.91 178.42 3k5o n GLU 117 N -5.18 0.16 -0.30 1.72 -0.58 -1.15 -1.86 120.64 113.45 3k5o n GLU 117 Ca -0.01 0.49 0.07 0.00 -0.42 0.00 0.00 57.16 57.29 3k5o n GLU 117 Cb 0.14 -1.86 0.21 0.00 -0.57 0.00 0.00 31.44 29.35 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 -2.17 2.97 -2.61 3.49 1.74 -0.90 -4.96 116.66 114.22 3k5o n ARG 118 Ca 0.01 -2.36 -0.21 0.00 -0.77 0.00 0.00 57.85 54.52 3k5o n ARG 118 Cb 0.15 -1.48 0.01 0.00 -1.02 0.00 0.00 32.46 30.11 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 0.45 -1.32 -3.73 -1.55 3.72 -0.78 -4.45 117.46 109.80 3k5o n PHE 119 Ca 0.16 0.18 -0.36 0.00 -0.05 0.00 0.00 57.45 57.38 3k5o n PHE 119 Cb 0.59 -4.13 -0.07 0.00 -0.94 0.00 0.00 39.48 34.93 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 -3.08 5.39 0.00 4.37 1.01 -0.65 -4.71 121.20 123.54 3k5o s ILE 120 Ca 0.11 0.32 0.00 0.00 0.00 0.00 0.00 60.65 61.07 3k5o s ILE 120 Cb -0.05 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.93 3k5o s ILE 120 CO 0.13 0.51 0.00 0.35 0.00 0.00 0.00 174.94 175.93 3k5o n THR 121 N 2.83 0.00 0.02 2.92 -2.24 -1.26 -4.47 114.28 112.08 3k5o n THR 121 Ca -0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3k5o n THR 121 Cb 0.53 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.25 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 -0.58 0.25 -4.72 3.42 7.64 -1.26 -4.87 113.62 113.49 3k5o n SER 122 Ca 0.00 0.05 -0.42 0.00 1.01 0.00 0.00 58.87 59.51 3k5o n SER 122 Cb 0.00 -0.07 -0.03 0.00 -1.01 0.00 0.00 64.21 63.11 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 -2.00 4.23 0.12 1.43 0.02 -1.26 -1.86 135.00 135.67 3k5o s PRO 123 Ca 0.00 2.34 -0.07 0.00 0.02 0.00 0.00 61.00 63.29 3k5o s PRO 123 Cb 0.00 -3.15 -0.01 0.00 0.02 0.00 0.00 34.50 31.36 3k5o s PRO 123 CO 0.00 -0.56 0.18 0.14 -0.33 0.00 0.00 177.00 176.43 3k5o s VAL 124 N 0.90 0.12 -0.13 3.83 -7.23 0.92 -1.88 120.40 116.93 3k5o s VAL 124 Ca 0.68 -1.42 -0.01 0.00 -1.81 0.00 0.00 61.98 59.42 3k5o s VAL 124 Cb -0.43 -1.63 -0.02 0.00 0.56 0.00 0.00 36.38 34.86 3k5o s VAL 124 CO 0.34 -0.54 -0.12 0.26 -0.31 0.00 0.00 175.10 174.73 3k5o s TRP 125 N -3.93 2.84 0.00 2.82 0.52 -0.11 -0.10 118.94 120.98 3k5o s TRP 125 Ca 0.12 -0.58 0.04 0.00 0.02 0.00 0.00 56.10 55.71 3k5o s TRP 125 Cb 0.05 -1.85 -0.01 0.00 -1.15 0.00 0.00 33.47 30.50 3k5o s TRP 125 CO -0.05 -0.17 -0.14 0.54 0.02 0.00 0.00 176.95 177.15 3k5o s VAL 126 N 0.31 1.07 0.08 4.03 0.11 0.70 -1.83 120.40 124.87 3k5o s VAL 126 Ca -0.09 -0.68 0.01 0.00 -2.93 0.00 0.00 61.98 58.29 3k5o s VAL 126 Cb -0.16 -0.91 -0.04 0.00 -1.53 0.00 0.00 36.38 33.75 3k5o s VAL 126 CO 0.05 0.22 -0.06 -1.83 -3.33 0.00 0.00 175.10 170.15 3k5o s GLU 127 N -0.52 0.76 0.00 1.54 -1.05 -0.69 -0.64 118.70 118.10 3k5o s GLU 127 Ca 0.04 -1.24 0.00 0.00 -0.15 0.00 0.00 54.97 53.62 3k5o s GLU 127 Cb -0.06 -0.14 0.00 0.00 -0.44 0.00 0.00 34.13 33.49 3k5o s GLU 127 CO -0.00 -0.03 0.00 0.41 0.95 0.00 0.00 175.26 176.59 3k5o n GLY 128 N 0.18 -0.90 3.70 -3.83 0.00 -1.26 -0.54 105.19 102.53 3k5o n GLY 128 Ca -0.14 -1.11 -0.36 0.00 0.00 0.00 0.00 46.02 44.40 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 6.29 -0.23 1.61 1.01 -0.71 -4.91 116.67 115.73 3k5o s ASP 129 Ca 0.00 0.33 -0.29 0.00 0.71 0.00 0.00 52.55 53.30 3k5o s ASP 129 Cb 0.00 -2.15 -0.00 0.00 1.01 0.00 0.00 42.92 41.78 3k5o s ASP 129 CO 0.00 0.07 1.20 -0.32 0.21 0.00 0.00 175.17 176.33 3k5o s MET 130 N 0.78 4.14 -0.23 8.23 -2.45 -1.26 -1.17 119.30 127.34 3k5o s MET 130 Ca 0.12 1.43 -0.02 0.00 -1.25 0.00 0.00 55.69 55.97 3k5o s MET 130 Cb -0.13 -3.76 0.07 0.00 1.25 0.00 0.00 34.83 32.26 3k5o s MET 130 CO 0.03 -0.81 0.05 -1.58 1.05 0.00 0.00 175.02 173.76 3k5o s HIS 131 N 3.66 1.29 -1.33 4.11 5.04 0.18 -4.83 115.29 123.41 3k5o s HIS 131 Ca 0.52 -1.16 -0.06 0.00 -1.54 0.00 0.00 55.06 52.82 3k5o s HIS 131 Cb -0.18 -1.24 0.02 0.00 0.04 0.00 0.00 32.58 31.22 3k5o s HIS 131 CO 0.15 -0.70 1.03 0.09 -2.34 0.00 0.00 174.74 172.96 3k5o n ASN 132 N 4.97 -3.99 0.00 9.88 3.02 -1.26 -1.82 115.26 126.07 3k5o n ASN 132 Ca -0.07 -0.64 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 3k5o n ASN 132 Cb 0.45 -4.75 0.00 0.00 -0.61 0.00 0.00 39.78 34.88 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 -1.62 0.82 3.47 7.41 0.00 -1.26 -5.00 105.19 109.00 3k5o n GLY 133 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 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 2.78 -0.30 2.61 2.01 -0.75 -4.51 115.64 114.07 3k5o s THR 134 Ca 0.00 -1.33 -0.14 0.00 0.31 0.00 0.00 61.69 60.53 3k5o s THR 134 Cb 0.00 -2.21 -0.03 0.00 0.01 0.00 0.00 72.50 70.26 3k5o s THR 134 CO 0.00 0.24 0.32 -0.63 -0.69 0.00 0.00 174.62 173.85 3k5o s ILE 135 N -1.01 5.21 0.21 1.82 1.01 -0.27 0.47 121.20 128.64 3k5o s ILE 135 Ca 0.16 0.29 0.08 0.00 0.00 0.00 0.00 60.65 61.18 3k5o s ILE 135 Cb -0.10 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 3k5o s ILE 135 CO 0.07 0.11 -0.02 0.68 0.00 0.00 0.00 174.94 175.78 3k5o s VAL 136 N 1.96 3.51 -1.44 2.92 -7.23 -0.32 -0.40 120.40 119.40 3k5o s VAL 136 Ca 0.12 -1.66 -0.10 0.00 -1.81 0.00 0.00 61.98 58.53 3k5o s VAL 136 Cb -0.16 -2.80 0.04 0.00 0.56 0.00 0.00 36.38 34.01 3k5o s VAL 136 CO 0.11 -0.21 1.01 0.59 -0.31 0.00 0.00 175.10 176.28 3k5o n ASN 137 N -0.39 -5.76 -4.81 4.85 3.02 -0.81 -1.74 115.26 109.62 3k5o n ASN 137 Ca -0.09 -0.57 -0.31 0.00 -0.03 0.00 0.00 54.58 53.58 3k5o n ASN 137 Cb 0.57 -4.57 0.05 0.00 -0.61 0.00 0.00 39.78 35.21 3k5o n ASN 137 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k5o s ALA 138 N -3.27 2.66 -0.04 5.41 0.00 -0.91 -4.56 121.76 121.04 3k5o s ALA 138 Ca 0.57 0.16 0.02 0.00 0.00 0.00 0.00 51.96 52.71 3k5o s ALA 138 Cb -0.26 -3.20 0.01 0.00 0.00 0.00 0.00 23.12 19.67 3k5o s ALA 138 CO 0.70 -1.19 -0.09 1.03 0.00 0.00 0.00 175.76 176.21 3k5o s ARG 139 N -4.84 1.18 0.08 0.00 0.52 0.30 -4.73 118.95 111.46 3k5o s ARG 139 Ca 0.59 -0.31 0.09 0.00 -0.52 0.00 0.00 55.73 55.59 3k5o s ARG 139 Cb -0.15 -1.06 -0.03 0.00 0.52 0.00 0.00 34.95 34.23 3k5o s ARG 139 CO 0.51 0.06 -0.24 -0.51 0.02 0.00 0.00 175.30 175.14 3k5o s LEU 140 N 0.46 2.23 0.07 2.53 1.02 -1.26 -1.70 118.68 122.02 3k5o s LEU 140 Ca -0.08 -0.63 -0.05 0.00 0.02 0.00 0.00 54.13 53.39 3k5o s LEU 140 Cb -0.12 -1.14 -0.02 0.00 0.02 0.00 0.00 46.19 44.93 3k5o s LEU 140 CO 0.01 0.19 0.08 -1.59 0.02 0.00 0.00 176.35 175.06 3k5o s LYS 141 N -1.54 0.71 0.47 1.70 -2.85 -0.76 -4.98 119.74 112.50 3k5o s LYS 141 Ca 0.11 -1.07 -0.24 0.00 -1.00 0.00 0.00 55.97 53.77 3k5o s LYS 141 Cb -0.10 0.27 -0.07 0.00 -2.06 0.00 0.00 37.83 35.87 3k5o s LYS 141 CO 0.03 -0.18 1.36 -2.14 0.10 0.00 0.00 175.35 174.53 3k5o s PRO 142 N -3.79 3.57 -0.17 1.78 0.02 -1.26 -0.93 135.00 134.22 3k5o s PRO 142 Ca 0.05 2.27 -0.02 0.00 0.02 0.00 0.00 61.00 63.32 3k5o s PRO 142 Cb 0.06 -2.53 -0.01 0.00 0.02 0.00 0.00 34.50 32.03 3k5o s PRO 142 CO -0.10 -0.85 -0.08 -1.58 -0.33 0.00 0.00 177.00 174.05 3k5o s HIS 143 N -1.27 2.91 0.49 6.54 2.46 -0.79 -4.55 115.29 121.08 3k5o s HIS 143 Ca 0.64 -0.73 0.15 0.00 0.47 0.00 0.00 55.06 55.59 3k5o s HIS 143 Cb -0.41 -1.97 1.15 0.00 -0.13 0.00 0.00 32.58 31.23 3k5o s HIS 143 CO 0.51 -0.33 2.09 -1.00 -2.47 0.00 0.00 174.74 173.54 3k5o h PRO 144 N 7.29 0.04 0.00 2.88 0.13 -1.96 -3.39 132.00 136.99 3k5o h PRO 144 Ca -0.33 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3k5o h PRO 144 Cb 1.19 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3k5o h PRO 144 CO 0.59 0.09 0.00 -0.40 -0.23 0.00 0.00 178.00 178.05 3k5o n ASP 145 N -4.47 0.00 -4.74 1.44 5.68 -1.26 -5.10 116.55 108.10 3k5o n ASP 145 Ca -0.02 -0.95 -0.42 0.00 -0.50 0.00 0.00 54.79 52.90 3k5o n ASP 145 Cb 0.14 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 2.84 -0.04 2.11 5.04 -1.26 -5.01 117.35 121.02 3k5o s TYR 146 Ca 0.00 0.62 0.01 0.00 -2.44 0.00 0.00 57.07 55.26 3k5o s TYR 146 Cb 0.00 -4.08 0.02 0.00 0.35 0.00 0.00 41.96 38.25 3k5o s TYR 146 CO 0.00 -3.82 -0.06 1.03 -1.34 0.00 0.00 175.55 171.36 3k5o s ARG 147 N 0.23 0.95 0.36 4.97 1.81 -1.26 -4.71 118.95 121.29 3k5o s ARG 147 Ca 0.68 -0.18 -0.12 0.00 -1.72 0.00 0.00 55.73 54.38 3k5o s ARG 147 Cb -0.48 -0.90 -0.07 0.00 -0.45 0.00 0.00 34.95 33.05 3k5o s ARG 147 CO 0.41 -0.02 0.74 -1.25 -0.68 0.00 0.00 175.30 174.49 3k5o s PRO 148 N 0.71 3.87 0.22 3.54 0.04 -1.26 -5.04 135.00 137.07 3k5o s PRO 148 Ca -0.10 0.53 -0.29 0.00 0.04 0.00 0.00 61.00 61.18 3k5o s PRO 148 Cb -0.13 -2.42 -0.09 0.00 0.04 0.00 0.00 34.50 31.90 3k5o s PRO 148 CO 0.01 0.06 0.89 -1.25 0.04 0.00 0.00 177.00 176.76 3k5o s PRO 149 N -3.43 4.77 0.02 0.56 0.04 -1.26 -5.05 135.00 130.65 3k5o s PRO 149 Ca 0.52 1.39 0.01 0.00 0.04 0.00 0.00 61.00 62.96 3k5o s PRO 149 Cb -0.10 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.14 3k5o s PRO 149 CO 0.25 0.53 -0.05 -0.51 0.04 0.00 0.00 177.00 177.26 3k5o s LEU 150 N -1.15 2.19 0.00 -3.56 1.43 -1.26 -4.82 118.68 111.51 3k5o s LEU 150 Ca 0.40 -0.41 0.03 0.00 -1.03 0.00 0.00 54.13 53.11 3k5o s LEU 150 Cb -0.25 -0.08 -0.03 0.00 0.03 0.00 0.00 46.19 45.85 3k5o s LEU 150 CO 0.30 -0.17 -0.07 -0.54 0.23 0.00 0.00 176.35 176.10 3k5o s LYS 151 N -1.17 2.54 0.29 1.70 1.02 -1.26 -5.00 119.74 117.86 3k5o s LYS 151 Ca -0.09 -0.73 0.10 0.00 0.02 0.00 0.00 55.97 55.27 3k5o s LYS 151 Cb -0.08 -2.50 -0.06 0.00 -0.52 0.00 0.00 37.83 34.68 3k5o s LYS 151 CO -0.00 0.60 -0.14 -1.58 -0.92 0.00 0.00 175.35 173.31 3k5o s TRP 152 N -1.00 2.19 -0.04 3.18 0.51 -1.26 -1.35 118.94 121.18 3k5o s TRP 152 Ca 0.17 -0.47 -0.01 0.00 -2.12 0.00 0.00 56.10 53.68 3k5o s TRP 152 Cb -0.11 -1.10 0.03 0.00 -0.81 0.00 0.00 33.47 31.48 3k5o s TRP 152 CO 0.07 0.57 0.02 0.54 -0.51 0.00 0.00 176.95 177.65 3k5o s VAL 153 N -2.68 0.08 -0.32 4.03 0.11 0.12 -1.97 120.40 119.76 3k5o s VAL 153 Ca 0.30 0.22 -0.12 0.00 -2.93 0.00 0.00 61.98 59.44 3k5o s VAL 153 Cb -0.01 -0.24 -0.03 0.00 -1.53 0.00 0.00 36.38 34.57 3k5o s VAL 153 CO 0.14 0.16 0.23 -0.55 -3.33 0.00 0.00 175.10 171.75 3k5o s SER 154 N 1.54 6.05 -0.06 3.54 0.15 0.11 -0.72 113.70 124.31 3k5o s SER 154 Ca -0.03 -0.31 0.01 0.00 0.70 0.00 0.00 55.95 56.32 3k5o s SER 154 Cb -0.13 -2.13 -0.03 0.00 -1.71 0.00 0.00 66.02 62.02 3k5o s SER 154 CO -0.03 -0.18 -0.06 -0.51 1.20 0.00 0.00 173.24 173.66 3k5o s ILE 155 N 1.73 3.79 -0.13 6.45 2.07 -0.46 -1.45 121.20 133.20 3k5o s ILE 155 Ca 0.06 -0.47 -0.06 0.00 -1.41 0.00 0.00 60.65 58.77 3k5o s ILE 155 Cb -0.17 -2.56 0.05 0.00 0.13 0.00 0.00 42.46 39.91 3k5o s ILE 155 CO 0.11 0.58 0.30 -0.62 -1.91 0.00 0.00 174.94 173.39 3k5o s ASP 156 N -0.88 -0.25 0.14 4.50 2.15 -0.83 -4.60 116.67 116.89 3k5o s ASP 156 Ca 0.13 0.65 0.07 0.00 0.43 0.00 0.00 52.55 53.82 3k5o s ASP 156 Cb -0.11 0.57 -0.04 0.00 -0.30 0.00 0.00 42.92 43.04 3k5o s ASP 156 CO 0.02 -0.18 -0.02 0.27 -0.17 0.00 0.00 175.17 175.09 3k5o s ILE 157 N 1.49 3.75 -0.04 4.11 -4.36 -1.26 -0.56 121.20 124.33 3k5o s ILE 157 Ca -0.08 -1.28 0.07 0.00 -0.26 0.00 0.00 60.65 59.10 3k5o s ILE 157 Cb -0.10 -2.84 -0.01 0.00 1.25 0.00 0.00 42.46 40.76 3k5o s ILE 157 CO -0.10 -0.01 -0.25 -1.61 0.24 0.00 0.00 174.94 173.21 3k5o s GLU 158 N -2.66 2.35 0.35 0.37 0.41 -0.70 -5.01 118.70 113.81 3k5o s GLU 158 Ca 0.26 -0.89 0.05 0.00 -0.41 0.00 0.00 54.97 53.98 3k5o s GLU 158 Cb -0.10 -2.07 -0.03 0.00 -1.78 0.00 0.00 34.13 30.15 3k5o s GLU 158 CO 0.18 0.42 0.20 0.95 -0.49 0.00 0.00 175.26 176.52 3k5o s THR 159 N -0.29 0.27 0.95 3.63 -4.23 -1.26 -0.01 115.64 114.70 3k5o s THR 159 Ca 0.01 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.36 3k5o s THR 159 Cb -0.12 -2.45 0.19 0.00 1.34 0.00 0.00 72.50 71.46 3k5o s THR 159 CO 0.02 0.00 1.31 0.42 -0.54 0.00 0.00 174.62 175.84 3k5o s THR 160 N -3.43 2.00 0.49 3.99 -4.23 0.16 -4.85 115.64 109.77 3k5o s THR 160 Ca 0.34 0.00 0.18 0.00 -1.18 0.00 0.00 61.69 61.03 3k5o s THR 160 Cb 0.03 -3.00 0.33 0.00 1.34 0.00 0.00 72.50 71.20 3k5o s THR 160 CO 0.20 0.00 2.04 -0.09 -0.54 0.00 0.00 174.62 176.23 3k5o h ARG 161 N -1.60 0.15 -0.63 3.99 2.43 -1.95 -1.10 114.38 115.67 3k5o h ARG 161 Ca -0.45 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3k5o h ARG 161 Cb 1.24 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 3k5o h ARG 161 CO 0.40 0.10 0.00 0.72 -1.51 0.00 0.00 179.97 179.68 3k5o n HIS 162 N -4.46 1.07 -0.32 2.20 8.25 -1.26 -4.94 115.22 115.76 3k5o n HIS 162 Ca 0.06 -0.47 0.00 0.00 -0.26 0.00 0.00 57.72 57.05 3k5o n HIS 162 Cb 0.35 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.35 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 1.24 0.91 3.74 -1.41 0.00 -0.41 -5.05 105.19 104.21 3k5o n GLY 163 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.55 4.60 0.36 1.61 2.02 -1.26 -4.64 118.70 120.83 3k5o s GLU 164 Ca 0.00 1.77 -0.28 0.00 0.02 0.00 0.00 54.97 56.47 3k5o s GLU 164 Cb 0.00 -3.24 -0.11 0.00 0.10 0.00 0.00 34.13 30.88 3k5o s GLU 164 CO 0.00 0.10 1.49 -0.51 0.02 0.00 0.00 175.26 176.36 3k5o s LEU 165 N -0.71 4.33 -0.11 1.80 1.43 -1.26 0.37 118.68 124.53 3k5o s LEU 165 Ca 0.48 3.00 -0.04 0.00 -1.03 0.00 0.00 54.13 56.55 3k5o s LEU 165 Cb -0.31 -3.66 -0.05 0.00 0.03 0.00 0.00 46.19 42.20 3k5o s LEU 165 CO 0.37 -0.86 -0.13 -1.22 0.23 0.00 0.00 176.35 174.75 3k5o n TYR 166 N 0.83 0.00 -3.62 0.29 4.01 0.98 -4.83 117.16 114.81 3k5o n TYR 166 Ca 0.02 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.68 3k5o n TYR 166 Cb 0.39 -0.40 -0.02 0.00 -0.31 0.00 0.00 39.34 39.00 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 -3.55 0.96 -0.12 0.00 1.01 -0.01 -1.73 121.20 117.77 3k5o s ILE 168 Ca 0.07 -0.32 -0.03 0.00 0.00 0.00 0.00 60.65 60.37 3k5o s ILE 168 Cb -0.02 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 3k5o s ILE 168 CO -0.04 0.33 0.00 -0.83 0.00 0.00 0.00 174.94 174.41 3k5o s GLY 169 N 1.15 1.84 -0.08 6.18 0.00 0.28 -0.66 107.32 116.03 3k5o s GLY 169 Ca -0.06 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 43.87 3k5o s GLY 169 CO -0.02 -0.37 -0.06 1.08 0.00 0.00 0.00 173.10 173.74 3k5o s LEU 170 N -0.44 1.13 -0.10 0.66 1.43 0.08 -1.97 118.68 119.48 3k5o s LEU 170 Ca 0.08 -0.20 0.01 0.00 -1.03 0.00 0.00 54.13 52.98 3k5o s LEU 170 Cb -0.12 -0.64 0.02 0.00 0.03 0.00 0.00 46.19 45.48 3k5o s LEU 170 CO 0.02 -0.10 -0.10 -0.70 0.23 0.00 0.00 176.35 175.70 3k5o s GLU 171 N 1.42 1.67 0.00 1.70 -6.30 -0.53 -1.77 118.70 114.89 3k5o s GLU 171 Ca -0.02 -0.34 0.00 0.00 -2.50 0.00 0.00 54.97 52.11 3k5o s GLU 171 Cb -0.13 -1.58 0.00 0.00 0.00 0.00 0.00 34.13 32.41 3k5o s GLU 171 CO -0.04 -0.16 0.00 0.41 0.02 0.00 0.00 175.26 175.49 3k5o n GLY 172 N 4.54 1.15 2.79 -1.50 0.00 -0.01 0.10 105.19 112.27 3k5o n GLY 172 Ca -0.16 -1.92 -0.20 0.00 0.00 0.00 0.00 46.02 43.73 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 0.71 3.29 0.00 0.00 -1.26 -5.03 105.19 101.69 3k5o n GLY 174 Ca -0.14 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.16 1.15 -0.06 1.61 1.03 -0.52 -5.14 119.66 117.56 3k5o s GLN 175 Ca 0.00 -1.35 -0.00 0.00 0.04 0.00 0.00 55.36 54.05 3k5o s GLN 175 Cb 0.00 0.33 0.03 0.00 0.03 0.00 0.00 33.01 33.40 3k5o s GLN 175 CO 0.00 -0.40 -0.02 1.03 -2.54 0.00 0.00 175.29 173.37 3k5o s ARG 176 N -4.04 0.68 0.01 9.60 0.52 -1.26 -0.83 118.95 123.64 3k5o s ARG 176 Ca 0.24 0.02 -0.21 0.00 -0.52 0.00 0.00 55.73 55.26 3k5o s ARG 176 Cb 0.05 -0.90 0.04 0.00 0.52 0.00 0.00 34.95 34.66 3k5o s ARG 176 CO 0.04 -0.21 0.46 -1.50 0.02 0.00 0.00 175.30 174.11 3k5o s ILE 177 N 1.51 0.04 -0.07 1.52 2.07 -0.73 -3.04 121.20 122.49 3k5o s ILE 177 Ca -0.02 -0.32 0.01 0.00 -1.41 0.00 0.00 60.65 58.91 3k5o s ILE 177 Cb -0.13 -0.87 0.02 0.00 0.13 0.00 0.00 42.46 41.61 3k5o s ILE 177 CO -0.03 -0.18 -0.07 -0.69 -1.91 0.00 0.00 174.94 172.06 3k5o s VAL 178 N -1.87 0.82 -0.26 4.00 1.01 -0.58 -0.74 120.40 122.78 3k5o s VAL 178 Ca -0.09 -0.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.54 3k5o s VAL 178 Cb -0.02 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.48 3k5o s VAL 178 CO 0.02 0.31 0.23 -0.31 0.00 0.00 0.00 175.10 175.35 3k5o s TYR 179 N 1.25 3.27 -0.05 5.22 2.02 0.16 -1.86 117.35 127.36 3k5o s TYR 179 Ca -0.05 0.24 0.06 0.00 -0.37 0.00 0.00 57.07 56.96 3k5o s TYR 179 Cb -0.14 -2.39 -0.01 0.00 -0.40 0.00 0.00 41.96 39.02 3k5o s TYR 179 CO -0.02 -0.08 -0.24 1.41 -1.57 0.00 0.00 175.55 175.05 3k5o s MET 180 N 1.54 2.34 0.09 -0.62 -2.45 -0.44 -0.83 119.30 118.93 3k5o s MET 180 Ca 0.09 -0.86 -0.31 0.00 -1.25 0.00 0.00 55.69 53.37 3k5o s MET 180 Cb -0.15 -2.03 -0.08 0.00 1.25 0.00 0.00 34.83 33.82 3k5o s MET 180 CO 0.08 0.39 1.52 -1.17 1.05 0.00 0.00 175.02 176.89 3k5o s LEU 181 N -0.21 4.36 0.00 4.11 2.96 -0.68 -0.23 118.68 128.98 3k5o s LEU 181 Ca -0.01 2.40 -0.11 0.00 -0.22 0.00 0.00 54.13 56.19 3k5o s LEU 181 Cb -0.13 -3.57 0.15 0.00 0.50 0.00 0.00 46.19 43.13 3k5o s LEU 181 CO 0.03 -0.78 0.86 0.61 -1.32 0.00 0.00 176.35 175.75 3k5o n GLY 182 N 3.75 -1.35 3.79 7.98 0.00 0.17 -4.82 105.19 114.71 3k5o n GLY 182 Ca 0.14 -1.70 -0.30 0.00 0.00 0.00 0.00 46.02 44.16 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 -4.88 1.73 0.56 1.61 0.04 -1.26 -4.94 135.00 127.85 3k5o s PRO 183 Ca 0.49 0.53 -0.19 0.00 0.04 0.00 0.00 61.00 61.87 3k5o s PRO 183 Cb -0.01 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.59 3k5o s PRO 183 CO 0.34 -1.84 1.16 -2.00 0.04 0.00 0.00 177.00 174.70 3k5o s GLU 184 N -5.18 3.23 0.28 4.56 2.12 -1.26 -5.05 118.70 117.39 3k5o s GLU 184 Ca 0.62 1.70 -0.20 0.00 0.36 0.00 0.00 54.97 57.44 3k5o s GLU 184 Cb -0.15 -1.99 0.02 0.00 0.26 0.00 0.00 34.13 32.27 3k5o s GLU 184 CO 0.54 -0.97 0.69 0.54 -0.54 0.00 0.00 175.26 175.53 3k5o s ASN 185 N -1.69 -0.25 0.46 -1.70 2.20 -1.26 -5.09 114.94 107.61 3k5o s ASN 185 Ca 0.74 -0.64 0.00 0.00 -0.94 0.00 0.00 52.86 52.03 3k5o s ASN 185 Cb -0.26 0.71 0.00 0.00 -2.00 0.00 0.00 41.25 39.70 3k5o s ASN 185 CO 0.29 -1.33 0.00 0.61 -2.94 0.00 0.00 177.10 173.74 3k5o n GLY 186 N -0.45 -0.18 2.93 0.45 0.00 -1.25 -4.28 105.19 102.41 3k5o n GLY 186 Ca -0.04 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 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 2.88 -0.04 1.61 2.15 -1.26 -4.99 116.67 113.01 3k5o s ASP 187 Ca 0.00 -0.66 0.20 0.00 0.43 0.00 0.00 52.55 52.52 3k5o s ASP 187 Cb 0.00 -1.02 0.64 0.00 -0.30 0.00 0.00 42.92 42.24 3k5o s ASP 187 CO 0.00 -0.15 1.54 0.00 -0.17 0.00 0.00 175.17 176.39 3k5o n ALA 188 N 4.82 2.62 -0.29 3.66 0.00 -1.26 -4.59 120.51 125.47 3k5o n ALA 188 Ca -0.13 -1.42 -0.05 0.00 0.00 0.00 0.00 53.44 51.83 3k5o n ALA 188 Cb 0.48 -0.90 0.07 0.00 0.00 0.00 0.00 19.45 19.10 3k5o n ALA 188 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3k5o h SER 189 N 3.94 1.06 -0.52 0.00 0.02 -2.01 -3.17 113.55 112.87 3k5o h SER 189 Ca 0.00 -0.14 -0.13 0.00 -0.84 0.00 0.00 61.79 60.68 3k5o h SER 189 Cb 1.14 -0.27 -0.08 0.00 0.14 0.00 0.00 62.40 63.33 3k5o h SER 189 CO 0.09 0.90 0.17 -0.24 -1.14 0.00 0.00 176.83 176.61 3k5o n SER 190 N -4.34 4.05 -4.76 3.07 2.88 -1.26 -4.99 113.62 108.27 3k5o n SER 190 Ca 0.07 -2.83 -0.39 0.00 -1.33 0.00 0.00 58.87 54.39 3k5o n SER 190 Cb 0.14 -0.67 -0.05 0.00 -0.75 0.00 0.00 64.21 62.88 3k5o n SER 190 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3k5o s LEU 191 N -2.09 4.54 0.34 2.46 1.43 -1.20 -4.93 118.68 119.24 3k5o s LEU 191 Ca 0.39 2.03 0.16 0.00 -1.03 0.00 0.00 54.13 55.69 3k5o s LEU 191 Cb 0.31 -3.71 0.55 0.00 0.03 0.00 0.00 46.19 43.37 3k5o s LEU 191 CO 0.10 -0.00 1.68 -0.78 0.23 0.00 0.00 176.35 177.58 3k5o h ASP 192 N 3.81 0.00 -4.68 2.29 3.58 -1.94 -3.47 116.42 116.01 3k5o h ASP 192 Ca -0.46 0.00 -0.49 0.00 0.42 0.00 0.00 57.03 56.50 3k5o h ASP 192 Cb 1.20 0.00 -0.11 0.00 1.72 0.00 0.00 39.33 42.14 3k5o h ASP 192 CO 0.67 0.46 -0.43 2.22 -2.88 0.00 0.00 179.24 179.28 3k5o n PHE 193 N -3.59 -0.08 -2.87 0.28 1.16 -1.26 -5.09 117.46 106.00 3k5o n PHE 193 Ca -0.00 -2.45 -0.41 0.00 -1.87 0.00 0.00 57.45 52.71 3k5o n PHE 193 Cb 0.55 0.06 -0.04 0.00 -1.61 0.00 0.00 39.48 38.45 3k5o n PHE 193 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 3k5o s GLU 194 N -3.39 4.36 -0.18 3.97 2.56 -1.17 -5.03 118.70 119.82 3k5o s GLU 194 Ca 0.23 1.08 0.01 0.00 0.00 0.00 0.00 54.97 56.29 3k5o s GLU 194 Cb 0.01 -3.54 0.03 0.00 2.00 0.00 0.00 34.13 32.63 3k5o s GLU 194 CO 0.16 -0.24 -0.13 -1.17 -0.56 0.00 0.00 175.26 173.32 3k5o s LEU 195 N 1.83 2.11 -0.10 2.70 2.96 -1.26 -1.52 118.68 125.39 3k5o s LEU 195 Ca 0.41 -0.74 0.04 0.00 -0.22 0.00 0.00 54.13 53.62 3k5o s LEU 195 Cb -0.17 -1.27 -0.00 0.00 0.50 0.00 0.00 46.19 45.25 3k5o s LEU 195 CO 0.15 -0.09 -0.23 -0.70 -1.32 0.00 0.00 176.35 174.16 3k5o s GLU 196 N 1.40 3.07 0.02 1.98 2.12 -0.78 -5.00 118.70 121.51 3k5o s GLU 196 Ca 0.02 -0.86 -0.12 0.00 0.36 0.00 0.00 54.97 54.37 3k5o s GLU 196 Cb -0.15 -2.34 -0.06 0.00 0.26 0.00 0.00 34.13 31.85 3k5o s GLU 196 CO -0.10 0.19 0.39 0.71 -0.54 0.00 0.00 175.26 175.92 3k5o s TYR 197 N 0.32 3.67 0.29 5.30 2.02 -1.26 -1.32 117.35 126.36 3k5o s TYR 197 Ca -0.17 0.89 0.11 0.00 -0.37 0.00 0.00 57.07 57.53 3k5o s TYR 197 Cb -0.18 -2.22 -0.05 0.00 -0.40 0.00 0.00 41.96 39.11 3k5o s TYR 197 CO 0.08 0.61 -0.14 0.14 -1.57 0.00 0.00 175.55 174.66 3k5o s VAL 198 N -1.19 2.60 0.17 0.71 -7.23 0.67 -4.90 120.40 111.23 3k5o s VAL 198 Ca 0.26 -2.28 0.04 0.00 -1.81 0.00 0.00 61.98 58.19 3k5o s VAL 198 Cb -0.15 -2.46 -0.14 0.00 0.56 0.00 0.00 36.38 34.19 3k5o s VAL 198 CO 0.14 -0.36 1.39 0.00 -0.31 0.00 0.00 175.10 175.97 3k5o h ALA 199 N 2.15 0.55 -2.84 1.32 0.00 -1.93 0.48 119.26 118.99 3k5o h ALA 199 Ca -0.41 -0.73 -0.15 0.00 0.00 0.00 0.00 54.91 53.63 3k5o h ALA 199 Cb 1.26 -0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.87 3k5o h ALA 199 CO 0.62 0.93 -0.19 -1.54 0.00 0.00 0.00 179.25 179.07 3k5o s SER 200 N -6.90 0.25 0.15 0.00 1.04 -1.26 -4.63 113.70 102.36 3k5o s SER 200 Ca -0.02 -1.17 -0.13 0.00 0.48 0.00 0.00 55.95 55.10 3k5o s SER 200 Cb 0.10 0.59 0.04 0.00 0.10 0.00 0.00 66.02 66.85 3k5o s SER 200 CO 0.82 -1.17 1.69 0.03 0.98 0.00 0.00 173.24 175.59 3k5o h ARG 201 N 2.25 0.79 -0.31 4.02 3.08 -1.93 -2.12 114.38 120.16 3k5o h ARG 201 Ca -0.28 -0.16 0.07 0.00 0.07 