#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tkd s ILE 2 N 0.00 1.34 -0.10 1.12 -4.36 -0.35 -1.36 121.20 117.49 1tkd s ILE 2 Ca 0.00 -1.57 0.03 0.00 -0.26 0.00 0.00 60.65 58.85 1tkd s ILE 2 Cb 0.00 -1.40 -0.01 0.00 1.25 0.00 0.00 42.46 42.30 1tkd s ILE 2 CO 0.00 -0.30 -0.19 -0.69 0.24 0.00 0.00 174.94 174.00 1tkd s VAL 3 N -1.71 2.52 0.26 8.37 1.01 0.63 -0.10 120.40 131.38 1tkd s VAL 3 Ca 0.05 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 1tkd s VAL 3 Cb -0.07 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 1tkd s VAL 3 CO 0.03 0.55 0.27 -0.55 0.00 0.00 0.00 175.10 175.40 1tkd s SER 4 N 0.16 0.65 -0.18 3.32 0.15 0.17 0.02 113.70 117.99 1tkd s SER 4 Ca -0.11 -1.44 -0.30 0.00 0.70 0.00 0.00 55.95 54.80 1tkd s SER 4 Cb -0.16 0.50 0.14 0.00 -1.71 0.00 0.00 66.02 64.79 1tkd s SER 4 CO 0.06 -1.01 1.08 -0.62 1.20 0.00 0.00 173.24 173.95 1tkd s ASP 5 N -3.21 -0.28 0.25 5.45 2.15 -1.15 -4.38 116.67 115.50 1tkd s ASP 5 Ca 0.36 0.25 0.05 0.00 0.43 0.00 0.00 52.55 53.64 1tkd s ASP 5 Cb 0.04 0.24 -0.05 0.00 -0.30 0.00 0.00 42.92 42.84 1tkd s ASP 5 CO 0.17 -0.29 -0.02 0.27 -0.17 0.00 0.00 175.17 175.13 1tkd s ILE 6 N -1.40 1.25 -0.10 4.11 -4.36 -1.26 -2.41 121.20 117.03 1tkd s ILE 6 Ca 0.02 -2.06 0.01 0.00 -0.26 0.00 0.00 60.65 58.36 1tkd s ILE 6 Cb -0.01 -2.41 0.02 0.00 1.25 0.00 0.00 42.46 41.31 1tkd s ILE 6 CO -0.02 -0.30 -0.13 -1.61 0.24 0.00 0.00 174.94 173.12 1tkd s GLU 7 N -3.82 2.00 0.38 0.37 0.41 0.27 -4.98 118.70 113.33 1tkd s GLU 7 Ca 0.29 -0.48 0.04 0.00 -0.41 0.00 0.00 54.97 54.41 1tkd s GLU 7 Cb 0.05 -1.76 -0.05 0.00 -1.78 0.00 0.00 34.13 30.60 1tkd s GLU 7 CO 0.10 -0.09 0.07 0.00 -0.49 0.00 0.00 175.26 174.85 1tkd s ALA 8 N 1.08 2.78 -1.95 5.21 0.00 -1.26 0.15 121.76 127.77 1tkd s ALA 8 Ca -0.05 -1.63 0.29 0.00 0.00 0.00 0.00 51.96 50.58 1tkd s ALA 8 Cb -0.15 0.60 1.36 0.00 0.00 0.00 0.00 23.12 24.93 1tkd s ALA 8 CO -0.02 -0.28 1.93 0.27 0.00 0.00 0.00 175.76 177.66 1tkd n ASN 9 N -0.97 0.60 -3.49 0.00 6.94 -0.68 -4.84 115.26 112.82 1tkd n ASN 9 Ca -0.05 -0.91 -0.02 0.00 -0.02 0.00 0.00 54.58 53.57 1tkd n ASN 9 Cb 0.66 -0.03 0.01 0.00 -2.36 0.00 0.00 39.78 38.06 1tkd n ASN 9 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1tkd s ALA 10 N -2.23 -1.72 0.88 -2.53 0.00 -1.26 -4.68 121.76 110.22 1tkd s ALA 10 Ca 0.36 -0.15 -0.11 0.00 0.00 0.00 0.00 51.96 52.06 1tkd s ALA 10 Cb 0.21 0.72 0.12 0.00 0.00 0.00 0.00 23.12 24.17 1tkd s ALA 10 CO 0.41 -1.07 1.09 -0.51 0.00 0.00 0.00 175.76 175.69 1tkd s LEU 11 N -3.32 2.34 0.23 0.00 1.43 -1.26 -4.49 118.68 113.62 1tkd s LEU 11 Ca 0.20 1.50 -0.09 0.00 -1.03 0.00 0.00 54.13 54.71 1tkd s LEU 11 Cb -0.02 -3.95 0.38 0.00 0.03 0.00 0.00 46.19 42.63 1tkd s LEU 11 CO 0.04 -2.54 1.64 0.25 0.23 0.00 0.00 176.35 175.96 1tkd h LEU 12 N -1.48 -0.36 -1.07 1.79 5.85 -1.95 -0.14 115.31 117.95 1tkd h LEU 12 Ca -0.49 0.19 0.28 0.00 0.84 0.00 0.00 57.88 58.70 1tkd h LEU 12 Cb 1.28 0.33 -0.13 0.00 0.37 0.00 0.00 40.66 42.52 1tkd h LEU 12 CO 0.55 -0.17 0.61 -0.33 -0.34 0.00 0.00 178.44 178.76 1tkd h GLU 13 N 0.09 0.45 0.00 1.25 3.07 -2.00 -3.03 114.58 114.41 1tkd h GLU 13 Ca 0.38 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.21 1tkd h GLU 13 Cb 0.65 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.44 1tkd h GLU 13 CO -0.64 0.30 -0.31 -1.13 -1.40 0.00 0.00 179.01 175.83 1tkd n SER 14 N -4.89 1.09 -4.76 1.42 3.41 -0.76 -5.07 113.62 104.05 1tkd n SER 14 Ca 0.29 -2.52 -0.41 0.00 -0.26 0.00 0.00 58.87 55.96 1tkd n SER 14 Cb 0.86 -0.31 -0.02 0.00 -0.26 0.00 0.00 64.21 64.48 1tkd n SER 14 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1tkd s VAL 15 N -1.32 2.85 0.00 -3.33 0.11 -0.14 -4.79 120.40 113.79 1tkd s VAL 15 Ca 0.16 0.79 0.00 0.00 -2.93 0.00 0.00 61.98 60.00 1tkd s VAL 15 Cb 0.15 -3.50 0.00 0.00 -1.53 0.00 0.00 36.38 31.49 1tkd s VAL 15 CO 0.00 0.16 0.05 0.35 -3.33 0.00 0.00 175.10 172.33 1tkd n THR 16 N 1.55 0.00 -3.73 5.04 -2.24 -1.26 -4.87 114.28 108.77 1tkd n THR 16 Ca 0.03 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.61 1tkd n THR 16 Cb 0.42 1.57 -0.14 0.00 -2.10 0.00 0.00 70.33 70.08 1tkd n THR 16 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1tkd s LYS 17 N -0.05 0.16 -0.13 -0.78 1.02 -1.26 -4.80 119.74 113.90 1tkd s LYS 17 Ca 0.00 0.48 -0.25 0.00 0.02 0.00 0.00 55.97 56.22 1tkd s LYS 17 Cb 0.00 -0.14 -0.02 0.00 -0.52 0.00 0.00 37.83 37.15 1tkd s LYS 17 CO 0.00 -0.17 0.81 0.12 -0.92 0.00 0.00 175.35 175.19 1tkd s PHE 18 N 1.29 3.48 -0.19 3.18 5.36 -1.26 -1.69 117.98 128.14 1tkd s PHE 18 Ca -0.09 1.29 -0.16 0.00 -0.96 0.00 0.00 56.93 57.01 1tkd s PHE 18 Cb -0.11 -2.98 -0.12 0.00 -0.34 0.00 0.00 43.02 39.48 1tkd s PHE 18 CO -0.08 -0.15 -0.04 0.72 -1.46 0.00 0.00 175.22 174.22 1tkd n HIS 19 N 4.79 0.77 -3.82 10.12 8.25 0.12 -4.66 115.22 130.79 1tkd n HIS 19 Ca 0.03 0.33 -0.06 0.00 -0.26 0.00 0.00 57.72 57.77 1tkd n HIS 19 Cb 0.50 -0.93 -0.01 0.00 1.12 0.00 0.00 29.99 30.66 1tkd n HIS 19 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1tkd s GLY 21 N -2.99 -0.12 0.00 0.00 0.00 -0.18 -0.57 107.32 103.46 1tkd s GLY 21 Ca 0.13 -0.27 0.02 0.00 0.00 0.00 0.00 44.72 44.60 1tkd s GLY 21 CO 0.06 -0.49 -0.06 0.14 0.00 0.00 0.00 173.10 172.75 1tkd s VAL 22 N -3.83 0.47 -0.05 1.40 1.01 -1.01 -0.15 120.40 118.23 1tkd s VAL 22 Ca 0.04 -0.35 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1tkd s VAL 22 Cb 0.03 -0.42 0.02 0.00 0.00 0.00 0.00 36.38 36.01 1tkd s VAL 22 CO -0.11 0.07 -0.06 -0.63 0.00 0.00 0.00 175.10 174.37 1tkd s ILE 23 N -0.29 0.66 -0.25 2.22 1.01 -0.30 -2.95 121.20 121.30 1tkd s ILE 23 Ca 0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 60.65 60.44 1tkd s ILE 23 Cb -0.03 -0.67 0.01 0.00 0.01 0.00 0.00 42.46 41.78 1tkd s ILE 23 CO -0.00 0.26 -0.02 -0.47 0.00 0.00 0.00 174.94 174.70 1tkd s TYR 24 N 0.94 3.04 -0.26 3.97 5.04 0.10 -0.83 117.35 129.35 1tkd s TYR 24 Ca -0.11 -1.18 -0.11 0.00 -2.44 0.00 0.00 57.07 53.24 1tkd s TYR 24 Cb -0.14 -2.12 -0.05 0.00 0.35 0.00 0.00 41.96 40.00 1tkd s TYR 24 CO 0.00 -0.62 0.17 0.34 -1.34 0.00 0.00 175.55 174.10 1tkd s ASP 25 N 1.42 6.05 0.50 4.32 -1.08 -0.89 -0.27 116.67 126.72 1tkd s ASP 25 Ca 0.03 0.05 0.25 0.00 -0.52 0.00 0.00 52.55 52.36 1tkd s ASP 25 Cb -0.16 -2.11 1.30 0.00 -1.46 0.00 0.00 42.92 40.49 1tkd s ASP 25 CO -0.03 0.01 2.02 1.88 0.52 0.00 0.00 175.17 179.57 1tkd h TYR 26 N 7.90 0.00 -0.03 -5.34 0.05 -1.55 0.42 116.97 118.41 1tkd h TYR 26 Ca -0.37 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.26 1tkd h TYR 26 Cb 1.18 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.90 1tkd h TYR 26 CO 0.71 0.16 -0.67 0.66 -1.05 0.00 0.00 178.16 177.96 1tkd h SER 27 N 0.00 0.17 0.00 3.88 4.64 -1.92 -3.26 113.55 117.05 1tkd h SER 27 Ca -0.00 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1tkd h SER 27 Cb 0.41 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1tkd h SER 27 CO 0.02 0.79 -1.38 0.35 -0.87 0.00 0.00 176.83 175.74 1tkd n THR 28 N -3.79 0.00 -3.64 2.95 -2.24 -1.06 -4.99 114.28 101.50 1tkd n THR 28 Ca -0.02 -0.27 -0.24 0.00 -2.27 0.00 0.00 64.05 61.25 1tkd n THR 28 Cb 0.66 0.49 0.07 0.00 -2.10 0.00 0.00 70.33 69.45 1tkd n THR 28 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tkd n ALA 29 N -1.81 -1.47 -2.65 6.98 0.00 0.14 -4.99 120.51 116.72 1tkd n ALA 29 Ca -0.00 0.25 -0.09 0.00 0.00 0.00 0.00 53.44 53.60 1tkd n ALA 29 Cb 0.38 -4.59 -0.11 0.00 0.00 0.00 0.00 19.45 15.13 1tkd n ALA 29 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1tkd s GLU 30 N -6.20 0.47 -0.07 0.00 2.02 -1.17 -4.99 118.70 108.76 1tkd s GLU 30 Ca 0.47 -0.86 -0.04 0.00 0.02 0.00 0.00 54.97 54.56 1tkd s GLU 30 Cb -0.22 0.04 -0.04 0.00 0.10 0.00 0.00 34.13 34.02 1tkd s GLU 30 CO 0.76 -0.05 0.10 0.71 0.02 0.00 0.00 175.26 176.80 1tkd s TYR 31 N -2.29 3.42 -0.06 1.61 1.51 -1.26 -2.09 117.35 118.19 1tkd s TYR 31 Ca -0.06 0.35 0.01 0.00 -1.01 0.00 0.00 57.07 56.36 1tkd s TYR 31 Cb -0.04 -1.84 0.02 0.00 -0.11 0.00 0.00 41.96 39.99 1tkd s TYR 31 CO -0.03 0.62 -0.07 0.08 -1.11 0.00 0.00 175.55 175.04 1tkd s VAL 32 N -1.08 0.77 -0.08 0.71 1.01 -0.01 -4.98 120.40 116.75 1tkd s VAL 32 Ca 0.18 -0.23 -0.08 0.00 0.00 0.00 0.00 61.98 61.85 1tkd s VAL 32 Cb -0.12 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1tkd s VAL 32 CO 0.08 0.29 0.21 -0.44 0.00 0.00 0.00 175.10 175.24 1tkd s SER 33 N 1.07 6.48 -0.12 3.32 0.01 -1.26 -1.15 113.70 122.05 1tkd s SER 33 Ca -0.08 0.57 0.02 0.00 1.31 0.00 0.00 55.95 57.77 1tkd s SER 33 Cb -0.14 -2.10 0.01 0.00 0.21 0.00 0.00 66.02 63.99 1tkd s SER 33 CO -0.01 0.37 -0.19 -0.31 0.41 0.00 0.00 173.24 173.52 1tkd s TYR 34 N -1.08 2.31 0.60 2.43 1.51 0.78 -4.99 117.35 118.91 1tkd s TYR 34 Ca 0.19 -1.12 0.03 0.00 -1.01 0.00 0.00 57.07 55.16 1tkd s TYR 34 Cb -0.13 -1.61 0.07 0.00 -0.11 0.00 0.00 41.96 40.18 1tkd s TYR 34 CO 0.08 -0.53 0.83 1.03 -1.11 0.00 0.00 175.55 175.84 1tkd s ARG 35 N 0.87 2.23 0.44 -0.62 0.52 -1.26 -1.01 118.95 120.12 1tkd s ARG 35 Ca -0.08 -1.11 0.28 0.00 -0.52 0.00 0.00 55.73 54.31 1tkd s ARG 35 Cb -0.15 -2.50 1.36 0.00 0.52 0.00 0.00 34.95 34.18 1tkd s ARG 35 CO -0.01 -0.94 1.68 -1.00 0.02 0.00 0.00 175.30 175.05 1tkd h PRO 36 N -0.05 0.16 -0.01 3.54 0.13 -1.22 0.59 132.00 135.15 1tkd h PRO 36 Ca -0.38 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1tkd h PRO 36 Cb 1.28 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1tkd h PRO 36 CO 0.45 0.11 -0.06 -1.13 -0.23 0.00 0.00 178.00 177.13 1tkd n SER 37 N -4.59 0.86 -1.18 1.44 3.41 -1.26 -3.40 113.62 108.90 1tkd n SER 37 Ca 0.33 -1.07 0.11 0.00 -0.26 0.00 0.00 58.87 57.98 1tkd n SER 37 Cb 1.28 -0.00 0.28 0.00 -0.26 0.00 0.00 64.21 65.51 1tkd n SER 37 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1tkd n ASP 38 N -0.48 3.44 -0.16 4.04 8.00 0.21 -4.59 116.55 127.01 1tkd n ASP 38 Ca 0.18 -1.98 -0.03 0.00 0.71 0.00 0.00 54.79 53.66 1tkd n ASP 38 Cb 0.28 -0.38 0.04 0.00 -0.02 0.00 0.00 41.12 41.04 1tkd n ASP 38 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1tkd h PHE 39 N 3.94 -0.23 -0.84 1.24 3.57 -1.57 0.11 116.94 123.15 1tkd h PHE 39 Ca 0.00 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.56 1tkd h PHE 39 Cb 0.89 0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.77 1tkd h PHE 39 CO 0.38 -0.20 0.55 0.78 -2.23 0.00 0.00 178.31 177.59 1tkd h GLY 40 N 0.01 1.20 1.20 2.40 0.00 -1.89 -1.15 103.07 104.85 1tkd h GLY 40 Ca 0.24 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 1tkd h GLY 40 CO -0.49 0.40 0.12 0.00 0.00 0.00 0.00 176.54 176.57 1tkd h ALA 41 N 1.33 1.05 -0.04 3.60 0.00 -1.55 -0.74 119.26 122.91 1tkd h ALA 41 Ca 0.32 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1tkd h ALA 41 Cb -0.07 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1tkd h ALA 41 CO -0.09 0.62 0.02 -0.92 0.00 0.00 0.00 179.25 178.88 1tkd h TYR 42 N 0.93 0.05 -0.74 0.00 3.20 -0.08 -1.14 116.97 119.19 1tkd h TYR 42 Ca 0.19 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.08 1tkd h TYR 42 Cb 0.37 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.58 1tkd h TYR 42 CO 0.02 0.07 0.48 -0.07 -1.64 0.00 0.00 178.16 177.03 1tkd h LEU 43 N 0.01 0.81 -0.88 2.82 3.38 -0.94 -1.99 115.31 118.52 1tkd h LEU 43 Ca 0.01 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1tkd h LEU 43 Cb 0.04 