0.00 0.00 59.98 59.68 3k5o h ARG 201 Cb 1.25 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 3k5o h ARG 201 CO 0.39 0.72 0.22 -1.35 -1.07 0.00 0.00 179.97 178.88 3k5o h PRO 202 N 0.70 0.09 0.00 0.04 0.11 -1.96 -0.80 132.00 130.18 3k5o h PRO 202 Ca 0.17 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.18 3k5o h PRO 202 Cb 0.25 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 3k5o h PRO 202 CO -0.01 0.06 -0.42 1.96 -0.21 0.00 0.00 178.00 179.39 3k5o h GLN 203 N 0.10 0.00 -0.61 1.05 4.20 -1.79 -2.18 115.11 115.87 3k5o h GLN 203 Ca 0.14 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.83 3k5o h GLN 203 Cb 0.44 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 3k5o h GLN 203 CO -0.01 0.42 0.31 -0.07 -0.67 0.00 0.00 178.83 178.80 3k5o h LEU 204 N 0.00 0.79 -0.74 1.46 3.38 -1.03 0.26 115.31 119.42 3k5o h LEU 204 Ca -0.00 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3k5o h LEU 204 Cb 0.78 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 3k5o h LEU 204 CO 0.05 0.68 0.09 -0.07 0.09 0.00 0.00 178.44 179.29 3k5o h LEU 205 N 0.84 1.01 -0.70 1.67 3.38 -1.49 0.33 115.31 120.34 3k5o h LEU 205 Ca 0.21 -0.24 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 3k5o h LEU 205 Cb 0.09 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3k5o h LEU 205 CO -0.03 1.01 -0.01 -0.33 0.09 0.00 0.00 178.44 179.17 3k5o h GLU 206 N 0.98 1.00 -0.42 1.13 5.08 -0.81 0.76 114.58 122.30 3k5o h GLU 206 Ca 0.19 -0.31 -0.12 0.00 -1.00 0.00 0.00 59.36 58.13 3k5o h GLU 206 Cb 0.44 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3k5o h GLU 206 CO 0.01 0.98 -0.21 0.87 -1.00 0.00 0.00 179.01 179.67 3k5o h LYS 207 N 0.91 0.89 -0.63 2.33 1.79 -0.09 -1.04 116.57 120.73 3k5o h LYS 207 Ca 0.16 -0.39 0.02 0.00 -2.18 0.00 0.00 60.65 58.27 3k5o h LYS 207 Cb 0.54 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 31.13 3k5o h LYS 207 CO 0.03 1.04 0.40 1.25 -1.08 0.00 0.00 179.45 181.08 3k5o h LEU 208 N 0.71 0.66 -0.71 2.94 5.85 0.00 0.14 115.31 124.90 3k5o h LEU 208 Ca 0.09 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3k5o h LEU 208 Cb 0.77 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 3k5o h LEU 208 CO 0.06 0.46 0.39 0.78 -0.34 0.00 0.00 178.44 179.79 3k5o h ASN 209 N 0.78 0.89 -0.66 1.25 2.35 -0.61 -1.69 115.58 117.90 3k5o h ASN 209 Ca 0.25 -0.10 -0.09 0.00 -0.55 0.00 0.00 56.30 55.82 3k5o h ASN 209 Cb -0.01 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.11 3k5o h ASN 209 CO -0.09 0.73 0.07 0.00 -1.65 0.00 0.00 177.43 176.49 3k5o h ALA 210 N 1.20 0.88 -0.28 -0.83 0.00 -0.36 -1.18 119.26 118.69 3k5o h ALA 210 Ca 0.25 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3k5o h ALA 210 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3k5o h ALA 210 CO -0.04 0.67 0.17 2.35 0.00 0.00 0.00 179.25 182.41 3k5o h TRP 211 N 1.03 0.36 -0.70 0.00 7.01 -0.38 0.14 115.95 123.42 3k5o h TRP 211 Ca 0.20 0.00 -0.07 0.00 2.11 0.00 0.00 58.89 61.13 3k5o h TRP 211 Cb 0.49 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 27.40 3k5o h TRP 211 CO 0.04 0.26 0.16 0.74 -2.79 0.00 0.00 178.44 176.84 3k5o h PHE 212 N 0.36 1.18 -0.31 2.65 0.04 -1.13 0.28 116.94 120.01 3k5o h PHE 212 Ca 0.10 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 3k5o h PHE 212 Cb -0.01 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 37.80 3k5o h PHE 212 CO -0.05 0.96 0.13 0.00 -0.60 0.00 0.00 178.31 178.75 3k5o h ALA 213 N 1.10 0.40 -0.09 2.45 0.00 -0.89 0.77 119.26 123.00 3k5o h ALA 213 Ca 0.22 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 3k5o h ALA 213 Cb 0.39 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.06 3k5o h ALA 213 CO 0.00 -0.01 -0.43 -0.91 0.00 0.00 0.00 179.25 177.91 3k5o h ASN 214 N 0.36 0.54 0.87 0.00 2.35 -0.71 -3.35 115.58 115.63 3k5o h ASN 214 Ca 0.10 -0.64 -0.12 0.00 -0.55 0.00 0.00 56.30 55.09 3k5o h ASN 214 Cb 0.17 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3k5o h ASN 214 CO -0.01 1.09 -1.21 1.88 -1.65 0.00 0.00 177.43 177.54 3k5o h TYR 215 N 0.02 0.00 -6.30 1.19 0.05 -0.50 -3.50 116.97 107.93 3k5o h TYR 215 Ca -0.03 0.00 -0.40 0.00 0.05 0.00 0.00 58.73 58.35 3k5o h TYR 215 Cb 1.08 0.00 0.04 0.00 1.01 0.00 0.00 36.73 38.86 3k5o h TYR 215 CO 0.12 0.41 -0.84 -3.47 -1.05 0.00 0.00 178.16 173.33 3k5o n ASP 216 N -2.87 -5.47 -4.79 3.88 2.03 0.26 -4.94 116.55 104.65 3k5o n ASP 216 Ca -0.06 -0.89 -0.34 0.00 0.52 0.00 0.00 54.79 54.02 3k5o n ASP 216 Cb 0.75 -3.06 -0.00 0.00 -0.72 0.00 0.00 41.12 38.09 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 -5.44 3.40 0.03 -0.67 0.04 -1.26 -4.95 135.00 126.15 3k5o s PRO 217 Ca 0.29 1.38 0.09 0.00 0.04 0.00 0.00 61.00 62.81 3k5o s PRO 217 Cb -0.12 -2.03 -0.22 0.00 0.04 0.00 0.00 34.50 32.17 3k5o s PRO 217 CO 0.87 -0.76 0.93 -0.44 0.04 0.00 0.00 177.00 177.63 3k5o h ASP 218 N 0.92 0.02 -3.79 6.66 3.32 -1.57 -3.46 116.42 118.52 3k5o h ASP 218 Ca -0.48 -0.03 -0.39 0.00 0.02 0.00 0.00 57.03 56.14 3k5o h ASP 218 Cb 1.23 -0.01 -0.31 0.00 0.22 0.00 0.00 39.33 40.47 3k5o h ASP 218 CO 0.57 1.03 -0.77 -0.69 -1.72 0.00 0.00 179.24 177.66 3k5o s VAL 219 N -2.64 0.62 -0.23 -1.35 1.01 -0.46 -0.80 120.40 116.54 3k5o s VAL 219 Ca -0.03 -0.27 -0.05 0.00 0.00 0.00 0.00 61.98 61.63 3k5o s VAL 219 Cb 0.09 -0.56 -0.01 0.00 0.00 0.00 0.00 36.38 35.89 3k5o s VAL 219 CO 0.82 0.20 -0.00 -0.63 0.00 0.00 0.00 175.10 175.49 3k5o s ILE 220 N 0.22 3.71 0.23 2.22 1.01 0.86 -0.71 121.20 128.74 3k5o s ILE 220 Ca -0.03 -0.40 0.11 0.00 0.00 0.00 0.00 60.65 60.34 3k5o s ILE 220 Cb -0.08 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.63 3k5o s ILE 220 CO 0.00 0.38 -0.21 0.27 0.00 0.00 0.00 174.94 175.38 3k5o s ILE 221 N 1.52 2.31 -0.03 2.92 -4.36 0.11 -0.84 121.20 122.83 3k5o s ILE 221 Ca 0.06 -2.22 -0.15 0.00 -0.26 0.00 0.00 60.65 58.08 3k5o s ILE 221 Cb -0.15 -2.17 0.05 0.00 1.25 0.00 0.00 42.46 41.44 3k5o s ILE 221 CO -0.01 -0.31 0.67 0.61 0.24 0.00 0.00 174.94 176.14 3k5o n GLY 222 N -0.22 0.35 3.21 6.27 0.00 -1.15 -1.36 105.19 112.29 3k5o n GLY 222 Ca -0.09 -0.93 -0.35 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.33 3.18 -1.47 1.61 -0.11 -1.26 -0.41 118.94 118.14 3k5o s TRP 223 Ca 0.16 -1.63 -0.05 0.00 1.22 0.00 0.00 56.10 55.80 3k5o s TRP 223 Cb -0.00 -2.12 0.01 0.00 -1.50 0.00 0.00 33.47 29.86 3k5o s TRP 223 CO -0.01 -0.75 0.64 -1.71 -4.62 0.00 0.00 176.95 170.50 3k5o n ASN 224 N 4.68 -5.97 -0.09 5.86 5.15 -1.26 -4.87 115.26 118.76 3k5o n ASN 224 Ca -0.14 -0.30 0.12 0.00 -0.60 0.00 0.00 54.58 53.65 3k5o n ASN 224 Cb 0.45 -4.76 0.49 0.00 -0.53 0.00 0.00 39.78 35.43 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 -1.46 0.90 0.00 3.44 3.04 -1.91 -1.52 116.25 118.75 3k5o h VAL 225 Ca -0.51 -0.15 -0.01 0.00 -1.01 0.00 0.00 66.70 65.01 3k5o h VAL 225 Cb 1.35 0.43 -0.00 0.00 -2.01 0.00 0.00 31.29 31.06 3k5o h VAL 225 CO 0.54 0.08 -0.27 0.58 -1.01 0.00 0.00 177.57 177.49 3k5o h VAL 226 N 0.44 0.19 -0.53 1.51 2.07 -1.95 0.13 116.25 118.11 3k5o h VAL 226 Ca 0.28 -1.18 0.07 0.00 0.82 0.00 0.00 66.70 66.70 3k5o h VAL 226 Cb 0.53 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 3k5o h VAL 226 CO -0.08 0.07 0.35 1.56 0.02 0.00 0.00 177.57 179.49 3k5o h GLN 227 N -1.00 0.42 0.00 1.57 1.08 -1.97 -2.60 115.11 112.61 3k5o h GLN 227 Ca -0.02 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 3k5o h GLN 227 Cb 0.35 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.68 3k5o h GLN 227 CO -0.01 0.28 0.00 0.34 -0.95 0.00 0.00 178.83 178.48 3k5o n PHE 228 N -4.47 0.00 0.06 2.96 7.35 -0.57 -4.46 117.46 118.32 3k5o n PHE 228 Ca 0.08 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.61 3k5o n PHE 228 Cb 0.28 0.00 -0.09 0.00 0.35 0.00 0.00 39.48 40.02 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 -1.56 -0.01 -2.13 3.32 -1.61 -0.57 116.42 113.86 3k5o h ASP 229 Ca 0.00 0.18 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 3k5o h ASP 229 Cb 0.00 0.60 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 3k5o h ASP 229 CO 0.00 -0.51 -0.21 -0.07 -1.72 0.00 0.00 179.24 176.73 3k5o h LEU 230 N -0.66 0.37 -0.10 1.55 3.38 -0.85 -1.40 115.31 117.59 3k5o h LEU 230 Ca 0.02 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 3k5o h LEU 230 Cb 0.71 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 3k5o h LEU 230 CO -0.35 0.59 -0.06 -0.09 0.09 0.00 0.00 178.44 178.63 3k5o h ARG 231 N 0.34 0.22 -0.71 1.13 2.43 -1.21 -1.82 114.38 114.76 3k5o h ARG 231 Ca 0.06 -0.10 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 3k5o h ARG 231 Cb 0.56 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 3k5o h ARG 231 CO 0.04 0.58 0.34 0.52 -1.51 0.00 0.00 179.97 179.94 3k5o h MET 232 N -0.14 1.02 -0.88 0.20 2.86 -1.02 0.15 114.93 117.11 3k5o h MET 232 Ca 0.02 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 3k5o h MET 232 Cb 0.52 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.96 3k5o h MET 232 CO 0.02 0.80 0.52 -0.07 1.06 0.00 0.00 176.91 179.24 3k5o h LEU 233 N 0.99 1.06 -0.63 1.22 3.38 -1.25 -0.57 115.31 119.51 3k5o h LEU 233 Ca 0.24 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 3k5o h LEU 233 Cb 0.12 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3k5o h LEU 233 CO -0.03 0.83 0.25 -0.61 0.09 0.00 0.00 178.44 178.97 3k5o h GLN 234 N 1.21 0.94 -0.74 1.13 5.75 -0.41 -0.43 115.11 122.57 3k5o h GLN 234 Ca 0.31 -0.17 -0.01 0.00 -0.15 0.00 0.00 58.65 58.64 3k5o h GLN 234 Cb -0.03 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 28.33 3k5o h GLN 234 CO -0.06 0.79 0.44 0.87 -2.65 0.00 0.00 178.83 178.22 3k5o h LYS 235 N 0.88 1.01 -0.37 1.69 1.79 0.02 -1.80 116.57 119.78 3k5o h LYS 235 Ca 0.21 -0.10 -0.03 0.00 -2.18 0.00 0.00 60.65 58.56 3k5o h LYS 235 Cb 0.20 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.63 3k5o h LYS 235 CO -0.02 0.73 0.13 0.45 -1.08 0.00 0.00 179.45 179.66 3k5o h HIS 236 N 1.02 0.58 -0.87 -1.35 3.86 -0.63 -1.63 115.15 116.12 3k5o h HIS 236 Ca 0.26 -0.05 0.01 0.00 -1.16 0.00 0.00 60.37 59.43 3k5o h HIS 236 Cb -0.02 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 28.24 3k5o h HIS 236 CO -0.01 0.54 0.57 0.00 0.86 0.00 0.00 177.93 179.90 3k5o h ALA 237 N 0.97 1.36 -0.34 2.45 0.00 -0.79 -0.59 119.26 122.33 3k5o h ALA 237 Ca 0.12 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3k5o h ALA 237 Cb 0.22 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3k5o h ALA 237 CO -0.01 0.59 -0.11 0.93 0.00 0.00 0.00 179.25 180.65 3k5o h GLU 238 N 1.19 0.67 -0.77 0.00 5.08 -1.14 -0.19 114.58 119.42 3k5o h GLU 238 Ca 0.32 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 3k5o h GLU 238 Cb -0.12 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.06 3k5o h GLU 238 CO -0.07 0.85 0.44 -0.09 -1.00 0.00 0.00 179.01 179.14 3k5o h ARG 239 N 0.45 1.06 -0.25 2.33 2.43 -0.76 -2.60 114.38 117.03 3k5o h ARG 239 Ca 0.08 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3k5o h ARG 239 Cb 0.62 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 3k5o h ARG 239 CO 0.04 0.77 0.00 0.66 -1.51 0.00 0.00 179.97 179.93 3k5o n TYR 240 N -4.46 0.32 -3.82 2.20 4.01 -0.28 -4.95 117.16 110.18 3k5o n TYR 240 Ca 0.07 -0.16 -0.25 0.00 -0.16 0.00 0.00 57.90 57.40 3k5o n TYR 240 Cb 0.08 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.13 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 0.61 -4.86 -4.38 -0.72 5.12 -0.43 -5.00 116.66 107.01 3k5o n ARG 241 Ca 0.16 0.58 -0.28 0.00 -1.93 0.00 0.00 57.85 56.38 3k5o n ARG 241 Cb 0.39 -5.20 -0.13 0.00 -1.16 0.00 0.00 32.46 26.36 3k5o n ARG 241 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3k5o s LEU 242 N -6.94 2.32 0.01 0.55 1.43 -0.21 -5.04 118.68 110.79 3k5o s LEU 242 Ca 0.25 -0.74 -0.30 0.00 -1.03 0.00 0.00 54.13 52.31 3k5o s LEU 242 Cb -0.13 -1.17 -0.03 0.00 0.03 0.00 0.00 46.19 44.89 3k5o s LEU 242 CO 0.83 0.16 1.01 -2.16 0.23 0.00 0.00 176.35 176.42 3k5o s PRO 243 N -2.05 4.54 -0.93 1.29 0.04 -1.26 -4.48 135.00 132.14 3k5o s PRO 243 Ca 0.13 1.46 -0.17 0.00 0.04 0.00 0.00 61.00 62.47 3k5o s PRO 243 Cb -0.10 -3.45 0.17 0.00 0.04 0.00 0.00 34.50 31.16 3k5o s PRO 243 CO 0.06 -0.08 1.05 -1.17 0.04 0.00 0.00 177.00 176.90 3k5o s LEU 244 N 1.03 5.59 -1.35 -3.56 2.96 -1.26 -4.96 118.68 117.13 3k5o s LEU 244 Ca 0.53 -2.38 -0.13 0.00 -0.22 0.00 0.00 54.13 51.93 3k5o s LEU 244 Cb -0.22 -2.34 0.10 0.00 0.50 0.00 0.00 46.19 44.23 3k5o s LEU 244 CO 0.28 -0.86 1.96 0.54 -1.32 0.00 0.00 176.35 176.95 3k5o n ARG 245 N 5.58 3.22 -0.00 1.98 1.74 -1.26 -1.27 116.66 126.64 3k5o n ARG 245 Ca 0.22 -3.14 0.12 0.00 -0.77 0.00 0.00 57.85 54.29 3k5o n ARG 245 Cb 0.48 -3.17 0.20 0.00 -1.02 0.00 0.00 32.46 28.95 3k5o n ARG 245 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3k5o n LEU 246 N 5.60 2.64 -4.94 0.55 4.77 -1.15 -4.80 117.00 119.68 3k5o n LEU 246 Ca 0.46 -0.89 -0.20 0.00 -0.03 0.00 0.00 56.01 55.35 3k5o n LEU 246 Cb 0.39 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.46 3k5o n LEU 246 CO 0.83 0.44 -0.03 -0.83 -1.33 0.00 0.00 177.39 176.46 3k5o s GLY 247 N -1.99 1.46 0.98 -0.72 0.00 -0.57 -4.76 107.32 101.71 3k5o s GLY 247 Ca 0.31 -1.40 -0.12 0.00 0.00 0.00 0.00 44.72 43.50 3k5o s GLY 247 CO 0.31 -1.38 1.09 0.50 0.00 0.00 0.00 173.10 173.63 3k5o s ARG 248 N -4.02 0.61 -1.54 2.90 0.52 0.33 -2.31 118.95 115.44 3k5o s ARG 248 Ca 0.39 0.57 -0.05 0.00 -0.52 0.00 0.00 55.73 56.12 3k5o s ARG 248 Cb -0.08 -1.75 0.01 0.00 0.52 0.00 0.00 34.95 33.65 3k5o s ARG 248 CO 0.29 -2.62 0.51 -3.47 0.02 0.00 0.00 175.30 170.02 3k5o n ASP 249 N -4.11 -5.73 -2.58 0.23 2.03 -1.26 -1.87 116.55 103.26 3k5o n ASP 249 Ca 0.06 -0.25 -0.16 0.00 0.52 0.00 0.00 54.79 54.95 3k5o n ASP 249 Cb 0.57 -4.66 -0.00 0.00 -0.72 0.00 0.00 41.12 36.30 3k5o n ASP 249 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 3k5o n ASN 250 N -2.42 -4.45 -4.85 1.67 5.15 -1.21 -4.93 115.26 104.22 3k5o n ASN 250 Ca -0.12 0.05 -0.32 0.00 -0.60 0.00 0.00 54.58 53.60 3k5o n ASN 250 Cb 0.62 -3.73 -0.04 0.00 -0.53 0.00 0.00 39.78 36.10 3k5o n ASN 250 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3k5o s SER 251 N -2.16 6.64 0.63 1.20 1.04 -0.78 -4.89 113.70 115.37 3k5o s SER 251 Ca 0.07 1.41 -0.12 0.00 0.48 0.00 0.00 55.95 57.79 3k5o s SER 251 Cb -0.03 -2.44 -0.03 0.00 0.10 0.00 0.00 66.02 63.62 3k5o s SER 251 CO 0.08 -0.47 1.03 -1.61 0.98 0.00 0.00 173.24 173.26 3k5o s GLU 252 N -3.80 3.48 0.15 4.02 2.02 -1.26 -1.51 118.70 121.80 3k5o s GLU 252 Ca 0.56 0.83 -0.30 0.00 0.02 0.00 0.00 54.97 56.08 3k5o s GLU 252 Cb -0.10 -2.06 -0.07 0.00 0.10 0.00 0.00 34.13 32.00 3k5o s GLU 252 CO 0.28 -0.67 1.07 -1.17 0.02 0.00 0.00 175.26 174.79 3k5o s LEU 253 N -5.14 4.49 0.14 1.80 2.96 -0.40 -4.56 118.68 117.97 3k5o s LEU 253 Ca 0.56 2.01 0.03 0.00 -0.22 0.00 0.00 54.13 56.51 3k5o s LEU 253 Cb -0.12 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 3k5o s LEU 253 CO 0.52 -0.19 0.23 -1.61 -1.32 0.00 0.00 176.35 173.97 3k5o s GLU 254 N -0.20 3.29 0.18 1.98 0.41 -0.83 -4.98 118.70 118.56 3k5o s GLU 254 Ca 0.49 -0.65 0.05 0.00 -0.41 0.00 0.00 54.97 54.46 3k5o s GLU 254 Cb -0.28 -2.89 -0.05 0.00 -1.78 0.00 0.00 34.13 29.14 3k5o s GLU 254 CO 0.33 0.52 -0.09 -1.58 -0.49 0.00 0.00 175.26 173.96 3k5o s TRP 255 N -1.70 1.45 0.00 1.61 0.52 -1.26 -1.28 118.94 118.27 3k5o s TRP 255 Ca 0.33 -0.75 0.00 0.00 0.02 0.00 0.00 56.10 55.71 3k5o s TRP 255 Cb -0.11 -0.75 0.00 0.00 -1.15 0.00 0.00 33.47 31.46 3k5o s TRP 255 CO 0.27 0.13 0.00 0.54 0.02 0.00 0.00 176.95 177.91 3k5o n ARG 256 N -0.30 0.00 -1.39 4.98 5.12 -1.26 -4.98 116.66 118.84 3k5o n ARG 256 Ca -0.09 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 3k5o n ARG 256 Cb 0.61 -0.26 0.00 0.00 -1.16 0.00 0.00 32.46 31.65 3k5o n ARG 256 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 3k5o n PHE 266 N -1.82 -3.69 -4.36 -1.55 3.72 -1.26 -5.12 117.46 103.38 3k5o n PHE 266 Ca 0.00 1.94 -0.31 0.00 -0.05 0.00 0.00 57.45 59.03 3k5o n PHE 266 Cb 0.00 -3.15 -0.10 0.00 -0.94 0.00 0.00 39.48 35.29 3k5o n PHE 266 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k5o s ALA 267 N -2.40 2.91 -0.07 4.37 0.00 -1.26 -5.02 121.76 120.28 3k5o s ALA 267 Ca 0.00 -1.18 0.01 0.00 0.00 0.00 0.00 51.96 50.80 3k5o s ALA 267 Cb 0.00 -0.93 0.02 0.00 0.00 0.00 0.00 23.12 22.21 3k5o s ALA 267 CO 0.00 0.62 -0.09 -1.14 0.00 0.00 0.00 175.76 175.15 3k5o s GLN 268 N -1.87 1.47 -0.25 0.00 0.74 -0.40 -4.93 119.66 114.41 3k5o s GLN 268 Ca 0.19 -0.30 -0.05 0.00 0.05 0.00 0.00 55.36 55.25 3k5o s GLN 268 Cb -0.11 -1.34 -0.00 0.00 1.10 0.00 0.00 33.01 32.65 3k5o s GLN 268 CO 0.11 -0.08 0.01 0.00 -0.55 0.00 0.00 175.29 174.78 3k5o s ALA 269 N 1.03 2.95 0.04 1.58 0.00 -1.26 -1.96 121.76 124.14 3k5o s ALA 269 Ca -0.08 -1.26 -0.34 0.00 0.00 0.00 0.00 51.96 50.28 3k5o s ALA 269 Cb -0.15 -1.90 -0.12 0.00 0.00 0.00 0.00 23.12 20.95 3k5o s ALA 269 CO -0.00 -0.61 1.75 1.17 0.00 0.00 0.00 175.76 178.07 3k5o n LYS 270 N 4.83 2.26 -1.01 0.00 4.81 -1.26 -1.75 118.16 126.04 3k5o n LYS 270 Ca -0.17 0.82 -0.00 0.00 -0.87 0.00 0.00 58.31 58.09 3k5o n LYS 270 Cb 0.50 -2.65 -0.00 0.00 0.02 0.00 0.00 35.03 32.90 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 3.98 0.45 3.04 3.14 0.00 -1.26 0.12 105.19 114.66 3k5o n GLY 271 Ca 0.20 -0.08 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.44 0.48 -0.10 1.61 0.52 -0.72 -4.85 118.95 115.44 3k5o s ARG 272 Ca 0.00 -0.91 -0.07 0.00 -0.52 0.00 0.00 55.73 54.24 3k5o s ARG 272 Cb 0.00 0.09 -0.04 0.00 0.52 0.00 0.00 34.95 35.52 3k5o s ARG 272 CO 0.00 -0.06 0.15 -0.51 0.02 0.00 0.00 175.30 174.90 3k5o s LEU 273 N -2.14 4.39 -0.26 2.53 1.43 0.02 -4.46 118.68 120.19 3k5o s LEU 273 Ca -0.05 0.46 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 3k5o s LEU 273 Cb -0.02 -2.15 0.04 0.00 0.03 0.00 0.00 46.19 44.09 3k5o s LEU 273 CO -0.05 0.39 -0.06 -0.63 0.23 0.00 0.00 176.35 176.23 3k5o s ILE 274 N -1.07 2.72 -0.25 -0.59 1.01 -1.26 -0.09 121.20 121.67 3k5o s ILE 274 Ca 0.17 -1.24 0.03 0.00 0.00 0.00 0.00 60.65 59.60 3k5o s ILE 274 Cb -0.12 -2.46 0.06 0.00 0.01 0.00 0.00 42.46 39.94 3k5o s ILE 274 CO 0.06 0.09 -0.11 -0.63 0.00 0.00 0.00 174.94 174.34 3k5o s ILE 275 N 1.26 2.09 -0.06 2.92 -1.09 -0.02 -4.78 121.20 121.52 3k5o s ILE 275 Ca -0.03 -1.53 -0.29 0.00 -2.23 0.00 0.00 60.65 56.57 3k5o s ILE 275 Cb -0.18 -2.19 -0.02 0.00 -1.58 0.00 0.00 42.46 38.49 3k5o s ILE 275 CO -0.04 0.02 0.95 -0.62 -1.23 0.00 0.00 174.94 174.01 3k5o s ASP 276 N 1.15 7.25 0.25 3.58 2.15 -1.26 -2.94 116.67 126.85 3k5o s ASP 276 Ca -0.07 1.53 -0.04 0.00 0.43 0.00 0.00 52.55 54.40 3k5o s ASP 276 Cb -0.19 -2.54 0.30 0.00 -0.30 0.00 0.00 42.92 40.18 3k5o s ASP 276 CO -0.06 -0.32 1.78 1.23 -0.17 0.00 0.00 175.17 177.63 3k5o h GLY 277 N 7.34 1.00 0.96 2.66 0.00 -1.12 -2.45 103.07 111.46 3k5o h GLY 277 Ca -0.37 -0.60 -0.04 0.00 0.00 0.00 0.00 47.33 46.32 3k5o h GLY 277 CO 0.79 0.56 -0.42 -2.22 0.00 0.00 0.00 176.54 175.26 3k5o h ILE 278 N 0.89 0.08 -0.81 2.60 2.04 -1.92 0.22 117.51 120.61 3k5o h ILE 278 Ca 0.19 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 3k5o h ILE 278 Cb 0.34 0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 3k5o h ILE 278 CO 0.00 0.00 0.51 -0.08 0.00 0.00 0.00 178.15 178.58 3k5o h GLU 279 N -1.24 1.09 -0.25 2.37 4.81 -1.97 -0.82 114.58 118.57 3k5o h GLU 279 Ca -0.12 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 58.99 3k5o h GLU 279 Cb 0.91 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 3k5o h GLU 279 CO 0.20 0.75 0.02 0.00 -0.73 0.00 0.00 179.01 179.24 3k5o h ALA 280 N 1.45 0.33 -0.78 2.92 0.00 -1.37 -0.89 119.26 120.92 3k5o h ALA 280 Ca 0.29 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3k5o h ALA 280 Cb -0.07 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3k5o h ALA 280 CO -0.06 0.04 0.32 -0.07 0.00 0.00 0.00 179.25 179.48 3k5o h LEU 281 N 0.21 1.06 -0.79 0.00 4.07 -0.73 -2.45 115.31 116.69 3k5o h LEU 281 Ca 0.07 -0.17 -0.04 0.00 0.08 0.00 0.00 57.88 57.83 3k5o h LEU 281 Cb 0.38 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 41.81 3k5o h LEU 281 CO 0.01 0.94 0.34 0.11 -1.08 0.00 0.00 178.44 178.76 3k5o h LYS 282 N 1.12 1.16 0.00 1.13 1.57 -1.00 -1.39 116.57 119.16 3k5o h LYS 282 Ca 0.26 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3k5o h LYS 282 Cb 0.20 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3k5o h LYS 282 CO -0.02 0.93 0.00 -1.13 -0.57 0.00 0.00 179.45 178.65 3k5o n SER 283 N -4.32 0.00 -0.66 0.86 3.41 -0.35 -1.45 113.62 111.11 3k5o n SER 283 Ca 0.07 0.16 0.07 0.00 -0.26 0.00 0.00 58.87 58.90 3k5o n SER 283 Cb 0.17 -0.32 0.12 0.00 -0.26 0.00 0.00 64.21 63.92 3k5o n SER 283 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k5o n ALA 284 N -1.32 2.33 -1.67 7.33 0.00 -0.56 -4.99 120.51 121.64 3k5o n ALA 284 Ca 0.06 -0.91 -0.07 0.00 0.00 0.00 0.00 53.44 52.52 3k5o n ALA 284 Cb 0.12 -0.49 -0.02 0.00 0.00 0.00 0.00 19.45 19.07 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 0.73 -0.17 -2.46 0.00 3.72 -0.53 -5.02 117.46 113.74 3k5o n PHE 285 Ca 0.11 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.17 3k5o n PHE 285 Cb 0.40 -1.74 -0.02 0.00 -0.94 0.00 0.00 39.48 37.18 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 -2.30 2.92 -0.04 1.38 0.52 -1.01 -5.03 118.94 115.38 3k5o s TRP 286 Ca 0.00 1.57 0.02 0.00 0.02 0.00 0.00 56.10 57.71 3k5o s TRP 286 Cb 0.00 -3.15 0.01 0.00 -1.15 0.00 0.00 33.47 29.19 3k5o s TRP 286 CO 0.00 -1.05 -0.08 -0.80 0.02 0.00 0.00 176.95 175.04 3k5o s ASN 287 N -1.87 1.21 0.14 2.95 -0.87 -1.26 -4.72 114.94 110.52 3k5o s ASN 287 Ca 0.68 -0.19 -0.01 0.00 -1.57 0.00 0.00 52.86 51.78 3k5o s ASN 287 Cb -0.19 -0.50 -0.04 0.00 -0.02 0.00 0.00 41.25 40.50 3k5o s ASN 287 CO 0.23 0.01 0.05 -0.36 -2.57 0.00 0.00 177.10 174.45 3k5o s PHE 288 N 0.61 0.90 0.18 2.20 0.08 -1.26 -5.04 117.98 115.66 3k5o s PHE 288 Ca -0.10 -1.21 -0.18 0.00 0.12 0.00 0.00 56.93 55.56 3k5o s PHE 288 Cb -0.13 -0.51 0.12 0.00 -0.57 0.00 0.00 43.02 41.94 3k5o s PHE 288 CO 0.01 -0.49 1.63 1.03 -0.10 0.00 0.00 175.22 177.31 3k5o h SER 289 N 2.84 -0.64 -5.33 1.36 0.87 -1.98 -3.44 113.55 107.23 3k5o h SER 289 Ca -0.35 0.16 -0.12 0.00 -1.23 0.00 0.00 61.79 60.25 3k5o h SER 289 Cb 1.20 0.36 -0.12 0.00 -0.44 0.00 0.00 62.40 63.40 3k5o h SER 289 CO 0.59 -0.22 -0.34 -0.94 -0.53 0.00 0.00 176.83 175.40 3k5o s SER 290 N -5.16 0.04 -0.12 6.23 1.04 -1.26 -2.74 113.70 111.72 3k5o s SER 290 Ca -0.14 -1.00 0.18 0.00 0.48 0.00 0.00 55.95 55.46 3k5o s SER 290 Cb 0.15 0.46 0.74 0.00 0.10 0.00 0.00 66.02 67.47 3k5o s SER 290 CO 0.71 -0.95 1.64 0.49 0.98 0.00 0.00 173.24 176.11 3k5o n PHE 291 N -0.27 1.55 -2.21 5.02 3.72 -1.26 -4.23 117.46 119.78 3k5o n PHE 291 Ca -0.04 -0.61 -0.36 0.00 -0.05 0.00 0.00 57.45 56.40 3k5o n PHE 291 Cb 0.63 -0.27 0.01 0.00 -0.94 0.00 0.00 39.48 38.91 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 -0.88 5.70 0.22 4.37 1.04 -1.26 -4.87 113.70 118.02 3k5o s SER 292 Ca 0.52 2.24 -0.08 0.00 0.48 0.00 0.00 55.95 59.11 3k5o s SER 292 Cb 0.34 -2.59 0.28 0.00 0.10 0.00 0.00 66.02 64.14 3k5o s SER 292 CO 0.24 -1.24 1.83 0.25 0.98 0.00 0.00 173.24 175.30 3k5o h LEU 293 N 1.29 0.67 -1.18 2.42 5.85 -2.00 -2.58 115.31 119.79 3k5o h LEU 293 Ca -0.50 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.18 3k5o h LEU 293 Cb 1.27 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 3k5o h LEU 293 CO 0.57 0.43 -0.15 -0.33 -0.34 0.00 0.00 178.44 178.62 3k5o h GLU 294 N 0.81 0.39 -0.08 1.25 3.07 -1.97 -1.40 114.58 116.65 3k5o h GLU 294 Ca 0.33 -0.11 -0.05 0.00 -0.50 0.00 0.00 59.36 59.03 3k5o h GLU 294 Cb 0.17 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 3k5o h GLU 294 CO -0.17 0.54 -0.15 1.15 -1.40 0.00 0.00 179.01 178.98 3k5o h THR 295 N 0.36 1.40 -0.72 1.13 2.02 -1.82 -1.02 112.91 114.26 3k5o h THR 295 Ca 0.07 -1.43 0.00 0.00 0.77 0.00 0.00 66.41 65.82 3k5o h THR 295 Cb 0.48 2.15 -0.04 0.00 -1.74 0.00 0.00 68.15 69.01 3k5o h THR 295 CO 0.03 0.40 0.45 0.58 0.37 0.00 0.00 175.52 177.35 3k5o h VAL 296 N -0.22 1.20 -0.51 3.16 2.07 -1.38 -0.08 116.25 120.48 3k5o h VAL 296 Ca 0.00 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 3k5o h VAL 296 Cb 0.72 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 3k5o h VAL 296 CO 0.03 0.20 0.22 0.00 0.02 0.00 0.00 177.57 178.04 3k5o h ALA 297 N 1.24 0.66 -0.35 1.67 0.00 -1.21 0.66 119.26 121.94 3k5o h ALA 297 Ca 0.26 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 3k5o h ALA 297 Cb -0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3k5o h ALA 297 CO -0.05 0.25 0.01 0.37 0.00 0.00 0.00 179.25 179.82 3k5o h GLN 298 N 0.68 0.61 -0.02 0.00 -0.00 -0.83 0.12 115.11 115.66 3k5o h GLN 298 Ca 0.17 -0.19 -0.25 0.00 -0.00 0.00 0.00 58.65 58.38 3k5o h GLN 298 Cb 0.16 -0.06 0.02 0.00 0.00 0.00 0.00 27.48 27.60 3k5o h GLN 298 CO -0.02 0.72 -0.99 0.93 0.00 0.00 0.00 178.83 179.48 3k5o h GLU 299 N 0.43 0.67 0.18 1.69 5.08 -0.87 -0.55 114.58 121.20 3k5o h GLU 299 Ca 0.10 -0.69 -0.34 0.00 -1.00 0.00 0.00 59.36 57.43 3k5o h GLU 299 Cb 0.44 0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.89 3k5o h GLU 299 CO 0.02 1.28 -1.63 1.25 -1.00 0.00 0.00 179.01 178.92 3k5o h LEU 300 N 0.39 0.59 -1.40 1.33 5.85 0.30 -3.40 115.31 118.97 3k5o h LEU 300 Ca -0.11 -0.81 0.00 0.00 0.84 0.00 0.00 57.88 57.80 3k5o h LEU 300 Cb 1.63 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.47 3k5o h LEU 300 CO 0.19 1.67 0.00 0.18 -0.34 0.00 0.00 178.44 180.14 3k5o n LEU 301 N -3.57 1.51 -1.89 2.25 4.77 0.34 -5.00 117.00 115.41 3k5o n LEU 301 Ca -0.21 -1.13 -0.14 0.00 -0.03 0.00 0.00 56.01 54.51 3k5o n LEU 301 Cb 1.07 -0.01 0.02 0.00 -2.33 0.00 0.00 43.42 42.17 3k5o n LEU 301 CO 0.53 0.34 -0.02 0.61 -1.33 0.00 0.00 177.39 177.51 3k5o n GLY 302 N 0.21 -0.07 0.00 -0.72 0.00 -0.22 -4.94 105.19 99.45 3k5o n GLY 302 Ca 0.03 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3k5o n GLY 302 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3k5o n GLU 303 N -2.71 0.00 -1.56 1.61 4.07 -0.81 -4.91 120.64 116.33 3k5o n GLU 303 Ca -0.08 0.00 -0.48 0.00 -0.06 0.00 0.00 57.16 56.54 3k5o n GLU 303 Cb 0.58 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.91 3k5o n GLU 303 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 3k5o n ASN 309 N 0.00 2.87 -0.33 4.31 5.15 -1.26 -4.85 115.26 121.16 3k5o n ASN 309 Ca 0.00 0.51 0.10 0.00 -0.60 0.00 0.00 54.58 54.59 3k5o n ASN 309 Cb 0.00 -1.39 0.27 0.00 -0.53 0.00 0.00 39.78 38.14 3k5o n ASN 309 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 3k5o h PRO 310 N 12.31 0.69 -0.59 1.20 0.11 -1.98 0.33 132.00 144.06 3k5o h PRO 310 Ca -0.38 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.60 3k5o h PRO 310 Cb 1.28 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 3k5o h PRO 310 CO 0.98 0.46 0.02 -1.49 -0.21 0.00 0.00 178.00 177.76 3k5o h TRP 311 N 0.71 1.12 -0.42 0.65 6.55 -2.01 0.10 115.95 122.65 3k5o h TRP 311 Ca 0.52 -0.18 -0.06 0.00 0.95 0.00 0.00 58.89 60.12 3k5o h TRP 311 Cb 0.77 -0.29 -0.02 0.00 -0.86 0.00 0.00 29.16 28.76 3k5o h TRP 311 CO -0.05 0.99 0.03 -0.44 -1.05 0.00 0.00 178.44 177.92 3k5o h ASP 312 N 0.93 0.71 -0.27 -3.49 3.32 -1.61 -2.23 116.42 113.77 3k5o h ASP 312 Ca 0.17 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.94 3k5o h ASP 312 Cb 0.52 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 3k5o h ASP 312 CO 0.03 0.82 0.17 -0.09 -1.72 0.00 0.00 179.24 178.45 3k5o h ARG 313 N 0.57 0.36 -0.75 3.56 9.65 -0.11 -1.47 114.38 126.18 3k5o h ARG 313 Ca 0.12 -0.02 0.02 0.00 -1.10 0.00 0.00 59.98 59.01 3k5o h ARG 313 Cb 0.43 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.89 3k5o h ARG 313 CO 0.02 0.25 0.48 1.98 2.80 0.00 0.00 179.97 185.50 3k5o h MET 314 N 0.36 0.93 -0.27 0.20 4.05 -0.73 -0.62 114.93 118.85 3k5o h MET 314 Ca 0.10 -0.06 -0.05 0.00 -0.28 0.00 0.00 59.70 59.41 3k5o h MET 314 Cb -0.03 -0.21 -0.01 0.00 -0.80 0.00 0.00 31.60 30.55 3k5o h MET 314 CO -0.02 0.61 -0.03 -0.44 0.23 0.00 0.00 176.91 177.26 3k5o h ASP 315 N 0.96 0.50 -0.46 1.39 3.32 -1.19 -1.33 116.42 119.61 3k5o h ASP 315 Ca 0.30 -0.34 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 3k5o h ASP 315 Cb -0.02 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 3k5o h ASP 315 CO -0.10 0.72 0.14 -0.08 -1.72 0.00 0.00 179.24 178.21 3k5o h GLU 316 N 0.27 0.77 -0.43 3.56 4.57 -0.99 0.57 114.58 122.91 3k5o h GLU 316 Ca 0.07 -0.14 -0.09 0.00 -1.18 0.00 0.00 59.36 58.02 3k5o h GLU 316 Cb 0.48 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 3k5o h GLU 316 CO 0.02 0.69 -0.09 0.82 -1.18 0.00 0.00 179.01 179.27 3k5o h ILE 317 N 0.75 1.27 -0.56 2.32 2.04 -1.02 -0.07 117.51 122.25 3k5o h ILE 317 Ca 0.17 -1.19 -0.09 0.00 1.00 0.00 0.00 64.86 64.75 3k5o h ILE 317 Cb 0.25 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 3k5o h ILE 317 CO -0.01 0.40 -0.02 0.44 0.00 0.00 0.00 178.15 178.96 3k5o h ASP 318 N 0.65 0.97 -0.17 1.72 3.32 -0.39 -2.42 116.42 120.11 3k5o h ASP 318 Ca 0.11 -0.28 -0.13 0.00 0.02 0.00 0.00 57.03 56.75 3k5o h ASP 318 Cb 0.62 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 3k5o h ASP 318 CO 0.04 1.04 -0.35 -0.09 -1.72 0.00 0.00 179.24 178.16 3k5o h ARG 319 N 0.90 0.68 -0.54 3.56 2.43 0.34 -2.64 114.38 119.13 3k5o h ARG 319 Ca 0.16 -0.33 -0.10 0.00 -0.81 0.00 0.00 59.98 58.90 3k5o h ARG 319 Cb 0.56 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 3k5o h ARG 319 CO 0.03 0.93 -0.05 0.00 -1.51 0.00 0.00 179.97 179.38 3k5o h ARG 320 N 0.57 0.98 -0.73 0.20 3.08 -0.79 0.27 114.38 117.96 3k5o h ARG 320 Ca 0.06 -0.34 -0.03 0.00 0.07 0.00 0.00 59.98 59.74 3k5o h ARG 320 Cb 0.87 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.81 3k5o h ARG 320 CO 0.08 1.01 0.35 0.35 -1.07 0.00 0.00 179.97 180.69 3k5o h PHE 321 N 0.86 1.02 -0.31 3.04 3.57 -1.36 0.53 116.94 124.29 3k5o h PHE 321 Ca 0.15 -0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.45 3k5o h PHE 321 Cb 0.60 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 3k5o h PHE 321 CO 0.04 0.74 -0.42 0.00 -2.23 0.00 0.00 178.31 176.45 3k5o h ALA 322 N 1.36 0.67 0.00 2.41 0.00 -1.04 -3.41 119.26 119.26 3k5o h ALA 322 Ca 0.25 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3k5o h ALA 322 Cb 0.10 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3k5o h ALA 322 CO -0.03 0.67 -0.95 0.39 0.00 0.00 0.00 179.25 179.32 3k5o n GLU 323 N -4.03 3.70 -3.16 0.00 1.02 0.88 -4.95 120.64 114.10 3k5o n GLU 323 Ca -0.02 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.89 3k5o n GLU 323 Cb 0.55 -0.98 -0.06 0.00 -0.02 0.00 0.00 31.44 30.93 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 -1.91 -0.35 0.02 1.62 -0.08 0.17 -3.85 116.55 112.17 3k5o n ASP 324 Ca 0.00 -2.71 0.14 0.00 -1.51 0.00 0.00 54.79 50.70 3k5o n ASP 324 Cb 0.46 -0.31 0.59 0.00 2.34 0.00 0.00 41.12 44.21 3k5o n ASP 324 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3k5o h LYS 325 N 4.27 0.18 -0.81 -0.67 1.57 -1.37 -0.75 116.57 118.99 3k5o h LYS 325 Ca 0.08 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.80 3k5o h LYS 325 Cb 0.91 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.14 3k5o h LYS 325 CO 0.42 0.12 0.33 -1.35 -0.57 0.00 0.00 179.45 178.40 3k5o h PRO 326 N 0.19 1.20 -0.45 3.15 0.11 -1.86 0.13 132.00 134.47 3k5o h PRO 326 Ca 0.21 -0.21 -0.08 0.00 0.11 0.00 0.00 66.00 66.02 3k5o h PRO 326 Cb 0.57 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.47 3k5o h PRO 326 CO -0.03 0.96 -0.07 0.00 -0.21 0.00 0.00 178.00 178.65 3k5o h ALA 327 N 1.19 1.05 -0.54 -0.75 0.00 -1.49 -0.14 119.26 118.58 3k5o h ALA 327 Ca 0.27 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 3k5o h ALA 327 Cb 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3k5o h ALA 327 CO -0.02 0.58 -0.08 1.25 0.00 0.00 0.00 179.25 180.98 3k5o h LEU 328 N 0.71 0.98 -0.32 0.00 5.85 -0.98 -1.54 115.31 120.00 3k5o h LEU 328 Ca 0.13 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 3k5o h LEU 328 Cb 0.53 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 3k5o h LEU 328 CO 0.03 1.08 0.14 0.00 -0.34 0.00 0.00 178.44 179.35 3k5o h ALA 329 N 1.01 0.42 -0.47 1.25 0.00 -0.57 -0.13 119.26 120.77 3k5o h ALA 329 Ca 0.14 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.00 3k5o h ALA 329 Cb 0.63 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 3k5o h ALA 329 CO 0.04 0.00 0.15 1.15 0.00 0.00 0.00 179.25 180.59 3k5o h THR 330 N 0.38 0.81 -0.63 0.00 2.02 -0.82 -0.03 112.91 114.64 3k5o h THR 330 Ca 0.11 -0.11 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 3k5o h THR 330 Cb 0.16 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 3k5o h THR 330 CO -0.01 0.06 0.27 0.22 0.37 0.00 0.00 175.52 176.42 3k5o h TYR 331 N 0.31 0.94 0.07 3.16 3.20 -0.97 -1.62 116.97 122.06 3k5o h TYR 331 Ca 0.23 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 3k5o h TYR 331 Cb 0.25 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.24 3k5o h TYR 331 CO -0.18 0.74 -0.03 -0.97 -1.64 0.00 0.00 178.16 176.08 3k5o h ASN 332 N 0.88 -0.08 0.03 -2.11 -1.24 -0.25 -2.48 115.58 110.33 3k5o h ASN 332 Ca 0.21 -0.05 -0.06 0.00 0.71 0.00 0.00 56.30 57.10 3k5o h ASN 332 Cb 0.18 0.02 -0.01 0.00 0.73 0.00 0.00 38.32 39.24 3k5o h ASN 332 CO -0.02 0.00 -0.18 0.25 -1.29 0.00 0.00 177.43 176.19 3k5o h LEU 333 N -0.16 0.28 -0.75 0.34 5.85 -0.98 -2.48 115.31 117.41 3k5o h LEU 333 Ca -0.01 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.67 3k5o h LEU 333 Cb 0.13 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.04 3k5o h LEU 333 CO 0.02 0.48 0.47 0.50 -0.34 0.00 0.00 178.44 179.57 3k5o h LYS 334 N 0.27 0.90 -0.61 1.25 1.63 -1.07 -0.58 116.57 118.35 3k5o h LYS 334 Ca 0.05 -0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 59.73 3k5o h LYS 334 Cb 0.48 -0.20 -0.03 0.00 -0.60 0.00 0.00 32.23 31.89 3k5o h LYS 334 CO 0.03 0.59 0.11 -0.91 -3.45 0.00 0.00 179.45 175.82 3k5o h ASN 335 N 0.92 0.94 -0.29 4.20 4.21 -1.00 0.01 115.58 124.57 3k5o h ASN 335 Ca 0.30 -0.21 -0.00 0.00 1.21 0.00 0.00 56.30 57.60 3k5o h ASN 335 Cb 0.02 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 36.95 3k5o h ASN 335 CO -0.11 0.93 0.17 0.00 -1.29 0.00 0.00 177.43 177.13 3k5o h GLU 337 N 0.36 0.73 -0.53 0.00 5.08 -0.84 -2.11 114.58 117.28 3k5o h GLU 337 Ca 0.10 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3k5o h GLU 337 Cb 0.03 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 3k5o h GLU 337 CO -0.02 0.80 0.32 -0.07 -1.00 0.00 0.00 179.01 179.04 3k5o h LEU 338 N 0.67 0.63 -0.95 1.33 3.38 -0.74 0.24 115.31 119.88 3k5o h LEU 338 Ca 0.12 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3k5o h LEU 338 Cb 0.53 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 3k5o h LEU 338 CO 0.03 0.50 0.29 0.58 0.09 0.00 0.00 178.44 179.93 3k5o h VAL 339 N 0.71 1.24 -0.43 1.22 2.07 -1.14 -0.16 116.25 119.75 3k5o h VAL 339 Ca 0.19 -0.75 -0.12 0.00 0.82 0.00 0.00 66.70 66.84 3k5o h VAL 339 Cb -0.01 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 3k5o h VAL 339 CO -0.04 0.30 -0.20 0.74 0.02 0.00 0.00 177.57 178.40 3k5o h THR 340 N 1.03 1.27 -0.43 2.57 2.02 -0.67 -2.00 112.91 116.70 3k5o h THR 340 Ca 0.24 -1.33 -0.03 0.00 0.77 0.00 0.00 66.41 66.06 3k5o h THR 340 Cb 0.19 1.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 3k5o h THR 340 CO -0.02 0.45 0.15 1.56 0.37 0.00 0.00 175.52 178.03 3k5o h GLN 341 N 0.75 0.66 -0.86 6.66 4.20 0.10 -2.56 115.11 124.05 3k5o h GLN 341 Ca 0.10 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3k5o h GLN 341 Cb 0.74 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.38 3k5o h GLN 341 CO 0.06 0.63 0.54 0.82 -0.67 0.00 0.00 178.83 180.21 3k5o h ILE 342 N 0.55 1.23 -0.09 2.54 2.04 -0.88 -0.92 117.51 121.98 3k5o h ILE 342 Ca 0.14 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 3k5o h ILE 342 Cb 0.24 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.32 3k5o h ILE 342 CO -0.01 0.24 0.05 -0.26 0.00 0.00 0.00 178.15 178.17 3k5o h PHE 343 N 1.18 0.12 -0.60 1.37 0.05 -1.21 -0.88 116.94 116.97 3k5o h PHE 343 Ca 0.31 -0.00 0.02 0.00 3.82 0.00 0.00 57.97 62.12 3k5o h PHE 343 Cb -0.08 -0.04 -0.04 0.00 2.00 0.00 0.00 35.95 37.79 3k5o h PHE 343 CO -0.01 0.17 0.38 0.45 -0.18 0.00 0.00 178.31 179.12 3k5o h HIS 344 N 0.04 0.71 -0.41 -0.55 3.86 -1.19 0.25 115.15 117.86 3k5o h HIS 344 Ca 0.03 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.20 3k5o h HIS 344 Cb 0.09 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.31 3k5o h HIS 344 CO -0.04 0.42 0.03 -0.22 0.86 0.00 0.00 177.93 178.98 3k5o h LYS 345 N 0.75 0.70 0.00 2.45 1.63 -1.03 -2.99 116.57 118.09 3k5o h LYS 345 Ca 0.23 -0.21 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 3k5o h LYS 345 Cb -0.02 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.54 3k5o h LYS 345 CO -0.08 0.77 0.00 1.79 -3.45 0.00 0.00 179.45 178.48 3k5o h THR 346 N 0.54 0.00 -6.10 1.00 1.35 -0.96 -3.47 112.91 105.27 3k5o h THR 346 Ca 0.12 -0.89 -0.44 0.00 -0.55 0.00 0.00 66.41 64.65 3k5o h THR 346 Cb 0.43 1.89 0.04 0.00 -1.73 0.00 0.00 68.15 68.78 3k5o h THR 346 CO 0.01 0.00 -0.74 -0.62 -0.25 0.00 0.00 175.52 173.93 3k5o n GLU 347 N -3.01 -6.36 0.11 4.72 1.02 0.85 -4.89 120.64 113.07 3k5o n GLU 347 Ca 0.04 0.69 -0.02 0.00 -0.02 0.00 0.00 57.16 57.85 3k5o n GLU 347 Cb 0.50 -5.61 0.20 0.00 -0.02 0.00 0.00 31.44 26.50 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 -2.27 1.35 -0.28 -3.67 6.09 -1.87 -3.22 117.51 113.63 3k5o h ILE 348 Ca -0.58 -1.71 -0.06 0.00 -1.37 0.00 0.00 64.86 61.13 3k5o h ILE 348 Cb 1.37 1.84 -0.01 0.00 0.47 0.00 0.00 36.82 40.50 3k5o h ILE 348 CO 0.62 0.50 -0.07 0.24 -3.07 0.00 0.00 178.15 176.38 3k5o h MET 349 N 0.14 0.54 -0.87 2.19 2.86 -1.90 -0.70 114.93 117.18 3k5o h MET 349 Ca 0.01 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.43 3k5o h MET 349 Cb 0.92 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.51 3k5o h MET 349 CO 0.07 0.74 0.49 -1.35 1.06 0.00 0.00 176.91 177.93 3k5o h PRO 350 N 0.30 1.20 -0.55 -0.22 0.11 -1.97 0.32 132.00 131.20 3k5o h PRO 350 Ca 0.07 -0.13 -0.04 0.00 0.11 0.00 0.00 66.00 66.01 3k5o h PRO 350 Cb 0.54 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.39 3k5o h PRO 350 CO 0.03 0.87 0.17 0.35 -0.21 0.00 0.00 178.00 179.20 3k5o h PHE 351 N 1.21 0.89 -0.29 0.65 3.57 -1.55 -0.65 116.94 120.77 3k5o h PHE 351 Ca 0.31 -0.09 -0.11 0.00 3.53 0.00 0.00 57.97 61.61 3k5o h PHE 351 Cb 0.00 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.47 3k5o h PHE 351 CO 0.01 0.75 -0.28 -0.07 -2.23 0.00 0.00 178.31 176.49 3k5o h LEU 352 N 0.76 0.60 -0.35 0.59 3.38 -0.50 -2.02 115.31 117.78 3k5o h LEU 352 Ca 0.18 -0.23 -0.17 0.00 0.09 0.00 0.00 57.88 57.76 3k5o h LEU 352 Cb 0.29 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 3k5o h LEU 352 CO -0.00 0.86 -0.43 -0.07 0.09 0.00 0.00 178.44 178.89 3k5o h LEU 353 N 0.51 0.98 -0.53 1.67 3.38 -0.67 -2.43 115.31 118.22 3k5o h LEU 353 Ca 0.07 -0.49 -0.07 0.00 0.09 0.00 0.00 57.88 57.48 3k5o h LEU 353 Cb 0.75 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3k5o h LEU 353 CO 0.06 1.27 0.08 -0.33 0.09 0.00 0.00 178.44 179.61 3k5o h GLU 354 N 0.71 0.89 -0.72 1.13 4.39 -1.05 -1.95 114.58 117.98 3k5o h GLU 354 Ca 0.05 -0.24 -0.02 0.00 0.34 0.00 0.00 59.36 59.49 3k5o h GLU 354 Cb 1.03 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.54 3k5o h GLU 354 CO 0.10 0.87 0.38 -0.09 -1.16 0.00 0.00 179.01 179.11 3k5o h ARG 355 N 0.77 1.01 -0.09 2.33 2.43 -1.33 -0.88 114.38 118.63 3k5o h ARG 355 Ca 0.16 -0.13 -0.10 0.00 -0.81 0.00 0.00 59.98 59.11 3k5o h ARG 355 Cb 0.42 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 3k5o h ARG 355 CO 0.01 0.76 -0.39 0.00 -1.51 0.00 0.00 179.97 178.84 3k5o h ALA 356 N 1.19 1.18 -0.19 2.80 0.00 -1.33 0.78 119.26 123.69 3k5o h ALA 356 Ca 0.25 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 3k5o h ALA 356 Cb 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3k5o h ALA 356 CO -0.04 0.56 -0.24 1.15 0.00 0.00 0.00 179.25 180.68 3k5o h THR 357 N 0.16 1.25 0.15 0.00 2.02 -0.53 -1.98 112.91 113.97 3k5o h THR 357 Ca 0.02 -1.16 -0.27 0.00 0.77 0.00 0.00 66.41 65.77 3k5o h THR 357 Cb 0.77 1.37 0.01 0.00 -1.74 0.00 0.00 68.15 68.55 3k5o h THR 357 CO 0.06 0.36 -1.28 0.58 0.37 0.00 0.00 175.52 175.61 3k5o h VAL 358 N 0.32 1.19 0.00 3.16 2.07 -0.66 -3.40 116.25 118.93 3k5o h VAL 358 Ca 0.05 -2.49 0.00 0.00 0.82 0.00 0.00 66.70 65.08 3k5o h VAL 358 Cb 0.60 2.91 0.00 0.00 -1.52 0.00 0.00 31.29 33.27 3k5o h VAL 358 CO 0.04 0.74 -0.62 -0.46 0.02 0.00 0.00 177.57 177.29 3k5o n ASN 359 N -3.92 0.58 0.00 0.57 0.23 0.22 -4.96 115.26 107.97 3k5o n ASN 359 Ca -0.21 -0.19 0.00 0.00 -0.53 0.00 0.00 54.58 53.66 3k5o n ASN 359 Cb 0.92 0.33 0.00 0.00 -2.08 0.00 0.00 39.78 38.96 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 1.44 0.89 3.97 4.83 0.00 -0.75 -4.55 105.19 111.02 3k5o n GLY 360 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 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 3.89 0.72 0.99 1.43 -1.26 -4.88 118.68 119.59 3k5o s LEU 361 Ca 0.00 0.10 -0.16 0.00 -1.03 0.00 0.00 54.13 53.04 3k5o s LEU 361 Cb 0.00 -2.99 0.03 0.00 0.03 0.00 0.00 46.19 43.27 3k5o s LEU 361 CO 0.00 -0.48 1.25 -2.84 0.23 0.00 0.00 176.35 174.51 3k5o s PRO 362 N -4.31 2.11 0.47 1.29 0.02 -1.26 -4.62 135.00 128.70 3k5o s PRO 362 Ca 0.44 1.91 0.13 0.00 0.02 0.00 0.00 61.00 63.50 3k5o s PRO 362 Cb -0.10 -1.81 1.08 0.00 0.02 0.00 0.00 34.50 33.69 3k5o s PRO 362 CO 0.34 -1.89 2.08 0.28 -0.33 0.00 0.00 177.00 177.48 3k5o h VAL 363 N -0.16 1.01 -0.18 3.83 2.07 -1.89 -2.47 116.25 118.47 3k5o h VAL 363 Ca -0.49 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 66.94 3k5o h VAL 363 Cb 1.32 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 3k5o h VAL 363 CO 0.50 0.05 0.00 -0.90 0.02 0.00 0.00 177.57 177.24 3k5o n ASP 364 N -4.49 1.88 -4.66 0.57 3.85 -1.26 -4.94 116.55 107.49 3k5o n ASP 364 Ca 0.02 -1.73 -0.45 0.00 -0.71 0.00 0.00 54.79 51.91 3k5o n ASP 364 Cb 0.15 -0.11 -0.03 0.00 -1.35 0.00 0.00 41.12 39.77 3k5o n ASP 364 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.20 175.05 3k5o n ARG 365 N 0.46 2.00 0.07 0.11 3.00 -0.93 -4.96 116.66 116.41 3k5o n ARG 365 Ca 0.17 0.72 -0.08 0.00 -0.00 0.00 0.00 57.85 58.65 3k5o n ARG 365 Cb 0.37 -2.39 -0.05 0.00 0.00 0.00 0.00 32.46 30.38 3k5o n ARG 365 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 3k5o h HIS 366 N 4.63 -0.25 0.00 -0.14 -0.00 -1.92 -3.47 115.15 113.99 3k5o h HIS 366 Ca -0.45 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 59.91 3k5o h HIS 366 Cb 1.27 0.08 0.00 0.00 -0.00 0.00 0.00 27.41 28.77 3k5o h HIS 366 CO 0.58 0.05 0.00 0.41 -0.00 0.00 0.00 177.93 178.97 3k5o n GLY 367 N 0.86 0.66 1.90 5.26 0.00 -1.26 -5.00 105.19 107.62 3k5o n GLY 367 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 4.72 0.47 0.27 -0.02 0.00 -1.26 -4.95 105.19 104.42 3k5o n GLY 368 Ca 0.00 -0.51 0.02 0.00 0.00 0.00 0.00 46.02 45.53 3k5o n GLY 368 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3k5o h SER 369 N 0.00 0.39 -0.14 1.61 4.64 -1.98 0.91 113.55 118.98 3k5o h SER 369 Ca 0.00 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.16 3k5o h SER 369 Cb 0.00 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 3k5o h SER 369 CO 0.00 0.43 -0.34 0.58 -0.87 0.00 0.00 176.83 176.63 3k5o h VAL 370 N 0.42 1.37 -0.16 0.95 2.07 -1.96 -1.34 116.25 117.59 3k5o h VAL 370 Ca 0.10 -1.62 -0.09 0.00 0.82 0.00 0.00 66.70 65.90 3k5o h VAL 370 Cb 0.23 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 3k5o h VAL 370 CO 0.00 0.48 -0.32 0.00 0.02 0.00 0.00 177.57 177.76 3k5o h ALA 371 N 0.53 1.17 -0.35 1.67 0.00 -1.86 -1.99 119.26 118.44 3k5o h ALA 371 Ca -0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 3k5o h ALA 371 Cb 0.95 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3k5o h ALA 371 CO 0.07 0.54 -0.08 0.00 0.00 0.00 0.00 179.25 179.78 3k5o h ALA 372 N 1.40 0.48 -0.68 0.00 0.00 0.88 -0.96 119.26 120.39 3k5o h ALA 372 Ca 0.04 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3k5o h ALA 372 Cb 0.70 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3k5o h ALA 372 CO 0.05 0.33 0.44 