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 1tkd h LEU 43 CO -0.00 0.57 0.58 0.44 0.09 0.00 0.00 178.44 180.11 1tkd h ASP 44 N 0.96 0.98 -0.51 -0.43 3.32 -0.83 -1.03 116.42 118.87 1tkd h ASP 44 Ca 0.29 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 1tkd h ASP 44 Cb -0.04 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.25 1tkd h ASP 44 CO -0.09 0.69 0.27 0.00 -1.72 0.00 0.00 179.24 178.39 1tkd h ALA 45 N 1.34 1.46 -0.14 3.45 0.00 -0.50 0.03 119.26 124.89 1tkd h ALA 45 Ca 0.34 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 1tkd h ALA 45 Cb -0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1tkd h ALA 45 CO -0.09 0.44 -0.24 -0.07 0.00 0.00 0.00 179.25 179.29 1tkd h LEU 46 N 0.76 0.46 -1.61 0.00 3.38 -0.73 -3.01 115.31 114.55 1tkd h LEU 46 Ca 0.19 -0.53 -0.04 0.00 0.09 0.00 0.00 57.88 57.58 1tkd h LEU 46 Cb 0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1tkd h LEU 46 CO -0.03 0.90 -0.21 -0.33 0.09 0.00 0.00 178.44 178.87 1tkd h GLU 47 N 0.03 0.00 -0.32 1.13 5.08 -0.88 -2.18 114.58 117.43 1tkd h GLU 47 Ca 0.01 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 1tkd h GLU 47 Cb 0.81 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 1tkd h GLU 47 CO 0.05 0.21 -0.15 0.00 -1.00 0.00 0.00 179.01 178.12 1tkd h ALA 48 N 1.79 1.14 -0.26 3.43 0.00 -0.94 0.29 119.26 124.71 1tkd h ALA 48 Ca -0.00 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 1tkd h ALA 48 Cb 0.40 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1tkd h ALA 48 CO 0.03 0.54 -0.45 1.49 0.00 0.00 0.00 179.25 180.86 1tkd h GLU 49 N 0.51 0.65 -0.08 0.00 4.57 -1.27 -2.32 114.58 116.64 1tkd h GLU 49 Ca 0.09 -0.35 -0.01 0.00 -1.18 0.00 0.00 59.36 57.90 1tkd h GLU 49 Cb 0.56 0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1tkd h GLU 49 CO 0.04 0.96 0.01 0.28 -1.18 0.00 0.00 179.01 179.11 1tkd h VAL 50 N 0.52 1.24 0.00 0.32 2.07 -1.02 0.56 116.25 119.94 1tkd h VAL 50 Ca 0.03 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1tkd h VAL 50 Cb 0.98 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1tkd h VAL 50 CO 0.09 0.21 -0.01 0.00 0.02 0.00 0.00 177.57 177.87 1tkd h ALA 51 N 0.75 1.09 -0.01 1.67 0.00 -0.89 0.39 119.26 122.26 1tkd h ALA 51 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1tkd h ALA 51 Cb 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1tkd h ALA 51 CO 0.00 0.02 -0.09 -2.13 0.00 0.00 0.00 179.25 177.05 1tkd n ARG 52 N -3.23 1.16 -1.10 0.00 0.63 -0.88 -4.89 116.66 108.35 1tkd n ARG 52 Ca -0.02 -0.57 -0.03 0.00 -0.92 0.00 0.00 57.85 56.31 1tkd n ARG 52 Cb 0.13 -1.49 -0.01 0.00 0.45 0.00 0.00 32.46 31.54 1tkd n ARG 52 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1tkd n GLY 53 N 1.22 0.64 0.00 5.14 0.00 0.13 -5.02 105.19 107.30 1tkd n GLY 53 Ca 0.17 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1tkd n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tkd n GLY 54 N -2.32 -0.20 3.26 -0.02 0.00 0.17 -2.11 105.19 103.96 1tkd n GLY 54 Ca -0.03 -1.79 -0.23 0.00 0.00 0.00 0.00 46.02 43.97 1tkd n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tkd s LEU 55 N 0.00 2.29 -0.11 0.99 1.43 -1.26 -4.40 118.68 117.62 1tkd s LEU 55 Ca 0.00 -0.66 0.02 0.00 -1.03 0.00 0.00 54.13 52.46 1tkd s LEU 55 Cb 0.00 -0.80 0.01 0.00 0.03 0.00 0.00 46.19 45.43 1tkd s LEU 55 CO 0.00 0.03 -0.18 -0.63 0.23 0.00 0.00 176.35 175.80 1tkd s ILE 56 N -1.17 1.72 -0.17 -0.59 1.01 0.44 -1.21 121.20 121.23 1tkd s ILE 56 Ca 0.05 -0.79 -0.04 0.00 0.00 0.00 0.00 60.65 59.87 1tkd s ILE 56 Cb -0.10 -1.53 -0.02 0.00 0.01 0.00 0.00 42.46 40.81 1tkd s ILE 56 CO 0.04 0.48 -0.03 -0.69 0.00 0.00 0.00 174.94 174.74 1tkd s VAL 57 N 0.76 3.83 0.21 2.92 1.01 0.85 -0.99 120.40 129.00 1tkd s VAL 57 Ca -0.10 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.56 1tkd s VAL 57 Cb -0.16 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.48 1tkd s VAL 57 CO 0.01 0.48 -0.07 -0.36 0.00 0.00 0.00 175.10 175.16 1tkd s PHE 58 N 0.58 1.58 -0.39 5.22 0.08 -0.34 -0.66 117.98 124.05 1tkd s PHE 58 Ca -0.03 -0.76 -0.05 0.00 0.12 0.00 0.00 56.93 56.21 1tkd s PHE 58 Cb -0.14 -0.84 0.09 0.00 -0.57 0.00 0.00 43.02 41.55 1tkd s PHE 58 CO 0.03 0.14 0.18 -1.58 -0.10 0.00 0.00 175.22 173.88 1tkd s HIS 59 N -3.22 3.44 -0.04 0.36 5.65 -1.26 -1.32 115.29 118.89 1tkd s HIS 59 Ca 0.24 -2.01 0.00 0.00 0.25 0.00 0.00 55.06 53.54 1tkd s HIS 59 Cb 0.03 -2.91 0.00 0.00 -1.18 0.00 0.00 32.58 28.52 1tkd s HIS 59 CO 0.07 -0.90 0.00 -1.71 -0.65 0.00 0.00 174.74 171.55 1tkd n ASN 60 N 4.71 -2.90 0.09 9.88 5.15 -1.26 -4.90 115.26 126.02 1tkd n ASN 60 Ca -0.07 0.01 -0.01 0.00 -0.60 0.00 0.00 54.58 53.91 1tkd n ASN 60 Cb 0.42 -0.58 0.26 0.00 -0.53 0.00 0.00 39.78 39.35 1tkd n ASN 60 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1tkd h GLY 61 N 0.00 0.28 0.49 8.20 0.00 -1.89 -1.58 103.07 108.58 1tkd h GLY 61 Ca -0.01 -0.24 0.10 0.00 0.00 0.00 0.00 47.33 47.18 1tkd h GLY 61 CO 0.01 0.22 0.44 0.45 0.00 0.00 0.00 176.54 177.66 1tkd h HIS 62 N 0.22 0.80 0.01 5.60 3.86 -1.91 -0.81 115.15 122.92 1tkd h HIS 62 Ca 0.03 0.03 -0.29 0.00 -1.16 0.00 0.00 60.37 58.98 1tkd h HIS 62 Cb 0.71 -0.24 -0.05 0.00 1.06 0.00 0.00 27.41 28.90 1tkd h HIS 62 CO 0.01 0.31 -1.67 0.87 0.86 0.00 0.00 177.93 178.31 1tkd h LYS 63 N 0.73 0.02 0.00 2.45 1.57 -1.86 -3.42 116.57 116.06 1tkd h LYS 63 Ca 0.39 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1tkd h LYS 63 Cb 0.38 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1tkd h LYS 63 CO -0.26 0.57 0.00 0.98 -0.57 0.00 0.00 179.45 180.17 1tkd n TYR 64 N -3.09 0.00 -0.31 -1.35 9.36 -0.60 -4.72 117.16 116.44 1tkd n TYR 64 Ca -0.16 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.01 1tkd n TYR 64 Cb 1.04 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.76 1tkd n TYR 64 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 1tkd h ASP 65 N 0.00 -1.46 0.48 2.98 5.19 -1.67 0.20 116.42 122.14 1tkd h ASP 65 Ca 0.00 0.28 -0.01 0.00 -0.62 0.00 0.00 57.03 56.68 1tkd h ASP 65 Cb 0.00 0.72 -0.01 0.00 0.18 0.00 0.00 39.33 40.22 1tkd h ASP 65 CO 0.00 -0.30 -0.37 0.58 -3.12 0.00 0.00 179.24 176.04 1tkd h VAL 66 N -0.09 0.25 -0.55 -1.35 2.07 -1.44 0.18 116.25 115.33 1tkd h VAL 66 Ca 0.27 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.74 1tkd h VAL 66 Cb 0.56 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1tkd h VAL 66 CO -0.85 0.00 0.13 -0.65 0.02 0.00 0.00 177.57 176.22 1tkd h PRO 67 N -0.84 0.84 -0.65 1.57 0.11 -1.68 -2.54 132.00 128.81 1tkd h PRO 67 Ca -0.05 -0.17 0.01 0.00 0.11 0.00 0.00 66.00 65.90 1tkd h PRO 67 Cb 0.71 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 31.66 1tkd h PRO 67 CO 0.00 0.75 0.42 0.00 -0.21 0.00 0.00 178.00 178.97 1tkd h ALA 68 N 1.34 0.83 -0.64 -0.75 0.00 -0.36 -1.36 119.26 118.32 1tkd h ALA 68 Ca 0.18 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1tkd h ALA 68 Cb 0.29 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1tkd h ALA 68 CO -0.00 0.22 0.07 -0.07 0.00 0.00 0.00 179.25 179.47 1tkd h LEU 69 N 0.85 1.04 -0.42 0.00 3.38 -0.71 0.18 115.31 119.63 1tkd h LEU 69 Ca 0.25 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1tkd h LEU 69 Cb -0.06 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.39 1tkd h LEU 69 CO -0.07 1.05 0.22 0.74 0.09 0.00 0.00 178.44 180.47 1tkd h THR 70 N 0.99 1.00 0.12 0.22 2.02 -1.01 0.19 112.91 116.44 1tkd h THR 70 Ca 0.19 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 1tkd h THR 70 Cb 0.47 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.40 1tkd h THR 70 CO 0.02 0.08 -0.06 0.50 0.37 0.00 0.00 175.52 176.43 1tkd h LYS 71 N 0.45 -0.16 -0.57 6.66 3.64 -0.86 -2.78 116.57 122.94 1tkd h LYS 71 Ca 0.17 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1tkd h LYS 71 Cb 0.06 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 1tkd h LYS 71 CO -0.11 0.11 0.25 -0.07 -2.27 0.00 0.00 179.45 177.37 1tkd h LEU 72 N -0.43 0.73 -1.02 5.20 3.38 -0.49 -1.64 115.31 121.04 1tkd h LEU 72 Ca -0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1tkd h LEU 72 Cb 0.35 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1tkd h LEU 72 CO 0.03 0.64 0.49 0.00 0.09 0.00 0.00 178.44 179.68 1tkd h ALA 73 N 1.48 1.26 -0.11 1.53 0.00 -0.58 0.17 119.26 123.00 1tkd h ALA 73 Ca 0.20 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 1tkd h ALA 73 Cb 0.12 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 17.57 1tkd h ALA 73 CO -0.02 0.62 -0.51 -0.22 0.00 0.00 0.00 179.25 179.11 1tkd h LYS 74 N 1.18 0.54 0.13 0.00 1.63 -1.13 0.75 116.57 119.67 1tkd h LYS 74 Ca 0.30 -0.43 -0.01 0.00 -0.85 0.00 0.00 60.65 59.66 1tkd h LYS 74 Cb -0.01 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.71 1tkd h LYS 74 CO -0.05 1.06 -0.06 -0.07 -3.45 0.00 0.00 179.45 176.88 1tkd h LEU 75 N 0.15 -0.14 0.17 5.20 3.38 -1.06 -1.85 115.31 121.16 1tkd h LEU 75 Ca -0.03 -0.37 -0.29 0.00 0.09 0.00 0.00 57.88 57.28 1tkd h LEU 75 Cb 1.15 0.04 0.03 0.00 0.09 0.00 0.00 40.66 41.97 1tkd h LEU 75 CO 0.11 0.33 -1.25 1.56 0.09 0.00 0.00 178.44 179.28 1tkd h GLN 76 N -0.66 0.55 -0.04 1.13 4.20 -0.82 -3.38 115.11 116.10 1tkd h GLN 76 Ca -0.02 -0.82 0.00 0.00 0.06 0.00 0.00 58.65 57.88 1tkd h GLN 76 Cb 0.50 0.29 0.00 0.00 0.30 0.00 0.00 27.48 28.57 1tkd h GLN 76 CO 0.03 1.38 0.00 1.28 -0.67 0.00 0.00 178.83 180.85 1tkd n LEU 77 N -3.83 1.71 -3.92 1.46 4.77 -0.92 -4.99 117.00 111.28 1tkd n LEU 77 Ca -0.15 -1.13 -0.25 0.00 -0.03 0.00 0.00 56.01 54.45 1tkd n LEU 77 Cb 1.00 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 42.05 1tkd n LEU 77 CO 0.57 0.36 -0.21 -3.20 -1.33 0.00 0.00 177.39 173.59 1tkd n ASN 78 N 0.36 -0.40 -4.32 -1.43 5.15 -0.31 -4.94 115.26 109.37 1tkd n ASN 78 Ca 0.04 -0.98 -0.28 0.00 -0.60 0.00 0.00 54.58 52.77 1tkd n ASN 78 Cb 0.20 -3.20 -0.14 0.00 -0.53 0.00 0.00 39.78 36.11 1tkd n ASN 78 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1tkd s ARG 79 N -6.47 1.51 -0.25 1.20 3.52 0.10 -4.93 118.95 113.64 1tkd s ARG 79 Ca 0.00 -1.12 -0.20 0.00 -0.13 0.00 0.00 55.73 54.29 1tkd s ARG 79 Cb -0.00 -1.75 -0.02 0.00 -1.56 0.00 0.00 34.95 31.62 1tkd s ARG 79 CO 0.88 0.44 0.59 -1.21 -0.81 0.00 0.00 175.30 175.19 1tkd s GLU 80 N -1.47 4.11 -0.08 5.12 0.41 -1.26 -2.76 118.70 122.77 1tkd s GLU 80 Ca 0.10 0.49 -0.01 0.00 -0.41 0.00 0.00 54.97 55.14 1tkd s GLU 80 Cb -0.10 -3.64 0.03 0.00 -1.78 0.00 0.00 34.13 28.64 1tkd s GLU 80 CO 0.03 -0.37 -0.02 0.12 -0.49 0.00 0.00 175.26 174.54 1tkd s PHE 81 N 2.36 0.84 -0.37 1.61 5.36 -1.26 -5.07 117.98 121.45 1tkd s PHE 81 Ca 0.25 -0.29 0.02 0.00 -0.96 0.00 0.00 56.93 55.96 1tkd s PHE 81 Cb -0.16 -0.89 0.15 0.00 -0.34 0.00 0.00 43.02 41.79 1tkd s PHE 81 CO 0.09 -0.36 0.32 -1.01 -1.46 0.00 0.00 175.22 172.80 1tkd s HIS 82 N 1.88 0.13 0.26 10.12 3.76 -1.26 -4.26 115.29 125.92 1tkd s HIS 82 Ca 0.04 -1.22 -0.31 0.00 -0.15 0.00 0.00 55.06 53.42 1tkd s HIS 82 Cb -0.12 -0.60 -0.11 0.00 1.11 0.00 0.00 32.58 32.85 1tkd s HIS 82 CO -0.06 -0.92 1.62 -0.51 -0.85 0.00 0.00 174.74 174.03 1tkd s LEU 83 N 1.17 4.35 0.45 0.89 1.43 -1.26 -4.93 118.68 120.78 1tkd s LEU 83 Ca 0.19 2.91 -0.23 0.00 -1.03 0.00 0.00 54.13 55.97 1tkd s LEU 83 Cb -0.16 -3.62 -0.08 0.00 0.03 0.00 0.00 46.19 42.36 1tkd s LEU 83 CO -0.02 -0.92 1.14 -2.84 0.23 0.00 0.00 176.35 173.93 1tkd s PRO 84 N 0.01 3.85 0.25 1.29 0.02 -1.26 -4.93 135.00 134.22 1tkd