0.35 0.00 0.00 0.00 179.25 180.42 3k5o h PHE 373 N 0.46 0.86 -0.73 0.00 3.57 -0.98 -2.10 116.94 118.02 3k5o h PHE 373 Ca 0.09 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 3k5o h PHE 373 Cb 0.59 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 3k5o h PHE 373 CO 0.05 0.55 0.25 0.78 -2.23 0.00 0.00 178.31 177.71 3k5o h GLY 374 N 0.92 1.20 0.89 2.40 0.00 -1.18 0.19 103.07 107.49 3k5o h GLY 374 Ca 0.25 -0.69 0.02 0.00 0.00 0.00 0.00 47.33 46.91 3k5o h GLY 374 CO -0.05 0.65 0.14 0.84 0.00 0.00 0.00 176.54 178.11 3k5o h HIS 375 N 1.08 0.25 -0.08 5.60 -0.00 -0.54 0.73 115.15 122.19 3k5o h HIS 375 Ca 0.24 0.01 -0.17 0.00 -0.00 0.00 0.00 60.37 60.45 3k5o h HIS 375 Cb 0.27 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 27.60 3k5o h HIS 375 CO 0.02 0.14 -0.67 -0.07 -0.00 0.00 0.00 177.93 177.36 3k5o h LEU 376 N 0.29 0.40 -0.04 0.26 3.38 -1.27 -3.35 115.31 114.98 3k5o h LEU 376 Ca 0.11 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 3k5o h LEU 376 Cb 0.02 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3k5o h LEU 376 CO -0.07 0.95 -0.17 0.22 0.09 0.00 0.00 178.44 179.47 3k5o h TYR 377 N 0.24 0.24 -0.78 1.13 3.20 -0.18 -3.39 116.97 117.45 3k5o h TYR 377 Ca -0.02 -0.10 0.15 0.00 3.14 0.00 0.00 58.73 61.89 3k5o h TYR 377 Cb 1.21 -0.04 -0.14 0.00 1.54 0.00 0.00 36.73 39.30 3k5o h TYR 377 CO 0.03 0.80 -0.26 0.74 -1.64 0.00 0.00 178.16 177.84 3k5o h PHE 378 N -0.38 -0.63 -0.81 -3.82 -1.00 -1.00 -1.66 116.94 107.63 3k5o h PHE 378 Ca -0.01 0.08 0.04 0.00 2.81 0.00 0.00 57.97 60.88 3k5o h PHE 378 Cb 0.82 0.40 -0.05 0.00 3.61 0.00 0.00 35.95 40.72 3k5o h PHE 378 CO 0.14 -0.36 0.52 -1.00 -1.61 0.00 0.00 178.31 175.99 3k5o h PRO 379 N -0.04 0.97 -0.11 1.51 0.13 -1.76 -0.75 132.00 131.95 3k5o h PRO 379 Ca 0.34 -0.06 -0.14 0.00 -0.87 0.00 0.00 66.00 65.27 3k5o h PRO 379 Cb 0.58 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.48 3k5o h PRO 379 CO -0.81 0.64 -0.55 0.00 -0.23 0.00 0.00 178.00 177.05 3k5o h ARG 380 N 1.00 0.32 -0.42 0.86 3.08 -1.63 -2.44 114.38 115.15 3k5o h ARG 380 Ca 0.33 -0.21 -0.04 0.00 0.07 0.00 0.00 59.98 60.14 3k5o h ARG 380 Cb 0.03 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3k5o h ARG 380 CO -0.12 0.79 0.11 1.98 -1.07 0.00 0.00 179.97 181.67 3k5o h MET 381 N 0.25 0.66 -0.48 0.04 4.05 -0.75 -1.48 114.93 117.22 3k5o h MET 381 Ca 0.00 -0.15 -0.10 0.00 -0.28 0.00 0.00 59.70 59.17 3k5o h MET 381 Cb 1.05 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.74 3k5o h MET 381 CO 0.09 0.67 -0.10 0.45 0.23 0.00 0.00 176.91 178.25 3k5o h HIS 382 N 0.54 0.98 0.00 1.39 3.86 -1.09 -1.27 115.15 119.56 3k5o h HIS 382 Ca 0.13 -0.19 -0.05 0.00 -1.16 0.00 0.00 60.37 59.11 3k5o h HIS 382 Cb 0.29 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.51 3k5o h HIS 382 CO 0.02 0.94 -0.24 -0.09 0.86 0.00 0.00 177.93 179.41 3k5o h ARG 383 N 0.80 0.00 -0.00 2.45 2.43 -1.30 -0.53 114.38 118.22 3k5o h ARG 383 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3k5o h ARG 383 Cb 0.62 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 3k5o h ARG 383 CO 0.04 0.24 -0.16 0.00 -1.51 0.00 0.00 179.97 178.58 3k5o n ALA 384 N -2.42 2.80 -0.02 2.80 0.00 -0.57 -4.92 120.51 118.18 3k5o n ALA 384 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3k5o n ALA 384 Cb 0.31 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 1.38 0.99 3.28 0.00 0.00 -0.21 -5.06 105.19 105.58 3k5o n GLY 385 Ca 0.11 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 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 1.55 0.23 1.61 2.02 -0.53 -1.01 117.35 119.23 3k5o s TYR 386 Ca 0.00 -0.55 0.08 0.00 -0.37 0.00 0.00 57.07 56.23 3k5o s TYR 386 Cb 0.00 -0.78 -0.04 0.00 -0.40 0.00 0.00 41.96 40.74 3k5o s TYR 386 CO 0.00 0.22 0.06 0.14 -1.57 0.00 0.00 175.55 174.40 3k5o s VAL 387 N -2.33 3.83 0.35 0.71 -7.23 -0.47 -3.34 120.40 111.92 3k5o s VAL 387 Ca 0.13 -1.61 -0.27 0.00 -1.81 0.00 0.00 61.98 58.43 3k5o s VAL 387 Cb -0.04 -3.02 -0.09 0.00 0.56 0.00 0.00 36.38 33.79 3k5o s VAL 387 CO 0.04 -0.28 1.11 0.00 -0.31 0.00 0.00 175.10 175.66 3k5o s ALA 388 N -2.09 3.26 0.67 1.32 0.00 -1.26 -4.35 121.76 119.31 3k5o s ALA 388 Ca 0.31 0.88 -0.12 0.00 0.00 0.00 0.00 51.96 53.03 3k5o s ALA 388 Cb -0.08 -3.33 -0.00 0.00 0.00 0.00 0.00 23.12 19.71 3k5o s ALA 388 CO 0.21 -0.30 1.06 -1.25 0.00 0.00 0.00 175.76 175.48 3k5o s PRO 389 N -1.98 3.02 0.69 0.00 0.04 -1.26 -4.29 135.00 131.22 3k5o s PRO 389 Ca 0.52 1.01 -0.05 0.00 0.04 0.00 0.00 61.00 62.52 3k5o s PRO 389 Cb -0.29 -2.00 0.08 0.00 0.04 0.00 0.00 34.50 32.33 3k5o s PRO 389 CO 0.37 -1.04 0.98 -0.80 0.04 0.00 0.00 177.00 176.56 3k5o s ASN 390 N -3.56 4.70 0.58 6.66 0.01 -1.26 -4.84 114.94 117.23 3k5o s ASN 390 Ca 0.59 0.19 -0.14 0.00 -0.71 0.00 0.00 52.86 52.79 3k5o s ASN 390 Cb -0.14 -0.79 -0.05 0.00 0.41 0.00 0.00 41.25 40.67 3k5o s ASN 390 CO 0.51 -1.63 1.02 -0.22 -1.51 0.00 0.00 177.10 175.27 3k5o s LEU 391 N -5.17 3.43 -0.98 0.60 2.96 -1.26 -4.43 118.68 113.82 3k5o s LEU 391 Ca 0.62 1.59 -0.09 0.00 -0.22 0.00 0.00 54.13 56.03 3k5o s LEU 391 Cb -0.09 -4.50 0.09 0.00 0.50 0.00 0.00 46.19 42.18 3k5o s LEU 391 CO 0.44 -0.91 0.31 0.61 -1.32 0.00 0.00 176.35 175.48 3k5o n GLY 392 N -1.79 -0.47 0.11 7.98 0.00 -1.26 -4.83 105.19 104.92 3k5o n GLY 392 Ca 0.07 0.05 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.32 0.68 -3.02 1.61 1.02 -1.26 -4.89 120.64 111.45 3k5o n GLU 393 Ca 0.02 0.08 -0.41 0.00 -0.02 0.00 0.00 57.16 56.82 3k5o n GLU 393 Cb 0.51 -1.55 -0.06 0.00 -0.02 0.00 0.00 31.44 30.32 3k5o n GLU 393 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3k5o s VAL 394 N -2.51 4.89 0.44 2.62 0.11 -1.26 -5.05 120.40 119.64 3k5o s VAL 394 Ca -0.18 1.18 -0.23 0.00 -2.93 0.00 0.00 61.98 59.82 3k5o s VAL 394 Cb 0.07 -4.04 -0.08 0.00 -1.53 0.00 0.00 36.38 30.80 3k5o s VAL 394 CO 0.76 -0.10 1.12 -2.16 -3.33 0.00 0.00 175.10 171.38 3k5o s PRO 395 N 2.71 3.88 -0.03 1.54 0.04 -1.26 -4.98 135.00 136.91 3k5o s PRO 395 Ca 0.29 1.65 -0.22 0.00 0.04 0.00 0.00 61.00 62.76 3k5o s PRO 395 Cb -0.15 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 31.93 3k5o s PRO 395 CO 0.10 -0.42 0.67 -1.25 0.04 0.00 0.00 177.00 176.14 3k5o s PRO 396 N -2.69 4.41 0.48 0.56 0.04 -1.26 -4.74 135.00 131.81 3k5o s PRO 396 Ca 0.62 0.84 -0.02 0.00 0.04 0.00 0.00 61.00 62.48 3k5o s PRO 396 Cb -0.25 -3.40 -0.01 0.00 0.04 0.00 0.00 34.50 30.88 3k5o s PRO 396 CO 0.31 0.20 0.74 -1.01 0.04 0.00 0.00 177.00 177.28 3k5o s HIS 397 N 0.33 3.32 0.08 0.56 3.76 -1.26 -5.03 115.29 117.06 3k5o s HIS 397 Ca 0.35 0.46 -0.31 0.00 -0.15 0.00 0.00 55.06 55.41 3k5o s HIS 397 Cb -0.18 -2.38 -0.09 0.00 1.11 0.00 0.00 32.58 31.04 3k5o s HIS 397 CO 0.18 -0.41 1.70 0.00 -0.85 0.00 0.00 174.74 175.36 3k5o s ALA 398 N -2.68 3.70 -0.24 -1.40 0.00 -1.26 -4.98 121.76 114.90 3k5o s ALA 398 Ca 0.49 1.27 -0.17 0.00 0.00 0.00 0.00 51.96 53.55 3k5o s ALA 398 Cb -0.10 -3.71 -0.03 0.00 0.00 0.00 0.00 23.12 19.27 3k5o s ALA 398 CO 0.41 -1.14 0.47 0.45 0.00 0.00 0.00 175.76 175.94 3k5o s SER 399 N 2.50 6.42 0.37 0.00 0.15 -1.26 -5.05 113.70 116.83 3k5o s SER 399 Ca 0.76 0.50 -0.27 0.00 0.70 0.00 0.00 55.95 57.63 3k5o s SER 399 Cb -0.41 -2.26 -0.11 0.00 -1.71 0.00 0.00 66.02 61.52 3k5o s SER 399 CO 0.33 -0.21 1.27 -2.65 1.20 0.00 0.00 173.24 173.18 3k5o n PRO 400 N 5.19 2.03 -2.37 5.44 -0.02 -1.26 -5.04 135.00 138.97 3k5o n PRO 400 Ca -0.06 0.71 -0.25 0.00 -2.02 0.00 0.00 63.50 61.89 3k5o n PRO 400 Cb 0.50 -2.33 0.10 0.00 -0.02 0.00 0.00 33.50 31.75 3k5o n PRO 400 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3k5o s GLY 401 N -0.40 1.75 0.82 -1.23 0.00 -1.26 -4.98 107.32 102.02 3k5o s GLY 401 Ca 0.57 -1.35 -0.11 0.00 0.00 0.00 0.00 44.72 43.83 3k5o s GLY 401 CO 0.61 -0.83 1.09 -0.32 0.00 0.00 0.00 173.10 173.64 3k5o s GLY 402 N -4.66 1.63 0.34 0.20 0.00 -1.26 -4.95 107.32 98.62 3k5o s GLY 402 Ca 0.65 -0.08 -0.29 0.00 0.00 0.00 0.00 44.72 45.00 3k5o s GLY 402 CO 0.45 0.35 1.40 -0.47 0.00 0.00 0.00 173.10 174.83 3k5o s TYR 403 N -3.04 2.86 -0.14 1.90 5.04 -1.26 -4.85 117.35 117.86 3k5o s TYR 403 Ca 0.62 1.26 -0.06 0.00 -2.44 0.00 0.00 57.07 56.45 3k5o s TYR 403 Cb -0.16 -3.84 0.06 0.00 0.35 0.00 0.00 41.96 38.37 3k5o s TYR 403 CO 0.55 -2.44 0.30 0.08 -1.34 0.00 0.00 175.55 172.70 3k5o s VAL 404 N -0.97 -0.32 -0.12 3.14 1.01 -1.26 -2.54 120.40 119.34 3k5o s VAL 404 Ca 0.52 0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.65 3k5o s VAL 404 Cb -0.43 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 3k5o s VAL 404 CO 0.56 0.09 0.12 -0.32 0.00 0.00 0.00 175.10 175.55 3k5o s MET 405 N 2.07 3.42 0.15 2.72 1.75 -0.94 -5.04 119.30 123.43 3k5o s MET 405 Ca -0.03 -0.18 -0.31 0.00 -1.25 0.00 0.00 55.69 53.92 3k5o s MET 405 Cb -0.11 -3.15 -0.10 0.00 2.84 0.00 0.00 34.83 34.32 3k5o s MET 405 CO -0.10 0.74 1.54 -0.51 -0.65 0.00 0.00 175.02 176.04 3k5o s ASP 406 N -0.92 6.63 0.98 1.11 1.01 -1.26 -4.44 116.67 119.78 3k5o s ASP 406 Ca 0.14 2.56 -0.12 0.00 0.71 0.00 0.00 52.55 55.84 3k5o s ASP 406 Cb -0.12 -2.59 0.18 0.00 1.01 0.00 0.00 42.92 41.40 3k5o s ASP 406 CO 0.03 -0.79 1.10 -0.94 0.21 0.00 0.00 175.17 174.78 3k5o s SER 407 N 1.16 2.81 -0.42 0.27 1.04 -0.84 -4.80 113.70 112.92 3k5o s SER 407 Ca 0.69 1.19 0.01 0.00 0.48 0.00 0.00 55.95 58.31 3k5o s SER 407 Cb -0.42 -1.84 0.11 0.00 0.10 0.00 0.00 66.02 63.97 3k5o s SER 407 CO 0.31 -3.01 0.18 -0.13 0.98 0.00 0.00 173.24 171.56 3k5o s ARG 408 N -5.00 1.86 0.62 4.02 0.52 0.21 -4.69 118.95 116.48 3k5o s ARG 408 Ca 0.65 -2.03 -0.19 0.00 -0.52 0.00 0.00 55.73 53.64 3k5o s ARG 408 Cb -0.18 -3.42 -0.02 0.00 0.52 0.00 0.00 34.95 31.84 3k5o s ARG 408 CO 0.57 -1.04 1.29 -1.25 0.02 0.00 0.00 175.30 174.89 3k5o s PRO 409 N 0.73 2.74 0.00 3.54 0.04 -1.26 -4.84 135.00 135.96 3k5o s PRO 409 Ca 0.11 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.20 3k5o s PRO 409 Cb -0.21 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.39 3k5o s PRO 409 CO -0.05 -1.44 0.00 0.41 0.04 0.00 0.00 177.00 175.96 3k5o n GLY 410 N 0.79 0.62 3.33 0.56 0.00 0.89 -4.97 105.19 106.41 3k5o n GLY 410 Ca 0.14 -1.44 -0.34 0.00 0.00 0.00 0.00 46.02 44.39 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 2.78 0.36 0.99 2.96 -1.26 -0.20 118.68 124.32 3k5o s LEU 411 Ca 0.00 -0.37 0.07 0.00 -0.22 0.00 0.00 54.13 53.61 3k5o s LEU 411 Cb 0.00 -1.67 -0.07 0.00 0.50 0.00 0.00 46.19 44.95 3k5o s LEU 411 CO 0.00 0.06 -0.02 -0.31 -1.32 0.00 0.00 176.35 174.77 3k5o s TYR 412 N 0.96 2.32 -0.17 5.38 2.02 0.19 -4.97 117.35 123.08 3k5o s TYR 412 Ca -0.01 -0.68 -0.00 0.00 -0.37 0.00 0.00 57.07 56.00 3k5o s TYR 412 Cb -0.15 -1.51 0.00 0.00 -0.40 0.00 0.00 41.96 39.90 3k5o s TYR 412 CO -0.00 0.38 -0.14 -0.51 -1.57 0.00 0.00 175.55 173.70 3k5o s ASP 413 N -3.61 3.69 -0.18 2.29 1.01 -1.26 -0.94 116.67 117.67 3k5o s ASP 413 Ca 0.34 -0.48 -0.09 0.00 0.71 0.00 0.00 52.55 53.03 3k5o s ASP 413 Cb 0.07 -1.58 0.03 0.00 1.01 0.00 0.00 42.92 42.46 3k5o s ASP 413 CO 0.16 0.06 0.17 -1.20 0.21 0.00 0.00 175.17 174.58 3k5o n SER 414 N 4.23 -1.85 -4.04 0.27 7.64 -0.01 -4.06 113.62 115.80 3k5o n SER 414 Ca -0.19 1.17 -0.23 0.00 1.01 0.00 0.00 58.87 60.63 3k5o n SER 414 Cb 0.51 -4.67 -0.16 0.00 -1.01 0.00 0.00 64.21 58.88 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 -0.74 1.05 -0.00 0.44 1.01 -0.40 -1.95 120.40 119.81 3k5o s VAL 415 Ca -0.20 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 3k5o s VAL 415 Cb 0.01 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 3k5o s VAL 415 CO 0.68 0.32 0.09 -0.76 0.00 0.00 0.00 175.10 175.44 3k5o s LEU 416 N 0.33 3.96 -0.19 3.92 1.43 0.15 -0.79 118.68 127.49 3k5o s LEU 416 Ca -0.07 0.17 -0.02 0.00 -1.03 0.00 0.00 54.13 53.17 3k5o s LEU 416 Cb -0.12 -2.33 -0.01 0.00 0.03 0.00 0.00 46.19 43.76 3k5o s LEU 416 CO 0.02 0.27 -0.09 -0.69 0.23 0.00 0.00 176.35 176.09 3k5o s VAL 417 N -1.22 3.13 -0.16 -1.59 1.01 0.03 0.06 120.40 121.66 3k5o s VAL 417 Ca 0.24 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.63 3k5o s VAL 417 Cb -0.12 -2.38 0.02 0.00 0.00 0.00 0.00 36.38 33.90 3k5o s VAL 417 CO 0.15 0.47 -0.19 -0.76 0.00 0.00 0.00 175.10 174.78 3k5o s LEU 418 N 1.08 1.98 0.07 3.92 1.43 0.05 -1.10 118.68 126.11 3k5o s LEU 418 Ca 0.00 -0.58 0.04 0.00 -1.03 0.00 0.00 54.13 52.56 3k5o s LEU 418 Cb -0.15 -1.37 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 3k5o s LEU 418 CO -0.02 0.00 -0.12 1.51 0.23 0.00 0.00 176.35 177.96 3k5o s ASP 419 N 1.23 1.42 0.22 2.29 -4.77 -0.35 -0.99 116.67 115.71 3k5o s ASP 419 Ca 0.02 -0.65 -0.30 0.00 -3.30 0.00 0.00 52.55 48.32 3k5o s ASP 419 Cb -0.14 -0.01 -0.09 0.00 -1.09 0.00 0.00 42.92 41.59 3k5o s ASP 419 CO -0.09 -0.16 1.21 -0.31 0.70 0.00 0.00 175.17 176.52 3k5o s TYR 420 N -1.61 3.38 -0.08 2.11 2.02 -0.68 -0.09 117.35 122.41 3k5o s TYR 420 Ca -0.02 1.44 -0.30 0.00 -0.37 0.00 0.00 57.07 57.82 3k5o s TYR 420 Cb -0.08 -3.46 -0.03 0.00 -0.40 0.00 0.00 41.96 37.99 3k5o s TYR 420 CO 0.01 -1.28 1.15 0.21 -1.57 0.00 0.00 175.55 174.07 3k5o s LYS 421 N -0.61 4.36 -0.75 -0.62 2.20 0.59 -4.04 119.74 120.87 3k5o s LYS 421 Ca 0.51 1.59 -0.11 0.00 -0.36 0.00 0.00 55.97 57.61 3k5o s LYS 421 Cb -0.34 -3.56 0.01 0.00 -1.51 0.00 0.00 37.83 32.43 3k5o s LYS 421 CO 0.40 -0.43 0.48 0.43 -0.36 0.00 0.00 175.35 175.87 3k5o n SER 422 N 5.24 -3.42 0.03 1.43 7.64 -1.26 -4.66 113.62 118.62 3k5o n SER 422 Ca 0.11 -0.85 -0.12 0.00 1.01 0.00 0.00 58.87 59.01 3k5o n SER 422 Cb 0.47 -1.20 -0.06 0.00 -1.01 0.00 0.00 64.21 62.41 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 -0.50 -1.16 -0.47 -3.43 5.85 -1.96 -1.23 115.31 112.41 3k5o h LEU 423 Ca -0.51 0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.38 3k5o h LEU 423 Cb 1.07 0.47 -0.03 0.00 0.37 0.00 0.00 40.66 42.54 3k5o h LEU 423 CO 0.33 -0.42 0.29 1.88 -0.34 0.00 0.00 178.44 180.18 3k5o h TYR 424 N -0.50 0.54 -0.63 1.25 0.05 -1.96 -0.31 116.97 115.41 3k5o h TYR 424 Ca 0.07 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.83 3k5o h TYR 424 Cb 0.61 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 38.14 3k5o h TYR 424 CO -0.42 0.31 0.25 -1.35 -1.05 0.00 0.00 178.16 175.90 3k5o h PRO 425 N 0.58 0.92 -0.06 4.88 0.11 -1.83 -1.08 132.00 135.51 3k5o h PRO 425 Ca 0.19 -0.15 -0.08 0.00 0.11 0.00 0.00 66.00 66.06 3k5o h PRO 425 Cb 0.00 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 30.94 3k5o h PRO 425 CO -0.08 0.76 -0.35 0.66 -0.21 0.00 0.00 178.00 178.78 3k5o h SER 426 N 0.90 0.13 -0.32 -2.05 4.64 -0.58 -1.22 113.55 115.05 3k5o h SER 426 Ca 0.21 -0.04 -0.16 0.00 -0.47 0.00 0.00 61.79 61.33 3k5o h SER 426 Cb 0.18 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 3k5o h SER 426 CO -0.02 0.47 -0.40 0.40 -0.87 0.00 0.00 176.83 176.41 3k5o h ILE 427 N 0.11 1.28 -0.73 0.95 2.04 -0.38 0.67 117.51 121.45 3k5o h ILE 427 Ca 0.01 -1.58 -0.05 0.00 1.00 0.00 0.00 64.86 64.24 3k5o h ILE 427 Cb 0.67 1.43 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 3k5o h ILE 427 CO 0.05 0.52 0.24 0.40 0.00 0.00 0.00 178.15 179.36 3k5o h ILE 428 N 0.71 1.26 -0.16 -0.67 2.04 -0.80 0.88 117.51 120.77 3k5o h ILE 428 Ca 0.05 -0.88 -0.08 0.00 1.00 0.00 0.00 64.86 64.96 3k5o h ILE 428 Cb 0.99 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 3k5o h ILE 428 CO 0.10 0.35 -0.21 0.03 0.00 0.00 0.00 178.15 178.41 3k5o h ARG 429 N 1.08 0.42 -0.11 2.37 3.08 -1.01 -2.27 114.38 117.94 3k5o h ARG 429 Ca 0.24 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 3k5o h ARG 429 Cb 0.28 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.35 3k5o h ARG 429 CO -0.01 0.82 -0.23 1.15 -1.07 0.00 0.00 179.97 180.62 3k5o h THR 430 N 0.04 1.38 -0.64 2.04 2.02 -0.76 -3.33 112.91 113.67 3k5o h THR 430 Ca 0.02 -1.52 0.00 0.00 0.77 0.00 0.00 66.41 65.68 3k5o h THR 430 Cb 0.77 2.09 0.00 0.00 -1.74 0.00 0.00 68.15 69.27 3k5o h THR 430 CO 0.05 0.44 0.00 0.49 0.37 0.00 0.00 175.52 176.87 3k5o n PHE 431 N -4.48 1.50 -3.01 3.16 3.72 0.29 -4.57 117.46 114.07 3k5o n PHE 431 Ca -0.07 -0.62 -0.21 0.00 -0.05 0.00 0.00 57.45 56.50 3k5o n PHE 431 Cb 0.43 -0.26 0.01 0.00 -0.94 0.00 0.00 39.48 38.73 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 1.06 -1.90 -4.66 4.37 4.77 -0.87 -4.90 117.00 114.87 3k5o n LEU 432 Ca 0.26 -0.22 -0.42 0.00 -0.03 0.00 0.00 56.01 55.59 3k5o n LEU 432 Cb 0.90 -2.48 -0.03 0.00 -2.33 0.00 0.00 43.42 39.48 3k5o n LEU 432 CO 0.24 0.11 1.53 -0.63 -1.33 0.00 0.00 177.39 177.30 3k5o s ILE 433 N -2.97 3.11 -0.12 -0.08 -1.09 -1.10 -4.81 121.20 114.14 3k5o s ILE 433 Ca 0.27 0.20 -0.25 0.00 -2.23 0.00 0.00 60.65 58.64 3k5o s ILE 433 Cb -0.13 -3.13 0.06 0.00 -1.58 0.00 0.00 42.46 37.68 3k5o s ILE 433 CO 0.33 -0.02 0.61 -0.62 -1.23 0.00 0.00 174.94 174.02 3k5o s ASP 434 N 3.95 -0.60 0.06 3.58 2.15 -1.26 -4.49 116.67 120.06 3k5o s ASP 434 Ca 0.84 0.86 -0.21 0.00 0.43 0.00 0.00 52.55 54.46 3k5o s ASP 434 Cb -0.41 0.81 -0.13 0.00 -0.30 0.00 0.00 42.92 42.89 3k5o s ASP 434 CO 0.38 -0.44 1.49 -0.65 -0.17 0.00 0.00 175.17 175.78 3k5o h PRO 435 N 3.94 0.24 -0.37 4.34 0.11 -1.92 -1.12 132.00 137.22 3k5o h PRO 435 Ca -0.28 -0.08 -0.09 0.00 0.11 0.00 0.00 66.00 65.66 3k5o h PRO 435 Cb 1.15 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3k5o h PRO 435 CO 0.28 0.47 -0.13 0.28 -0.21 0.00 0.00 178.00 178.68 3k5o h VAL 436 N -0.01 1.28 -0.27 3.15 2.07 -1.97 -2.93 116.25 117.57 3k5o h VAL 436 Ca 0.04 -1.24 0.02 0.00 0.82 0.00 0.00 66.70 66.34 3k5o h VAL 436 Cb 0.35 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3k5o h VAL 436 CO 0.01 0.41 0.18 1.23 0.02 0.00 0.00 177.57 179.41 3k5o h GLY 437 N 0.55 0.32 0.65 2.17 0.00 -1.65 -0.58 103.07 104.52 3k5o h GLY 437 Ca 0.09 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.27 3k5o h GLY 437 CO 0.05 0.11 -0.09 -2.00 0.00 0.00 0.00 176.54 174.60 3k5o h LEU 438 N 0.29 0.23 -0.29 3.11 5.85 -1.04 0.81 115.31 124.28 3k5o h LEU 438 Ca 0.11 -0.49 0.05 0.00 0.84 0.00 0.00 57.88 58.39 3k5o h LEU 438 Cb 0.07 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 40.99 3k5o h LEU 438 CO -0.02 0.67 -0.00 0.58 -0.34 0.00 0.00 178.44 179.33 3k5o h VAL 439 N -0.21 0.79 -0.36 1.05 2.07 -1.28 0.25 116.25 118.57 3k5o h VAL 439 Ca 0.01 -0.03 -0.09 0.00 0.82 0.00 0.00 66.70 67.41 3k5o h VAL 439 Cb 0.61 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3k5o h VAL 439 CO 0.02 0.02 -0.13 -0.08 0.02 0.00 0.00 177.57 177.42 3k5o h GLU 440 N 0.08 0.72 -0.56 1.57 4.57 -1.08 -3.26 114.58 116.63 3k5o h GLU 440 Ca 0.14 -0.30 -0.02 0.00 -1.18 0.00 0.00 59.36 58.00 3k5o h GLU 440 Cb 0.18 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.71 3k5o h GLU 440 CO -0.23 0.89 0.27 0.78 -1.18 0.00 0.00 179.01 179.54 3k5o h GLY 441 N 0.51 0.86 2.00 1.92 0.00 0.11 -2.64 103.07 105.83 3k5o h GLY 441 Ca 0.09 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 3k5o h GLY 441 CO 0.04 0.41 -0.05 -0.33 0.00 0.00 0.00 176.54 176.61 3k5o h MET 442 N 0.76 0.00 -0.03 4.80 2.86 -0.89 -1.26 114.93 121.17 3k5o h MET 442 Ca 0.19 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.73 3k5o h MET 442 Cb 0.12 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 3k5o h MET 442 CO -0.02 0.05 -0.46 0.00 1.06 0.00 0.00 176.91 177.54 3k5o h ALA 443 N 1.95 1.19 -2.10 6.32 0.00 -1.51 -3.28 119.26 121.82 3k5o h ALA 443 Ca -0.00 -0.43 -0.55 0.00 0.00 0.00 0.00 54.91 53.94 3k5o h ALA 443 Cb 0.11 -0.08 -0.41 0.00 0.00 0.00 0.00 17.79 17.41 3k5o h ALA 443 CO 0.01 0.59 -0.94 1.04 0.00 0.00 0.00 179.25 179.95 3k5o n GLN 444 N -3.99 1.74 -0.95 0.00 6.02 -0.60 -5.02 117.38 114.58 3k5o n GLN 444 Ca -0.02 -3.93 -0.32 0.00 -0.01 0.00 0.00 57.00 52.72 3k5o n GLN 444 Cb 0.49 -1.81 -0.04 0.00 1.02 0.00 0.00 30.24 29.90 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 0.51 1.80 -3.97 -1.09 -0.04 -0.58 -4.22 135.00 127.41 3k5o n PRO 445 Ca 0.26 -1.66 -0.09 0.00 -0.04 0.00 0.00 63.50 61.97 3k5o n PRO 445 Cb 0.52 -2.69 -0.11 0.00 -0.04 0.00 0.00 33.50 31.18 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 4.19 0.24 0.61 3.54 1.47 -1.26 -5.02 116.67 120.44 3k5o s ASP 446 Ca 0.48 -0.46 0.30 0.00 1.18 0.00 0.00 52.55 54.04 3k5o s ASP 446 Cb 0.12 0.09 1.60 0.00 -0.34 0.00 0.00 42.92 44.39 3k5o s ASP 446 CO 0.04 -0.27 1.97 1.55 0.68 0.00 0.00 175.17 179.14 3k5o h PRO 447 N 4.76 0.00 0.08 2.11 0.13 -1.88 0.52 132.00 137.72 3k5o h PRO 447 Ca -0.32 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.56 3k5o h PRO 447 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3k5o h PRO 447 CO 0.42 0.00 -1.12 1.49 -0.23 0.00 0.00 178.00 178.56 3k5o h GLU 448 N 0.00 0.30 0.00 0.86 4.81 -1.97 -3.36 114.58 115.22 3k5o h GLU 448 Ca 0.11 -0.43 -0.15 0.00 -0.13 0.00 0.00 59.36 58.76 3k5o h GLU 448 Cb 0.81 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.30 3k5o h GLU 448 CO -0.00 1.16 -2.14 0.72 -0.73 0.00 0.00 179.01 178.02 3k5o n HIS 449 N -3.60 0.03 -4.18 0.92 8.25 -0.80 -4.96 115.22 110.87 3k5o n HIS 449 Ca -0.07 0.01 -0.12 0.00 -0.26 0.00 0.00 57.72 57.27 3k5o n HIS 449 Cb 0.95 -0.72 -0.09 0.00 1.12 0.00 0.00 29.99 31.25 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 -4.94 0.29 -0.05 0.41 0.01 0.18 -1.02 113.70 108.56 3k5o s SER 450 Ca -0.09 -1.37 0.04 0.00 1.31 0.00 0.00 55.95 55.85 3k5o s SER 450 Cb 0.11 0.43 -0.00 0.00 0.21 0.00 0.00 66.02 66.77 3k5o s SER 450 CO 0.87 -0.92 -0.19 0.28 0.41 0.00 0.00 173.24 173.70 3k5o s THR 451 N -4.04 1.59 0.05 1.44 -1.32 0.16 -3.75 115.64 109.77 3k5o s THR 451 Ca 0.37 -0.79 -0.29 0.00 -1.21 0.00 0.00 61.69 59.76 3k5o s THR 451 Cb 0.05 -1.36 -0.05 0.00 -1.51 0.00 0.00 72.50 69.63 3k5o s THR 451 CO 0.13 0.45 0.93 -0.70 -2.21 0.00 0.00 174.62 173.22 3k5o s GLU 452 N 0.07 4.60 0.00 7.08 2.12 -1.26 -1.05 118.70 130.26 3k5o s GLU 452 Ca -0.06 1.36 0.00 0.00 0.36 0.00 0.00 54.97 56.63 3k5o s GLU 452 Cb -0.13 -3.41 0.00 0.00 0.26 0.00 0.00 34.13 30.85 3k5o s GLU 452 CO 0.03 0.11 0.00 0.41 -0.54 0.00 0.00 175.26 175.27 3k5o n GLY 453 N 2.57 0.49 3.30 -1.50 0.00 0.11 -4.97 105.19 105.20 3k5o n GLY 453 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 3k5o n GLY 453 