s PRO 84 Ca 0.66 1.70 -0.04 0.00 0.02 0.00 0.00 61.00 63.35 1tkd s PRO 84 Cb -0.48 -2.43 0.41 0.00 0.02 0.00 0.00 34.50 32.02 1tkd s PRO 84 CO 0.43 -0.46 1.80 -0.09 -0.33 0.00 0.00 177.00 178.36 1tkd h ARG 85 N 2.14 0.75 0.00 5.54 2.43 -1.96 -1.86 114.38 121.42 1tkd h ARG 85 Ca -0.49 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.63 1tkd h ARG 85 Cb 1.24 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1tkd h ARG 85 CO 0.61 0.49 0.00 -0.85 -1.51 0.00 0.00 179.97 178.71 1tkd n GLU 86 N -4.76 0.04 0.00 0.20 0.00 -1.26 -2.23 120.64 112.63 1tkd n GLU 86 Ca 0.14 0.32 0.12 0.00 0.00 0.00 0.00 57.16 57.74 1tkd n GLU 86 Cb 0.29 -1.59 0.13 0.00 0.00 0.00 0.00 31.44 30.28 1tkd n GLU 86 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1tkd n ASN 87 N -1.67 2.22 -4.66 -1.84 4.13 -0.70 -4.85 115.26 107.88 1tkd n ASN 87 Ca 0.03 -1.62 -0.33 0.00 1.68 0.00 0.00 54.58 54.34 1tkd n ASN 87 Cb 0.16 0.21 -0.09 0.00 -1.54 0.00 0.00 39.78 38.53 1tkd n ASN 87 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1tkd s ILE 89 N -1.05 0.98 -0.21 0.00 1.01 -0.16 -4.94 121.20 116.83 1tkd s ILE 89 Ca 0.19 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.34 1tkd s ILE 89 Cb -0.11 -0.83 0.04 0.00 0.01 0.00 0.00 42.46 41.56 1tkd s ILE 89 CO 0.09 0.28 -0.14 -0.62 0.00 0.00 0.00 174.94 174.55 1tkd s ASP 90 N -0.14 3.69 0.54 3.58 -1.08 -1.26 -1.20 116.67 120.80 1tkd s ASP 90 Ca 0.02 -0.99 0.30 0.00 -0.52 0.00 0.00 52.55 51.36 1tkd s ASP 90 Cb -0.06 -1.45 1.51 0.00 -1.46 0.00 0.00 42.92 41.46 1tkd s ASP 90 CO 0.00 -0.10 2.08 0.71 0.52 0.00 0.00 175.17 178.37 1tkd h THR 91 N 6.36 0.43 -0.13 1.71 1.35 -1.57 -0.73 112.91 120.33 1tkd h THR 91 Ca -0.32 -0.51 -0.19 0.00 -0.55 0.00 0.00 66.41 64.84 1tkd h THR 91 Cb 1.09 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 1tkd h THR 91 CO 0.53 0.10 -0.71 0.25 -0.25 0.00 0.00 175.52 175.44 1tkd h LEU 92 N 0.00 0.68 -0.28 3.87 5.85 -1.91 0.23 115.31 123.76 1tkd h LEU 92 Ca -0.00 -0.43 -0.09 0.00 0.84 0.00 0.00 57.88 58.20 1tkd h LEU 92 Cb 0.35 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1tkd h LEU 92 CO 0.01 1.19 -0.17 0.58 -0.34 0.00 0.00 178.44 179.71 1tkd h VAL 93 N 0.41 1.30 -0.45 1.05 2.07 -1.75 -1.27 116.25 117.61 1tkd h VAL 93 Ca -0.03 -1.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.17 1tkd h VAL 93 Cb 1.30 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 1tkd h VAL 93 CO 0.13 0.41 0.19 -0.07 0.02 0.00 0.00 177.57 178.26 1tkd h LEU 94 N 0.35 0.61 -1.32 2.57 3.38 -1.07 -2.51 115.31 117.32 1tkd h LEU 94 Ca 0.06 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 1tkd h LEU 94 Cb 0.71 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1tkd h LEU 94 CO 0.05 0.60 -0.26 -1.28 0.09 0.00 0.00 178.44 177.63 1tkd h SER 95 N 0.58 0.12 1.37 -0.43 0.87 -0.46 -0.65 113.55 114.95 1tkd h SER 95 Ca 0.15 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1tkd h SER 95 Cb 0.17 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 1tkd h SER 95 CO -0.01 0.39 0.00 0.54 -0.53 0.00 0.00 176.83 177.21 1tkd n ARG 96 N -4.18 0.22 -0.11 2.24 1.74 -0.49 -1.17 116.66 114.91 1tkd n ARG 96 Ca -0.02 0.19 -0.23 0.00 -0.77 0.00 0.00 57.85 57.02 1tkd n ARG 96 Cb 0.34 -1.76 -0.11 0.00 -1.02 0.00 0.00 32.46 29.91 1tkd n ARG 96 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1tkd n LEU 97 N -2.13 1.93 -0.09 0.55 7.94 -0.84 -3.57 117.00 120.78 1tkd n LEU 97 Ca 0.06 0.39 -0.14 0.00 -1.11 0.00 0.00 56.01 55.20 1tkd n LEU 97 Cb 0.41 -0.94 -0.04 0.00 0.53 0.00 0.00 43.42 43.37 1tkd n LEU 97 CO 0.29 0.37 0.48 0.40 -1.11 0.00 0.00 177.39 177.83 1tkd h ILE 98 N -0.94 1.28 -1.82 1.96 2.04 -1.21 -3.24 117.51 115.58 1tkd h ILE 98 Ca -0.43 -1.64 -0.70 0.00 1.00 0.00 0.00 64.86 63.09 1tkd h ILE 98 Cb 1.41 1.59 -0.33 0.00 -0.74 0.00 0.00 36.82 38.75 1tkd h ILE 98 CO -0.24 0.54 0.37 1.41 0.00 0.00 0.00 178.15 180.22 1tkd n HIS 99 N -4.08 3.15 0.30 1.37 8.25 -0.32 -4.78 115.22 119.12 1tkd n HIS 99 Ca -0.04 -2.64 0.15 0.00 -0.26 0.00 0.00 57.72 54.93 1tkd n HIS 99 Cb 0.58 -0.76 0.67 0.00 1.12 0.00 0.00 29.99 31.60 1tkd n HIS 99 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1tkd h SER 100 N 2.85 0.00 1.15 0.41 4.64 -1.61 -1.72 113.55 119.28 1tkd h SER 100 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 1tkd h SER 100 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1tkd h SER 100 CO 1.21 0.00 -0.02 -0.46 -0.87 0.00 0.00 176.83 176.68 1tkd n ASN 101 N -2.58 0.31 -4.93 4.97 6.94 -1.26 -4.23 115.26 114.47 1tkd n ASN 101 Ca 0.00 0.50 -0.21 0.00 -0.02 0.00 0.00 54.58 54.85 1tkd n ASN 101 Cb 0.18 -0.57 -0.03 0.00 -2.36 0.00 0.00 39.78 37.00 1tkd n ASN 101 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1tkd s LEU 102 N -3.55 4.20 0.45 -4.53 1.43 -0.65 -5.02 118.68 111.01 1tkd s LEU 102 Ca 0.13 -0.01 0.08 0.00 -1.03 0.00 0.00 54.13 53.30 1tkd s LEU 102 Cb 0.17 -2.74 0.01 0.00 0.03 0.00 0.00 46.19 43.66 1tkd s LEU 102 CO 0.56 -0.06 0.52 -0.54 0.23 0.00 0.00 176.35 177.06 1tkd s LYS 103 N -3.93 2.60 0.17 1.70 1.02 -1.26 -5.04 119.74 115.00 1tkd s LYS 103 Ca 0.34 -1.46 -0.12 0.00 0.02 0.00 0.00 55.97 54.74 1tkd s LYS 103 Cb -0.09 -2.55 0.01 0.00 -0.52 0.00 0.00 37.83 34.67 1tkd s LYS 103 CO 0.28 -0.35 0.36 0.16 -0.92 0.00 0.00 175.35 174.88 1tkd s ASP 104 N -4.31 -0.07 0.00 2.83 1.47 -1.26 -4.67 116.67 110.65 1tkd s ASP 104 Ca 0.52 -0.69 0.02 0.00 1.18 0.00 0.00 52.55 53.58 1tkd s ASP 104 Cb -0.06 0.48 0.08 0.00 -0.34 0.00 0.00 42.92 43.07 1tkd s ASP 104 CO 0.31 -0.93 1.05 0.35 0.68 0.00 0.00 175.17 176.63 1tkd n THR 105 N -0.25 0.03 -3.91 2.11 -2.24 -1.26 -4.86 114.28 103.90 1tkd n THR 105 Ca -0.09 -0.03 -0.29 0.00 -2.27 0.00 0.00 64.05 61.36 1tkd n THR 105 Cb 0.63 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.88 1tkd n THR 105 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1tkd n ASP 106 N -0.45 -4.15 -2.58 3.42 2.03 -1.26 -1.40 116.55 112.16 1tkd n ASP 106 Ca 0.01 -0.81 -0.12 0.00 0.52 0.00 0.00 54.79 54.40 1tkd n ASP 106 Cb 0.02 -3.81 0.06 0.00 -0.72 0.00 0.00 41.12 36.67 1tkd n ASP 106 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1tkd n MET 107 N -4.61 -4.53 -1.00 -0.67 2.81 -1.26 -3.55 117.12 104.30 1tkd n MET 107 Ca -0.01 0.55 0.00 0.00 -1.81 0.00 0.00 57.70 56.44 1tkd n MET 107 Cb 0.55 -4.71 0.00 0.00 -0.71 0.00 0.00 33.22 28.35 1tkd n MET 107 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1tkd n GLY 108 N -1.17 0.69 0.17 3.03 0.00 -0.83 -4.89 105.19 102.19 1tkd n GLY 108 Ca -0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.96 1tkd n GLY 108 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1tkd h LEU 109 N 0.00 0.00 -8.67 0.99 3.38 -1.28 -3.44 115.31 106.28 1tkd h LEU 109 Ca 0.00 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.28 1tkd h LEU 109 Cb 0.01 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 40.48 1tkd h LEU 109 CO 0.00 0.18 -0.85 -0.76 0.09 0.00 0.00 178.44 177.11 1tkd s LEU 110 N -6.12 2.29 -0.06 1.67 1.43 -0.67 -5.05 118.68 112.18 1tkd s LEU 110 Ca 0.04 -0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 52.46 1tkd s LEU 110 Cb 0.07 -1.42 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 1tkd s LEU 110 CO 0.72 0.30 1.44 -0.13 0.23 0.00 0.00 176.35 178.92 1tkd s ARG 111 N -0.51 4.24 0.26 1.70 0.52 -1.26 -4.69 118.95 119.21 1tkd s ARG 111 Ca 0.07 1.96 -0.02 0.00 -0.52 0.00 0.00 55.73 57.21 1tkd s ARG 111 Cb -0.11 -3.75 0.52 0.00 0.52 0.00 0.00 34.95 32.13 1tkd s ARG 111 CO 0.01 -0.69 1.73 0.66 0.02 0.00 0.00 175.30 177.03 1tkd h SER 112 N 8.44 0.35 0.10 0.23 4.64 -1.97 -1.23 113.55 124.12 1tkd h SER 112 Ca -0.35 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1tkd h SER 112 Cb 1.16 0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1tkd h SER 112 CO 0.94 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 177.62 1tkd n GLY 113 N -1.33 -0.85 0.04 -0.77 0.00 -1.26 -1.67 105.19 99.35 1tkd n GLY 113 Ca 0.16 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.44 1tkd n GLY 113 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1tkd n LYS 114 N -2.11 0.26 -3.11 1.61 4.81 -0.46 -4.93 118.16 114.23 1tkd n LYS 114 Ca -0.01 0.02 -0.35 0.00 -0.87 0.00 0.00 58.31 57.11 1tkd n LYS 114 Cb 0.05 -1.61 -0.06 0.00 0.02 0.00 0.00 35.03 33.43 1tkd n LYS 114 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1tkd s LEU 115 N -3.91 4.25 0.58 3.14 1.43 -0.67 -5.08 118.68 118.43 1tkd s LEU 115 Ca 0.05 1.38 -0.08 0.00 -1.03 0.00 0.00 54.13 54.45 1tkd s LEU 115 Cb 0.14 -3.75 -0.02 0.00 0.03 0.00 0.00 46.19 42.59 1tkd s LEU 115 CO 0.77 -0.04 0.94 -2.16 0.23 0.00 0.00 176.35 176.08 1tkd s PRO 116 N -2.29 3.39 2.39 1.29 0.04 -1.26 -4.94 135.00 133.62 1tkd s PRO 116 Ca 0.47 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.92 1tkd s PRO 116 Cb -0.15 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.19 1tkd s PRO 116 CO 0.20 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 177.13 1tkd n GLY 117 N -2.59 -0.42 3.98 0.56 0.00 -1.26 -4.68 105.19 100.77 1tkd n GLY 117 Ca 0.04 -1.09 -0.18 0.00 0.00 0.00 0.00 46.02 44.79 1tkd n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tkd s ALA 124 N -1.48 4.46 -0.02 4.61 0.00 -1.26 -5.05 121.76 123.02 1tkd s ALA 124 Ca 0.00 -1.77 0.03 0.00 0.00 0.00 0.00 51.96 50.21 1tkd s ALA 124 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.67 1tkd s ALA 124 CO 0.00 -0.36 -0.09 -0.51 0.00 0.00 0.00 175.76 174.80 1tkd s LEU 125 N -4.35 1.82 0.24 0.00 1.43 -1.26 -4.18 118.68 112.38 1tkd s LEU 125 Ca 0.54 -0.19 -0.31 0.00 -1.03 0.00 0.00 54.13 53.14 1tkd s LEU 125 Cb -0.08 -0.55 -0.12 0.00 0.03 0.00 0.00 46.19 45.48 1tkd s LEU 125 CO 0.32 0.07 1.64 1.21 0.23 0.00 0.00 176.35 179.83 1tkd n GLU 126 N 3.22 2.64 0.33 1.70 0.00 -1.26 -4.88 120.64 122.38 1tkd n GLU 126 Ca -0.17 0.95 -0.17 0.00 0.00 0.00 0.00 57.16 57.76 1tkd n GLU 126 Cb 0.55 -2.75 -0.09 0.00 0.00 0.00 0.00 31.44 29.15 1tkd n GLU 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1tkd h ALA 127 N 5.79 -0.92 -0.73 4.31 0.00 -1.99 -0.70 119.26 125.03 1tkd h ALA 127 Ca -0.45 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.34 1tkd h ALA 127 Cb 1.22 0.45 -0.06 0.00 0.00 0.00 0.00 17.79 19.40 1tkd h ALA 127 CO 0.88 -1.03 0.43 -1.49 0.00 0.00 0.00 179.25 178.03 1tkd h TRP 128 N -0.90 0.79 -0.61 0.00 -0.00 -1.95 -0.74 115.95 112.54 1tkd h TRP 128 Ca -0.07 0.03 -0.06 0.00 -0.00 0.00 0.00 58.89 58.78 1tkd h TRP 128 Cb 0.73 -0.25 -0.03 0.00 -0.00 0.00 0.00 29.16 29.62 1tkd h TRP 128 CO -0.10 0.39 0.12 0.78 -0.00 0.00 0.00 178.44 179.63 1tkd h GLY 129 N 0.79 1.05 1.00 1.49 0.00 -1.93 -1.66 103.07 103.81 1tkd h GLY 129 Ca 0.32 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1tkd h GLY 129 CO -0.18 0.61 0.22 -1.82 0.00 0.00 0.00 176.54 175.37 1tkd h TYR 130 N 0.93 0.42 0.12 5.60 3.20 -0.02 -0.11 116.97 127.10 1tkd h TYR 130 Ca 0.19 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.09 1tkd h TYR 130 Cb 0.37 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 1tkd h TYR 130 CO 0.02 0.26 -0.34 0.00 -1.64 0.00 0.00 178.16 176.47 1tkd h ARG 131 N 0.45 -0.55 -0.90 1.82 2.47 -0.74 -1.56 114.38 115.38 1tkd h ARG 131 Ca 0.12 0.04 0.04 0.00 -1.26 0.00 0.00 59.98 58.92 1tkd h ARG 131 Cb -0.05 0.12 -0.05 0.00 -1.65 0.00 0.00 29.97 28.34 1tkd h ARG 131 CO -0.03 -0.36 0.58 -0.07 