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k5o s PHE 454 N 2.36 1.66 -0.93 1.61 0.08 -1.26 -4.74 117.98 116.77 3k5o s PHE 454 Ca 0.00 -0.50 -0.01 0.00 0.12 0.00 0.00 56.93 56.54 3k5o s PHE 454 Cb 0.00 -0.84 -0.01 0.00 -0.57 0.00 0.00 43.02 41.60 3k5o s PHE 454 CO 0.00 0.26 0.78 1.28 -0.10 0.00 0.00 175.22 177.43 3k5o n LEU 455 N 0.40 -3.79 -1.89 -0.37 4.32 -1.26 -2.45 117.00 111.96 3k5o n LEU 455 Ca -0.14 -0.50 -0.13 0.00 -0.02 0.00 0.00 56.01 55.22 3k5o n LEU 455 Cb 0.57 -2.58 -0.03 0.00 -1.62 0.00 0.00 43.42 39.76 3k5o n LEU 455 CO 0.28 0.27 -0.15 0.47 -1.22 0.00 0.00 177.39 177.04 3k5o n ASP 456 N -2.70 -3.74 -4.69 -1.43 8.00 -1.26 -4.92 116.55 105.80 3k5o n ASP 456 Ca -0.20 0.25 -0.40 0.00 0.71 0.00 0.00 54.79 55.15 3k5o n ASP 456 Cb 0.63 -3.33 -0.05 0.00 -0.02 0.00 0.00 41.12 38.34 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 -2.37 3.44 -0.07 2.24 0.00 -1.03 -4.98 121.76 119.00 3k5o s ALA 457 Ca 0.00 -0.05 0.04 0.00 0.00 0.00 0.00 51.96 51.95 3k5o s ALA 457 Cb 0.00 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 3k5o s ALA 457 CO 0.00 -0.28 -0.20 -1.58 0.00 0.00 0.00 175.76 173.70 3k5o s TRP 458 N 1.25 2.58 -0.14 0.00 0.52 -1.26 0.08 118.94 121.97 3k5o s TRP 458 Ca 0.33 -0.53 -0.00 0.00 0.02 0.00 0.00 56.10 55.92 3k5o s TRP 458 Cb -0.17 -1.65 -0.01 0.00 -1.15 0.00 0.00 33.47 30.50 3k5o s TRP 458 CO 0.14 -0.09 -0.13 -0.06 0.02 0.00 0.00 176.95 176.83 3k5o s PHE 459 N -0.26 2.81 0.39 -1.98 0.08 -0.22 -3.10 117.98 115.71 3k5o s PHE 459 Ca 0.00 -0.76 -0.27 0.00 0.12 0.00 0.00 56.93 56.02 3k5o s PHE 459 Cb -0.13 -1.87 -0.10 0.00 -0.57 0.00 0.00 43.02 40.35 3k5o s PHE 459 CO 0.03 -0.30 1.42 0.45 -0.10 0.00 0.00 175.22 176.72 3k5o s SER 460 N 0.53 6.29 -0.02 1.36 0.15 -0.36 -0.67 113.70 120.98 3k5o s SER 460 Ca -0.09 2.91 -0.03 0.00 0.70 0.00 0.00 55.95 59.45 3k5o s SER 460 Cb -0.16 -2.66 -0.27 0.00 -1.71 0.00 0.00 66.02 61.22 3k5o s SER 460 CO 0.04 -0.89 0.75 0.03 1.20 0.00 0.00 173.24 174.37 3k5o h ARG 461 N 2.85 0.24 0.19 5.44 3.08 -1.43 -3.40 114.38 121.35 3k5o h ARG 461 Ca -0.50 -0.41 -0.32 0.00 0.07 0.00 0.00 59.98 58.82 3k5o h ARG 461 Cb 1.24 0.15 0.02 0.00 0.08 0.00 0.00 29.97 31.46 3k5o h ARG 461 CO 0.63 1.08 -1.49 0.93 -1.07 0.00 0.00 179.97 180.05 3k5o h GLU 462 N 0.07 0.40 -4.47 0.04 3.07 -1.92 -3.45 114.58 108.31 3k5o h GLU 462 Ca -0.28 -0.68 -0.62 0.00 -0.50 0.00 0.00 59.36 57.27 3k5o h GLU 462 Cb 2.03 0.25 -0.38 0.00 -0.84 0.00 0.00 28.75 29.81 3k5o h GLU 462 CO 0.14 1.31 -0.79 0.21 -1.40 0.00 0.00 179.01 178.48 3k5o s LYS 463 N -2.61 1.78 0.17 2.33 2.20 -1.26 -5.10 119.74 117.25 3k5o s LYS 463 Ca -0.09 -1.03 -0.19 0.00 -0.36 0.00 0.00 55.97 54.30 3k5o s LYS 463 Cb 0.05 -2.62 0.04 0.00 -1.51 0.00 0.00 37.83 33.80 3k5o s LYS 463 CO 0.90 -0.57 0.52 -3.38 -0.36 0.00 0.00 175.35 172.45 3k5o s HIS 464 N 1.34 -0.26 0.00 4.03 -3.43 -1.26 -3.86 115.29 111.86 3k5o s HIS 464 Ca -0.06 -0.05 0.00 0.00 -0.80 0.00 0.00 55.06 54.15 3k5o s HIS 464 Cb -0.19 0.41 0.00 0.00 -1.43 0.00 0.00 32.58 31.37 3k5o s HIS 464 CO -0.06 -0.85 0.00 0.00 -2.00 0.00 0.00 174.74 171.83 3k5o h LEU 466 N 0.00 0.70 -0.81 0.00 5.85 -1.96 -2.68 115.31 116.41 3k5o h LEU 466 Ca 0.00 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.66 3k5o h LEU 466 Cb 0.95 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 3k5o h LEU 466 CO 0.00 0.64 0.52 -0.65 -0.34 0.00 0.00 178.44 178.61 3k5o h PRO 467 N 0.76 1.01 -0.56 5.25 0.11 -1.81 0.11 132.00 136.87 3k5o h PRO 467 Ca 0.18 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.19 3k5o h PRO 467 Cb 0.16 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.02 3k5o h PRO 467 CO -0.02 0.67 0.17 0.93 -0.21 0.00 0.00 178.00 179.54 3k5o h GLU 468 N 1.04 0.87 -0.36 1.05 3.07 -1.82 -1.45 114.58 116.97 3k5o h GLU 468 Ca 0.32 -0.19 -0.03 0.00 -0.50 0.00 0.00 59.36 58.95 3k5o h GLU 468 Cb -0.03 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.74 3k5o h GLU 468 CO -0.10 0.80 0.11 0.82 -1.40 0.00 0.00 179.01 179.24 3k5o h ILE 469 N 0.78 1.21 -0.56 3.13 2.04 -1.11 -1.41 117.51 121.60 3k5o h ILE 469 Ca 0.18 -0.70 -0.08 0.00 1.00 0.00 0.00 64.86 65.26 3k5o h ILE 469 Cb 0.29 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 3k5o h ILE 469 CO -0.00 0.24 0.03 0.58 0.00 0.00 0.00 178.15 178.99 3k5o h VAL 470 N 0.44 1.25 -0.68 1.67 2.07 -0.90 -1.30 116.25 118.81 3k5o h VAL 470 Ca 0.12 -1.05 -0.04 0.00 0.82 0.00 0.00 66.70 66.55 3k5o h VAL 470 Cb 0.26 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 3k5o h VAL 470 CO -0.00 0.38 0.28 0.74 0.02 0.00 0.00 177.57 178.98 3k5o h THR 471 N 0.87 1.24 -0.12 2.57 2.02 -1.06 0.19 112.91 118.62 3k5o h THR 471 Ca 0.17 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 3k5o h THR 471 Cb 0.48 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 3k5o h THR 471 CO 0.02 0.30 0.06 -1.13 0.37 0.00 0.00 175.52 175.14 3k5o h ASN 472 N 0.96 0.16 -0.55 4.18 -0.73 -0.79 -1.12 115.58 117.69 3k5o h ASN 472 Ca 0.23 -0.11 -0.05 0.00 1.87 0.00 0.00 56.30 58.24 3k5o h ASN 472 Cb 0.20 -0.04 -0.03 0.00 0.27 0.00 0.00 38.32 38.72 3k5o h ASN 472 CO -0.02 0.22 0.15 0.40 -0.37 0.00 0.00 177.43 177.82 3k5o h ILE 473 N 0.08 1.23 0.37 2.57 2.04 -0.97 -0.19 117.51 122.65 3k5o h ILE 473 Ca 0.04 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 3k5o h ILE 473 Cb 0.10 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3k5o h ILE 473 CO -0.01 0.32 -0.22 -0.25 0.00 0.00 0.00 178.15 177.99 3k5o h TRP 474 N 0.87 -0.58 -0.25 1.37 2.91 -0.26 0.92 115.95 120.93 3k5o h TRP 474 Ca 0.19 -0.01 -0.08 0.00 1.13 0.00 0.00 58.89 60.12 3k5o h TRP 474 Cb 0.30 0.20 -0.01 0.00 -0.51 0.00 0.00 29.16 29.14 3k5o h TRP 474 CO 0.02 -0.34 -0.20 0.45 -1.03 0.00 0.00 178.44 177.33 3k5o h HIS 475 N -0.56 0.50 -0.75 2.65 3.86 -1.11 -2.32 115.15 117.42 3k5o h HIS 475 Ca -0.04 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.07 3k5o h HIS 475 Cb 0.46 -0.13 -0.04 0.00 1.06 0.00 0.00 27.41 28.77 3k5o h HIS 475 CO -0.09 0.63 0.43 0.78 0.86 0.00 0.00 177.93 180.55 3k5o h GLY 476 N 0.98 1.10 0.96 2.45 0.00 -0.64 0.01 103.07 107.92 3k5o h GLY 476 Ca 0.07 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.92 3k5o h GLY 476 CO 0.04 0.46 0.06 -0.09 0.00 0.00 0.00 176.54 177.01 3k5o h ARG 477 N 1.03 0.12 -0.74 4.80 9.65 -0.41 -0.69 114.38 128.14 3k5o h ARG 477 Ca 0.27 -0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 59.11 3k5o h ARG 477 Cb -0.00 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.52 3k5o h ARG 477 CO -0.05 0.13 0.37 -0.44 2.80 0.00 0.00 179.97 182.78 3k5o h ASP 478 N 0.09 0.95 -0.06 -3.80 3.32 -1.08 -0.98 116.42 114.86 3k5o h ASP 478 Ca 0.03 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 3k5o h ASP 478 Cb 0.04 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.34 3k5o h ASP 478 CO -0.01 0.79 0.01 -0.08 -1.72 0.00 0.00 179.24 178.23 3k5o h GLU 479 N 1.05 0.09 -0.88 3.56 4.57 -0.80 -0.27 114.58 121.91 3k5o h GLU 479 Ca 0.26 -0.03 0.08 0.00 -1.18 0.00 0.00 59.36 58.50 3k5o h GLU 479 Cb 0.08 -0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 28.59 3k5o h GLU 479 CO -0.04 0.32 0.53 0.00 -1.18 0.00 0.00 179.01 178.65 3k5o h ALA 480 N 0.77 1.24 -0.39 2.92 0.00 -0.82 -0.18 119.26 122.79 3k5o h ALA 480 Ca 0.02 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 3k5o h ALA 480 Cb 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3k5o h ALA 480 CO 0.00 0.21 -0.31 -0.22 0.00 0.00 0.00 179.25 178.93 3k5o h LYS 481 N 0.91 0.87 -0.47 0.00 3.64 -0.98 0.28 116.57 120.83 3k5o h LYS 481 Ca 0.41 -0.41 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 3k5o h LYS 481 Cb 0.30 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 3k5o h LYS 481 CO -0.22 1.06 -0.06 -0.09 -2.27 0.00 0.00 179.45 177.87 3k5o h ARG 482 N 0.74 0.82 -0.09 1.90 2.43 -0.31 -2.49 114.38 117.38 3k5o h ARG 482 Ca 0.08 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 3k5o h ARG 482 Cb 0.87 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 3k5o h ARG 482 CO 0.08 0.86 0.00 1.04 -1.51 0.00 0.00 179.97 180.44 3k5o n GLN 483 N -4.18 1.43 -2.50 0.20 6.02 -0.15 -4.91 117.38 113.29 3k5o n GLN 483 Ca 0.02 -0.64 -0.13 0.00 -0.01 0.00 0.00 57.00 56.24 3k5o n GLN 483 Cb 0.34 -1.37 0.01 0.00 1.02 0.00 0.00 30.24 30.24 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 1.00 -0.11 3.39 1.08 0.00 -0.77 -4.95 105.19 104.82 3k5o n GLY 484 Ca 0.16 -0.28 -0.45 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.62 6.96 0.15 1.61 3.84 0.91 -4.91 114.94 120.87 3k5o s ASN 485 Ca 0.10 -2.87 -0.18 0.00 0.21 0.00 0.00 52.86 50.12 3k5o s ASN 485 Cb -0.04 -2.29 0.04 0.00 -0.55 0.00 0.00 41.25 38.41 3k5o s ASN 485 CO 0.12 -0.64 1.70 0.50 -2.79 0.00 0.00 177.10 175.99 3k5o h LYS 486 N 7.57 0.05 -0.42 0.43 3.64 -1.93 -0.53 116.57 125.38 3k5o h LYS 486 Ca 0.18 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 3k5o h LYS 486 Cb 0.96 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.75 3k5o h LYS 486 CO 1.00 0.03 -0.13 -1.00 -2.27 0.00 0.00 179.45 177.09 3k5o h PRO 487 N 0.05 0.77 -0.37 1.90 0.13 -1.92 -1.92 132.00 130.64 3k5o h PRO 487 Ca 0.15 -0.26 -0.13 0.00 -0.87 0.00 0.00 66.00 64.88 3k5o h PRO 487 Cb 0.21 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.28 3k5o h PRO 487 CO -0.28 0.86 -0.28 1.25 -0.23 0.00 0.00 178.00 179.32 3k5o h LEU 488 N 0.69 0.89 -0.54 1.56 5.85 -1.83 -0.76 115.31 121.17 3k5o h LEU 488 Ca 0.11 -0.44 0.01 0.00 0.84 0.00 0.00 57.88 58.40 3k5o h LEU 488 Cb 0.61 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 3k5o h LEU 488 CO 0.04 1.14 0.36 -1.28 -0.34 0.00 0.00 178.44 178.36 3k5o h SER 489 N 0.64 0.62 -0.46 1.25 0.87 -1.04 -0.61 113.55 114.82 3k5o h SER 489 Ca 0.07 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3k5o h SER 489 Cb 0.86 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.64 3k5o h SER 489 CO 0.07 0.45 0.28 -0.61 -0.53 0.00 0.00 176.83 176.49 3k5o h GLN 490 N 0.73 0.63 -0.51 2.24 4.15 -1.23 -0.67 115.11 120.45 3k5o h GLN 490 Ca 0.20 -0.06 -0.05 0.00 0.77 0.00 0.00 58.65 59.51 3k5o h GLN 490 Cb -0.08 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.46 3k5o h GLN 490 CO -0.05 0.47 0.11 0.00 -1.93 0.00 0.00 178.83 177.43 3k5o h ALA 491 N 1.13 0.68 -0.09 3.38 0.00 -0.71 -2.03 119.26 121.61 3k5o h ALA 491 Ca 0.17 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 3k5o h ALA 491 Cb 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3k5o h ALA 491 CO -0.03 0.38 -0.41 -0.07 0.00 0.00 0.00 179.25 179.12 3k5o h LEU 492 N 0.71 0.21 -0.22 0.00 3.38 -0.97 -2.37 115.31 116.05 3k5o h LEU 492 Ca 0.16 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3k5o h LEU 492 Cb 0.36 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3k5o h LEU 492 CO 0.00 0.61 0.08 0.50 0.09 0.00 0.00 178.44 179.72 3k5o h LYS 493 N 0.17 0.34 -0.05 1.13 3.64 -0.86 -1.52 116.57 119.42 3k5o h LYS 493 Ca 0.02 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3k5o h LYS 493 Cb 0.80 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.57 3k5o h LYS 493 CO 0.06 0.42 0.03 0.82 -2.27 0.00 0.00 179.45 178.51 3k5o h ILE 494 N 0.20 1.06 -0.54 2.00 2.04 -1.20 -1.71 117.51 119.36 3k5o h ILE 494 Ca 0.07 -0.18 -0.07 0.00 1.00 0.00 0.00 64.86 65.69 3k5o h ILE 494 Cb 0.21 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3k5o h ILE 494 CO -0.00 0.05 0.06 -0.29 0.00 0.00 0.00 178.15 177.98 3k5o h ILE 495 N 0.01 1.24 -0.46 -0.67 2.10 -1.38 -1.69 117.51 116.67 3k5o h ILE 495 Ca 0.02 -0.95 -0.13 0.00 1.08 0.00 0.00 64.86 64.89 3k5o h ILE 495 Cb 0.06 0.76 -0.01 0.00 -1.09 0.00 0.00 36.82 36.54 3k5o h ILE 495 CO -0.00 0.34 -0.22 -0.03 -1.08 0.00 0.00 178.15 177.16 3k5o h MET 496 N 0.81 0.95 0.00 2.19 4.05 -1.15 -2.33 114.93 119.45 3k5o h MET 496 Ca 0.17 -0.40 0.00 0.00 -0.28 0.00 0.00 59.70 59.19 3k5o h MET 496 Cb 0.39 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.16 3k5o h MET 496 CO 0.01 1.06 0.00 -0.91 0.23 0.00 0.00 176.91 177.30 3k5o h ASN 497 N 0.82 0.00 1.49 1.39 -0.26 -1.09 -3.11 115.58 114.81 3k5o h ASN 497 Ca 0.11 0.00 -0.07 0.00 -0.56 0.00 0.00 56.30 55.77 3k5o h ASN 497 Cb 0.78 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.03 3k5o h ASN 497 CO 0.06 0.00 -0.52 0.00 -1.06 0.00 0.00 177.43 175.91 3k5o h ALA 498 N 2.14 0.75 -0.55 -0.83 0.00 -0.74 -3.39 119.26 116.63 3k5o h ALA 498 Ca 0.00 -0.33 0.11 0.00 0.00 0.00 0.00 54.91 54.69 3k5o h ALA 498 Cb 0.47 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.16 3k5o h ALA 498 CO 0.00 0.43 0.00 0.74 0.00 0.00 0.00 179.25 180.42 3k5o h PHE 499 N 0.00 -0.03 -0.41 0.00 0.04 -1.46 -1.23 116.94 113.85 3k5o h PHE 499 Ca -0.02 0.04 0.03 0.00 2.80 0.00 0.00 57.97 60.82 3k5o h PHE 499 Cb 1.26 0.10 -0.03 0.00 2.20 0.00 0.00 35.95 39.48 3k5o h PHE 499 CO 0.00 -0.13 0.21 -0.92 -0.60 0.00 0.00 178.31 176.87 3k5o h TYR 500 N 0.12 0.39 -0.62 -0.55 3.20 -1.81 -1.65 116.97 116.05 3k5o h TYR 500 Ca 0.28 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 62.11 3k5o h TYR 500 Cb 0.44 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 3k5o h TYR 500 CO -0.34 0.21 0.15 0.78 -1.64 0.00 0.00 178.16 177.32 3k5o h GLY 501 N 0.43 1.03 1.05 1.82 0.00 -1.64 -2.00 103.07 103.77 3k5o h GLY 501 Ca 0.17 -0.62 -0.07 0.00 0.00 0.00 0.00 47.33 46.81 3k5o h GLY 501 CO -0.11 0.58 0.14 -2.08 0.00 0.00 0.00 176.54 175.06 3k5o h VAL 502 N 0.92 1.26 0.00 4.60 2.07 -0.87 -2.50 116.25 121.74 3k5o h VAL 502 Ca 0.20 -0.99 -0.04 0.00 0.82 0.00 0.00 66.70 66.69 3k5o h VAL 502 Cb 0.33 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3k5o h VAL 502 CO -0.00 0.37 -0.20 -0.07 0.02 0.00 0.00 177.57 177.69 3k5o h LEU 503 N 1.01 0.00 -0.95 2.57 3.38 -1.05 -3.05 115.31 117.22 3k5o h LEU 503 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3k5o h LEU 503 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3k5o h LEU 503 CO 0.01 0.20 -0.06 0.61 0.09 0.00 0.00 178.44 179.29 3k5o n GLY 504 N -0.10 -0.04 3.68 0.83 0.00 -0.77 -4.26 105.19 104.52 3k5o n GLY 504 Ca -0.00 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.12 4.22 -0.57 2.61 -1.32 -1.07 -4.97 115.64 112.41 3k5o s THR 505 Ca 0.34 -0.40 0.22 0.00 -1.21 0.00 0.00 61.69 60.65 3k5o s THR 505 Cb 0.20 -2.81 0.23 0.00 -1.51 0.00 0.00 72.50 68.61 3k5o s THR 505 CO 0.38 0.52 1.68 0.35 -2.21 0.00 0.00 174.62 175.33 3k5o n THR 506 N 1.86 0.84 0.66 5.08 -2.24 -1.26 -1.97 114.28 117.24 3k5o n THR 506 Ca -0.17 0.21 0.09 0.00 -2.27 0.00 0.00 64.05 61.91 3k5o n THR 506 Cb 0.53 -1.11 0.40 0.00 -2.10 0.00 0.00 70.33 68.05 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 -1.73 1.86 -2.85 6.98 0.00 -1.26 -4.28 120.51 119.23 3k5o n ALA 507 Ca 0.02 -0.07 -0.34 0.00 0.00 0.00 0.00 53.44 53.05 3k5o n ALA 507 Cb 0.23 -1.30 -0.10 0.00 0.00 0.00 0.00 19.45 18.28 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 6.72 0.00 -0.20 0.00 0.11 -1.85 -1.14 114.38 118.02 3k5o h ARG 509 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 3k5o h ARG 509 Cb 1.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.25 3k5o h ARG 509 CO 0.69 0.00 0.00 1.19 0.10 0.00 0.00 179.97 181.95 3k5o n PHE 510 N -2.32 0.25 -1.69 4.08 3.72 -1.26 -4.63 117.46 115.60 3k5o n PHE 510 Ca -0.01 -0.12 -0.44 0.00 -0.05 0.00 0.00 57.45 56.82 3k5o n PHE 510 Cb 0.06 0.00 -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 0.90 2.44 -3.67 1.38 7.35 -0.43 -4.94 117.46 120.48 3k5o n PHE 511 Ca 0.17 0.23 -0.09 0.00 -0.76 0.00 0.00 57.45 57.00 3k5o n PHE 511 Cb 0.48 -2.57 -0.10 0.00 0.35 0.00 0.00 39.48 37.64 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 0.86 -0.47 0.49 -2.13 2.15 -1.26 -4.85 116.67 111.46 3k5o s ASP 512 Ca 0.75 1.02 0.29 0.00 0.43 0.00 0.00 52.55 55.04 3k5o s ASP 512 Cb -0.61 1.14 1.38 0.00 -0.30 0.00 0.00 42.92 44.53 3k5o s ASP 512 CO 0.39 -0.22 1.83 -0.65 -0.17 0.00 0.00 175.17 176.35 3k5o h PRO 513 N 7.60 0.13 0.00 4.34 0.11 -1.90 -0.96 132.00 141.32 3k5o h PRO 513 Ca -0.26 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.79 3k5o h PRO 513 Cb 1.15 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3k5o h PRO 513 CO 0.20 0.09 -0.26 0.00 -0.21 0.00 0.00 178.00 177.82 3k5o h ARG 514 N 0.13 0.00 0.53 1.05 3.08 -1.96 -2.38 114.38 114.83 3k5o h ARG 514 Ca 0.52 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.54 3k5o h ARG 514 Cb 1.80 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.85 3k5o h ARG 514 CO -0.09 0.26 -0.25 -0.07 -1.07 0.00 0.00 179.97 178.74 3k5o h LEU 515 N 0.00 -0.60 -0.68 3.04 3.38 -1.52 -2.06 115.31 116.87 3k5o h LEU 515 Ca -0.00 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 3k5o h LEU 515 Cb 0.62 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 3k5o h LEU 515 CO 0.03 -0.20 0.10 0.00 0.09 0.00 0.00 178.44 178.46 3k5o h ALA 516 N -1.01 0.90 -0.25 1.53 0.00 -1.67 -2.72 119.26 116.04 3k5o h ALA 516 Ca -0.07 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 3k5o h ALA 516 Cb 0.59 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3k5o h ALA 516 CO 0.12 0.67 -0.14 0.66 0.00 0.00 0.00 179.25 180.56 3k5o h SER 517 N 1.04 0.41 -0.34 0.00 4.64 -1.52 -1.01 113.55 116.77 3k5o h SER 517 Ca 0.20 -0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.33 3k5o h SER 517 Cb 0.46 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.42 3k5o h SER 517 CO 0.02 0.58 -0.11 0.28 -0.87 0.00 0.00 176.83 176.73 3k5o h SER 518 N 0.39 0.76 0.26 4.97 0.02 -1.16 -0.40 113.55 118.39 3k5o h SER 518 Ca 0.07 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 60.79 3k5o h SER 518 Cb 0.49 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.83 3k5o h SER 518 CO 0.03 0.89 -0.12 0.40 -1.14 0.00 0.00 176.83 176.89 3k5o h ILE 519 N 0.70 0.79 -0.73 3.27 2.04 -1.13 -2.50 117.51 119.95 3k5o h ILE 519 Ca 0.12 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.41 3k5o h ILE 519 Cb 0.58 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.73 3k5o h ILE 519 CO 0.04 0.12 0.45 0.74 0.00 0.00 0.00 178.15 179.51 3k5o h THR 520 N -0.67 1.09 -0.46 -0.27 2.02 -1.12 -1.10 112.91 112.40 3k5o h THR 520 Ca -0.04 -0.30 -0.10 0.00 0.77 0.00 0.00 66.41 66.74 3k5o h THR 520 Cb 0.47 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 3k5o h THR 520 CO 0.06 0.16 -0.11 0.24 0.37 0.00 0.00 175.52 176.24 3k5o h MET 521 N 0.88 0.83 -0.61 6.66 2.86 -1.13 -2.41 114.93 122.01 3k5o h MET 521 Ca 0.29 -0.28 -0.07 0.00 -2.06 0.00 0.00 59.70 57.58 3k5o h MET 521 Cb 0.03 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 3k5o h MET 521 CO -0.12 0.90 0.11 -0.09 1.06 0.00 0.00 176.91 178.78 3k5o h ARG 522 N 0.75 0.98 -0.57 1.72 9.65 -0.96 -2.33 114.38 123.63 3k5o h ARG 522 Ca 0.12 -0.24 0.02 0.00 -1.10 0.00 0.00 59.98 58.78 3k5o h ARG 522 Cb 0.61 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 29.03 3k5o h ARG 522 CO 0.04 0.90 0.36 0.78 2.80 0.00 0.00 179.97 184.85 3k5o h GLY 523 N 1.03 0.80 0.95 2.80 0.00 -0.81 -0.14 103.07 107.70 3k5o h GLY 523 Ca 0.19 -0.27 0.01 0.00 0.00 0.00 0.00 47.33 47.26 3k5o h GLY 523 CO 0.01 0.25 0.24 0.45 0.00 0.00 0.00 176.54 177.49 3k5o h HIS 524 N 0.72 0.46 -0.16 5.60 3.86 -1.16 0.30 115.15 124.76 3k5o h HIS 524 Ca 0.22 0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.47 3k5o h HIS 524 Cb -0.03 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.27 3k5o h HIS 524 CO -0.05 0.28 -0.01 0.37 0.86 0.00 0.00 177.93 179.38 3k5o h GLN 525 N 0.49 0.04 -0.50 2.45 4.15 -1.03 0.38 115.11 121.10 3k5o h GLN 525 Ca 0.15 -0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.59 3k5o h GLN 525 Cb -0.02 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 3k5o h GLN 525 CO -0.05 0.03 0.30 0.82 -1.93 0.00 0.00 178.83 178.00 3k5o h ILE 526 N 0.04 1.06 -0.30 2.39 2.04 -0.68 0.11 117.51 122.18 3k5o h ILE 526 Ca 0.07 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.62 3k5o h ILE 526 Cb 0.09 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 3k5o h ILE 526 CO -0.13 0.11 -0.27 0.24 0.00 0.00 0.00 178.15 178.09 3k5o h MET 527 N 0.61 0.60 -0.38 2.37 2.86 -0.62 0.23 114.93 120.60 3k5o h MET 527 Ca 0.20 -0.25 -0.08 0.00 -2.06 0.00 0.00 59.70 57.51 3k5o h MET 527 Cb 0.00 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 3k5o h MET 527 CO -0.08 0.82 -0.07 -0.09 1.06 0.00 0.00 176.91 178.55 3k5o h ARG 528 N 0.52 0.71 -0.35 1.72 2.43 -0.55 -1.96 114.38 116.90 3k5o h ARG 528 Ca 0.07 -0.26 -0.09 0.00 -0.81 0.00 0.00 59.98 58.89 3k5o h ARG 528 Cb 0.74 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.23 3k5o h ARG 528 CO 0.06 0.84 -0.14 0.37 -1.51 0.00 0.00 179.97 179.59 3k5o h GLN 529 N 0.51 0.63 -0.75 0.20 5.75 -0.61 -2.79 115.11 118.06 3k5o h GLN 529 Ca 0.10 -0.21 -0.05 0.00 -0.15 0.00 0.00 58.65 58.34 3k5o h GLN 529 Cb 0.57 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.03 3k5o h GLN 529 CO 0.03 0.75 0.28 1.15 -2.65 0.00 0.00 178.83 178.39 3k5o h THR 530 N 0.57 1.26 -0.47 2.39 2.02 -0.69 -1.31 112.91 116.68 3k5o h THR 530 Ca 0.10 -0.84 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 3k5o h THR 530 Cb 0.57 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 3k5o h THR 530 CO 0.04 0.34 0.23 0.50 0.37 0.00 0.00 175.52 177.00 3k5o h LYS 531 N 1.09 0.67 -0.74 6.66 3.64 -1.15 -1.88 116.57 124.86 3k5o h LYS 531 Ca 0.25 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 3k5o h LYS 531 Cb 0.24 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 3k5o h LYS 531 CO -0.02 0.55 0.43 0.00 -2.27 0.00 0.00 179.45 178.14 3k5o h ALA 532 N 1.08 0.94 -0.30 5.00 0.00 -1.21 -1.51 119.26 123.26 3k5o h ALA 532 Ca 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3k5o h ALA 532 Cb 0.10 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3k5o h ALA 532 CO -0.02 0.43 0.17 -0.07 0.00 0.00 0.00 179.25 179.76 3k5o h LEU 533 N 1.01 0.37 -0.91 0.00 3.38 -0.96 -0.49 115.31 117.72 3k5o h LEU 533 Ca 0.26 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 3k5o h LEU 533 Cb -0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3k5o h LEU 533 CO -0.05 0.35 0.08 0.40 0.09 0.00 0.00 178.44 179.31 3k5o h ILE 534 N 0.37 1.24 -0.27 1.22 2.04 -1.16 -2.46 117.51 118.48 3k5o h ILE 534 Ca 0.11 -0.94 -0.14 0.00 1.00 0.00 0.00 64.86 64.89 3k5o h ILE 534 Cb 0.05 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 3k5o h ILE 534 CO -0.02 0.34 -0.39 -0.33 0.00 0.00 0.00 178.15 177.76 3k5o h GLU 535 N 0.84 0.63 0.00 2.37 5.08 -1.08 -2.29 114.58 120.12 3k5o h GLU 535 Ca 0.17 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 3k5o h GLU 535 Cb 0.39 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 3k5o h GLU 535 CO 0.01 0.91 -0.04 0.00 -1.00 0.00 0.00 179.01 178.90 3k5o h ALA 536 N 1.05 1.17 -0.16 3.43 0.00 -0.73 0.89 119.26 124.91 3k5o h ALA 536 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3k5o h ALA 536 Cb 0.91 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3k5o h ALA 536 CO 0.08 0.05 0.00 1.04 0.00 0.00 0.00 179.25 180.42 3k5o n GLN 537 N -3.38 1.79 -0.33 0.00 1.13 -0.89 -4.93 117.38 110.78 3k5o n GLN 537 Ca -0.02 -1.18 0.00 0.00 -1.94 0.00 0.00 57.00 53.86 3k5o n GLN 537 Cb 0.17 -1.41 0.00 0.00 0.11 0.00 0.00 30.24 29.10 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 1.16 0.81 3.38 1.08 0.00 0.31 -5.09 105.19 106.84 3k5o n GLY 538 Ca 0.17 -0.28 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 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 2.11 0.05 1.61 2.02 -1.05 -4.98 117.35 115.11 3k5o s TYR 539 Ca 0.00 -0.40 -0.19 0.00 -0.37 0.00 0.00 57.07 56.11 3k5o s TYR 539 Cb 0.00 -1.06 -0.06 0.00 -0.40 0.00 0.00 41.96 40.44 3k5o s TYR 539 CO 0.00 0.42 0.56 -0.51 -1.57 0.00 0.00 175.55 174.45 3k5o s ASP 540 N -2.60 7.03 -0.33 2.29 1.11 -1.19 -3.63 116.67 119.34 3k5o s ASP 540 Ca 0.18 1.22 -0.10 0.00 0.18 0.00 0.00 52.55 54.03 3k5o s ASP 540 Cb -0.07 -2.35 0.01 0.00 1.07 0.00 0.00 42.92 41.57 3k5o s ASP 540 CO 0.08 0.24 0.17 -0.69 1.18 0.00 0.00 175.17 176.15 3k5o s VAL 541 N -0.92 4.54 -1.03 -1.27 1.01 -1.26 -1.17 120.40 120.29 3k5o s VAL 541 Ca 0.29 -0.62 0.24 0.00 0.00 0.00 0.00 61.98 61.89 3k5o s VAL 541 Cb -0.19 -3.40 -0.06 0.00 0.00 0.00 0.00 36.38 32.73 3k5o s VAL 541 CO 0.18 -0.05 1.26 2.30 0.00 0.00 0.00 175.10 178.80 3k5o n ILE 542 N 4.98 0.00 -3.56 2.22 -5.35 -0.68 -4.90 119.36 112.07 3k5o n ILE 542 Ca -0.13 -0.01 -0.06 0.00 -0.27 0.00 0.00 62.75 62.28 3k5o n ILE 542 Cb 0.48 0.49 -0.02 0.00 -1.74 0.00 0.00 39.64 38.84 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 -2.98 -0.22 -0.28 4.28 5.04 -1.22 -0.62 117.35 121.35 3k5o s TYR 543 Ca 0.11 0.13 -0.17 0.00 -2.44 0.00 0.00 57.07 54.69 3k5o s TYR 543 Cb 0.17 0.52 0.12 0.00 0.35 0.00 0.00 41.96 43.12 3k5o s TYR 543 CO 0.74 -0.34 0.88 0.20 -1.34 0.00 0.00 175.55 175.69 3k5o s GLY 544 N -2.30 -0.24 0.00 8.97 0.00 -1.26 -0.88 107.32 111.61 3k5o s GLY 544 Ca 0.08 2.82 0.00 0.00 0.00 0.00 0.00 44.72 47.61 3k5o s GLY 544 CO -0.06 2.41 0.00 2.09 0.00 0.00 0.00 173.10 177.54 3k5o n ASP 545 N 3.68 0.00 -0.24 1.64 5.68 0.17 -2.22 116.55 125.26 3k5o n ASP 545 Ca -0.18 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.13 3k5o n ASP 545 Cb 0.58 0.00 0.15 0.00 -1.14 0.00 0.00 41.12 40.71 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 0.73 0.00 2.12 2.02 -1.82 -3.35 112.91 112.61 3k5o h THR 546 Ca 0.00 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.02 3k5o h THR 546 Cb 0.00 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 3k5o h THR 546 CO 0.00 0.08 0.00 -0.90 0.37 0.00 0.00 175.52 175.07 3k5o n ASP 547 N -4.98 0.12 -4.35 4.18 5.68 -1.26 -4.65 116.55 111.29 3k5o n ASP 547 Ca 0.12 -1.01 -0.31 0.00 -0.50 0.00 0.00 54.79 53.08 3k5o n ASP 547 Cb 0.34 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 40.17 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 -0.01 3.28 -0.08 -1.12 0.01 -1.26 -1.69 113.70 112.84 3k5o s SER 548 Ca 0.00 -0.45 0.05 0.00 1.31 0.00 0.00 55.95 56.86 3k5o s SER 548 Cb 0.00 -0.43 -0.00 0.00 0.21 0.00 0.00 66.02 65.80 3k5o s SER 548 CO 0.00 0.31 -0.23 -0.89 0.41 0.00 0.00 173.24 172.84 3k5o s THR 549 N -0.69 1.93 -0.27 1.44 2.01 -0.16 -0.66 115.64 119.24 3k5o s THR 549 Ca 0.11 -0.96 -0.07 0.00 0.31 0.00 0.00 61.69 61.07 3k5o s THR 549 Cb -0.10 -1.66 -0.02 0.00 0.01 0.00 0.00 72.50 70.74 3k5o s THR 549 CO 0.00 0.53 0.08 -0.36 -0.69 0.00 0.00 174.62 174.19 3k5o s PHE 550 N 0.17 3.11 -0.21 4.92 0.08 -0.06 -0.77 117.98 125.23 3k5o s PHE 550 Ca -0.12 -0.59 -0.04 0.00 0.12 0.00 0.00 56.93 56.30 3k5o s PHE 550 Cb -0.16 -2.26 -0.01 0.00 -0.57 0.00 0.00 43.02 40.02 3k5o s PHE 550 CO 0.06 -0.43 -0.05 0.08 -0.10 0.00 0.00 175.22 174.78 3k5o s VAL 551 N 1.58 3.40 -0.09 -0.44 1.01 0.11 -1.69 120.40 124.29 3k5o s VAL 551 Ca 0.05 -0.49 -0.23 0.00 0.00 0.00 0.00 61.98 61.31 3k5o s VAL 551 Cb -0.16 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 3k5o s VAL 551 CO 0.04 0.43 0.70 0.86 0.00 0.00 0.00 175.10 177.13 3k5o s TRP 552 N 1.34 3.55 -1.73 5.22 -0.00 -0.31 0.32 118.94 127.33 3k5o s TRP 552 Ca 0.04 1.22 0.02 0.00 -0.00 0.00 0.00 56.10 57.38 3k5o s TRP 552 Cb -0.14 -2.82 0.06 0.00 -0.00 0.00 0.00 33.47 30.57 3k5o s TRP 552 CO -0.02 0.04 0.94 1.28 -0.00 0.00 0.00 176.95 179.19 3k5o n LEU 553 N 4.00 0.62 -1.63 5.86 4.32 -0.82 -3.18 117.00 126.17 3k5o n LEU 553 Ca -0.01 -0.31 -0.20 0.00 -0.02 0.00 0.00 56.01 55.47 3k5o n LEU 553 Cb 0.51 -0.16 -0.08 0.00 -1.62 0.00 0.00 43.42 42.07 3k5o n LEU 553 CO 0.47 0.14 -0.20 0.29 -1.22 0.00 0.00 177.39 176.87 3k5o n LYS 554 N -0.22 -1.43 0.00 3.23 5.02 -1.26 -4.83 118.16 118.68 3k5o n LYS 554 Ca 0.02 1.18 0.00 0.00 -2.02 0.00 0.00 58.31 57.50 3k5o n LYS 554 Cb 0.13 -5.57 0.00 0.00 -0.02 0.00 0.00 35.03 29.57 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 -0.55 2.59 3.75 0.72 0.00 -1.26 -5.11 105.19 105.32 3k5o n GLY 555 Ca -0.21 -1.21 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 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 3.51 0.12 4.61 0.00 -1.26 -4.44 121.76 122.30 3k5o s ALA 556 Ca 0.00 1.12 0.06 0.00 0.00 0.00 0.00 51.96 53.14 3k5o s ALA 556 Cb 0.00 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 3k5o s ALA 556 CO 0.00 -0.52 -0.13 -1.01 0.00 0.00 0.00 175.76 174.10 3k5o s HIS 557 N -0.33 1.35 0.65 0.00 3.76 -1.26 -5.03 115.29 114.44 3k5o s HIS 557 Ca 0.53 -0.58 -0.15 0.00 -0.15 0.00 0.00 55.06 54.71 3k5o s HIS 557 Cb -0.37 -0.71 -0.00 0.00 1.11 0.00 0.00 32.58 32.61 3k5o s HIS 557 CO 0.42 0.12 1.12 -1.54 -0.85 0.00 0.00 174.74 174.01 3k5o s SER 558 N -2.50 5.10 0.33 1.40 1.04 -1.26 -4.78 113.70 113.02 3k5o s SER 558 Ca 0.09 2.04 0.03 0.00 0.48 0.00 0.00 55.95 58.59 3k5o s SER 558 Cb -0.04 -2.56 0.62 0.00 0.10 0.00 0.00 66.02 64.15 3k5o s SER 558 CO 0.03 -1.64 1.93 -0.33 0.98 0.00 0.00 173.24 174.21 3k5o h GLU 559 N 0.11 0.88 -0.16 4.02 4.39 -1.99 0.45 114.58 122.28 3k5o h GLU 559 Ca -0.47 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.15 3k5o h GLU 559 Cb 1.25 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.70 3k5o h GLU 559 CO 0.54 0.58 0.01 1.49 -1.16 0.00 0.00 179.01 180.47 3k5o h GLU 560 N 0.91 0.27 -0.49 2.33 4.81 -2.00 -2.28 114.58 118.13 3k5o h GLU 560 Ca 0.36 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.47 3k5o h GLU 560 Cb 0.22 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3k5o h GLU 560 CO -0.13 0.48 0.16 0.93 -0.73 0.00 0.00 179.01 179.72 3k5o h GLU 561 N 0.03 0.75 -0.76 1.92 5.08 -1.74 -2.69 114.58 117.18 3k5o h GLU 561 Ca 0.05 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 3k5o h GLU 561 Cb 0.35 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 3k5o h GLU 561 CO 0.01 0.70 0.41 0.00 -1.00 0.00 0.00 179.01 179.13 3k5o h ALA 562 N 1.01 0.97 -0.65 3.43 0.00 -0.93 -2.10 119.26 120.99 3k5o h ALA 562 Ca 0.16 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3k5o h ALA 562 Cb 0.26 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3k5o h ALA 562 CO -0.01 0.49 0.07 0.00 0.00 0.00 0.00 179.25 179.81 3k5o h ALA 563 N 1.21 0.87 -0.13 0.00 0.00 -1.32 -0.83 119.26 119.06 3k5o h ALA 563 Ca 0.27 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3k5o h ALA 563 Cb 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3k5o h ALA 563 CO -0.04 0.66 0.08 0.87 0.00 0.00 0.00 179.25 180.82 3k5o h LYS 564 N 1.02 0.18 -0.69 0.00 1.57 -1.25 -1.53 116.57 115.86 3k5o h LYS 564 Ca 0.19 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3k5o h LYS 564 Cb 0.48 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 3k5o h LYS 564 CO 0.02 0.16 0.45 0.82 -0.57 0.00 0.00 179.45 180.33 3k5o h ILE 565 N 0.15 1.18 -0.49 1.86 2.04 -1.22 0.10 117.51 121.14 3k5o h ILE 565 Ca 0.05 -0.35 0.01 0.00 1.00 0.00 0.00 64.86 65.57 3k5o h ILE 565 Cb 0.03 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.26 3k5o h ILE 565 CO -0.01 0.18 0.31 1.23 0.00 0.00 0.00 178.15 179.86 3k5o h GLY 566 N 0.94 0.68 1.10 5.37 0.00 -0.92 0.15 103.07 110.39 3k5o h GLY 566 Ca 0.25 -0.24 -0.09 0.00 0.00 0.00 0.00 47.33 47.25 3k5o h GLY 566 CO -0.05 0.22 0.04 3.21 0.00 0.00 0.00 176.54 179.96 3k5o h ARG 567 N 0.62 1.09 -0.47 4.80 3.08 -0.88 -2.52 114.38 120.09 3k5o h ARG 567 Ca 0.19 -0.32 -0.08 0.00 0.07 0.00 0.00 59.98 59.83 3k5o h ARG 567 Cb -0.03 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3k5o h ARG 567 CO -0.06 1.03 -0.03 0.00 -1.07 0.00 0.00 179.97 179.84 3k5o h ALA 568 N 1.03 0.64 -0.42 0.04 0.00 -0.51 -2.23 119.26 117.80 3k5o h ALA 568 Ca 0.18 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.81 3k5o h ALA 568 Cb 0.52 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3k5o h ALA 568 CO 0.02 0.47 0.28 -0.07 0.00 0.00 0.00 179.25 179.95 3k5o h LEU 569 N 0.70 0.48 -0.85 0.00 3.38 -0.55 -2.01 115.31 116.46 3k5o h LEU 569 Ca 0.13 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 3k5o h LEU 569 Cb 0.55 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3k5o h LEU 569 CO 0.03 0.34 -0.42 -0.37 0.09 0.00 0.00 178.44 178.12 3k5o h VAL 570 N 0.57 1.31 -0.45 1.22 -1.51 -1.37 -1.70 116.25 114.31 3k5o h VAL 570 Ca 0.16 -1.56 -0.11 0.00 -1.23 0.00 0.00 66.70 63.96 3k5o h VAL 570 Cb -0.06 1.66 -0.02 0.00 -2.13 0.00 0.00 31.29 30.75 3k5o h VAL 570 CO -0.04 0.47 -0.17 -0.61 -1.23 0.00 0.00 177.57 175.99 3k5o h GLN 571 N 0.28 0.86 -0.15 5.19 -0.00 -1.19 -0.86 115.11 119.24 3k5o h GLN 571 Ca 0.02 -0.33 -0.02 0.00 -0.00 0.00 0.00 58.65 58.32 3k5o h GLN 571 Cb 0.86 -0.05 -0.01 0.00 0.00 0.00 0.00 27.48 28.28 3k5o h GLN 571 CO 0.07 0.96 0.01 1.25 0.00 0.00 0.00 178.83 181.12 3k5o h HIS 572 N 0.76 0.27 -0.46 3.99 2.76 -1.16 -0.56 115.15 120.75 3k5o h HIS 572 Ca 0.11 -0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.20 3k5o h HIS 572 Cb 0.69 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.56 3k5o h HIS 572 CO 0.04 0.46 0.15 0.28 -1.30 0.00 0.00 177.93 177.56 3k5o h VAL 573 N 0.00 1.22 -0.62 5.26 2.07 -1.25 -0.76 116.25 122.17 3k5o h VAL 573 Ca 0.04 -0.73 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 3k5o h VAL 573 Cb 0.35 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 3k5o h VAL 573 CO 0.01 0.26 0.23 0.78 0.02 0.00 0.00 177.57 178.87 3k5o h ASN 574 N 0.60 0.85 0.16 0.57 2.35 -1.06 -2.02 115.58 117.03 3k5o h ASN 574 Ca 0.15 -0.12 -0.17 0.00 -0.55 0.00 0.00 56.30 55.61 3k5o h ASN 574 Cb 0.26 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 3k5o h ASN 574 CO -0.01 0.77 -0.62 0.00 -1.65 0.00 0.00 177.43 175.93 3k5o h ALA 575 N 1.35 0.69 -0.46 -0.83 0.00 -0.88 -2.64 119.26 116.49 3k5o h ALA 575 Ca 0.21 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3k5o h ALA 575 Cb 0.21 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3k5o h ALA 575 CO -0.02 0.72 0.25 2.35 0.00 0.00 0.00 179.25 182.55 3k5o h TRP 576 N 0.33 0.63 -0.66 0.00 7.01 -0.67 -1.22 115.95 121.38 3k5o h TRP 576 Ca -0.01 -0.02 -0.04 0.00 2.11 0.00 0.00 58.89 60.94 3k5o h TRP 576 Cb 1.17 -0.20 -0.03 0.00 -2.10 0.00 0.00 29.16 27.99 3k5o h TRP 576 CO 0.04 0.48 0.27 -1.49 -2.79 0.00 0.00 178.44 174.95 3k5o h TRP 577 N 0.60 0.99 -0.06 2.65 4.06 -1.32 0.10 115.95 122.98 3k5o h TRP 577 Ca 0.16 -0.07 0.00 0.00 2.06 0.00 0.00 58.89 61.04 3k5o h TRP 577 Cb 0.06 -0.30 -0.00 0.00 -1.00 0.00 0.00 29.16 27.92 3k5o h TRP 577 CO -0.02 0.77 0.04 0.00 -3.56 0.00 0.00 178.44 175.67 3k5o h ALA 578 N 1.12 0.08 -0.04 1.49 0.00 -1.17 -0.03 119.26 120.69 3k5o h ALA 578 Ca 0.22 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3k5o h ALA 578 Cb 0.19 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3k5o h ALA 578 CO -0.02 -0.42 -0.00 0.93 0.00 0.00 0.00 179.25 179.74 3k5o h GLU 579 N 0.06 0.08 0.09 0.00 4.39 -1.14 -2.76 114.58 115.29 3k5o h GLU 579 Ca 0.02 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3k5o h GLU 579 Cb 0.02 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 3k5o h GLU 579 CO -0.00 0.38 -0.09 1.15 -1.16 0.00 0.00 179.01 179.28 3k5o h THR 580 N -0.23 0.78 0.00 1.13 2.02 -0.73 -2.93 112.91 112.95 3k5o h THR 580 Ca 0.01 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 3k5o h THR 580 Cb 0.34 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 3k5o h THR 580 CO 0.00 0.00 -0.15 -0.07 0.37 0.00 0.00 175.52 175.68 3k5o h LEU 581 N -0.21 0.00 -1.69 2.58 3.38 -1.07 -2.44 115.31 115.86 3k5o h LEU 581 Ca 0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3k5o h LEU 581 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3k5o h LEU 581 CO -0.03 0.15 -0.18 0.06 0.09 0.00 0.00 178.44 178.52 3k5o h GLN 582 N 0.00 0.00 0.00 1.13 3.07 -1.29 -0.62 115.11 117.40 3k5o h GLN 582 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 3k5o h GLN 582 Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.99 3k5o h GLN 582 CO 0.02 0.18 -0.05 0.87 0.09 0.00 0.00 178.83 179.93 3k5o h LYS 583 N 0.00 0.00 -0.52 0.06 1.57 -1.49 0.19 116.57 116.37 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 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3k5o h LYS 583 CO 0.02 0.05 0.00 1.04 -0.57 0.00 0.00 179.45 180.00 3k5o n GLN 584 N -3.48 2.40 -3.09 3.15 6.02 -0.34 -4.92 117.38 117.13 3k5o n GLN 584 Ca -0.02 -2.16 -0.18 0.00 -0.01 0.00 0.00 57.00 54.63 3k5o n GLN 584 Cb 0.18 -1.49 0.04 0.00 1.02 0.00 0.00 30.24 29.99 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 1.29 -4.96 -4.46 -1.09 5.12 0.66 -5.02 116.66 108.20 3k5o n ARG 585 Ca 0.20 0.67 -0.29 0.00 -1.93 0.00 0.00 57.85 56.50 3k5o n ARG 585 Cb 0.53 -5.12 -0.13 0.00 -1.16 0.00 0.00 32.46 26.58 3k5o n ARG 585 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3k5o s LEU 586 N -5.56 2.38 -0.30 0.55 1.43 -0.62 -5.00 118.68 111.56 3k5o s LEU 586 Ca 0.34 -0.68 -0.08 0.00 -1.03 0.00 0.00 54.13 52.69 3k5o s LEU 586 Cb -0.15 -1.30 0.01 0.00 0.03 0.00 0.00 46.19 44.77 3k5o s LEU 586 CO 0.42 0.20 0.10 -0.89 0.23 0.00 0.00 176.35 176.41 3k5o s THR 587 N -1.03 4.14 0.05 5.49 2.01 -1.26 -3.21 115.64 121.83 3k5o s THR 587 Ca 0.14 -0.65 -0.31 0.00 0.31 0.00 0.00 61.69 61.19 3k5o s THR 587 Cb -0.10 -3.14 -0.07 0.00 0.01 0.00 0.00 72.50 69.20 3k5o s THR 587 CO 0.06 0.05 1.39 -0.55 -0.69 0.00 0.00 174.62 174.89 3k5o s SER 588 N 1.53 6.85 -0.00 3.53 0.15 -1.26 -4.56 113.70 119.93 3k5o s SER 588 Ca 0.03 2.21 0.06 0.00 0.70 0.00 0.00 55.95 58.95 3k5o s SER 588 Cb -0.17 -2.57 0.18 0.00 -1.71 0.00 0.00 66.02 61.74 3k5o s SER 588 CO 0.04 -0.68 1.15 0.00 1.20 0.00 0.00 173.24 174.94 3k5o n ALA 589 N 4.69 2.11 -1.84 5.45 0.00 -1.26 -4.93 120.51 124.74 3k5o n ALA 589 Ca 0.12 -1.12 -0.41 0.00 0.00 0.00 0.00 53.44 52.04 3k5o n ALA 589 Cb 0.43 -0.25 -0.03 0.00 0.00 0.00 0.00 19.45 19.60 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 -1.05 4.44 -0.29 0.00 1.43 -1.26 -4.85 118.68 117.09 3k5o s LEU 590 Ca 0.14 2.55 -0.01 0.00 -1.03 0.00 0.00 54.13 55.78 3k5o s LEU 590 Cb 0.07 -3.63 0.13 0.00 0.03 0.00 0.00 46.19 42.79 3k5o s LEU 590 CO 0.09 -0.50 0.25 -0.70 0.23 0.00 0.00 176.35 175.72 3k5o s GLU 591 N -1.16 0.30 0.29 1.70 2.12 -1.26 -4.93 118.70 115.76 3k5o s GLU 591 Ca 0.51 -0.28 -0.28 0.00 0.36 0.00 0.00 54.97 55.29 3k5o s GLU 591 Cb -0.38 -0.80 -0.10 0.00 0.26 0.00 0.00 34.13 33.11 3k5o s GLU 591 CO 0.46 -1.03 0.94 -1.17 -0.54 0.00 0.00 175.26 173.92 3k5o s LEU 592 N 2.25 4.45 0.15 2.70 2.96 -1.26 -0.30 118.68 129.63 3k5o s LEU 592 Ca 0.10 1.88 0.08 0.00 -0.22 0.00 0.00 54.13 55.97 3k5o s LEU 592 Cb -0.15 -3.87 -0.04 0.00 0.50 0.00 0.00 46.19 42.64 3k5o s LEU 592 CO -0.33 0.02 -0.18 -1.61 -1.32 0.00 0.00 176.35 172.92 3k5o s GLU 593 N -1.73 1.23 -0.48 1.98 2.02 0.88 -4.87 118.70 117.72 3k5o s GLU 593 Ca 0.47 -1.35 -0.20 0.00 0.02 0.00 0.00 54.97 53.91 3k5o s GLU 593 Cb -0.21 -1.31 0.04 0.00 0.10 0.00 0.00 34.13 32.75 3k5o s GLU 593 CO 0.27 0.27 0.63 -0.47 0.02 0.00 0.00 175.26 175.98 3k5o s TYR 594 N -1.89 3.05 -0.18 1.61 5.04 -1.26 -1.22 117.35 122.49 3k5o s TYR 594 Ca 0.13 -0.34 -0.19 0.00 -2.44 0.00 0.00 57.07 54.23 3k5o s TYR 594 Cb -0.06 -3.45 -0.21 0.00 0.35 0.00 0.00 41.96 38.59 3k5o s TYR 594 CO 0.06 -0.97 0.28 1.49 -1.34 0.00 0.00 175.55 175.07 3k5o h GLU 595 N 8.95 0.06 -2.39 4.97 4.81 -1.47 -3.49 114.58 126.03 3k5o h GLU 595 Ca -0.27 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 58.78 3k5o h GLU 595 Cb 1.10 0.04 -0.19 0.00 0.63 0.00 0.00 28.75 30.33 3k5o h GLU 595 CO 0.93 1.05 0.05 0.99 -0.73 0.00 0.00 179.01 181.31 3k5o s THR 596 N -2.40 0.02 -0.25 0.32 2.01 -1.13 -4.97 115.64 109.24 3k5o s THR 596 Ca -0.27 -0.15 0.03 0.00 0.31 0.00 0.00 61.69 61.61 3k5o s THR 596 Cb 0.06 -0.90 0.05 0.00 0.01 0.00 0.00 72.50 71.72 3k5o s THR 596 CO 0.64 -0.08 -0.12 -2.28 -0.69 0.00 0.00 174.62 172.08 3k5o s HIS 597 N -1.46 3.17 -0.32 4.92 2.46 -1.26 -0.79 115.29 122.01 3k5o s HIS 597 Ca -0.11 -2.20 -0.15 0.00 0.47 0.00 0.00 55.06 53.07 3k5o s HIS 597 Cb -0.01 -1.92 -0.02 0.00 -0.13 0.00 0.00 32.58 30.50 3k5o s HIS 597 CO 0.06 -0.87 0.38 -0.06 -2.47 0.00 0.00 174.74 171.79 3k5o s PHE 598 N 1.14 3.21 0.36 3.88 0.08 0.03 -4.63 117.98 122.06 3k5o s PHE 598 Ca -0.06 0.13 0.22 0.00 0.12 0.00 0.00 56.93 57.33 3k5o s PHE 598 Cb -0.19 -2.68 1.16 0.00 -0.57 0.00 0.00 43.02 40.74 3k5o s PHE 598 CO -0.06 -0.39 1.97 0.00 -0.10 0.00 0.00 175.22 176.64 3k5o s ARG 600 N -4.14 0.75 -0.03 0.00 1.81 -1.21 -0.83 118.95 115.30 3k5o s ARG 600 Ca -0.02 -0.21 -0.01 0.00 -1.72 0.00 0.00 55.73 53.77 3k5o s ARG 600 Cb 0.13 -0.73 0.02 0.00 -0.45 0.00 0.00 34.95 33.93 3k5o s ARG 600 CO 0.63 0.06 0.06 0.12 -0.68 0.00 0.00 175.30 175.49 3k5o s PHE 601 N 0.30 -0.04 -0.25 -0.53 5.36 -0.11 -0.98 117.98 121.73 3k5o s PHE 601 Ca -0.04 0.20 -0.05 0.00 -0.96 0.00 0.00 56.93 56.07 3k5o s PHE 601 Cb -0.08 -0.11 -0.01 0.00 -0.34 0.00 0.00 43.02 42.48 3k5o s PHE 601 CO 0.00 -0.08 0.02 -1.17 -1.46 0.00 0.00 175.22 172.53 3k5o s LEU 602 N 0.71 3.35 -0.27 6.12 2.96 0.02 0.55 118.68 132.13 3k5o s LEU 602 Ca -0.06 -0.48 -0.03 0.00 -0.22 0.00 0.00 54.13 53.34 3k5o s LEU 602 Cb -0.08 -1.82 0.02 0.00 0.50 0.00 0.00 46.19 44.81 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 1.51 2.86 0.89 1.98 -2.45 0.73 -2.78 119.30 122.04 3k5o s MET 603 Ca 0.04 -0.97 -0.14 0.00 -1.25 0.00 0.00 55.69 53.37 3k5o s MET 603 Cb -0.16 -3.11 0.14 0.00 1.25 0.00 0.00 34.83 32.96 3k5o s MET 603 CO 0.00 -0.43 1.25 -2.14 1.05 0.00 0.00 175.02 174.74 3k5o s PRO 604 N 1.36 1.24 -0.14 4.11 0.02 -1.26 -0.08 135.00 140.25 3k5o s PRO 604 Ca 0.00 -0.14 -0.28 0.00 0.02 0.00 0.00 61.00 60.60 3k5o s PRO 604 Cb -0.17 -1.89 -0.01 0.00 0.02 0.00 0.00 34.50 32.45 3k5o s PRO 604 CO -0.02 -2.05 0.97 0.99 -0.33 0.00 0.00 177.00 176.56 3k5o s THR 605 N -3.71 4.79 -0.12 0.99 2.01 -1.26 -4.16 115.64 114.18 3k5o s THR 605 Ca 0.68 1.95 -0.01 0.00 0.31 0.00 0.00 61.69 64.61 3k5o s THR 605 Cb -0.08 -4.27 0.04 0.00 0.01 0.00 0.00 72.50 68.20 3k5o s THR 605 CO 0.51 -0.02 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.78 3k5o s ILE 606 N 2.25 0.63 -0.04 1.82 1.01 -1.26 -4.97 121.20 120.64 3k5o s ILE 606 Ca 0.45 -0.22 0.07 0.00 0.00 0.00 0.00 60.65 60.96 3k5o s ILE 606 Cb -0.17 -0.85 -0.11 0.00 0.01 0.00 0.00 42.46 41.34 3k5o s ILE 606 CO 0.14 0.15 0.10 0.54 0.00 0.00 0.00 174.94 175.87 3k5o n ARG 607 N 5.05 1.57 -0.77 2.79 1.74 -1.26 -1.98 116.66 123.79 3k5o n ARG 607 Ca -0.09 -0.04 0.10 0.00 -0.77 0.00 0.00 57.85 57.06 3k5o n ARG 607 Cb 0.49 -1.19 -0.03 0.00 -1.02 0.00 0.00 32.46 30.71 3k5o n ARG 607 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k5o n GLY 608 N 2.30 -1.10 3.37 -0.13 0.00 -1.26 -4.86 105.19 103.51 3k5o n GLY 608 Ca -0.07 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 3k5o n GLY 608 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5o s LYS 615 N -1.48 3.05 -0.05 1.61 -2.85 -1.26 -5.12 119.74 113.64 3k5o s LYS 615 Ca 0.00 -0.91 0.02 0.00 -1.00 0.00 0.00 55.97 54.09 3k5o s LYS 615 Cb 0.00 -3.52 0.01 0.00 -2.06 0.00 0.00 37.83 32.26 3k5o s LYS 615 CO 0.00 -0.52 -0.10 1.03 0.10 0.00 0.00 175.35 175.86 3k5o s ARG 616 N 1.53 1.35 -0.07 1.78 0.52 -1.26 -3.69 118.95 119.12 3k5o s ARG 616 Ca 0.03 -0.34 -0.32 0.00 -0.52 0.00 0.00 55.73 54.58 3k5o s ARG 616 Cb -0.18 -1.18 0.14 0.00 0.52 0.00 0.00 34.95 34.25 3k5o s ARG 616 CO 0.05 0.04 1.40 1.52 0.02 0.00 0.00 175.30 178.32 3k5o s TYR 617 N 0.57 -0.01 -0.01 -0.53 -0.85 -0.27 -4.50 117.35 111.75 3k5o s TYR 617 Ca -0.11 -0.02 -0.05 0.00 -0.52 0.00 0.00 57.07 56.37 3k5o s TYR 617 Cb -0.14 0.52 0.00 0.00 0.38 0.00 0.00 41.96 42.72 3k5o s TYR 617 CO 0.02 -0.09 0.11 0.00 -1.52 0.00 0.00 175.55 174.07 3k5o s ALA 618 N -2.13 -0.25 0.16 9.51 0.00 -1.12 -0.72 121.76 127.22 3k5o s ALA 618 Ca 0.15 -0.09 -0.20 0.00 0.00 0.00 0.00 51.96 51.82 3k5o s ALA 618 Cb 0.07 0.04 0.05 0.00 0.00 0.00 0.00 23.12 23.28 3k5o s ALA 618 CO -0.06 -0.16 0.54 0.20 0.00 0.00 0.00 175.76 176.28 3k5o s GLY 619 N -1.02 -0.44 -0.12 0.00 0.00 0.06 -0.80 107.32 104.99 3k5o s GLY 619 Ca -0.11 0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.84 3k5o s GLY 619 CO 0.01 -0.02 -0.14 -2.27 0.00 0.00 0.00 173.10 170.68 3k5o s LEU 620 N -2.79 2.69 -0.17 0.66 2.96 -0.15 -0.68 118.68 121.20 3k5o s LEU 620 Ca 0.03 -0.33 -0.01 0.00 -0.22 0.00 0.00 54.13 53.60 3k5o s LEU 620 Cb -0.00 -1.60 -0.00 0.00 0.50 0.00 0.00 46.19 45.08 3k5o s LEU 620 CO -0.11 0.18 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.35 