0.56 0.00 0.00 179.97 180.65 1tkd h LEU 132 N -0.57 0.95 -1.23 3.04 3.38 -1.12 -1.13 115.31 118.64 1tkd h LEU 132 Ca 0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1tkd h LEU 132 Cb 0.60 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1tkd h LEU 132 CO -0.20 0.65 0.00 1.23 0.09 0.00 0.00 178.44 180.21 1tkd h GLY 133 N 1.11 0.00 -1.13 0.83 0.00 -0.55 -2.92 103.07 100.42 1tkd h GLY 133 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 1tkd h GLY 133 CO -0.13 0.00 -0.05 1.18 0.00 0.00 0.00 176.54 177.54 1tkd n GLU 134 N -2.55 1.24 -0.17 4.80 -0.58 -0.48 -2.84 120.64 120.05 1tkd n GLU 134 Ca 0.01 -1.29 -0.02 0.00 -0.42 0.00 0.00 57.16 55.43 1tkd n GLU 134 Cb 0.21 -1.28 0.07 0.00 -0.57 0.00 0.00 31.44 29.87 1tkd n GLU 134 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 1tkd h MET 135 N 2.75 0.33 -0.89 3.49 2.86 -1.20 -0.18 114.93 122.09 1tkd h MET 135 Ca 0.00 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1tkd h MET 135 Cb 0.61 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 32.15 1tkd h MET 135 CO 0.00 0.22 0.59 0.87 1.06 0.00 0.00 176.91 179.65 1tkd h LYS 136 N 0.34 1.16 -0.39 1.72 1.57 -1.83 0.14 116.57 119.29 1tkd h LYS 136 Ca 0.26 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.89 1tkd h LYS 136 Cb 0.30 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1tkd h LYS 136 CO -0.27 0.77 -0.04 0.78 -0.57 0.00 0.00 179.45 180.12 1tkd h GLY 137 N 1.20 0.77 1.63 3.86 0.00 -1.66 -1.73 103.07 107.14 1tkd h GLY 137 Ca 0.33 -0.60 -0.12 0.00 0.00 0.00 0.00 47.33 46.94 1tkd h GLY 137 CO -0.08 0.55 -0.42 0.83 0.00 0.00 0.00 176.54 177.42 1tkd h GLU 138 N 0.53 0.41 -0.25 4.80 5.08 -0.72 -1.78 114.58 122.63 1tkd h GLU 138 Ca 0.10 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 1tkd h GLU 138 Cb 0.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1tkd h GLU 138 CO 0.03 0.76 0.03 -0.92 -1.00 0.00 0.00 179.01 177.91 1tkd h TYR 139 N 0.34 0.46 -0.84 4.33 3.20 -0.63 -1.08 116.97 122.74 1tkd h TYR 139 Ca 0.03 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.84 1tkd h TYR 139 Cb 0.88 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.98 1tkd h TYR 139 CO 0.03 0.55 0.55 -0.22 -1.64 0.00 0.00 178.16 177.43 1tkd h LYS 140 N 0.23 1.11 -0.16 1.82 3.64 -1.18 0.60 116.57 122.63 1tkd h LYS 140 Ca 0.08 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1tkd h LYS 140 Cb 0.35 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1tkd h LYS 140 CO 0.01 0.74 0.10 -0.44 -2.27 0.00 0.00 179.45 177.58 1tkd h ASP 141 N 1.14 0.20 0.08 4.20 3.32 -1.05 0.63 116.42 124.94 1tkd h ASP 141 Ca 0.31 -0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.31 1tkd h ASP 141 Cb -0.12 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 1tkd h ASP 141 CO -0.07 0.20 -0.17 0.44 -1.72 0.00 0.00 179.24 177.92 1tkd h ASP 142 N 0.18 -0.48 -0.65 6.45 5.19 -0.73 -2.21 116.42 124.17 1tkd h ASP 142 Ca 0.06 0.06 0.08 0.00 -0.62 0.00 0.00 57.03 56.61 1tkd h ASP 142 Cb 0.04 0.19 -0.07 0.00 0.18 0.00 0.00 39.33 39.67 1tkd h ASP 142 CO -0.01 -0.25 0.31 0.15 -3.12 0.00 0.00 179.24 176.32 1tkd h PHE 143 N -0.32 0.55 -0.55 4.55 3.57 -0.70 -2.26 116.94 121.77 1tkd h PHE 143 Ca 0.03 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 1tkd h PHE 143 Cb 0.35 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.92 1tkd h PHE 143 CO -0.19 0.20 0.27 0.87 -2.23 0.00 0.00 178.31 177.24 1tkd h LYS 144 N 0.54 0.78 -0.30 1.11 1.57 -0.53 -2.65 116.57 117.10 1tkd h LYS 144 Ca 0.31 -0.11 -0.18 0.00 -1.87 0.00 0.00 60.65 58.80 1tkd h LYS 144 Cb 0.32 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1tkd h LYS 144 CO -0.25 0.64 -0.53 0.07 -0.57 0.00 0.00 179.45 178.80 1tkd h ARG 145 N 0.74 0.88 -0.75 3.15 0.11 -1.20 -2.66 114.38 114.65 1tkd h ARG 145 Ca 0.19 -0.55 0.11 0.00 0.10 0.00 0.00 59.98 59.83 1tkd h ARG 145 Cb 0.11 0.06 -0.08 0.00 1.11 0.00 0.00 29.97 31.17 1tkd h ARG 145 CO -0.03 1.19 0.37 0.52 0.10 0.00 0.00 179.97 182.12 1tkd h MET 146 N 0.67 0.58 0.22 0.08 2.86 -1.34 -0.14 114.93 117.86 1tkd h MET 146 Ca 0.02 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1tkd h MET 146 Cb 1.14 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.67 1tkd h MET 146 CO 0.12 0.38 -0.11 -0.07 1.06 0.00 0.00 176.91 178.30 1tkd h LEU 147 N 0.60 -0.25 -0.47 1.22 3.38 -1.37 -1.87 115.31 116.54 1tkd h LEU 147 Ca 0.38 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1tkd h LEU 147 Cb 0.46 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1tkd h LEU 147 CO -0.31 -0.12 0.00 -0.62 0.09 0.00 0.00 178.44 177.48 1tkd n GLU 148 N -5.19 0.06 0.05 1.13 1.02 -0.76 0.12 120.64 117.07 1tkd n GLU 148 Ca -0.09 0.49 0.12 0.00 -0.02 0.00 0.00 57.16 57.66 1tkd n GLU 148 Cb 0.16 -1.67 0.20 0.00 -0.02 0.00 0.00 31.44 30.11 1tkd n GLU 148 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1tkd n GLU 149 N -1.79 0.25 -0.11 3.49 1.02 -0.14 -3.58 120.64 119.79 1tkd n GLU 149 Ca 0.00 0.08 0.07 0.00 -0.02 0.00 0.00 57.16 57.30 1tkd n GLU 149 Cb 0.06 -1.66 0.13 0.00 -0.02 0.00 0.00 31.44 29.95 1tkd n GLU 149 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1tkd n GLN 150 N -2.03 1.91 0.00 3.49 1.13 0.33 -4.98 117.38 117.22 1tkd n GLN 150 Ca 0.04 -1.79 0.00 0.00 -1.94 0.00 0.00 57.00 53.31 1tkd n GLN 150 Cb 0.43 -1.32 0.00 0.00 0.11 0.00 0.00 30.24 29.46 1tkd n GLN 150 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1tkd n GLY 151 N 0.83 2.84 3.76 1.08 0.00 -0.59 -5.00 105.19 108.12 1tkd n GLY 151 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1tkd n GLY 151 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1tkd s GLU 152 N -0.07 3.32 0.62 1.61 2.02 -1.16 -4.92 118.70 120.12 1tkd s GLU 152 Ca 0.00 1.84 -0.07 0.00 0.02 0.00 0.00 54.97 56.75 1tkd s GLU 152 Cb 0.00 -2.15 0.01 0.00 0.10 0.00 0.00 34.13 32.09 1tkd s GLU 152 CO 0.00 -0.93 0.95 -1.21 0.02 0.00 0.00 175.26 174.09 1tkd s GLU 153 N -3.05 2.93 -0.07 1.61 2.02 -1.26 -3.84 118.70 117.04 1tkd s GLU 153 Ca 0.71 0.13 -0.03 0.00 0.02 0.00 0.00 54.97 55.81 1tkd s GLU 153 Cb -0.30 -2.21 -0.04 0.00 0.10 0.00 0.00 34.13 31.68 1tkd s GLU 153 CO 0.35 -0.77 0.06 -0.47 0.02 0.00 0.00 175.26 174.45 1tkd s TYR 154 N -3.08 3.32 0.04 1.61 5.04 -1.26 -4.97 117.35 118.05 1tkd s TYR 154 Ca 0.55 0.29 0.07 0.00 -2.44 0.00 0.00 57.07 55.54 1tkd s TYR 154 Cb -0.11 -1.81 -0.02 0.00 0.35 0.00 0.00 41.96 40.36 1tkd s TYR 154 CO 0.47 0.57 -0.21 0.08 -1.34 0.00 0.00 175.55 175.12 1tkd s VAL 155 N -1.02 1.67 0.00 3.14 1.01 -1.26 -5.04 120.40 118.90 1tkd s VAL 155 Ca 0.17 -1.19 0.00 0.00 0.00 0.00 0.00 61.98 60.96 1tkd s VAL 155 Cb -0.12 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.82 1tkd s VAL 155 CO 0.06 0.21 0.00 0.47 0.00 0.00 0.00 175.10 175.85 1tkd n ASP 156 N 1.87 0.00 -2.62 3.32 9.92 -1.26 -1.19 116.55 126.59 1tkd n ASP 156 Ca -0.17 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.08 1tkd n ASP 156 Cb 0.53 0.00 0.07 0.00 -0.64 0.00 0.00 41.12 41.08 1tkd n ASP 156 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1tkd n GLY 157 N 0.00 1.75 0.21 0.44 0.00 -1.26 -4.94 105.19 101.39 1tkd n GLY 157 Ca 0.00 -0.75 0.08 0.00 0.00 0.00 0.00 46.02 45.35 1tkd n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tkd h MET 158 N 1.92 0.00 0.00 1.61 -0.00 -1.58 -2.08 114.93 114.81 1tkd h MET 158 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.45 1tkd h MET 158 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.93 1tkd h MET 158 CO 0.05 0.00 0.00 -0.85 -0.00 0.00 0.00 176.91 176.11 1tkd n GLU 159 N -2.25 0.08 0.00 -0.10 0.00 -1.26 -1.74 120.64 115.37 1tkd n GLU 159 Ca -0.01 0.54 0.05 0.00 0.00 0.00 0.00 57.16 57.74 1tkd n GLU 159 Cb 0.40 -1.75 -0.01 0.00 0.00 0.00 0.00 31.44 30.08 1tkd n GLU 159 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 1tkd n TRP 160 N -1.93 0.00 -0.19 -1.84 7.02 -0.78 -4.63 117.44 115.10 1tkd n TRP 160 Ca -0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.38 1tkd n TRP 160 Cb 0.05 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 28.95 1tkd n TRP 160 CO 0.00 0.00 0.00 -1.49 -2.02 0.00 0.00 177.69 174.18 1tkd h TRP 161 N 1.08 1.13 -3.47 -5.99 6.55 -1.52 -3.38 115.95 110.36 1tkd h TRP 161 Ca 0.00 -0.23 -0.42 0.00 0.95 0.00 0.00 58.89 59.19 1tkd h TRP 161 Cb 0.36 -0.28 -0.17 0.00 -0.86 0.00 0.00 29.16 28.21 1tkd h TRP 161 CO 0.00 1.05 -0.75 -0.80 -1.05 0.00 0.00 178.44 176.88 1tkd s ASN 162 N -6.61 2.08 0.41 -3.49 0.01 -1.26 -4.98 114.94 101.10 1tkd s ASN 162 Ca -0.12 -0.86 -0.22 0.00 -0.71 0.00 0.00 52.86 50.95 1tkd s ASN 162 Cb 0.13 -0.07 -0.10 0.00 0.41 0.00 0.00 41.25 41.61 1tkd s ASN 162 CO 0.86 -0.16 0.97 0.12 -1.51 0.00 0.00 177.10 177.38 1tkd s PHE 163 N -2.34 3.36 0.21 2.20 5.36 -1.26 -5.00 117.98 120.50 1tkd s PHE 163 Ca 0.11 1.65 -0.18 0.00 -0.96 0.00 0.00 56.93 57.56 1tkd s PHE 163 Cb -0.04 -2.92 0.03 0.00 -0.34 0.00 0.00 43.02 39.74 1tkd s PHE 163 CO 0.03 -0.18 0.55 0.54 -1.46 0.00 0.00 175.22 174.70 1tkd s ASN 164 N -1.96 -0.26 0.53 6.13 2.20 -1.26 -5.06 114.94 115.26 1tkd s ASN 164 Ca 0.59 -0.51 0.31 0.00 -0.94 0.00 0.00 52.86 52.31 1tkd s ASN 164 Cb -0.14 0.60 1.41 0.00 -2.00 0.00 0.00 41.25 41.12 1tkd s ASN 164 CO 0.18 -1.10 2.02 -0.33 -2.94 0.00 0.00 177.10 174.93 1tkd h GLU 165 N 2.16 0.00 -0.38 3.55 4.39 -1.99 -2.43 114.58 119.88 1tkd h GLU 165 Ca -0.27 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.26 1tkd h GLU 165 Cb 1.26 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.91 1tkd h GLU 165 CO 0.35 0.09 -0.40 0.93 -1.16 0.00 0.00 179.01 178.82 1tkd h GLU 166 N 0.00 0.93 -0.76 2.33 4.39 -1.99 -1.56 114.58 117.92 1tkd h GLU 166 Ca -0.00 -0.50 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1tkd h GLU 166 Cb 0.46 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.10 1tkd h GLU 166 CO 0.01 1.15 0.49 1.98 -1.16 0.00 0.00 179.01 181.48 1tkd h MET 167 N 0.76 1.01 -0.12 2.33 4.05 -1.86 -1.67 114.93 119.43 1tkd h MET 167 Ca 0.06 -0.07 -0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1tkd h MET 167 Cb 0.99 -0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 31.56 1tkd h MET 167 CO 0.10 0.69 0.07 1.98 0.23 0.00 0.00 176.91 179.97 1tkd h MET 168 N 1.03 0.16 -0.97 0.39 -1.53 -1.23 -0.01 114.93 112.78 1tkd h MET 168 Ca 0.28 -0.02 0.04 0.00 -3.44 0.00 0.00 59.70 56.56 1tkd h MET 168 Cb -0.09 -0.03 -0.06 0.00 -0.55 0.00 0.00 31.60 30.87 1tkd h MET 168 CO -0.06 0.17 0.64 -0.44 0.14 0.00 0.00 176.91 177.36 1tkd h ASP 169 N 0.11 1.06 -0.49 1.39 3.32 -0.91 -0.31 116.42 120.59 1tkd h ASP 169 Ca 0.04 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.96 1tkd h ASP 169 Cb 0.05 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1tkd h ASP 169 CO -0.01 0.72 -0.18 1.88 -1.72 0.00 0.00 179.24 179.94 1tkd h TYR 170 N 1.23 1.12 -0.62 4.55 0.05 -1.02 -0.23 116.97 122.05 1tkd h TYR 170 Ca 0.39 -0.26 0.06 0.00 0.05 0.00 0.00 58.73 58.96 1tkd h TYR 170 Cb 0.01 -0.27 -0.05 0.00 1.01 0.00 0.00 36.73 37.44 1tkd h TYR 170 CO -0.00 1.08 0.33 -0.97 -1.05 0.00 0.00 178.16 177.55 1tkd h ASN 171 N 0.84 0.48 -0.48 3.88 -0.00 0.10 -0.01 115.58 120.40 1tkd h ASN 171 Ca 0.12 0.03 -0.03 0.00 -0.00 0.00 0.00 56.30 56.42 1tkd h ASN 171 Cb 0.75 -0.06 -0.02 0.00 -0.00 0.00 0.00 38.32 38.99 1tkd h ASN 171 CO 0.06 0.32 0.19 0.58 -0.00 0.00 0.00 177.43 178.57 1tkd h VAL 172 N 0.62 1.21 -0.77 2.57 2.07 -0.71 -2.77 116.25 118.46 1tkd h VAL 172 Ca 0.28 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 67.16 1tkd h VAL 172 Cb 0.18 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1tkd h VAL 172 CO -0.18 0.25 0.50 1.56 0.02 0.00 0.00 177.57 179.71 1tkd h GLN 173 N 0.63 0.96 -0.40 1.57 1.08 -0.25 -2.39 115.11 116.31 1tkd h GLN 173 Ca 0.16 -0.06 0.07 0.00 -1.45 0.00 0.00 58.65 57.37 1tkd h GLN 173 Cb 0.20 -0.22 -0.06 0.00 -0.05 0.00 0.00 27.48 27.36 1tkd h GLN 173 CO -0.01 0.64 0.05 -0.44 -0.95 0.00 0.00 178.83 178.12 1tkd h ASP 174 N 0.99 -0.05 -0.74 1.46 3.32 -0.75 -0.29 116.42 120.36 1tkd h ASP 174 Ca 0.30 0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.37 1tkd h ASP 174 Cb -0.05 0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1tkd h ASP 174 CO -0.09 0.01 0.28 0.58 -1.72 0.00 0.00 179.24 178.30 1tkd h VAL 175 N 0.17 1.26 -0.56 -1.35 2.07 -1.29 0.58 116.25 117.13 1tkd h VAL 175 Ca 0.20 -0.83 -0.11 0.00 0.82 0.00 0.00 66.70 66.77 1tkd h VAL 175 Cb 0.25 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1tkd h VAL 175 CO -0.28 0.33 -0.07 1.62 0.02 0.00 0.00 177.57 179.19 1tkd h VAL 176 N 1.08 1.27 -0.33 2.57 3.04 -1.01 0.13 116.25 122.99 1tkd h VAL 176 Ca 0.24 -1.23 -0.14 0.00 -1.01 0.00 0.00 66.70 64.57 1tkd h VAL 176 Cb 0.24 0.91 -0.00 0.00 -2.01 0.00 0.00 31.29 30.43 1tkd h VAL 176 CO -0.02 0.44 -0.35 0.58 -1.01 0.00 0.00 177.57 177.21 1tkd h VAL 177 N 0.93 1.29 -0.29 1.51 2.07 -0.71 -2.02 116.25 119.03 1tkd h VAL 177 Ca 0.15 -1.52 -0.05 0.00 0.82 0.00 0.00 66.70 66.10 1tkd h VAL 177 Cb 0.63 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1tkd h VAL 177 CO 0.04 0.50 -0.03 0.74 0.02 0.00 0.00 177.57 178.84 1tkd h THR 178 N 0.61 1.19 -0.44 2.57 2.02 0.37 0.20 112.91 119.42 1tkd h THR 178 Ca 0.05 -0.77 -0.12 0.00 0.77 0.00 0.00 66.41 66.34 1tkd h THR 178 Cb 0.94 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 1tkd h THR 178 CO 0.09 0.26 -0.21 0.50 0.37 0.00 0.00 175.52 176.52 1tkd h LYS 179 N 0.43 0.90 -0.21 6.66 3.64 -0.55 -0.47 116.57 126.96 1tkd h LYS 179 Ca 0.09 -0.37 -0.07 0.00 -1.27 0.00 0.00 60.65 59.04 1tkd h LYS 179 Cb 0.33 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1tkd h LYS 179 CO 0.01 1.02 -0.14 0.00 -2.27 0.00 0.00 179.45 178.07 1tkd h ALA 180 N 0.98 0.30 -0.20 5.00 0.00 -0.72 -2.36 119.26 122.26 1tkd h ALA 180 Ca 0.11 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1tkd h ALA 180 Cb 0.76 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1tkd h ALA 180 CO 0.06 0.17 -0.03 1.25 0.00 0.00 0.00 179.25 180.71 1tkd h LEU 181 N 0.16 -0.13 -0.22 0.00 6.46 -0.87 -0.67 115.31 120.03 1tkd h LEU 181 Ca 0.04 0.05 0.06 0.00 -0.12 0.00 0.00 57.88 57.91 1tkd h LEU 181 Cb 0.65 0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 40.61 1tkd h LEU 181 CO 0.04 -0.04 -0.23 0.25 -0.62 0.00 0.00 178.44 177.83 1tkd h LEU 182 N 0.03 -0.75 -1.81 2.25 5.85 -1.03 0.01 115.31 119.86 1tkd h LEU 182 Ca 0.09 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1tkd h LEU 182 Cb 0.13 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 1tkd h LEU 182 CO -0.18 -0.27 -0.14 -0.33 -0.34 0.00 0.00 178.44 177.18 1tkd h GLU 183 N -0.25 0.00 -0.28 1.25 5.08 -1.09 0.84 114.58 120.13 1tkd h GLU 183 Ca 0.13 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.31 1tkd h GLU 183 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1tkd h GLU 183 CO -0.37 0.14 -0.54 -0.22 -1.00 0.00 0.00 179.01 177.02 1tkd h LYS 184 N 0.00 0.86 -0.25 2.33 3.64 0.23 -2.60 116.57 120.79 1tkd h LYS 184 Ca -0.00 -0.55 -0.19 0.00 -1.27 0.00 0.00 60.65 58.63 1tkd h LYS 184 Cb 0.28 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1tkd h LYS 184 CO 0.02 1.19 -0.60 -0.07 -2.27 0.00 0.00 179.45 177.72 1tkd h LEU 185 N 0.64 0.96 -2.04 5.20 3.38 -0.37 -3.11 115.31 119.97 1tkd h LEU 185 Ca 0.01 -0.56 -0.01 0.00 0.09 0.00 0.00 57.88 57.41 1tkd h LEU 185 Cb 1.15 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1tkd h LEU 185 CO 0.12 1.34 -0.04 -0.07 0.09 0.00 0.00 178.44 179.88 1tkd h LEU 186 N 0.61 0.00 0.00 1.67 3.38 -0.85 -2.37 115.31 117.76 1tkd h LEU 186 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tkd h LEU 186 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1tkd h LEU 186 CO 0.13 0.04 0.00 -1.54 0.09 0.00 0.00 178.44 177.16 1tkd n SER 187 N -3.25 0.00 -4.58 -0.43 3.41 -0.98 -4.65 113.62 103.14 1tkd n SER 187 Ca -0.01 -0.25 -0.42 0.00 -0.26 0.00 0.00 58.87 57.92 1tkd n SER 187 Cb 0.22 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 63.91 1tkd n SER 187 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1tkd s ASP 188 N -2.47 6.35 0.58 4.04 -1.08 -0.89 -4.86 116.67 118.33 1tkd s ASP 188 Ca 0.30 0.27 0.27 0.00 -0.52 0.00 0.00 52.55 52.87 1tkd s ASP 188 Cb 0.19 -2.55 1.63 0.00 -1.46 0.00 0.00 42.92 40.74 1tkd s ASP 188 CO 0.42 -1.53 2.14 0.11 0.52 0.00 0.00 175.17 176.83 1tkd h LYS 189 N 10.13 0.00 -0.22 4.34 1.57 -1.83 -0.59 116.57 129.96 1tkd h LYS 189 Ca -0.26 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.44 1tkd h LYS 189 Cb 1.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 1tkd h LYS 189 CO 1.17 0.00 -0.23 1.25 -0.57 0.00 0.00 179.45 181.06 1tkd h HIS 190 N 0.00 0.45 0.00 -1.35 2.76 -1.97 -3.28 115.15 111.76 1tkd h HIS 190 Ca 0.07 -0.09 -0.28 0.00 -2.20 0.00 0.00 60.37 57.87 1tkd h HIS 190 Cb 0.34 -0.11 -0.05 0.00 1.55 0.00 0.00 27.41 29.13 1tkd h HIS 190 CO 0.00 0.61 -2.24 0.66 -1.30 0.00 0.00 177.93 175.66 1tkd n TYR 191 N -4.14 0.00 -3.87 5.26 4.02 -0.85 -4.79 117.16 112.79 1tkd n TYR 191 Ca -0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.61 1tkd n TYR 191 Cb 0.38 -0.85 -0.16 0.00 -0.02 0.00 0.00 39.34 38.68 1tkd n TYR 191 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1tkd s PHE 192 N -2.65 1.62 -0.02 -0.72 0.08 -0.29 -2.01 117.98 114.00 1tkd s PHE 192 Ca -0.09 -1.07 -0.34 0.00 0.12 0.00 0.00 56.93 55.55 1tkd s PHE 192 Cb 0.07 -1.27 -0.13 0.00 -0.57 0.00 0.00 43.02 41.12 1tkd s PHE 192 CO 0.80 -0.62 1.77 -2.30 -0.10 0.00 0.00 175.22 174.78 1tkd n PRO 193 N 4.89 2.11 -0.21 0.24 -0.02 -1.26 -4.08 135.00 136.68 1tkd n PRO 193 Ca -0.11 0.77 0.22 0.00 -2.02 0.00 0.00 63.50 62.36 1tkd n PRO 193 Cb 0.47 -2.58 0.59 0.00 -0.02 0.00 0.00 33.50 31.96 1tkd n PRO 193 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1tkd h PRO 194 N 8.06 0.25 0.00 0.52 0.11 -1.93 -2.21 132.00 136.79 1tkd h PRO 194 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1tkd h PRO 194 Cb 1.27 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1tkd h PRO 194 CO 0.93 0.16 0.00 0.39 -0.21 0.00 0.00 178.00 179.27 1tkd n GLU 195 N -4.43 0.04 -4.83 1.05 4.71 -1.26 -4.66 120.64 111.26 1tkd n GLU 195 Ca 0.19 0.32 -0.33 0.00 -0.01 0.00 0.00 57.16 57.33 1tkd n GLU 195 Cb 0.78 -1.59 -0.14 0.00 -1.01 0.00 0.00 31.44 29.48 1tkd n GLU 195 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1tkd s ILE 196 N -3.08 3.01 -0.80 -3.67 1.01 -0.83 -5.06 121.20 111.78 1tkd s ILE 196 Ca 0.06 -0.70 -0.18 0.00 0.00 0.00 0.00 60.65 59.83 1tkd s ILE 196 Cb 0.09 -2.23 0.14 0.00 0.01 0.00 0.00 42.46 40.46 1tkd s ILE 196 CO 0.27 0.54 0.94 -0.62 0.00 0.00 0.00 174.94 176.07 1tkd s ASP 197 N 0.04 6.51 0.00 3.58 2.15 -1.26 -4.87 116.67 122.81 1tkd s ASP 197 Ca -0.05 -1.93 0.04 0.00 0.43 0.00 0.00 52.55 51.04 1tkd s ASP 197 Cb -0.14 -2.34 0.20 0.00 -0.30 0.00 0.00 42.92 40.34 1tkd s ASP 197 CO 0.04 -1.01 0.80 0.49 -0.17 0.00 0.00 175.17 175.32 1tkd n PHE 198 N 6.07 0.00 1.11 -5.34 3.01 -1.26 -0.73 117.46 120.32 1tkd n PHE 198 Ca 0.11 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.70 1tkd n PHE 198 Cb 0.47 -0.13 0.30 0.00 -0.01 0.00 0.00 39.48 40.10 1tkd n PHE 198 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1tkd n THR 199 N -1.13 0.09 -2.66 4.37 -2.24 -1.26 -4.30 114.28 107.15 1tkd n THR 199 Ca 0.02 -0.43 -0.09 0.00 -2.27 0.00 0.00 64.05 61.28 1tkd n THR 199 Cb 0.02 0.95 0.03 0.00 -2.10 0.00 0.00 70.33 69.23 1tkd n THR 199 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1tkd n ASP 200 N 0.84 2.00 -3.97 3.42 2.03 0.09 -4.22 116.55 116.74 1tkd n ASP 200 Ca 0.17 -2.67 -0.09 0.00 0.52 0.00 0.00 54.79 52.72 1tkd n ASP 200 Cb 0.48 -0.50 -0.10 0.00 -0.72 0.00 0.00 41.12 40.29 1tkd n ASP 200 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1tkd s VAL 201 N -3.65 0.14 0.97 5.18 -7.23 -1.25 -4.94 120.40 109.62 1tkd s VAL 201 Ca 0.30 -1.19 -0.12 0.00 -1.81 0.00 0.00 61.98 59.16 1tkd s VAL 201 Cb 0.41 -0.89 0.17 0.00 0.56 0.00 0.00 36.38 36.63 1tkd s VAL 201 CO -0.01 -0.66 1.09 -0.83 -0.31 0.00 0.00 175.10 174.39 1tkd s GLY 202 N -2.15 1.58 0.23 2.32 0.00 -1.26 -4.73 107.32 103.31 1tkd s GLY 202 Ca -0.05 -0.28 -0.07 0.00 0.00 0.00 0.00 44.72 44.33 1tkd s GLY 202 CO -0.05 0.30 1.85 0.10 0.00 0.00 0.00 173.10 175.31 1tkd h TYR 203 N -1.80 1.25 -0.71 1.90 -0.00 -1.63 -1.44 116.97 114.54 1tkd h TYR 203 Ca -0.53 -0.03 0.04 0.00 0.00 0.00 0.00 58.73 58.21 1tkd h TYR 203 Cb 1.32 -0.40 -0.05 0.00 0.00 0.00 0.00 36.73 37.60 1tkd h TYR 203 CO 0.33 0.86 0.43 1.15 -0.00 0.00 0.00 178.16 180.93 1tkd h THR 204 N 1.27 1.05 -0.35 -0.90 2.02 -1.89 -1.65 112.91 112.47 1tkd h THR 204 Ca 0.32 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 67.17 1tkd h THR 204 Cb 0.03 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.59 1tkd h THR 204 CO -0.05 0.15 0.05 0.74 0.37 0.00 0.00 175.52 176.78 1tkd h THR 205 N 0.82 1.24 -0.54 3.16 2.02 -1.81 -1.33 112.91 116.47 1tkd h THR 205 Ca 0.30 -0.86 0.10 0.00 0.77 0.00 0.00 66.41 66.72 1tkd h THR 205 Cb 0.08 1.13 -0.08 0.00 -1.74 0.00 0.00 68.15 67.54 1tkd h THR 205 CO -0.14 0.29 0.05 0.15 0.37 0.00 0.00 175.52 176.24 1tkd h PHE 206 N 0.41 0.06 -0.03 3.16 3.04 -0.54 0.20 116.94 123.24 1tkd h PHE 206 Ca 0.10 0.04 -0.20 0.00 3.98 0.00 0.00 57.97 61.89 1tkd h PHE 206 Cb 0.37 0.06 0.01 0.00 2.56 0.00 0.00 35.95 38.95 1tkd h PHE 206 CO 0.03 -0.08 -0.77 -1.49 -2.02 0.00 0.00 178.31 173.98 1tkd h TRP 207 N 0.17 0.82 -0.19 0.41 4.06 -1.26 -3.03 115.95 116.93 1tkd h TRP 207 Ca 0.28 -0.43 -0.15 0.00 2.06 0.00 0.00 58.89 60.65 1tkd h TRP 207 Cb 0.41 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.46 1tkd h TRP 207 CO -0.29 1.25 -0.50 0.66 -3.56 0.00 0.00 178.44 176.01 1tkd h SER 208 N 0.16 0.56 1.64 -3.49 4.64 -0.91 -3.23 113.55 112.93 1tkd h SER 208 Ca -0.09 -0.28 -0.01 0.00 -0.47 0.00 0.00 61.79 60.95 1tkd h SER 208 Cb 1.44 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1tkd h SER 208 CO 0.15 0.96 -0.36 -0.33 -0.87 0.00 0.00 176.83 176.38 1tkd h GLU 209 N 0.40 0.00 -6.88 4.77 4.39 -0.74 -3.46 114.58 113.05 1tkd h GLU 209 Ca 0.02 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.23 1tkd h GLU 209 Cb 1.01 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.70 1tkd h GLU 209 CO 0.09 0.02 0.06 -1.54 -1.16 0.00 0.00 179.01 176.49 1tkd s SER 210 N -5.94 6.16 0.35 1.42 1.04 -1.14 -4.58 113.70 111.00 1tkd s SER 210 Ca 0.04 0.80 -0.27 0.00 0.48 0.00 0.00 55.95 57.00 1tkd s SER 210 Cb 0.07 -2.11 -0.12 0.00 0.10 0.00 0.00 66.02 63.95 1tkd s SER 210 CO 0.71 -0.61 1.15 -0.11 0.98 0.00 0.00 173.24 175.37 1tkd n LEU 211 N -2.22 2.91 -0.30 2.42 7.94 -0.85 -4.85 117.00 122.05 1tkd n LEU 211 Ca 0.00 1.16 0.12 0.00 -1.11 0.00 0.00 56.01 56.18 1tkd n LEU 211 Cb 0.56 -1.40 0.27 0.00 0.53 0.00 0.00 43.42 43.37 1tkd n LEU 211 CO 0.52 -0.96 0.90 -0.08 -1.11 0.00 0.00 177.39 176.67 1tkd h GLU 212 N 2.14 0.15 -1.19 1.96 4.81 -1.89 -0.47 114.58 120.10 1tkd h GLU 212 Ca -0.44 -0.01 0.35 0.00 -0.13 0.00 0.00 59.36 59.13 1tkd h GLU 212 Cb 1.31 -0.03 -0.11 0.00 0.63 0.00 0.00 28.75 30.55 1tkd h GLU 212 CO 0.61 0.10 0.77 0.00 -0.73 0.00 0.00 179.01 179.76 1tkd h ALA 213 N 1.79 2.53 -0.44 2.92 0.00 -1.83 0.24 119.26 124.47 1tkd h ALA 213 Ca 0.53 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.44 1tkd h ALA 213 Cb 1.06 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1tkd h ALA 213 CO -0.69 -1.04 -0.08 0.28 0.00 0.00 0.00 179.25 177.72 1tkd h VAL 214 N 0.22 1.25 -0.12 0.00 2.07 -1.41 -0.82 116.25 117.44 1tkd h VAL 214 Ca 0.70 -1.12 -0.22 0.00 0.82 0.00 0.00 66.70 66.88 1tkd h VAL 214 Cb 2.06 1.00 0.01 0.00 -1.52 0.00 0.00 31.29 32.85 1tkd h VAL 214 CO -0.34 0.38 -0.80 -0.78 0.02 0.00 0.00 177.57 176.05 1tkd h ASP 215 N 0.70 0.91 -0.40 0.57 3.58 -0.66 -3.04 116.42 118.08 1tkd h ASP 215 Ca 0.12 -0.65 -0.04 0.00 0.42 0.00 0.00 57.03 56.88 1tkd h ASP 215 Cb 0.55 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.31 1tkd h ASP 215 CO 0.03 1.42 0.10 0.40 -2.88 0.00 0.00 179.24 178.31 1tkd h ILE 216 N 0.46 1.23 -0.36 2.25 2.04 -1.21 -2.07 117.51 119.85 1tkd h ILE 216 Ca -0.07 -0.79 -0.00 0.00 1.00 0.00 0.00 64.86 65.00 1tkd h ILE 216 Cb 1.44 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 1tkd h ILE 216 CO 0.16 0.27 0.22 -0.33 0.00 0.00 0.00 178.15 178.47 1tkd h GLU 217 N 0.50 0.49 -0.35 2.37 4.39 -1.21 0.28 114.58 121.05 1tkd h GLU 217 Ca 0.13 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.70 1tkd h GLU 217 Cb 0.31 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 1tkd h GLU 217 CO 0.00 0.37 -0.10 0.45 -1.16 0.00 0.00 179.01 178.57 1tkd h HIS 218 N 0.47 0.65 -0.16 4.33 3.86 -1.49 -0.16 115.15 122.65 1tkd h HIS 218 Ca 0.13 -0.10 -0.16 0.00 -1.16 0.00 0.00 60.37 59.07 1tkd h HIS 218 Cb 0.00 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.29 1tkd h HIS 218 CO -0.04 0.69 -0.57 0.00 0.86 0.00 0.00 177.93 178.87 1tkd h ARG 219 N 0.56 0.51 -0.23 2.45 3.08 -1.08 -1.77 114.38 117.89 1tkd h ARG 219 Ca 0.10 -0.33 -0.03 0.00 0.07 0.00 0.00 59.98 59.80 1tkd h ARG 219 Cb 0.51 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1tkd h ARG 219 CO 0.03 0.94 0.04 0.00 -1.07 0.00 0.00 179.97 179.91 1tkd h ALA 220 N 0.99 0.31 -0.61 0.04 0.00 -0.52 -1.62 119.26 117.86 1tkd h ALA 220 Ca 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1tkd h ALA 220 Cb 1.11 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1tkd h ALA 220 CO 0.10 -0.02 0.27 0.00 0.00 0.00 0.00 179.25 179.60 1tkd h ALA 221 N 0.86 0.78 -0.60 0.00 0.00 -0.99 0.66 119.26 119.96 1tkd h ALA 221 Ca 0.07 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1tkd h ALA 221 Cb 0.31 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1tkd h ALA 221 CO 0.00 0.37 0.23 2.35 0.00 0.00 0.00 179.25 182.20 1tkd h TRP 222 N 0.83 0.93 -0.22 0.00 2.91 -1.25 -0.19 115.95 118.96 1tkd h TRP 222 Ca 0.21 -0.08 -0.06 0.00 1.13 0.00 0.00 58.89 60.09 1tkd h TRP 222 Cb 0.15 -0.28 -0.01 0.00 -0.51 0.00 0.00 29.16 28.52 1tkd h TRP 222 CO 0.00 0.75 -0.11 1.25 -1.03 0.00 0.00 178.44 179.30 1tkd h LEU 223 N 0.84 0.48 -1.22 0.65 5.85 -1.05 -3.02 115.31 117.84 1tkd h LEU 223 Ca 0.20 -0.41 -0.08 0.00 0.84 0.00 0.00 57.88 58.43 1tkd h LEU 223 Cb 0.22 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1tkd h LEU 223 CO -0.01 0.79 -0.38 -0.07 -0.34 0.00 0.00 178.44 178.42 1tkd h LEU 224 N 0.18 0.00 -0.25 2.25 3.38 -0.77 -1.78 115.31 118.32 1tkd h LEU 224 Ca 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1tkd h LEU 224 Cb 0.61 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1tkd h LEU 224 CO 0.03 0.38 0.13 0.00 0.09 0.00 0.00 178.44 179.08 1tkd h ALA 225 N 1.62 0.32 -0.88 1.53 0.00 -1.00 -1.38 119.26 119.47 1tkd h ALA 225 Ca -0.00 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.92 1tkd h ALA 225 Cb 0.71 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.33 1tkd h ALA 225 CO 0.05 -0.15 0.53 -0.22 0.00 0.00 0.00 179.25 179.46 1tkd h LYS 226 N 0.29 0.89 -0.79 0.00 1.63 -1.30 -1.13 116.57 116.16 1tkd h LYS 226 Ca 0.09 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.81 1tkd h LYS 226 Cb 0.07 -0.20 -0.04 0.00 -0.60 0.00 0.00 32.23 31.47 1tkd h LYS 226 CO -0.01 0.59 0.40 0.37 -3.45 0.00 0.00 179.45 177.34 1tkd h GLN 227 N 0.91 1.12 -0.43 1.90 4.15 -0.81 0.31 115.11 122.28 1tkd h GLN 227 Ca 0.41 -0.15 -0.01 0.00 0.77 0.00 0.00 58.65 59.67 1tkd h GLN 227 Cb 0.30 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 1tkd h GLN 227 CO -0.22 0.86 0.24 0.93 -1.93 0.00 0.00 178.83 178.71 1tkd h GLU 228 N 1.11 0.59 -0.79 1.69 5.08 -0.17 -0.40 114.58 121.68 1tkd h GLU 228 Ca 0.27 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.56 1tkd h GLU 228 Cb 0.09 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1tkd h GLU 228 CO -0.04 0.46 0.44 0.00 -1.00 0.00 0.00 179.01 178.87 1tkd h ARG 229 N 0.56 1.09 -0.17 2.33 3.08 -0.71 -2.64 114.38 117.92 1tkd h ARG 229 Ca 0.15 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 1tkd h ARG 229 Cb 0.03 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 1tkd h ARG 229 CO -0.03 0.79 0.08 -0.91 -1.07 0.00 0.00 179.97 178.84 1tkd h ASN 230 N 1.10 0.22 -3.96 7.04 2.35 -0.29 -3.49 115.58 118.55 1tkd h ASN 230 Ca 0.28 -0.12 0.03 0.00 -0.55 0.00 0.00 56.30 55.94 1tkd h ASN 230 Cb 0.01 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 1tkd h ASN 230 CO -0.05 0.28 -0.07 0.61 -1.65 0.00 0.00 177.43 176.55 1tkd n GLY 231 N -0.82 -1.95 3.22 2.83 0.00 -0.22 -4.86 105.19 103.38 1tkd n GLY 231 Ca -0.04 -1.47 -0.35 0.00 0.00 0.00 0.00 46.02 44.16 1tkd n GLY 231 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1tkd s PHE 232 N -2.04 3.11 -0.16 1.61 2.19 -0.11 -4.63 117.98 117.96 1tkd s PHE 232 Ca 0.00 -1.53 -0.38 0.00 0.33 0.00 0.00 56.93 55.35 1tkd s PHE 232 Cb 0.00 -2.09 -0.15 0.00 -1.31 0.00 0.00 43.02 39.47 1tkd s PHE 232 CO 0.00 -0.72 1.71 -2.30 1.83 0.00 0.00 175.22 175.74 1tkd n PRO 233 N 4.69 1.43 -5.20 10.12 -0.02 -1.26 -1.53 135.00 143.23 1tkd n PRO 233 Ca -0.16 0.52 -0.31 0.00 -2.02 0.00 0.00 63.50 61.54 1tkd n PRO 233 Cb 0.46 -2.24 -0.17 0.00 -0.02 0.00 0.00 33.50 31.54 1tkd n PRO 233 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1tkd s PHE 234 N 3.06 2.40 -1.26 6.00 5.36 -0.75 -1.55 117.98 131.24 1tkd s PHE 234 Ca 0.94 -0.82 -0.16 0.00 -0.96 0.00 0.00 56.93 55.94 1tkd s PHE 234 Cb -0.95 -1.59 0.12 0.00 -0.34 0.00 0.00 43.02 40.26 1tkd s PHE 234 CO 0.58 -0.29 1.62 -3.47 -1.46 0.00 0.00 175.22 172.21 1tkd n ASP 235 N 3.19 5.05 -0.23 6.13 -0.08 0.90 -4.76 116.55 126.74 1tkd n ASP 235 Ca -0.18 -2.95 0.04 0.00 -1.51 0.00 0.00 54.79 50.19 1tkd n ASP 235 Cb 0.52 -1.66 0.15 0.00 2.34 0.00 0.00 41.12 42.47 1tkd n ASP 235 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1tkd h THR 236 N 5.09 0.57 -0.52 5.18 2.02 -1.92 -2.23 112.91 121.10 1tkd h THR 236 Ca 0.39 -0.10 0.02 0.00 0.77 0.00 0.00 66.41 67.50 1tkd h THR 236 Cb 0.86 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 1tkd h THR 236 CO 1.38 0.05 0.32 0.50 0.37 0.00 0.00 175.52 178.13 1tkd h LYS 237 N 0.28 0.61 -0.12 6.66 3.11 -2.00 -1.40 116.57 123.71 1tkd h LYS 237 Ca 0.38 -0.04 -0.07 0.00 -2.81 0.00 0.00 60.65 58.11 1tkd h LYS 237 Cb 0.61 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.69 1tkd h LYS 237 CO -0.46 0.40 -0.25 0.00 -2.81 0.00 0.00 179.45 176.33 1tkd h ALA 238 N 1.23 1.35 0.04 5.00 0.00 -1.83 -2.27 119.26 122.78 1tkd h ALA 238 Ca 0.21 -0.29 -0.22 0.00 0.00 0.00 0.00 54.91 54.60 1tkd h ALA 238 Cb 0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1tkd h ALA 238 CO -0.09 0.45 -1.04 0.82 0.00 0.00 0.00 179.25 179.39 1tkd h ILE 239 N 0.19 1.61 -0.25 0.00 1.08 -1.03 -2.21 117.51 116.90 1tkd h ILE 239 Ca 0.03 -3.16 -0.12 0.00 -0.39 0.00 0.00 64.86 61.23 1tkd h ILE 239 Cb 0.56 2.80 -0.01 0.00 -3.07 0.00 0.00 36.82 37.10 1tkd h ILE 239 CO 0.04 0.91 -0.33 -0.33 -0.69 0.00 0.00 178.15 177.75 1tkd h GLU 240 N 0.04 0.53 -0.26 2.37 5.08 -1.09 0.94 114.58 122.19 1tkd h GLU 240 Ca -0.05 -0.24 -0.14 0.00 -1.00 0.00 0.00 59.36 57.93 1tkd h GLU 240 Cb 1.77 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.00 1tkd h GLU 240 CO 0.15 0.80 -0.40 0.93 -1.00 0.00 0.00 179.01 179.49 1tkd h GLU 241 N 0.46 0.61 -0.34 2.33 5.08 -1.39 -1.79 114.58 119.53 1tkd h GLU 241 Ca 0.05 -0.31 -0.09 0.00 -1.00 0.00 0.00 59.36 58.01 1tkd h GLU 241 Cb 0.80 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 1tkd h GLU 241 CO 0.07 0.90 -0.17 1.25 -1.00 0.00 0.00 179.01 180.06 1tkd h LEU 242 N 0.50 0.61 -0.66 1.33 5.85 -0.93 -1.93 115.31 120.08 1tkd h LEU 242 Ca 0.04 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.52 1tkd h LEU 242 Cb 0.92 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 1tkd h LEU 242 CO 0.08 0.80 0.21 0.22 -0.34 0.00 0.00 178.44 179.41 1tkd h TYR 243 N 0.56 1.07 0.07 1.25 3.20 -0.42 0.08 116.97 122.78 1tkd h TYR 243 Ca 0.09 -0.11 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 1tkd h TYR 243 Cb 0.61 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.57 1tkd h TYR 243 CO 0.03 0.86 -0.03 0.28 -1.64 0.00 0.00 178.16 177.65 1tkd h VAL 244 N 0.97 1.00 -0.43 1.81 2.07 -1.02 0.23 116.25 120.87 1tkd h VAL 244 Ca 0.21 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1tkd h VAL 244 Cb 0.30 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1tkd h VAL 244 CO -0.01 0.06 0.23 -0.08 0.02 0.00 0.00 177.57 177.79 1tkd h GLU 245 N -0.20 0.45 -0.46 1.57 4.81 -1.19 -0.86 114.58 118.70 1tkd h GLU 245 Ca -0.01 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1tkd h GLU 245 Cb 0.17 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1tkd h GLU 245 CO 0.02 0.30 0.12 -0.07 -0.73 0.00 0.00 179.01 178.64 1tkd h LEU 246 N 0.46 0.70 -1.09 1.64 3.38 -0.81 -1.81 115.31 117.77 1tkd h LEU 246 Ca 0.18 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1tkd h LEU 246 Cb 0.07 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1tkd h LEU 246 CO -0.11 0.74 0.58 0.00 0.09 0.00 0.00 178.44 179.74 1tkd h ALA 247 N 0.98 1.33 -0.35 1.53 0.00 -0.20 0.87 119.26 123.43 1tkd h ALA 247 Ca 0.15 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1tkd h ALA 247 Cb 0.31 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1tkd h ALA 247 CO -0.00 0.61 0.02 0.00 0.00 0.00 0.00 179.25 179.87 1tkd h ALA 248 N 1.42 0.47 -0.45 0.00 0.00 -0.94 -0.76 119.26 118.99 1tkd h ALA 248 Ca 0.33 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1tkd h ALA 248 Cb -0.12 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1tkd h ALA 248 CO -0.07 0.21 0.03 -0.09 0.00 0.00 0.00 179.25 179.33 1tkd h ARG 249 N 0.42 0.73 -0.30 0.00 9.65 -0.82 -1.59 114.38 122.47 1tkd h ARG 249 Ca 0.10 -0.17 -0.05 0.00 -1.10 0.00 0.00 59.98 58.75 1tkd h ARG 249 Cb 0.43 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.90 1tkd h ARG 249 CO 0.01 0.72 -0.01 -0.09 2.80 0.00 0.00 179.97 183.41 1tkd h ARG 250 N 0.69 0.54 -0.44 0.20 2.43 -0.59 -1.88 114.38 115.33 1tkd h ARG 250 Ca 0.14 -0.18 0.05 0.00 -0.81 0.00 0.00 59.98 59.18 1tkd h ARG 250 Cb 0.39 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 1tkd h ARG 250 CO 0.01 0.69 0.19 0.77 -1.51 0.00 0.00 179.97 180.13 1tkd h SER 251 N 0.34 0.24 -0.74 -3.80 0.02 -0.75 0.31 113.55 109.17 1tkd h SER 251 Ca 0.08 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1tkd h SER 251 Cb 0.46 -0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.96 1tkd h SER 251 CO 0.02 0.18 0.30 -0.08 -1.14 0.00 0.00 176.83 176.11 1tkd h GLU 252 N 0.38 1.10 -0.55 3.45 4.57 -1.22 0.37 114.58 122.69 1tkd h GLU 252 Ca 0.20 -0.20 -0.08 0.00 -1.18 0.00 0.00 59.36 58.11 1tkd h GLU 252 Cb 0.15 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.54 1tkd h GLU 252 CO -0.17 0.90 0.05 -0.07 -1.18 0.00 0.00 179.01 178.54 1tkd h LEU 253 N 1.06 0.91 -0.45 1.64 3.38 -0.83 -1.23 115.31 119.79 1tkd h LEU 253 Ca 0.25 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1tkd h LEU 253 Cb 0.20 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1tkd h LEU 253 CO -0.02 0.96 0.25 0.25 0.09 0.00 0.00 178.44 179.97 1tkd h LEU 254 N 0.82 0.57 0.03 1.67 5.85 -0.58 0.17 115.31 123.84 1tkd h LEU 254 Ca 0.16 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.82 1tkd h LEU 254 Cb 0.47 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 1tkd h LEU 254 CO 0.02 0.49 -0.19 -0.09 -0.34 0.00 0.00 178.44 178.33 1tkd h ARG 255 N 0.59 -0.32 -0.17 1.25 2.43 -0.64 0.25 114.38 117.78 1tkd h ARG 255 Ca 0.16 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1tkd h ARG 255 Cb 0.05 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1tkd h ARG 255 CO -0.03 -0.21 0.05 0.87 -1.51 0.00 0.00 179.97 179.14 1tkd h LYS 256 N -0.33 0.26 -0.87 0.20 1.57 -1.05 -2.48 116.57 113.88 1tkd h LYS 256 Ca 0.05 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1tkd h LYS 256 Cb 0.39 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.62 1tkd h LYS 256 CO -0.16 0.39 0.55 -0.07 -0.57 0.00 0.00 179.45 179.59 1tkd h LEU 257 N 0.09 1.02 -0.74 2.94 3.38 -0.45 -1.20 115.31 120.34 1tkd h LEU 257 Ca 0.05 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1tkd h LEU 257 Cb 0.24 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1tkd h LEU 257 CO -0.00 0.76 0.00 0.71 0.09 0.00 0.00 178.44 180.00 1tkd h THR 258 N 1.18 0.00 0.13 0.22 1.35 -0.43 0.27 112.91 115.64 1tkd h THR 258 Ca 0.31 -0.33 -0.30 0.00 -0.55 0.00 0.00 66.41 65.54 1tkd h THR 258 Cb -0.09 1.15 -0.00 0.00 -1.73 0.00 0.00 68.15 67.48 1tkd h THR 258 CO -0.06 0.00 -1.49 -0.08 -0.25 0.00 0.00 175.52 173.64 1tkd h GLU 259 N 0.00 0.28 0.00 4.72 4.22 -0.78 -3.35 114.58 119.67 1tkd h GLU 259 Ca 0.00 -0.48 -0.16 0.00 0.08 0.00 0.00 59.36 58.80 1tkd h GLU 259 Cb 0.45 0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.89 1tkd h GLU 259 CO 0.00 1.17 -0.61 1.15 -2.18 0.00 0.00 179.01 178.54 1tkd h THR 260 N 0.08 1.43 -3.65 0.32 2.02 -0.71 -3.42 112.91 108.97 1tkd h THR 260 Ca -0.23 -2.09 -0.70 0.00 0.77 0.00 0.00 66.41 64.16 1tkd h THR 260 Cb 2.02 2.61 -0.29 0.00 -1.74 0.00 0.00 68.15 70.75 1tkd h THR 260 CO 0.18 0.61 -0.59 -0.36 0.37 0.00 0.00 175.52 175.72 1tkd s PHE 261 N -3.19 3.28 0.81 3.16 0.08 0.91 -5.05 117.98 117.99 1tkd s PHE 261 Ca -0.13 -1.49 -0.11 0.00 0.12 0.00 0.00 56.93 55.32 1tkd s PHE 261 Cb 0.03 -2.37 0.08 0.00 -0.57 0.00 0.00 43.02 40.19 1tkd s PHE 261 CO 0.82 -0.75 1.09 0.20 -0.10 0.00 0.00 175.22 176.48 1tkd s GLY 262 N 1.48 1.63 0.78 4.36 0.00 -1.26 -4.45 107.32 109.86 1tkd s GLY 262 Ca -0.01 -0.06 -0.12 0.00 0.00 0.00 0.00 44.72 44.53 1tkd s GLY 262 CO 0.02 0.36 1.11 -1.35 0.00 0.00 0.00 173.10 173.25 1tkd s SER 263 N -3.67 4.73 0.26 1.64 1.04 -1.26 -4.57 113.70 111.88 1tkd s SER 263 Ca 0.61 1.14 -0.13 0.00 0.48 0.00 0.00 55.95 58.06 1tkd s SER 263 Cb -0.16 -1.85 0.00 0.00 0.10 0.00 0.00 66.02 64.11 1tkd s SER 263 CO 0.55 -1.80 0.51 -1.66 0.98 0.00 0.00 173.24 171.83 1tkd s TRP 264 N -3.29 0.36 -0.02 5.02 -2.14 -0.27 -4.99 118.94 113.61 1tkd s TRP 264 Ca 0.60 -0.74 0.00 0.00 2.66 0.00 0.00 56.10 58.63 1tkd s TRP 264 Cb -0.13 0.24 -0.04 0.00 -3.10 0.00 0.00 33.47 30.45 1tkd s TRP 264 CO 0.53 -1.05 0.02 0.71 -2.66 0.00 0.00 176.95 174.50 1tkd s TYR 265 N -3.86 3.15 0.05 1.66 1.51 -1.26 0.33 117.35 118.94 1tkd s TYR 265 Ca 0.22 0.14 0.04 0.00 -1.01 0.00 0.00 57.07 56.46 1tkd s TYR 265 Cb -0.01 -1.72 -0.02 0.00 -0.11 0.00 0.00 41.96 40.10 1tkd s TYR 265 CO 0.10 0.49 -0.12 -0.65 -1.11 0.00 0.00 175.55 174.26 1tkd s GLN 266 N -1.45 0.75 0.37 -0.62 -0.21 -0.38 -4.93 119.66 113.20 1tkd s GLN 266 Ca 0.19 -0.82 -0.26 0.00 0.02 0.00 0.00 55.36 54.48 1tkd s GLN 266 Cb -0.12 -0.70 -0.09 0.00 1.00 0.00 0.00 33.01 33.10 1tkd s GLN 266 CO 0.09 0.16 1.17 -1.25 -2.12 0.00 0.00 175.29 173.34 1tkd s PRO 267 N -1.48 4.19 -0.29 2.91 0.04 -1.26 0.43 135.00 139.54 1tkd s PRO 267 Ca -0.03 1.87 -0.15 0.00 0.04 0.00 0.00 61.00 62.74 1tkd s PRO 267 Cb -0.09 -2.80 0.13 0.00 0.04 0.00 0.00 34.50 31.78 1tkd s PRO 267 CO 0.01 -0.21 0.85 0.21 0.04 0.00 0.00 177.00 177.90 1tkd s LYS 268 N -2.11 0.48 0.00 4.56 2.47 0.70 -4.77 119.74 121.08 1tkd s LYS 268 Ca 0.54 0.95 0.00 0.00 -1.56 0.00 0.00 55.97 55.90 1tkd s LYS 268 Cb -0.32 0.29 0.00 0.00 -1.46 0.00 0.00 37.83 36.34 1tkd s LYS 268 CO 0.40 -0.12 0.00 0.41 0.16 0.00 0.00 175.35 176.20 1tkd n GLY 269 N 4.39 0.52 3.76 5.54 0.00 -1.26 -3.99 105.19 114.15 1tkd n GLY 269 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1tkd n GLY 269 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1tkd s GLY 270 N -1.27 2.70 -0.07 -0.02 0.00 -1.26 -4.94 107.32 102.46 1tkd s GLY 270 Ca 0.00 1.26 -0.02 0.00 0.00 0.00 0.00 44.72 45.96 1tkd s GLY 270 CO 0.00 2.05 -0.08 -1.30 0.00 0.00 0.00 173.10 173.78 1tkd n THR 271 N 1.58 0.38 -1.84 0.90 -2.24 -0.95 -4.79 114.28 107.33 1tkd n THR 271 Ca 0.03 -0.12 -0.31 0.00 -2.27 0.00 0.00 64.05 61.39 1tkd n THR 271 Cb 0.41 -1.24 0.03 0.00 -2.10 0.00 0.00 70.33 67.44 1tkd n THR 271 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1tkd s GLU 272 N -2.13 3.15 -0.03 -0.78 2.02 -0.85 -4.88 118.70 115.21 1tkd s GLU 272 Ca -0.09 0.63 -0.15 0.00 0.02 0.00 0.00 54.97 55.38 1tkd s GLU 272 Cb 0.03 -2.04 -0.05 0.00 0.10 0.00 0.00 34.13 32.17 1tkd s GLU 272 CO 0.13 -0.86 0.41 1.41 0.02 0.00 0.00 175.26 176.37 1tkd s MET 273 N -5.25 4.03 -0.04 1.61 -2.45 -1.26 -1.78 119.30 114.16 1tkd s MET 273 Ca 0.57 0.40 -0.27 0.00 -1.25 0.00 0.00 55.69 55.14 1tkd s MET 273 Cb -0.11 -3.28 -0.03 0.00 1.25 0.00 0.00 34.83 32.65 1tkd s MET 273 CO 0.53 0.55 0.85 0.12 1.05 0.00 0.00 175.02 178.12 1tkd s PHE 274 N -0.62 3.61 0.12 4.11 5.36 -1.26 -4.84 117.98 124.45 1tkd s PHE 274 Ca 0.24 1.47 0.10 0.00 -0.96 0.00 0.00 56.93 57.78 1tkd s PHE 274 Cb -0.16 -2.97 -0.04 0.00 -0.34 0.00 0.00 43.02 39.51 1tkd s PHE 274 CO 0.12 0.02 -0.25 0.00 -1.46 0.00 0.00 175.22 173.65 1tkd s HIS 276 N -1.07 2.28 0.54 0.00 2.46 0.30 -4.83 115.29 114.96 1tkd s HIS 276 Ca 0.12 0.03 0.32 0.00 0.47 0.00 0.00 55.06 56.01 1tkd s HIS 276 Cb -0.10 -4.18 1.84 0.00 -0.13 0.00 0.00 32.58 30.01 1tkd s HIS 276 CO 0.05 -4.80 2.22 -1.35 -2.47 0.00 0.00 174.74 168.40 1tkd h PRO 277 N 8.27 0.00 0.00 2.88 0.11 -1.95 0.82 132.00 142.13 1tkd h PRO 277 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1tkd h PRO 277 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1tkd h PRO 277 CO 0.95 0.03 -0.47 -2.13 -0.21 0.00 0.00 178.00 176.18 1tkd n ARG 278 N -3.60 0.30 0.10 1.05 0.63 -1.26 -4.62 116.66 109.25 1tkd n ARG 278 Ca -0.03 0.27 -0.03 0.00 -0.92 0.00 0.00 57.85 57.14 1tkd n ARG 278 Cb 0.13 -1.20 0.18 0.00 0.45 0.00 0.00 32.46 32.02 1tkd n ARG 278 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 1tkd h THR 279 N -0.62 1.35 0.00 5.15 2.02 -1.97 -3.46 112.91 115.38 1tkd h THR 279 Ca 0.00 -1.76 0.00 0.00 0.77 0.00 0.00 66.41 65.42 1tkd h THR 279 Cb 0.47 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 1tkd h THR 279 CO 0.00 0.52 0.00 0.61 0.37 0.00 0.00 175.52 177.02 1tkd n GLY 280 N 0.04 0.90 3.72 2.16 0.00 0.28 -4.95 105.19 107.34 1tkd n GLY 280 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1tkd n GLY 280 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1tkd s LYS 281 N -0.14 4.21 0.32 1.61 2.20 -1.26 -4.44 119.74 122.26 1tkd s LYS 281 Ca 0.00 2.37 -0.29 0.00 -0.36 0.00 0.00 55.97 57.69 1tkd s LYS 281 Cb 0.00 -3.18 -0.10 0.00 -1.51 0.00 0.00 37.83 33.03 1tkd s LYS 281 CO 0.00 -0.62 1.27 -2.14 -0.36 0.00 0.00 175.35 173.50 1tkd s PRO 282 N 1.25 4.39 -0.65 4.03 0.02 -1.26 -0.54 135.00 142.24 1tkd s PRO 282 Ca 0.70 2.15 0.06 0.00 0.02 0.00 0.00 61.00 63.93 1tkd s PRO 282 Cb -0.44 -3.08 0.25 0.00 0.02 0.00 0.00 34.50 31.26 1tkd s PRO 282 CO 0.31 -0.13 0.77 1.28 -0.33 0.00 0.00 177.00 178.91 1tkd n LEU 283 N 0.85 3.87 -0.54 -5.54 4.77 0.66 -4.90 117.00 116.17 1tkd n LEU 283 Ca -0.00 -5.45 0.44 0.00 -0.03 0.00 0.00 56.01 50.97 1tkd n LEU 283 Cb 0.42 -0.68 0.76 0.00 -2.33 0.00 0.00 43.42 41.60 1tkd n LEU 283 CO 0.58 2.06 1.39 -0.65 -1.33 0.00 0.00 177.39 179.45 1tkd h PRO 284 N 4.15 0.03 0.00 3.23 0.11 -1.94 0.34 132.00 137.92 1tkd h PRO 284 Ca 0.20 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.31 1tkd h PRO 284 Cb 0.65 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.76 1tkd h PRO 284 CO 0.85 0.02 -0.00 0.87 -0.21 0.00 0.00 178.00 179.53 1tkd h LYS 285 N 0.03 0.00 -6.89 1.05 1.79 -1.95 -3.44 116.57 107.16 1tkd h LYS 285 Ca 0.80 0.00 -0.47 0.00 -2.18 0.00 0.00 60.65 58.80 1tkd h LYS 285 Cb 3.06 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 33.69 1tkd h LYS 285 CO -0.09 0.00 0.27 0.71 -1.08 0.00 0.00 179.45 179.26 1tkd s TYR 286 N -3.45 3.47 0.51 -1.35 2.02 0.12 -5.00 117.35 113.67 1tkd s TYR 286 Ca 0.04 1.56 -0.21 0.00 -0.37 0.00 0.00 57.07 58.09 1tkd s TYR 286 Cb 0.07 -2.78 -0.08 0.00 -0.40 0.00 0.00 41.96 38.77 1tkd s TYR 286 CO 0.60 0.07 1.01 -2.30 -1.57 0.00 0.00 175.55 173.36 1tkd n PRO 287 N -0.08 1.19 -1.86 -1.71 -0.02 -1.26 -4.77 135.00 126.47 1tkd n PRO 287 Ca 0.04 0.44 -0.36 0.00 -2.02 0.00 0.00 63.50 61.59 1tkd n PRO 287 Cb 0.52 -2.14 0.05 0.00 -0.02 0.00 0.00 33.50 31.92 1tkd n PRO 287 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1tkd s ARG 288 N -2.40 2.75 0.28 -0.52 1.81 -1.26 -4.52 118.95 115.09 1tkd s ARG 288 Ca 0.69 1.91 0.01 0.00 -1.72 0.00 0.00 55.73 56.61 1tkd s ARG 288 Cb -0.48 -1.89 -0.00 0.00 -0.45 0.00 0.00 34.95 32.13 1tkd s ARG 288 CO 0.52 -1.40 0.02 0.44 -0.68 0.00 0.00 175.30 174.20 1tkd n ILE 289 N -1.81 0.00 -3.70 1.52 -5.35 -0.74 -4.50 119.36 104.79 1tkd n ILE 289 Ca 0.14 -1.39 -0.18 0.00 -0.27 0.00 0.00 62.75 61.06 1tkd n ILE 289 Cb 0.49 0.34 -0.17 0.00 -1.74 0.00 0.00 39.64 38.56 1tkd n ILE 289 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1tkd s LYS 290 N -3.02 -0.04 -0.43 6.28 2.36 -0.17 -2.00 119.74 122.72 1tkd s LYS 290 Ca 0.03 0.37 -0.06 0.00 -2.55 0.00 0.00 55.97 53.76 1tkd s LYS 290 Cb 0.00 -0.39 0.11 0.00 -1.05 0.00 0.00 37.83 36.50 1tkd s LYS 290 CO 0.02 -0.28 0.26 0.99 1.55 0.00 0.00 175.35 177.89 1tkd s THR 291 N 1.90 3.78 0.40 3.43 2.01 -1.26 -1.91 115.64 123.98 1tkd s THR 291 Ca 0.01 -1.82 -0.27 0.00 0.31 0.00 0.00 61.69 59.92 1tkd s THR 291 Cb -0.12 -3.48 -0.10 0.00 0.01 0.00 0.00 72.50 68.80 1tkd s THR 291 CO -0.04 -0.67 1.48 -2.16 -0.69 0.00 0.00 174.62 172.54 1tkd s PRO 292 N 1.28 3.97 0.00 4.92 0.04 -1.26 -4.79 135.00 139.15 1tkd s PRO 292 Ca 0.06 2.54 0.22 0.00 0.04 0.00 0.00 61.00 63.86 1tkd s PRO 292 Cb -0.24 -2.87 -0.09 0.00 0.04 0.00 0.00 34.50 31.34 1tkd s PRO 292 CO -0.02 -0.64 1.01 1.63 0.04 0.00 0.00 177.00 179.02 