3k5o s ILE 621 N 0.28 2.86 -0.42 6.68 1.01 0.37 -1.18 121.20 130.81 3k5o s ILE 621 Ca -0.10 -0.69 -0.23 0.00 0.00 0.00 0.00 60.65 59.63 3k5o s ILE 621 Cb -0.16 -2.24 0.02 0.00 0.01 0.00 0.00 42.46 40.09 3k5o s ILE 621 CO 0.06 0.49 0.76 -1.58 0.00 0.00 0.00 174.94 174.67 3k5o s GLN 622 N 1.00 3.50 -0.43 2.79 2.00 -1.26 -1.44 119.66 125.82 3k5o s GLN 622 Ca -0.01 -0.02 0.00 0.00 -2.00 0.00 0.00 55.36 53.33 3k5o s GLN 622 Cb -0.15 -3.90 0.12 0.00 0.80 0.00 0.00 33.01 29.88 3k5o s GLN 622 CO -0.02 -1.01 0.20 -1.21 -0.50 0.00 0.00 175.29 172.74 3k5o s GLU 623 N 3.16 1.91 7.82 1.67 2.02 0.11 -5.00 118.70 130.40 3k5o s GLU 623 Ca 0.29 -2.06 0.00 0.00 0.02 0.00 0.00 54.97 53.22 3k5o s GLU 623 Cb -0.13 -3.45 0.00 0.00 0.10 0.00 0.00 34.13 30.66 3k5o s GLU 623 CO 0.20 -1.05 0.00 0.41 0.02 0.00 0.00 175.26 174.84 3k5o n GLY 624 N 4.11 3.52 0.19 -1.39 0.00 -1.26 -1.39 105.19 108.97 3k5o n GLY 624 Ca 0.02 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.10 3k5o n GLY 624 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3k5o n ASP 625 N 7.49 0.78 -4.56 1.61 2.03 -1.26 -4.90 116.55 117.74 3k5o n ASP 625 Ca 0.00 -0.78 -0.24 0.00 0.52 0.00 0.00 54.79 54.29 3k5o n ASP 625 Cb 0.00 0.02 -0.09 0.00 -0.72 0.00 0.00 41.12 40.33 3k5o n ASP 625 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3k5o s LYS 626 N -2.45 1.94 0.03 -0.67 -0.14 -0.49 -5.14 119.74 112.82 3k5o s LYS 626 Ca 0.28 -1.68 0.05 0.00 -1.36 0.00 0.00 55.97 53.25 3k5o s LYS 626 Cb 0.20 -1.91 -0.02 0.00 -1.68 0.00 0.00 37.83 34.42 3k5o s LYS 626 CO 0.48 0.29 -0.14 -0.65 -0.76 0.00 0.00 175.35 174.57 3k5o s GLN 627 N -3.61 0.96 0.02 1.68 -0.21 -1.26 0.07 119.66 117.31 3k5o s GLN 627 Ca 0.32 -0.68 0.01 0.00 0.02 0.00 0.00 55.36 55.02 3k5o s GLN 627 Cb -0.04 -0.96 -0.01 0.00 1.00 0.00 0.00 33.01 33.00 3k5o s GLN 627 CO 0.17 0.24 -0.04 -0.98 -2.12 0.00 0.00 175.29 172.57 3k5o s ARG 628 N -0.92 0.31 0.17 2.91 1.70 -0.52 -4.95 118.95 117.66 3k5o s ARG 628 Ca 0.02 -0.47 0.01 0.00 -0.47 0.00 0.00 55.73 54.83 3k5o s ARG 628 Cb -0.07 -0.07 -0.04 0.00 -0.57 0.00 0.00 34.95 34.20 3k5o s ARG 628 CO 0.01 0.00 0.33 -1.64 -1.08 0.00 0.00 175.30 172.92 3k5o s MET 629 N -1.02 3.47 -0.03 3.89 -1.94 -1.26 -0.48 119.30 121.93 3k5o s MET 629 Ca -0.09 -0.51 0.02 0.00 -1.71 0.00 0.00 55.69 53.40 3k5o s MET 629 Cb -0.07 -2.92 0.01 0.00 2.01 0.00 0.00 34.83 33.86 3k5o s MET 629 CO -0.00 0.47 -0.08 0.08 -0.01 0.00 0.00 175.02 175.48 3k5o s VAL 630 N -1.80 0.74 -0.09 -6.03 1.01 0.15 -4.97 120.40 109.40 3k5o s VAL 630 Ca 0.36 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.04 3k5o s VAL 630 Cb -0.11 -0.68 0.02 0.00 0.00 0.00 0.00 36.38 35.61 3k5o s VAL 630 CO 0.29 0.24 -0.10 -0.36 0.00 0.00 0.00 175.10 175.17 3k5o s PHE 631 N 0.37 1.48 -0.09 5.22 0.08 -1.26 -0.76 117.98 123.02 3k5o s PHE 631 Ca -0.06 -0.66 0.04 0.00 0.12 0.00 0.00 56.93 56.37 3k5o s PHE 631 Cb -0.10 -1.16 0.00 0.00 -0.57 0.00 0.00 43.02 41.19 3k5o s PHE 631 CO 0.01 -0.41 -0.22 0.15 -0.10 0.00 0.00 175.22 174.65 3k5o s LYS 632 N 1.21 2.77 -1.53 0.44 -0.14 0.11 -4.81 119.74 117.79 3k5o s LYS 632 Ca -0.04 -0.79 -0.06 0.00 -1.36 0.00 0.00 55.97 53.72 3k5o s LYS 632 Cb -0.14 -2.12 0.05 0.00 -1.68 0.00 0.00 37.83 33.94 3k5o s LYS 632 CO -0.03 0.16 0.44 0.41 -0.76 0.00 0.00 175.35 175.57 3k5o n GLY 633 N 3.55 -0.27 2.56 -3.33 0.00 -1.24 -1.11 105.19 105.36 3k5o n GLY 633 Ca -0.20 0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 3k5o n GLY 633 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k5o n LEU 634 N -4.42 3.82 -4.14 0.99 4.77 -1.26 -4.56 117.00 112.19 3k5o n LEU 634 Ca -0.20 -5.49 -0.12 0.00 -0.03 0.00 0.00 56.01 50.17 3k5o n LEU 634 Cb 0.63 -0.57 -0.11 0.00 -2.33 0.00 0.00 43.42 41.04 3k5o n LEU 634 CO 0.81 2.15 -0.40 -1.61 -1.33 0.00 0.00 177.39 177.01 3k5o s GLU 635 N -2.74 0.76 0.00 3.23 2.02 -1.26 -5.11 118.70 115.61 3k5o s GLU 635 Ca 0.42 -1.13 0.00 0.00 0.02 0.00 0.00 54.97 54.28 3k5o s GLU 635 Cb 0.19 -0.33 0.00 0.00 0.10 0.00 0.00 34.13 34.09 3k5o s GLU 635 CO -0.05 0.03 0.61 2.41 0.02 0.00 0.00 175.26 178.28 3k5o n THR 636 N 0.54 0.00 -3.64 3.63 -1.04 -1.26 -5.18 114.28 107.33 3k5o n THR 636 Ca -0.16 1.06 -0.05 0.00 -2.04 0.00 0.00 64.05 62.86 3k5o n THR 636 Cb 0.58 -1.97 -0.07 0.00 -1.82 0.00 0.00 70.33 67.05 3k5o n THR 636 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 3k5o s TRP 641 N -1.86 -0.22 0.24 -1.42 -0.11 -1.26 -5.24 118.94 109.07 3k5o s TRP 641 Ca 0.00 0.52 0.05 0.00 1.22 0.00 0.00 56.10 57.88 3k5o s TRP 641 Cb 0.00 0.44 -0.05 0.00 -1.50 0.00 0.00 33.47 32.36 3k5o s TRP 641 CO 0.00 -0.12 -0.03 0.95 -4.62 0.00 0.00 176.95 173.13 3k5o s THR 642 N -0.06 1.24 0.41 5.86 -4.23 -1.26 -4.51 115.64 113.09 3k5o s THR 642 Ca 0.05 -2.07 0.18 0.00 -1.18 0.00 0.00 61.69 58.68 3k5o s THR 642 Cb -0.04 -2.33 0.19 0.00 1.34 0.00 0.00 72.50 71.66 3k5o s THR 642 CO -0.11 -0.36 1.97 -0.65 -0.54 0.00 0.00 174.62 174.93 3k5o h PRO 643 N 2.44 0.00 0.08 3.99 0.11 -1.77 -0.80 132.00 136.06 3k5o h PRO 643 Ca -0.39 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.74 3k5o h PRO 643 Cb 1.22 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 3k5o h PRO 643 CO 0.65 0.22 -0.24 1.25 -0.21 0.00 0.00 178.00 179.66 3k5o h LEU 644 N 0.00 -0.70 -0.31 2.35 5.85 -1.74 0.13 115.31 120.88 3k5o h LEU 644 Ca -0.00 0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 3k5o h LEU 644 Cb 0.43 0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3k5o h LEU 644 CO 0.03 -0.33 0.04 0.00 -0.34 0.00 0.00 178.44 177.84 3k5o h ALA 645 N 0.35 0.41 -0.62 1.25 0.00 -1.70 -1.70 119.26 117.26 3k5o h ALA 645 Ca 0.04 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3k5o h ALA 645 Cb 0.47 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3k5o h ALA 645 CO -0.16 0.12 0.40 0.37 0.00 0.00 0.00 179.25 179.98 3k5o h GLN 646 N 0.34 0.82 -0.32 0.00 5.75 -0.93 0.14 115.11 120.91 3k5o h GLN 646 Ca 0.09 -0.06 -0.15 0.00 -0.15 0.00 0.00 58.65 58.38 3k5o h GLN 646 Cb 0.37 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.73 3k5o h GLN 646 CO 0.01 0.55 -0.41 0.37 -2.65 0.00 0.00 178.83 176.70 3k5o h GLN 647 N 0.83 0.79 -0.14 1.69 4.15 -0.74 -2.07 115.11 119.62 3k5o h GLN 647 Ca 0.22 -0.42 -0.01 0.00 0.77 0.00 0.00 58.65 59.21 3k5o h GLN 647 Cb -0.08 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 3k5o h GLN 647 CO -0.05 1.05 0.05 0.35 -1.93 0.00 0.00 178.83 178.30 3k5o h PHE 648 N 0.64 0.23 -0.28 3.99 3.57 -0.89 -0.17 116.94 124.03 3k5o h PHE 648 Ca 0.05 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3k5o h PHE 648 Cb 0.98 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 3k5o h PHE 648 CO 0.05 0.33 0.17 0.37 -2.23 0.00 0.00 178.31 177.01 3k5o h GLN 649 N 0.06 0.37 0.38 1.11 4.15 -0.74 0.52 115.11 120.97 3k5o h GLN 649 Ca 0.05 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.43 3k5o h GLN 649 Cb 0.21 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.80 3k5o h GLN 649 CO -0.00 0.27 -0.34 0.37 -1.93 0.00 0.00 178.83 177.21 3k5o h GLN 650 N 0.36 -0.70 -0.40 1.69 4.15 -1.26 0.26 115.11 119.21 3k5o h GLN 650 Ca 0.10 0.05 -0.13 0.00 0.77 0.00 0.00 58.65 59.44 3k5o h GLN 650 Cb -0.01 0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 3k5o h GLN 650 CO -0.02 -0.47 -0.26 0.93 -1.93 0.00 0.00 178.83 177.09 3k5o h GLU 651 N -0.73 0.84 -0.16 1.69 5.08 -0.98 -2.61 114.58 117.72 3k5o h GLU 651 Ca -0.03 -0.37 -0.04 0.00 -1.00 0.00 0.00 59.36 57.92 3k5o h GLU 651 Cb 0.64 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 3k5o h GLU 651 CO -0.03 1.00 -0.06 1.25 -1.00 0.00 0.00 179.01 180.17 3k5o h LEU 652 N 0.72 0.33 -0.89 1.33 5.85 -0.80 -2.34 115.31 119.52 3k5o h LEU 652 Ca 0.09 -0.40 -0.06 0.00 0.84 0.00 0.00 57.88 58.35 3k5o h LEU 652 Cb 0.80 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.71 3k5o h LEU 652 CO 0.07 0.65 0.14 1.88 -0.34 0.00 0.00 178.44 180.84 3k5o h TYR 653 N 0.01 1.00 -0.50 1.25 0.99 -0.52 -1.88 116.97 117.31 3k5o h TYR 653 Ca 0.04 -0.11 -0.07 0.00 2.00 0.00 0.00 58.73 60.59 3k5o h TYR 653 Cb 0.52 -0.29 -0.02 0.00 1.00 0.00 0.00 36.73 37.95 3k5o h TYR 653 CO 0.06 0.83 0.02 1.25 -0.00 0.00 0.00 178.16 180.33 3k5o h LEU 654 N 0.92 0.84 -0.18 3.88 5.85 -1.45 0.17 115.31 125.33 3k5o h LEU 654 Ca 0.19 -0.29 0.01 0.00 0.84 0.00 0.00 57.88 58.63 3k5o h LEU 654 Cb 0.34 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3k5o h LEU 654 CO 0.00 0.93 0.09 0.03 -0.34 0.00 0.00 178.44 179.15 3k5o h ARG 655 N 0.73 0.19 -0.29 1.25 3.08 -1.11 -0.45 114.38 117.79 3k5o h ARG 655 Ca 0.14 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 60.08 3k5o h ARG 655 Cb 0.48 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 3k5o h ARG 655 CO 0.02 0.12 -0.25 0.82 -1.07 0.00 0.00 179.97 179.62 3k5o h ILE 656 N 0.19 1.27 -0.40 2.04 2.04 -1.18 0.22 117.51 121.69 3k5o h ILE 656 Ca 0.07 -1.29 -0.07 0.00 1.00 0.00 0.00 64.86 64.57 3k5o h ILE 656 Cb 0.02 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 3k5o h ILE 656 CO -0.05 0.42 -0.04 -0.26 0.00 0.00 0.00 178.15 178.21 3k5o h PHE 657 N 0.49 0.70 -0.41 1.37 0.04 -0.24 -2.41 116.94 116.48 3k5o h PHE 657 Ca 0.07 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.74 3k5o h PHE 657 Cb 0.69 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.65 3k5o h PHE 657 CO 0.03 0.70 0.00 0.54 -0.60 0.00 0.00 178.31 178.97 3k5o n ARG 658 N -4.22 2.04 -2.87 1.51 1.74 -0.21 -4.94 116.66 109.70 3k5o n ARG 658 Ca 0.02 -1.60 -0.20 0.00 -0.77 0.00 0.00 57.85 55.29 3k5o n ARG 658 Cb 0.30 -1.37 0.01 0.00 -1.02 0.00 0.00 32.46 30.39 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 0.80 -5.11 -4.97 0.55 3.02 -0.37 -4.99 115.26 104.19 3k5o n ASN 659 Ca 0.16 -0.17 -0.21 0.00 -0.03 0.00 0.00 54.58 54.33 3k5o n ASN 659 Cb 0.39 -4.21 -0.00 0.00 -0.61 0.00 0.00 39.78 35.35 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 -5.52 3.21 0.35 3.52 2.02 0.63 -5.01 118.70 117.90 3k5o s GLU 660 Ca 0.21 -0.72 -0.28 0.00 0.02 0.00 0.00 54.97 54.20 3k5o s GLU 660 Cb -0.10 -2.73 -0.11 0.00 0.10 0.00 0.00 34.13 31.29 3k5o s GLU 660 CO 0.26 0.04 1.38 -2.14 0.02 0.00 0.00 175.26 174.82 3k5o s PRO 661 N -4.27 4.26 0.00 0.39 0.02 -1.26 -4.39 135.00 129.75 3k5o s PRO 661 Ca 0.43 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.81 3k5o s PRO 661 Cb -0.10 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.40 3k5o s PRO 661 CO 0.33 -0.32 0.00 2.48 -0.33 0.00 0.00 177.00 179.16 3k5o n TYR 662 N 0.66 0.00 -0.24 6.54 0.18 -1.26 -4.85 117.16 118.19 3k5o n TYR 662 Ca 0.00 0.00 0.04 0.00 1.88 0.00 0.00 57.90 59.83 3k5o n TYR 662 Cb 0.41 0.00 0.17 0.00 -0.38 0.00 0.00 39.34 39.53 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 0.28 -0.05 -3.48 4.20 -2.00 0.18 115.11 114.23 3k5o h GLN 663 Ca 0.00 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 3k5o h GLN 663 Cb 0.18 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 3k5o h GLN 663 CO 0.00 0.18 -0.44 1.49 -0.67 0.00 0.00 178.83 179.39 3k5o h GLU 664 N 0.29 0.12 -0.52 1.46 4.57 -2.00 -2.58 114.58 115.91 3k5o h GLU 664 Ca 0.39 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.48 3k5o h GLU 664 Cb 0.65 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.21 3k5o h GLU 664 CO -0.48 0.54 0.19 -0.92 -1.18 0.00 0.00 179.01 177.16 3k5o h TYR 665 N 0.10 0.82 -0.27 0.92 3.20 -1.34 -0.89 116.97 119.50 3k5o h TYR 665 Ca 0.01 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.78 3k5o h TYR 665 Cb 0.82 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 3k5o h TYR 665 CO 0.01 0.69 0.09 0.28 -1.64 0.00 0.00 178.16 177.58 3k5o h VAL 666 N 0.71 1.20 -0.14 1.81 2.07 -1.04 -1.50 116.25 119.35 3k5o h VAL 666 Ca 0.17 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 67.07 3k5o h VAL 666 Cb 0.23 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3k5o h VAL 666 CO -0.01 0.21 0.08 0.03 0.02 0.00 0.00 177.57 177.90 3k5o h ARG 667 N 0.27 0.16 -0.95 1.57 3.08 -1.32 -1.02 114.38 116.17 3k5o h ARG 667 Ca 0.09 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3k5o h ARG 667 Cb 0.24 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.20 3k5o h ARG 667 CO -0.00 0.11 0.61 1.49 -1.07 0.00 0.00 179.97 181.10 3k5o h GLU 668 N 0.17 1.27 -0.16 0.04 4.57 -1.12 0.14 114.58 119.48 3k5o h GLU 668 Ca 0.06 -0.09 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 3k5o h GLU 668 Cb -0.00 -0.28 -0.01 0.00 -0.16 0.00 0.00 28.75 28.30 3k5o h GLU 668 CO -0.03 0.86 0.02 1.15 -1.18 0.00 0.00 179.01 179.83 3k5o h THR 669 N 1.30 1.22 0.08 0.32 2.02 -0.89 -0.97 112.91 115.99 3k5o h THR 669 Ca 0.35 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.80 3k5o h THR 669 Cb -0.11 1.39 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 3k5o h THR 669 CO -0.07 0.22 -0.05 0.40 0.37 0.00 0.00 175.52 176.38 3k5o h ILE 670 N 0.05 0.89 -0.59 3.11 2.04 -0.81 0.40 117.51 122.59 3k5o h ILE 670 Ca 0.05 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 3k5o h ILE 670 Cb 0.31 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 3k5o h ILE 670 CO 0.00 0.00 0.33 -0.78 0.00 0.00 0.00 178.15 177.71 3k5o h ASP 671 N -0.13 0.74 -0.07 1.72 3.58 -0.71 -1.10 116.42 120.44 3k5o h ASP 671 Ca -0.01 -0.09 -0.08 0.00 0.42 0.00 0.00 57.03 57.28 3k5o h ASP 671 Cb 0.11 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 40.96 3k5o h ASP 671 CO 0.01 0.61 -0.19 0.11 -2.88 0.00 0.00 179.24 176.89 3k5o h LYS 672 N 0.81 0.45 -0.11 0.28 1.57 -1.04 -1.11 116.57 117.43 3k5o h LYS 672 Ca 0.21 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 3k5o h LYS 672 Cb 0.03 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 3k5o h LYS 672 CO -0.04 0.63 0.02 1.25 -0.57 0.00 0.00 179.45 180.75 3k5o h LEU 673 N 0.41 0.16 -1.29 2.94 5.85 -0.29 -0.88 115.31 122.21 3k5o h LEU 673 Ca 0.07 -0.24 -0.06 0.00 0.84 0.00 0.00 57.88 58.49 3k5o h LEU 673 Cb 0.58 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 3k5o h LEU 673 CO 0.04 0.36 -0.30 0.24 -0.34 0.00 0.00 178.44 178.44 3k5o h MET 674 N -0.04 0.00 0.00 1.25 2.86 -1.05 -2.52 114.93 115.44 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 0.26 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.92 3k5o h MET 674 CO 0.00 0.30 -0.02 0.00 1.06 0.00 0.00 176.91 178.26 3k5o h ALA 675 N 1.70 1.00 0.00 6.32 0.00 -1.02 -3.47 119.26 123.79 3k5o h ALA 675 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3k5o h ALA 675 Cb 0.68 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3k5o h ALA 675 CO 0.04 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.72 3k5o n GLY 676 N 0.52 0.77 0.33 0.00 0.00 -0.94 -4.97 105.19 100.90 3k5o n GLY 676 Ca 0.02 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.38 1.25 -0.29 1.61 1.02 -0.38 -3.94 120.64 117.54 3k5o n GLU 677 Ca 0.00 -0.67 0.08 0.00 -0.02 0.00 0.00 57.16 56.55 3k5o n GLU 677 Cb 0.00 -1.49 0.19 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 -0.29 2.98 -0.14 -4.62 4.77 -1.24 -4.79 117.00 113.67 3k5o n LEU 678 Ca 0.17 -3.20 0.23 0.00 -0.03 0.00 0.00 56.01 53.18 3k5o n LEU 678 Cb 0.33 -0.49 0.65 0.00 -2.33 0.00 0.00 43.42 41.58 3k5o n LEU 678 CO 0.20 0.81 1.23 0.44 -1.33 0.00 0.00 177.39 178.74 3k5o h ASP 679 N 0.71 0.12 0.60 -1.43 5.19 -1.92 -0.61 116.42 119.07 3k5o h ASP 679 Ca 0.02 0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.42 3k5o h ASP 679 Cb 1.18 -0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.68 3k5o h ASP 679 CO 0.10 0.05 -0.09 0.00 -3.12 0.00 0.00 179.24 176.18 3k5o h ALA 680 N 1.62 1.11 -0.09 3.45 0.00 -1.93 -2.68 119.26 120.74 3k5o h ALA 680 Ca 0.39 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3k5o h ALA 680 Cb 1.35 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3k5o h ALA 680 CO -0.05 0.11 0.00 0.54 0.00 0.00 0.00 179.25 179.85 3k5o n ARG 681 N -3.36 2.02 -0.26 0.00 1.74 -0.24 -4.39 116.66 112.18 3k5o n ARG 681 Ca -0.01 -1.50 0.07 0.00 -0.77 0.00 0.00 57.85 55.64 3k5o n ARG 681 Cb 0.27 -1.46 0.21 0.00 -1.02 0.00 0.00 32.46 30.45 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 0.79 2.57 -4.64 0.55 4.77 -1.01 -1.82 117.00 118.20 3k5o n LEU 682 Ca 0.17 -1.29 -0.41 0.00 -0.03 0.00 0.00 56.01 54.45 3k5o n LEU 682 Cb 0.47 -0.33 -0.05 0.00 -2.33 0.00 0.00 43.42 41.18 3k5o n LEU 682 CO 0.15 0.60 0.59 -0.69 -1.33 0.00 0.00 177.39 176.71 3k5o s VAL 683 N -1.46 4.87 0.22 4.08 1.01 -1.26 -4.62 120.40 123.25 3k5o s VAL 683 Ca 0.31 1.47 -0.22 0.00 0.00 0.00 0.00 61.98 63.54 3k5o s VAL 683 Cb 0.17 -4.07 -0.08 0.00 0.00 0.00 0.00 36.38 32.39 3k5o s VAL 683 CO 0.20 -0.04 0.76 -0.31 0.00 0.00 0.00 175.10 175.70 3k5o s TYR 684 N 2.72 3.72 -0.16 5.22 2.02 0.78 -4.47 117.35 127.18 3k5o s TYR 684 Ca 0.33 1.49 -0.01 0.00 -0.37 0.00 0.00 57.07 58.51 3k5o s TYR 684 Cb -0.15 -2.68 0.04 0.00 -0.40 0.00 0.00 41.96 38.76 3k5o s TYR 684 CO 0.08 0.37 -0.05 1.03 -1.57 0.00 0.00 175.55 175.41 3k5o s ARG 685 N -1.77 1.38 0.01 -0.62 0.52 -1.26 -1.38 118.95 115.83 3k5o s ARG 685 Ca 0.42 -0.46 -0.00 0.00 -0.52 0.00 0.00 55.73 55.16 3k5o s ARG 685 Cb -0.18 -1.93 -0.01 0.00 0.52 0.00 0.00 34.95 33.35 3k5o s ARG 685 CO 0.22 -0.42 -0.02 0.21 0.02 0.00 0.00 175.30 175.32 3k5o s LYS 686 N 1.66 0.23 0.26 3.54 2.20 -0.50 -4.98 119.74 122.15 3k5o s LYS 686 Ca 0.01 -0.44 -0.30 0.00 -0.36 0.00 0.00 55.97 54.88 3k5o s LYS 686 Cb -0.15 0.08 -0.09 0.00 -1.51 0.00 0.00 37.83 36.16 3k5o s LYS 686 CO -0.08 -0.04 1.02 1.03 -0.36 0.00 0.00 175.35 176.92 3k5o s ARG 687 N -1.07 4.75 -0.49 4.03 0.52 -1.26 -1.41 118.95 124.02 3k5o s ARG 687 Ca -0.12 1.64 -0.17 0.00 -0.52 0.00 0.00 55.73 56.57 3k5o s ARG 687 Cb -0.07 -3.24 0.07 0.00 0.52 0.00 0.00 34.95 32.23 3k5o s ARG 687 CO -0.01 0.37 0.49 -0.51 0.02 0.00 0.00 175.30 175.67 3k5o s LEU 688 N -1.30 5.38 0.00 2.53 2.01 -0.08 -4.92 118.68 122.30 3k5o s LEU 688 Ca 0.43 -1.18 0.27 0.00 0.01 0.00 0.00 54.13 53.65 3k5o s LEU 688 Cb -0.29 -2.29 0.85 0.00 0.01 0.00 0.00 46.19 44.47 3k5o s LEU 688 CO 0.36 -0.76 1.62 -2.11 1.01 0.00 0.00 176.35 176.48 3k5o n ARG 689 N 5.60 0.90 -4.17 1.70 1.85 -1.26 -3.51 116.66 117.77 3k5o n ARG 689 Ca -0.10 -0.51 -0.16 0.00 -1.00 0.00 0.00 57.85 56.08 3k5o n ARG 689 Cb 0.44 -1.49 -0.11 0.00 -1.05 0.00 0.00 32.46 30.25 3k5o n ARG 689 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3k5o s ARG 690 N -2.45 0.82 0.35 2.89 0.52 -1.26 -4.98 118.95 114.84 3k5o s ARG 690 Ca 0.26 -1.03 -0.29 0.00 -0.52 0.00 0.00 55.73 54.15 3k5o s ARG 690 Cb 0.20 -0.68 -0.11 0.00 0.52 0.00 0.00 34.95 34.87 3k5o s ARG 690 CO 0.49 0.13 1.52 -2.30 0.02 0.00 0.00 175.30 175.17 3k5o n PRO 691 N 0.97 2.66 -0.23 3.54 -0.02 -1.26 -4.06 135.00 136.60 3k5o n PRO 691 Ca -0.19 0.94 0.30 0.00 -2.02 0.00 0.00 63.50 62.53 3k5o n PRO 691 Cb 0.56 -2.68 0.71 0.00 -0.02 0.00 0.00 33.50 32.06 3k5o n PRO 691 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3k5o h LEU 692 N 3.57 0.05 -1.24 2.45 5.85 -0.56 -0.97 115.31 124.46 3k5o h LEU 692 Ca -0.49 0.01 0.20 0.00 0.84 0.00 0.00 57.88 58.44 3k5o h LEU 692 Cb 1.24 -0.00 -0.09 0.00 0.37 0.00 0.00 40.66 42.18 3k5o h LEU 692 CO 0.69 0.01 0.62 -1.28 -0.34 0.00 0.00 178.44 178.14 3k5o h SER 693 N 0.05 0.61 -0.03 1.25 0.87 -1.87 -3.07 113.55 111.35 3k5o h SER 693 Ca 0.48 0.07 -0.15 0.00 -1.23 0.00 0.00 61.79 60.97 3k5o h SER 693 Cb 1.83 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.75 3k5o h SER 693 CO -0.03 0.22 -0.47 -0.33 -0.53 0.00 0.00 176.83 175.69 3k5o h GLU 694 N 0.60 0.58 -6.41 2.24 5.08 -1.52 -3.45 114.58 111.71 3k5o h GLU 694 Ca 0.54 -0.33 -0.53 0.00 -1.00 0.00 0.00 59.36 58.04 3k5o h GLU 694 Cb 1.06 0.02 0.02 0.00 0.50 0.00 0.00 28.75 30.35 3k5o h GLU 694 CO -0.29 0.93 1.08 0.71 -1.00 0.00 0.00 179.01 180.43 3k5o s TYR 695 N -4.14 2.09 0.00 4.33 2.02 -1.16 -4.72 117.35 115.76 3k5o s TYR 695 Ca -0.08 0.10 0.00 0.00 -0.37 0.00 0.00 57.07 56.73 3k5o s TYR 695 Cb 0.12 -4.04 0.00 0.00 -0.40 0.00 0.00 41.96 37.64 3k5o s TYR 695 CO 0.83 -4.33 0.00 1.04 -1.57 0.00 0.00 175.55 171.53 3k5o n GLN 696 N 6.24 1.67 -3.32 -0.62 1.13 -1.26 -4.99 117.38 116.23 3k5o n GLN 696 Ca 0.17 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.80 3k5o n GLN 696 Cb 0.41 -0.14 -0.08 0.00 0.11 0.00 0.00 30.24 30.54 3k5o n GLN 696 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3k5o s ARG 697 N 0.00 3.06 -0.16 -1.09 0.52 -1.26 -4.72 118.95 115.30 3k5o s ARG 697 Ca 0.00 -0.93 -0.14 0.00 -0.52 0.00 0.00 55.73 54.14 3k5o s ARG 697 Cb 0.00 -4.02 0.02 0.00 0.52 0.00 0.00 34.95 31.47 3k5o s ARG 697 CO 0.00 -0.94 0.24 0.09 0.02 0.00 0.00 175.30 174.71 3k5o n ASN 698 N 5.57 -1.95 -4.69 0.23 3.02 -1.26 -4.68 115.26 111.50 3k5o n ASN 698 Ca -0.09 -0.07 -0.44 0.00 -0.03 0.00 0.00 54.58 53.96 3k5o n ASN 698 Cb 0.46 -0.57 -0.04 0.00 -0.61 0.00 0.00 39.78 39.03 3k5o n ASN 698 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3k5o n VAL 699 N -0.08 0.25 -1.97 2.41 0.31 -1.26 -4.98 118.33 113.00 3k5o n VAL 699 Ca -0.03 -0.05 -0.38 0.00 -0.01 0.00 0.00 64.34 63.87 3k5o n VAL 699 Cb 0.25 -1.92 0.02 0.00 -0.91 0.00 0.00 33.84 31.27 3k5o n VAL 699 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3k5o s PRO 700 N 2.24 3.51 0.24 5.55 0.04 -1.26 -4.76 135.00 140.55 3k5o s PRO 700 Ca 0.82 2.10 -0.09 0.00 0.04 0.00 0.00 61.00 63.87 3k5o s PRO 700 Cb -0.56 -2.42 0.38 0.00 0.04 0.00 0.00 34.50 31.94 3k5o s PRO 700 CO 0.39 -0.85 1.62 -1.35 0.04 0.00 0.00 177.00 176.85 3k5o h PRO 701 N 1.91 0.05 -0.88 0.56 0.11 -1.98 -0.95 132.00 130.82 3k5o h PRO 701 Ca -0.50 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.62 3k5o h PRO 701 Cb 1.27 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.32 3k5o h PRO 701 CO 0.59 0.04 0.58 1.12 -0.21 0.00 0.00 178.00 180.12 3k5o h HIS 702 N 0.06 1.09 -0.47 0.65 2.07 -1.98 0.74 115.15 117.30 3k5o h HIS 702 Ca 0.39 0.03 -0.09 0.00 -2.85 0.00 0.00 60.37 57.85 3k5o h HIS 702 Cb 0.65 -0.37 -0.02 0.00 2.57 0.00 0.00 27.41 30.25 3k5o h HIS 702 CO -0.49 0.67 -0.04 0.28 -3.07 0.00 0.00 177.93 175.27 3k5o h VAL 703 N 1.16 1.27 0.00 6.12 2.07 -1.58 -1.43 116.25 123.86 3k5o h VAL 703 Ca 0.33 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.72 3k5o h VAL 703 Cb -0.07 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 3k5o h VAL 703 CO -0.08 0.39 0.00 0.08 0.02 0.00 0.00 177.57 177.98 3k5o h ARG 704 N 0.72 0.00 0.06 1.57 0.11 -0.45 -0.83 114.38 115.57 3k5o h ARG 704 Ca 0.13 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 59.93 3k5o h ARG 704 Cb 0.57 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.67 3k5o h ARG 704 CO 0.03 0.00 -1.14 0.00 0.10 0.00 0.00 179.97 178.96 3k5o h ALA 705 N 2.23 0.09 -0.57 0.08 0.00 -0.46 -2.94 119.26 117.69 3k5o h ALA 705 Ca 0.00 -0.74 -0.08 0.00 0.00 0.00 0.00 54.91 54.08 3k5o h ALA 705 Cb 0.59 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3k5o h ALA 705 CO 0.00 0.71 0.02 0.00 0.00 0.00 0.00 179.25 179.98 3k5o h ALA 706 N 0.39 0.96 -0.82 0.00 0.00 -0.84 -1.10 119.26 117.85 3k5o h ALA 706 Ca -0.15 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.51 3k5o h ALA 706 Cb 1.81 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 19.32 3k5o h ALA 706 CO 0.22 0.63 0.52 -0.09 0.00 0.00 0.00 179.25 180.53 3k5o h ARG 707 N 0.89 0.95 -0.30 0.00 2.43 -1.19 -1.60 114.38 115.56 3k5o h ARG 707 Ca 0.17 -0.06 -0.18 0.00 -0.81 0.00 0.00 59.98 59.10 3k5o h ARG 707 Cb 0.50 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 3k5o h ARG 707 CO 0.02 0.63 -0.51 -0.07 -1.51 0.00 0.00 179.97 178.53 3k5o h LEU 708 N 0.98 0.96 -0.51 3.80 4.07 -1.27 -2.12 115.31 121.22 3k5o h LEU 708 Ca 0.34 -0.50 0.02 0.00 0.08 0.00 0.00 57.88 57.82 3k5o h LEU 708 Cb 0.08 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 41.51 3k5o h LEU 708 CO -0.14 1.29 0.31 0.00 -1.08 0.00 0.00 178.44 178.83 3k5o h ALA 709 N 0.73 0.65 0.00 1.53 0.00 -0.46 -1.63 119.26 120.08 3k5o h ALA 709 Ca 0.02 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 3k5o h ALA 709 Cb 1.12 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3k5o h ALA 709 CO 0.12 0.03 -0.41 -0.44 0.00 0.00 0.00 179.25 178.55 3k5o h ASP 710 N 0.63 0.00 -0.31 0.00 3.32 -1.34 -1.86 116.42 116.86 3k5o h ASP 710 Ca 0.20 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.26 3k5o h ASP 710 Cb -0.01 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 3k5o h ASP 710 CO -0.08 0.41 0.19 -0.08 -1.72 0.00 0.00 179.24 177.96 3k5o h GLU 711 N 0.00 0.38 0.00 3.56 4.81 -0.66 -0.48 114.58 122.19 3k5o h GLU 711 Ca -0.00 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.09 3k5o h GLU 711 Cb 1.13 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.41 3k5o h GLU 711 CO 0.05 0.25 -0.52 1.49 -0.73 0.00 0.00 179.01 179.55 3k5o h GLU 712 N 0.39 0.00 -0.70 1.92 4.57 -1.22 -2.28 114.58 117.26 3k5o h GLU 712 Ca 0.12 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.29 3k5o h GLU 712 Cb -0.01 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.55 3k5o h GLU 712 CO -0.05 0.52 0.38 -0.91 -1.18 0.00 0.00 179.01 177.76 3k5o h ASN 713 N 0.00 0.88 -0.13 1.04 2.35 -0.41 -0.57 115.58 118.74 3k5o h ASN 713 Ca -0.01 -0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.59 3k5o h ASN 713 Cb 0.98 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 39.12 3k5o h ASN 713 CO 0.07 0.73 -0.13 1.56 -1.65 0.00 0.00 177.43 178.00 3k5o h GLN 714 N 0.96 0.32 -0.94 0.81 7.50 -1.00 1.05 115.11 123.80 3k5o h GLN 714 Ca 0.24 -0.17 0.01 0.00 0.50 0.00 0.00 58.65 59.24 3k5o h GLN 714 Cb 0.05 0.01 -0.05 0.00 0.05 0.00 0.00 27.48 27.54 3k5o h GLN 714 CO -0.04 0.72 0.62 1.57 -1.50 0.00 0.00 178.83 180.20 3k5o h LYS 715 N -0.07 1.21 -0.31 1.46 5.09 -1.28 -1.37 116.57 121.30 3k5o h LYS 715 Ca 0.02 -0.07 0.00 0.00 0.09 0.00 0.00 60.65 60.69 3k5o h LYS 715 Cb 0.66 -0.27 0.00 0.00 0.10 0.00 0.00 32.23 32.72 3k5o h LYS 715 CO 0.03 0.80 0.00 2.89 -2.09 0.00 0.00 179.45 181.09 3k5o n ARG 716 N -4.40 1.92 -1.00 0.07 1.85 -0.23 -4.95 116.66 109.92 3k5o n ARG 716 Ca 0.11 -1.41 -0.00 0.00 -1.00 0.00 0.00 57.85 55.55 3k5o n ARG 716 Cb 0.03 -1.37 -0.00 0.00 -1.05 0.00 0.00 32.46 30.07 3k5o n ARG 716 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3k5o n GLY 717 N 1.19 0.49 3.96 2.89 0.00 -0.52 -5.03 105.19 108.16 3k5o n GLY 717 Ca 0.15 -0.02 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 3k5o n GLY 717 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k5o s ARG 718 N -0.07 1.83 0.37 1.61 0.52 0.35 -4.97 118.95 118.59 3k5o s ARG 718 Ca 0.00 -0.64 -0.22 0.00 -0.52 0.00 0.00 55.73 54.35 3k5o s ARG 718 Cb 0.00 -2.22 -0.10 0.00 0.52 0.00 0.00 34.95 33.15 3k5o s ARG 718 CO 0.00 -1.42 0.92 -2.14 0.02 0.00 0.00 175.30 172.68 3k5o s PRO 719 N -5.24 4.33 0.30 3.54 0.02 -1.26 -4.26 135.00 132.43 3k5o s PRO 719 Ca 0.64 1.14 -0.29 0.00 0.02 0.00 0.00 61.00 62.51 3k5o s PRO 719 Cb -0.08 -2.45 -0.10 0.00 0.02 0.00 0.00 34.50 31.90 3k5o s PRO 719 CO 0.45 0.11 1.13 -0.51 -0.33 0.00 0.00 177.00 177.85 3k5o s LEU 720 N -2.71 4.48 -0.01 -5.54 1.43 -1.26 -4.90 118.68 110.17 3k5o s LEU 720 Ca 0.56 2.31 0.09 0.00 -1.03 0.00 0.00 54.13 56.07 3k5o s LEU 720 Cb -0.13 -3.70 -0.14 0.00 0.03 0.00 0.00 46.19 42.25 3k5o s LEU 720 CO 0.17 -0.26 0.22 0.00 0.23 0.00 0.00 176.35 176.72 3k5o n GLN 721 N 0.96 0.64 -0.27 1.70 6.02 -1.26 -4.78 117.38 120.39 3k5o n GLN 721 Ca -0.00 -0.08 0.08 0.00 -0.01 0.00 0.00 57.00 57.00 3k5o n GLN 721 Cb 0.45 -1.19 0.17 0.00 1.02 0.00 0.00 30.24 30.68 3k5o n GLN 721 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3k5o n TYR 722 N -1.76 0.04 -0.02 1.08 4.01 -1.26 -4.76 117.16 114.49 3k5o n TYR 722 Ca -0.01 -1.17 -0.16 0.00 -0.16 0.00 0.00 57.90 56.39 3k5o n TYR 722 Cb 0.23 -0.19 -0.05 0.00 -0.31 0.00 0.00 39.34 39.02 3k5o n TYR 722 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 3k5o h GLN 723 N 0.39 0.74 -2.84 -0.72 1.08 -1.96 -3.36 115.11 108.44 3k5o h GLN 723 Ca 0.00 -0.59 -0.61 0.00 -1.45 0.00 0.00 58.65 56.00 3k5o h GLN 723 Cb 1.02 0.12 -0.42 0.00 -0.05 0.00 0.00 27.48 28.15 3k5o h GLN 723 CO 0.01 1.20 -0.60 0.09 -0.95 0.00 0.00 178.83 178.58 3k5o n ASN 724 N -3.93 3.01 -0.17 1.46 4.13 -1.26 0.02 115.26 118.52 3k5o n ASN 724 Ca -0.07 -3.22 0.00 0.00 1.68 0.00 0.00 54.58 52.97 3k5o n ASN 724 Cb 0.73 -0.73 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 3k5o n ASN 724 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 3k5o n ARG 725 N 1.73 0.00 0.00 3.52 1.74 -1.26 -4.97 116.66 117.43 3k5o n ARG 725 Ca 0.23 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.31 3k5o n ARG 725 Cb 0.37 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.81 3k5o n ARG 725 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k5o n GLY 726 N 0.00 -1.23 3.32 -0.13 0.00 -1.23 -4.72 105.19 101.21 3k5o n GLY 726 Ca 0.00 -2.12 -0.32 0.00 0.00 0.00 0.00 46.02 43.58 3k5o n GLY 726 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5o s THR 727 N 0.00 2.31 -0.03 2.61 2.01 -1.11 -0.91 115.64 120.52 3k5o s THR 727 Ca 0.00 -0.99 0.06 0.00 0.31 0.00 0.00 61.69 61.07 3k5o s THR 727 Cb 0.00 -1.85 -0.01 0.00 0.01 0.00 0.00 72.50 70.65 3k5o s THR 727 CO 0.00 0.57 -0.21 -0.51 -0.69 0.00 0.00 174.62 173.78 3k5o s ILE 728 N -0.35 1.72 -0.15 1.82 2.07 -0.50 -4.97 121.20 120.84 3k5o s ILE 728 Ca 0.02 -0.91 -0.05 0.00 -1.41 0.00 0.00 60.65 58.30 3k5o s ILE 728 Cb -0.12 -1.44 -0.03 0.00 0.13 0.00 0.00 42.46 40.99 3k5o s ILE 728 CO 0.02 0.49 0.01 -0.54 -1.91 0.00 0.00 174.94 173.01 3k5o s LYS 729 N -0.32 3.64 0.21 3.50 1.02 -1.26 -1.41 119.74 125.12 3k5o s LYS 729 Ca 0.03 -0.41 -0.08 0.00 0.02 0.00 0.00 55.97 55.52 3k5o s LYS 729 Cb -0.10 -3.01 -0.02 0.00 -0.52 0.00 0.00 37.83 34.18 3k5o s LYS 729 CO 0.01 0.37 0.33 1.52 -0.92 0.00 0.00 175.35 176.65 3k5o s TYR 730 N 0.05 0.60 0.11 3.18 -0.85 -0.48 -1.23 117.35 118.73 3k5o s TYR 730 Ca 0.03 -0.92 0.02 0.00 -0.52 0.00 0.00 57.07 55.68 3k5o s TYR 730 Cb -0.13 -0.09 -0.04 0.00 0.38 0.00 0.00 41.96 42.08 3k5o s TYR 730 CO 0.02 -0.82 -0.05 0.14 -1.52 0.00 0.00 175.55 173.32 3k5o s VAL 731 N -4.04 0.70 -0.31 -3.49 -7.23 -0.39 -0.16 120.40 105.48 3k5o s VAL 731 Ca 0.26 -1.95 -0.16 0.00 -1.81 0.00 0.00 61.98 58.32 3k5o s VAL 731 Cb 0.03 -1.77 -0.02 0.00 0.56 0.00 0.00 36.38 35.17 3k5o s VAL 731 CO 0.07 -0.79 0.39 0.86 -0.31 0.00 0.00 175.10 175.32 3k5o s TRP 732 N -3.62 3.22 0.49 2.82 -0.11 -1.26 -1.33 118.94 119.14 3k5o s TRP 732 Ca 0.14 0.22 0.07 0.00 1.22 0.00 0.00 56.10 57.75 3k5o s TRP 732 Cb 0.05 -2.67 0.02 0.00 -1.50 0.00 0.00 33.47 29.37 3k5o s TRP 732 CO -0.03 -0.35 0.43 0.95 -4.62 0.00 0.00 176.95 173.33 3k5o s THR 733 N 2.11 2.14 0.58 5.86 -4.23 0.78 -0.74 115.64 122.15 3k5o s THR 733 Ca 0.15 -1.38 0.43 0.00 -1.18 0.00 0.00 61.69 59.70 3k5o s THR 733 Cb -0.16 -2.53 0.44 0.00 1.34 0.00 0.00 72.50 71.59 3k5o s THR 733 CO 0.11 0.00 2.31 0.71 -0.54 0.00 0.00 174.62 177.22 3k5o h THR 734 N 0.82 0.03 -0.43 3.99 1.35 -1.06 0.19 112.91 117.79 3k5o h THR 734 Ca -0.38 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 3k5o h THR 734 Cb 1.28 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 3k5o h THR 734 CO 0.56 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 176.42 3k5o n ASN 735 N -3.12 4.16 0.00 5.36 5.03 -1.26 -5.06 115.26 120.37 3k5o n ASN 735 Ca -0.02 -2.61 0.00 0.00 0.87 0.00 0.00 54.58 52.81 3k5o n ASN 735 Cb 0.11 -0.50 0.00 0.00 -1.02 0.00 0.00 39.78 38.36 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 0.34 -1.73 3.74 7.41 0.00 0.67 -4.97 105.19 110.64 3k5o n GLY 736 Ca 0.21 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 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 4.28 0.01 1.61 0.02 -1.26 -0.16 135.00 139.50 3k5o s PRO 737 Ca 0.00 2.26 0.01 0.00 0.02 0.00 0.00 61.00 63.29 3k5o s PRO 737 Cb 0.00 -3.14 -0.01 0.00 0.02 0.00 0.00 34.50 31.37 3k5o s PRO 737 CO 0.00 -0.43 -0.03 -1.21 -0.33 0.00 0.00 177.00 175.00 3k5o s GLU 738 N 0.01 0.23 0.41 5.54 2.02 -0.44 -4.56 118.70 121.91 3k5o s GLU 738 Ca 0.61 -0.33 -0.27 0.00 0.02 0.00 0.00 54.97 55.00 3k5o s GLU 738 Cb -0.41 -0.06 -0.10 0.00 0.10 0.00 0.00 34.13 33.66 3k5o s GLU 738 CO 0.40 0.01 1.45 -1.25 0.02 0.00 0.00 175.26 175.89 3k5o s PRO 739 N -0.71 3.92 0.20 0.39 0.04 -1.25 -1.27 135.00 136.32 3k5o s PRO 739 Ca -0.06 2.49 -0.10 0.00 0.04 0.00 0.00 61.00 63.37 3k5o s PRO 739 Cb -0.05 -2.83 0.19 0.00 0.04 0.00 0.00 34.50 31.85 3k5o s PRO 739 CO -0.00 -0.65 1.84 1.25 0.04 0.00 0.00 177.00 179.47 3k5o h LEU 740 N 2.70 0.66 -1.52 -3.56 5.85 -1.48 -0.60 115.31 117.37 3k5o h LEU 740 Ca -0.51 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.18 3k5o h LEU 740 Cb 1.25 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 3k5o h LEU 740 CO 0.63 0.45 -0.12 0.44 -0.34 0.00 0.00 178.44 179.50 3k5o h ASP 741 N 0.79 0.16 -0.62 1.25 3.32 -1.90 -3.07 116.42 116.34 3k5o h ASP 741 Ca 0.27 -0.03 -0.45 0.00 0.02 0.00 0.00 57.03 56.85 3k5o h ASP 741 Cb 0.05 -0.04 -0.36 0.00 0.22 0.00 0.00 39.33 39.20 3k5o h ASP 741 CO -0.12 0.30 -0.78 -1.22 -1.72 0.00 0.00 179.24 175.70 3k5o n TYR 742 N -4.32 2.26 -1.68 4.55 4.01 -0.93 -5.03 117.16 116.02 3k5o n TYR 742 Ca -0.01 -2.09 -0.44 0.00 -0.16 0.00 0.00 57.90 55.20 3k5o n TYR 742 Cb 0.24 -0.32 -0.03 0.00 -0.31 0.00 0.00 39.34 38.91 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 -0.76 2.63 -0.01 -0.72 7.27 -0.28 -4.66 117.38 120.85 3k5o n GLN 743 Ca 0.39 0.96 0.02 0.00 0.07 0.00 0.00 57.00 58.44 3k5o n GLN 743 Cb 0.92 -2.84 -0.04 0.00 2.41 0.00 0.00 30.24 30.69 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 5.94 0.61 -4.46 3.69 0.63 -1.26 -5.05 116.66 116.76 3k5o n ARG 744 Ca 0.19 -0.04 -0.24 0.00 -0.92 0.00 0.00 57.85 56.84 3k5o n ARG 744 Cb 0.36 -1.13 -0.10 0.00 0.45 0.00 0.00 32.46 32.03 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 -2.78 3.52 0.41 6.15 0.01 -1.26 -5.12 113.70 114.63 3k5o s SER 745 Ca -0.02 -1.02 -0.26 0.00 1.31 0.00 0.00 55.95 55.96 3k5o s SER 745 Cb 0.03 -0.29 -0.09 0.00 0.21 0.00 0.00 66.02 65.88 3k5o s SER 745 CO 0.23 0.03 1.36 -2.84 0.41 0.00 0.00 173.24 172.43 3k5o s PRO 746 N -3.45 3.95 0.53 12.44 0.02 -1.26 -4.79 135.00 142.44 3k5o s PRO 746 Ca 0.29 2.28 -0.21 0.00 0.02 0.00 0.00 61.00 63.38 3k5o s PRO 746 Cb -0.05 -2.79 -0.05 0.00 0.02 0.00 0.00 34.50 31.63 3k5o s PRO 746 CO 0.14 -0.55 1.27 -0.51 -0.33 0.00 0.00 177.00 177.02 3k5o s LEU 747 N -2.39 3.86 -0.66 -5.54 1.43 -1.26 -0.56 118.68 113.55 3k5o s LEU 747 Ca 0.57 2.56 -0.12 0.00 -1.03 0.00 0.00 54.13 56.10 3k5o s LEU 747 Cb -0.41 -4.33 0.17 0.00 0.03 0.00 0.00 46.19 41.65 3k5o s LEU 747 CO 0.53 -1.40 0.58 -0.62 0.23 0.00 0.00 176.35 175.67 3k5o s ASP 748 N -1.20 6.21 0.46 2.29 2.15 0.08 -4.53 116.67 122.13 3k5o s ASP 748 Ca 0.71 -2.36 0.18 0.00 0.43 0.00 0.00 52.55 51.51 3k5o s ASP 748 Cb -0.35 -2.12 1.10 0.00 -0.30 0.00 0.00 42.92 41.25 3k5o s ASP 748 CO 0.41 -0.63 1.99 1.88 -0.17 0.00 0.00 175.17 178.65 3k5o h TYR 749 N 8.06 0.00 -0.71 -5.34 0.05 -1.91 -2.53 116.97 114.59 3k5o h TYR 749 Ca -0.07 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.64 3k5o h TYR 749 Cb 1.05 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.76 3k5o h TYR 749 CO 0.84 0.19 0.16 1.49 -1.05 0.00 0.00 178.16 179.80 3k5o h GLU 750 N 0.00 1.14 -0.56 4.88 4.57 -1.96 -0.75 114.58 121.89 3k5o h GLU 750 Ca -0.00 -0.28 0.03 0.00 -1.18 0.00 0.00 59.36 57.93 3k5o h GLU 750 Cb 0.37 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.77 3k5o h GLU 750 CO 0.02 1.00 0.33 1.25 -1.18 0.00 0.00 179.01 180.44 3k5o h HIS 751 N 1.07 0.61 -0.47 0.92 2.76 -1.85 0.13 115.15 118.34 3k5o h HIS 751 Ca 0.22 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.28 3k5o h HIS 751 Cb 0.38 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 3k5o h HIS 751 CO 0.03 0.34 -0.21 1.88 -1.30 0.00 0.00 177.93 178.67 3k5o h TYR 752 N 0.65 1.08 -0.15 5.26 0.05 -1.44 0.24 116.97 122.65 3k5o h TYR 752 Ca 0.23 -0.25 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 3k5o h TYR 752 Cb 0.05 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.53 3k5o h TYR 752 CO -0.07 1.05 0.06 1.25 -1.05 0.00 0.00 178.16 179.41 3k5o h LEU 753 N 0.82 0.21 -0.06 3.88 5.85 -0.62 -0.58 115.31 124.80 3k5o h LEU 753 Ca 0.11 -0.16 -0.25 0.00 0.84 0.00 0.00 57.88 58.42 3k5o h LEU 753 Cb 0.77 -0.05 0.01 0.00 0.37 0.00 0.00 40.66 41.76 3k5o h LEU 753 CO 0.06 0.31 -1.03 0.74 -0.34 0.00 0.00 178.44 178.19 3k5o h THR 754 N 0.09 1.34 -0.00 1.05 2.02 -0.72 -0.19 112.91 116.50 3k5o h THR 754 Ca 0.05 -2.39 0.00 0.00 0.77 0.00 0.00 66.41 64.84 3k5o h THR 754 Cb 0.17 2.45 0.00 0.00 -1.74 0.00 0.00 68.15 69.02 3k5o h THR 754 CO -0.00 0.72 -0.79 0.54 0.37 0.00 0.00 175.52 176.36 3k5o n ARG 755 N -3.79 1.48 0.02 6.66 5.12 0.82 -4.40 116.66 122.57 3k5o n ARG 755 Ca -0.09 -0.01 -0.02 0.00 -1.93 0.00 0.00 57.85 55.80 3k5o n ARG 755 Cb 0.88 -1.29 -0.01 0.00 -1.16 0.00 0.00 32.46 30.88 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 -1.38 0.07 -0.04 5.56 1.13 -0.35 -4.74 117.38 117.63 3k5o n GLN 756 Ca 0.03 0.03 -0.13 0.00 -1.94 0.00 0.00 57.00 54.99 3k5o n GLN 756 Cb 0.26 -0.62 -0.09 0.00 0.11 0.00 0.00 30.24 29.90 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 -0.13 0.24 -0.32 1.08 3.38 -1.20 -3.29 115.31 115.07 3k5o h LEU 757 Ca -0.03 -0.54 0.06 0.00 0.09 0.00 0.00 57.88 57.46 3k5o h LEU 757 Cb 0.40 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 3k5o h LEU 757 CO -0.02 0.73 -0.01 -0.61 0.09 0.00 0.00 178.44 178.63 3k5o h GLN 758 N -0.25 0.08 -0.84 1.13 4.15 -1.23 -2.06 115.11 116.10 3k5o h GLN 758 Ca 0.01 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 3k5o h GLN 758 Cb 0.68 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.31 3k5o h GLN 758 CO 0.03 0.05 0.50 -1.00 -1.93 0.00 0.00 178.83 176.48 3k5o h PRO 759 N 0.09 1.13 -0.14 -2.39 0.13 -1.78 0.43 132.00 129.47 3k5o h PRO 759 Ca 0.15 -0.10 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 3k5o h PRO 759 Cb 0.21 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.10 3k5o h PRO 759 CO -0.26 0.79 0.06 0.28 -0.23 0.00 0.00 178.00 178.64 3k5o h VAL 760 N 1.15 1.14 -0.27 1.56 2.07 -1.57 -1.95 116.25 118.38 3k5o h VAL 760 Ca 0.30 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 3k5o h VAL 760 Cb -0.04 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 3k5o h VAL 760 CO -0.06 0.13 0.04 0.00 0.02 0.00 0.00 177.57 177.70 3k5o h ALA 761 N 0.91 0.36 0.00 1.67 0.00 -0.99 -2.53 119.26 118.68 3k5o h ALA 761 Ca 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3k5o h ALA 761 Cb 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3k5o h ALA 761 CO -0.00 0.06 0.00 0.93 0.00 0.00 0.00 179.25 180.23 3k5o h GLU 762 N 0.27 0.00 0.00 0.00 5.08 -0.08 -1.02 114.58 118.82 3k5o h GLU 762 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3k5o h GLU 762 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 3k5o h GLU 762 CO 0.01 0.00 0.00 0.78 -1.00 0.00 0.00 179.01 178.80 3k5o h GLY 763 N 0.43 0.00 0.00 -3.84 0.00 -0.89 -3.40 103.07 95.38 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 -2.60 0.00 -0.35 2.60 3.06 -0.68 -4.87 119.36 116.52 3k5o n ILE 764 Ca 0.03 0.00 0.13 0.00 -2.50 0.00 0.00 62.75 60.41 3k5o n ILE 764 Cb 0.34 -0.29 0.32 0.00 0.54 0.00 0.00 39.64 40.55 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 0.74 -2.01 9.51 3.38 -1.43 -1.48 115.31 124.02 3k5o h LEU 765 Ca 0.00 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.08 3k5o h LEU 765 Cb 0.40 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3k5o h LEU 765 CO 0.00 0.25 0.02 -0.65 0.09 0.00 0.00 178.44 178.15 3k5o h PRO 766 N 0.73 0.00 0.00 1.13 0.11 -1.78 -0.40 132.00 131.79 3k5o h PRO 766 Ca 0.58 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.69 3k5o h PRO 766 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3k5o h PRO 766 CO -0.40 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.58 3k5o n PHE 767 N -4.51 0.74 -1.63 0.65 3.72 -0.56 -2.70 117.46 113.16 3k5o n PHE 767 Ca -0.02 0.26 0.04 0.00 -0.05 0.00 0.00 57.45 57.67 3k5o n PHE 767 Cb 0.12 -0.92 0.20 0.00 -0.94 0.00 0.00 39.48 37.94 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 -2.14 2.21 -3.73 4.37 -5.35 -0.72 -4.76 119.36 109.25 3k5o n ILE 768 Ca 0.04 -3.30 -0.22 0.00 -0.27 0.00 0.00 62.75 59.00 3k5o n ILE 768 Cb 0.31 -0.29 0.03 0.00 -1.74 0.00 0.00 39.64 37.95 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 -4.86 -4.28 6.28 1.02 -1.10 -4.99 120.64 111.63 3k5o n GLU 769 Ca 0.21 0.61 -0.15 0.00 -0.02 0.00 0.00 57.16 57.80 3k5o n GLU 769 Cb 0.71 -5.16 -0.10 0.00 -0.02 0.00 0.00 31.44 26.87 3k5o n GLU 769 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3k5o s ASP 770 N -4.29 1.25 -0.04 1.62 -1.08 -0.24 -5.02 116.67 108.87 3k5o s ASP 770 Ca 0.05 -1.27 0.01 0.00 -0.52 0.00 0.00 52.55 50.82 3k5o s ASP 770 Cb -0.02 0.13 0.02 0.00 -1.46 0.00 0.00 42.92 41.59 3k5o s ASP 770 CO 0.82 -0.63 -0.03 0.21 0.52 0.00 0.00 175.17 176.05 3k5o s ASN 771 N -3.24 0.73 0.07 -0.34 3.84 -1.26 -3.29 114.94 111.44 3k5o s ASN 771 Ca 0.30 -0.09 -0.18 0.00 0.21 0.00 0.00 52.86 53.11 3k5o s ASN 771 Cb 0.07 -0.35 -0.11 0.00 -0.55 0.00 0.00 41.25 40.31 3k5o s ASN 771 CO 0.08 -0.06 1.41 0.15 -2.79 0.00 0.00 177.10 175.89 3k5o h PHE 772 N 7.13 0.62 -1.00 0.43 3.57 -1.94 -2.77 116.94 122.97 3k5o h PHE 772 Ca -0.40 -0.17 0.07 0.00 3.53 0.00 0.00 57.97 61.00 3k5o h PHE 772 Cb 1.15 -0.14 -0.07 0.00 2.79 0.00 0.00 35.95 39.68 3k5o h PHE 772 CO 0.50 0.83 0.65 0.00 -2.23 0.00 0.00 178.31 178.06 3k5o h ALA 773 N 0.69 1.41 -0.78 2.41 0.00 -1.98 0.35 119.26 121.36 3k5o h ALA 773 Ca 0.04 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3k5o h ALA 773 Cb 0.70 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3k5o h ALA 773 CO 0.05 0.42 0.30 1.15 0.00 0.00 0.00 179.25 181.16 3k5o h THR 774 N 1.16 1.26 -0.13 0.00 2.02 -1.97 0.43 112.91 115.68 3k5o h THR 774 Ca 0.44 -0.84 -0.17 0.00 0.77 0.00 0.00 66.41 66.61 3k5o h THR 774 Cb 0.21 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 3k5o h THR 774 CO -0.18 0.34 -0.61 -0.07 0.37 0.00 0.00 175.52 175.36 3k5o h LEU 775 N 1.15 0.51 -0.10 2.58 3.38 -0.95 -2.07 115.31 119.81 3k5o h LEU 775 Ca 0.26 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 3k5o h LEU 775 Cb 0.24 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3k5o h LEU 775 CO -0.02 1.00 -0.20 -0.03 0.09 0.00 0.00 178.44 179.28 3k5o h MET 776 N 0.33 0.32 0.00 1.13 4.05 0.15 -2.79 114.93 118.12 3k5o h MET 776 Ca -0.01 -0.21 -0.07 0.00 -0.28 0.00 0.00 59.70 59.14 3k5o h MET 776 Cb 1.16 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.97 3k5o h MET 776 CO 0.11 0.80 -0.32 1.79 0.23 0.00 0.00 176.91 179.52 3k5o h THR 777 N -0.12 1.05 0.00 -0.77 1.35 -0.18 0.25 112.91 114.50 3k5o h THR 777 Ca 0.00 -1.15 -0.06 0.00 -0.55 0.00 0.00 66.41 64.65 3k5o h THR 777 Cb 0.78 1.65 -0.01 0.00 -1.73 0.00 0.00 68.15 68.85 3k5o h THR 777 CO 0.04 0.31 -0.30 1.23 -0.25 0.00 0.00 175.52 176.55 3k5o h GLY 778 N 1.22 0.00 0.04 5.82 0.00 -1.33 0.31 103.07 109.12 3k5o h GLY 778 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.08 3k5o h GLY 778 CO 0.04 0.00 -1.32 -1.61 0.00 0.00 0.00 176.54 173.65 3k5o h GLN 779 N 0.00 0.02 -0.00 4.80 5.75 -1.02 -3.41 115.11 121.24 3k5o h GLN 779 Ca -0.00 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 3k5o h GLN 779 Cb 0.69 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.25 3k5o h GLN 779 CO 0.04 1.01 -0.91 1.28 -2.65 0.00 0.00 178.83 177.60 3k5o n LEU 780 N -4.38 1.05 0.00 -2.39 4.77 0.80 -5.03 117.00 111.83 3k5o n LEU 780 Ca -0.32 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.13 3k5o n LEU 780 Cb 0.71 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 3k5o n LEU 780 CO 0.20 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 3k5o n GLY 781 N 1.47 -3.11 0.75 -0.72 0.00 0.11 -4.57 105.19 99.13 3k5o n GLY 781 Ca 0.04 -1.87 0.12 0.00 0.00 0.00 0.00 46.02 44.31 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 2.28 0.00 0.99 4.77 -1.26 -4.49 117.00 119.28 3k5o n LEU 782 Ca 0.00 -0.90 0.00 0.00 -0.03 0.00 0.00 56.01 55.08 3k5o n LEU 782 Cb 0.00 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3k5o n LEU 782 CO 0.00 0.45 0.00 2.22 -1.33 0.00 0.00 177.39 178.73