1tkd n LYS 293 N 0.24 0.32 -4.29 4.56 5.02 -1.26 -1.59 118.16 121.16 1tkd n LYS 293 Ca 0.02 -0.26 -0.18 0.00 -2.02 0.00 0.00 58.31 55.87 1tkd n LYS 293 Cb 0.40 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.81 1tkd n LYS 293 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1tkd s VAL 294 N -2.86 1.54 0.00 -0.18 1.01 -1.26 -4.80 120.40 113.86 1tkd s VAL 294 Ca 0.11 -1.96 0.00 0.00 0.00 0.00 0.00 61.98 60.14 1tkd s VAL 294 Cb 0.17 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.75 1tkd s VAL 294 CO 0.77 -0.49 0.00 0.61 0.00 0.00 0.00 175.10 175.99 1tkd n GLY 295 N 0.11 2.30 0.76 4.51 0.00 -1.26 -3.66 105.19 107.95 1tkd n GLY 295 Ca -0.12 -1.54 -0.04 0.00 0.00 0.00 0.00 46.02 44.32 1tkd n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tkd n GLY 296 N 1.82 3.36 0.22 -0.02 0.00 -1.25 0.26 105.19 109.57 1tkd n GLY 296 Ca 0.00 -1.58 -0.15 0.00 0.00 0.00 0.00 46.02 44.29 1tkd n GLY 296 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1tkd h ILE 297 N 1.24 1.30 -0.94 -0.61 5.03 -1.90 -3.42 117.51 118.21 1tkd h ILE 297 Ca -0.06 -1.71 -0.61 0.00 -0.12 0.00 0.00 64.86 62.36 1tkd h ILE 297 Cb 0.28 1.78 -0.09 0.00 -3.03 0.00 0.00 36.82 35.76 1tkd h ILE 297 CO 0.08 0.54 -0.45 -0.36 -0.68 0.00 0.00 178.15 177.29 1tkd s PHE 298 N -4.04 2.10 0.63 1.37 0.40 -1.26 -1.31 117.98 115.87 1tkd s PHE 298 Ca -0.12 -0.77 0.04 0.00 -0.60 0.00 0.00 56.93 55.48 1tkd s PHE 298 Cb 0.09 -1.84 0.10 0.00 0.51 0.00 0.00 43.02 41.87 1tkd s PHE 298 CO 0.86 0.01 0.87 0.15 0.70 0.00 0.00 175.22 177.82 1tkd s LYS 299 N -4.00 2.05 0.31 0.44 1.02 0.16 -4.41 119.74 115.30 1tkd s LYS 299 Ca 0.29 -1.31 -0.28 0.00 0.02 0.00 0.00 55.97 54.68 1tkd s LYS 299 Cb 0.02 -2.49 -0.09 0.00 -0.52 0.00 0.00 37.83 34.74 1tkd s LYS 299 CO 0.16 -1.10 1.09 -1.59 -0.92 0.00 0.00 175.35 173.00 1tkd s LYS 300 N -4.88 4.52 0.19 1.68 -2.85 -1.26 -4.76 119.74 112.38 1tkd s LYS 300 Ca 0.63 1.75 -0.31 0.00 -1.00 0.00 0.00 55.97 57.04 1tkd s LYS 300 Cb -0.06 -3.04 -0.10 0.00 -2.06 0.00 0.00 37.83 32.57 1tkd s LYS 300 CO 0.41 0.12 1.54 -1.25 0.10 0.00 0.00 175.35 176.27 1tkd s PRO 301 N -1.69 4.22 -0.21 1.78 0.04 -1.26 -4.87 135.00 133.01 1tkd s PRO 301 Ca 0.48 2.36 0.15 0.00 0.04 0.00 0.00 61.00 64.03 1tkd s PRO 301 Cb -0.30 -3.13 0.67 0.00 0.04 0.00 0.00 34.50 31.77 1tkd s PRO 301 CO 0.38 -0.56 1.58 1.63 0.04 0.00 0.00 177.00 180.07 1tkd n LYS 302 N 3.46 3.85 -3.97 4.56 5.02 -1.26 -4.79 118.16 125.03 1tkd n LYS 302 Ca 0.12 -3.00 0.03 0.00 -2.02 0.00 0.00 58.31 53.44 1tkd n LYS 302 Cb 0.39 -2.04 0.01 0.00 -0.02 0.00 0.00 35.03 33.36 1tkd n LYS 302 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1tkd s ASN 303 N -1.41 0.00 0.26 4.39 4.22 -1.26 -5.06 114.94 116.08 1tkd s ASN 303 Ca 0.48 -0.12 -0.29 0.00 -2.14 0.00 0.00 52.86 50.79 1tkd s ASN 303 Cb 0.38 0.09 -0.09 0.00 1.28 0.00 0.00 41.25 42.90 1tkd s ASN 303 CO 0.12 -0.18 1.19 -1.59 -2.04 0.00 0.00 177.10 174.60 1tkd s LYS 304 N -2.03 4.52 -0.36 3.55 0.00 -1.26 -1.38 119.74 122.78 1tkd s LYS 304 Ca 0.29 1.93 -0.05 0.00 0.00 0.00 0.00 55.97 58.15 1tkd s LYS 304 Cb 0.00 -3.18 0.01 0.00 0.00 0.00 0.00 37.83 34.66 1tkd s LYS 304 CO -0.02 0.01 0.40 0.00 0.00 0.00 0.00 175.35 175.74 1tkd n ALA 305 N 1.54 -2.55 0.00 0.59 0.00 -1.26 -4.74 120.51 114.09 1tkd n ALA 305 Ca 0.01 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1tkd n ALA 305 Cb 0.44 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.28 1tkd n ALA 305 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1tkd n GLN 306 N -0.94 0.00 0.01 0.00 6.02 -1.22 -2.93 117.38 118.31 1tkd n GLN 306 Ca 0.04 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.15 1tkd n GLN 306 Cb 0.39 0.00 0.39 0.00 1.02 0.00 0.00 30.24 32.04 1tkd n GLN 306 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1tkd n ARG 307 N 0.00 0.02 -0.18 -1.09 0.63 -0.48 -3.09 116.66 112.48 1tkd n ARG 307 Ca 0.00 0.01 0.07 0.00 -0.92 0.00 0.00 57.85 57.01 1tkd n ARG 307 Cb 0.00 -1.52 0.15 0.00 0.45 0.00 0.00 32.46 31.54 1tkd n ARG 307 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1tkd n GLU 308 N -1.55 2.31 -3.68 -0.14 1.02 -1.26 -5.00 120.64 112.33 1tkd n GLU 308 Ca 0.06 -2.37 -0.25 0.00 -0.02 0.00 0.00 57.16 54.57 1tkd n GLU 308 Cb 0.35 -1.47 0.03 0.00 -0.02 0.00 0.00 31.44 30.33 1tkd n GLU 308 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tkd n GLY 309 N -0.72 -0.65 0.13 0.62 0.00 -1.18 -4.80 105.19 98.59 1tkd n GLY 309 Ca 0.14 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1tkd n GLY 309 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tkd n ARG 310 N -4.14 0.00 -0.78 1.61 1.74 -1.26 -4.87 116.66 108.96 1tkd n ARG 310 Ca -0.20 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 56.86 1tkd n ARG 310 Cb 0.64 -0.87 0.02 0.00 -1.02 0.00 0.00 32.46 31.23 1tkd n ARG 310 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1tkd n GLU 311 N -2.41 0.44 0.18 5.56 1.02 -1.15 -4.90 120.64 119.37 1tkd n GLU 311 Ca 0.00 -0.33 -0.08 0.00 -0.02 0.00 0.00 57.16 56.73 1tkd n GLU 311 Cb 0.42 -0.09 -0.04 0.00 -0.02 0.00 0.00 31.44 31.71 1tkd n GLU 311 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1tkd h PRO 312 N 0.00 -0.50 -0.08 3.49 0.13 -1.97 -3.43 132.00 129.64 1tkd h PRO 312 Ca -0.04 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1tkd h PRO 312 Cb 0.15 0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.39 1tkd h PRO 312 CO 0.04 -0.33 0.00 0.00 -0.23 0.00 0.00 178.00 177.48 1tkd n GLU 314 N 2.84 0.43 -2.61 0.00 2.13 -1.26 -4.74 120.64 117.43 1tkd n GLU 314 Ca 0.00 0.15 -0.39 0.00 0.66 0.00 0.00 57.16 57.58 1tkd n GLU 314 Cb 0.00 -1.52 -0.05 0.00 0.27 0.00 0.00 31.44 30.14 1tkd n GLU 314 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1tkd s LEU 315 N 1.06 4.47 -0.69 4.31 1.43 -1.26 0.38 118.68 128.38 1tkd s LEU 315 Ca 0.77 2.07 -0.22 0.00 -1.03 0.00 0.00 54.13 55.72 1tkd s LEU 315 Cb -1.02 -3.79 0.08 0.00 0.03 0.00 0.00 46.19 41.49 1tkd s LEU 315 CO 0.55 -0.11 0.97 -0.62 0.23 0.00 0.00 176.35 177.37 1tkd s ASP 316 N -1.21 6.22 0.29 2.29 3.68 -0.43 -4.59 116.67 122.94 1tkd s ASP 316 Ca 0.47 -1.13 0.23 0.00 2.13 0.00 0.00 52.55 54.25 1tkd s ASP 316 Cb -0.26 -2.41 1.09 0.00 -1.45 0.00 0.00 42.92 39.88 1tkd s ASP 316 CO 0.33 -1.39 1.69 0.41 0.13 0.00 0.00 175.17 176.34 1tkd n THR 317 N 5.87 0.94 0.00 1.71 -1.04 -1.26 -4.46 114.28 116.04 1tkd n THR 317 Ca -0.01 0.50 0.00 0.00 -2.04 0.00 0.00 64.05 62.50 1tkd n THR 317 Cb 0.46 -1.47 0.00 0.00 -1.82 0.00 0.00 70.33 67.49 1tkd n THR 317 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1tkd n ARG 318 N -2.26 0.00 0.00 -2.82 1.74 -1.26 -4.91 116.66 107.15 1tkd n ARG 318 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1tkd n ARG 318 Cb 0.12 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.56 1tkd n ARG 318 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1tkd n GLU 319 N 0.00 0.00 -4.56 5.56 2.13 -1.26 -5.15 120.64 117.35 1tkd n GLU 319 Ca 0.00 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.56 1tkd n GLU 319 Cb 0.00 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.60 1tkd n GLU 319 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 1tkd s TYR 320 N 0.00 2.40 -0.03 4.31 2.02 -1.26 -5.14 117.35 119.65 1tkd s TYR 320 Ca 0.00 -0.59 0.01 0.00 -0.37 0.00 0.00 57.07 56.12 1tkd s TYR 320 Cb 0.00 -1.51 0.02 0.00 -0.40 0.00 0.00 41.96 40.08 1tkd s TYR 320 CO 0.00 0.50 -0.01 0.08 -1.57 0.00 0.00 175.55 174.55 1tkd s VAL 321 N -2.69 0.28 0.19 0.71 1.01 -1.26 -3.86 120.40 114.78 1tkd s VAL 321 Ca 0.33 0.02 -0.33 0.00 0.00 0.00 0.00 61.98 62.00 1tkd s VAL 321 Cb 0.05 -0.35 -0.13 0.00 0.00 0.00 0.00 36.38 35.95 1tkd s VAL 321 CO 0.17 0.16 1.65 0.00 0.00 0.00 0.00 175.10 177.08 1tkd n ALA 322 N 4.07 2.15 0.00 5.51 0.00 0.14 -1.41 120.51 130.97 1tkd n ALA 322 Ca -0.26 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1tkd n ALA 322 Cb 0.51 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1tkd n ALA 322 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tkd n GLY 323 N 3.67 2.44 3.46 0.00 0.00 -0.62 -4.99 105.19 109.15 1tkd n GLY 323 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1tkd n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tkd s ALA 324 N -2.23 3.17 0.49 4.61 0.00 -0.50 -4.96 121.76 122.34 1tkd s ALA 324 Ca 0.00 -2.14 -0.21 0.00 0.00 0.00 0.00 51.96 49.61 1tkd s ALA 324 Cb 0.00 -3.95 -0.07 0.00 0.00 0.00 0.00 23.12 19.10 1tkd s ALA 324 CO 0.00 -2.88 1.13 -1.25 0.00 0.00 0.00 175.76 172.77 1tkd s PRO 325 N 3.71 3.64 0.18 0.00 0.04 -1.26 -4.41 135.00 136.89 1tkd s PRO 325 Ca 0.26 1.66 -0.08 0.00 0.04 0.00 0.00 61.00 62.89 1tkd s PRO 325 Cb -0.13 -2.24 -0.01 0.00 0.04 0.00 0.00 34.50 32.16 1tkd s PRO 325 CO 0.03 -0.63 0.28 1.52 0.04 0.00 0.00 177.00 178.25 1tkd s TYR 326 N -1.67 0.52 -0.28 0.56 1.13 -0.80 -4.98 117.35 111.82 1tkd s TYR 326 Ca 0.67 -0.86 -0.07 0.00 -1.41 0.00 0.00 57.07 55.40 1tkd s TYR 326 Cb -0.25 -0.10 -0.00 0.00 -1.10 0.00 0.00 41.96 40.50 1tkd s TYR 326 CO 0.30 -0.74 0.07 0.99 -2.51 0.00 0.00 175.55 173.65 1tkd s THR 327 N -4.01 3.99 0.16 -3.49 2.01 -1.26 -1.00 115.64 112.05 1tkd s THR 327 Ca 0.21 -0.57 -0.31 0.00 0.31 0.00 0.00 61.69 61.34 1tkd s THR 327 Cb 0.03 -3.00 -0.09 0.00 0.01 0.00 0.00 72.50 69.46 1tkd s THR 327 CO 0.03 0.16 1.38 -2.84 -0.69 0.00 0.00 174.62 172.67 1tkd s PRO 328 N 1.52 4.33 0.20 4.92 0.02 -1.26 -4.96 135.00 139.77 1tkd s PRO 328 Ca 0.04 2.12 0.01 0.00 0.02 0.00 0.00 61.00 63.19 1tkd s PRO 328 Cb -0.16 -3.21 -0.05 0.00 0.02 0.00 0.00 34.50 31.10 1tkd s PRO 328 CO 0.02 -0.39 0.04 0.14 -0.33 0.00 0.00 177.00 176.49 1tkd s VAL 329 N 0.65 0.59 0.11 3.83 -7.23 -1.26 -0.22 120.40 116.88 1tkd s VAL 329 Ca 0.62 -1.99 0.06 0.00 -1.81 0.00 0.00 61.98 58.86 1tkd s VAL 329 Cb -0.38 -2.32 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 1tkd s VAL 329 CO 0.34 -0.28 -0.15 -1.83 -0.31 0.00 0.00 175.10 172.87 1tkd s GLU 330 N -3.97 1.02 -0.33 4.82 -1.05 0.17 -4.73 118.70 114.64 1tkd s GLU 330 Ca 0.30 -1.19 -0.16 0.00 -0.15 0.00 0.00 54.97 53.76 1tkd s GLU 330 Cb 0.07 -1.00 -0.01 0.00 -0.44 0.00 0.00 34.13 32.75 1tkd s GLU 330 CO 0.08 0.20 0.43 -1.58 0.95 0.00 0.00 175.26 175.34 1tkd s HIS 331 N -1.84 3.21 -0.13 4.83 5.65 -1.26 -1.25 115.29 124.49 1tkd s HIS 331 Ca 0.07 0.17 -0.04 0.00 0.25 0.00 0.00 55.06 55.52 1tkd s HIS 331 Cb -0.07 -2.75 -0.03 0.00 -1.18 0.00 0.00 32.58 28.55 1tkd s HIS 331 CO 0.03 -0.43 -0.00 0.54 -0.65 0.00 0.00 174.74 174.24 1tkd s VAL 332 N 2.19 4.24 -0.14 0.89 0.11 0.15 -4.96 120.40 122.88 1tkd s VAL 332 Ca 0.16 -0.25 -0.09 0.00 -2.93 0.00 0.00 61.98 58.87 1tkd s VAL 332 Cb -0.16 -2.84 -0.04 0.00 -1.53 0.00 0.00 36.38 31.81 1tkd s VAL 332 CO 0.12 0.54 0.16 -0.69 -3.33 0.00 0.00 175.10 171.90 1tkd s VAL 333 N -0.19 5.43 0.13 2.04 1.01 -1.26 -1.12 120.40 126.45 1tkd s VAL 333 Ca 0.05 0.27 -0.35 0.00 0.00 0.00 0.00 61.98 61.95 1tkd s VAL 333 Cb -0.13 -3.46 -0.16 0.00 0.00 0.00 0.00 36.38 32.64 1tkd s VAL 333 CO 0.02 0.54 1.38 0.33 0.00 0.00 0.00 175.10 177.37 1tkd n PHE 334 N 2.57 1.72 -4.03 5.22 7.35 -1.26 -4.95 117.46 124.08 1tkd n PHE 334 Ca -0.18 0.54 -0.31 0.00 -0.76 0.00 0.00 57.45 56.73 1tkd n PHE 334 Cb 0.54 -2.39 -0.15 0.00 0.35 0.00 0.00 39.48 37.83 1tkd n PHE 334 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1tkd s ASN 335 N 0.50 4.56 0.63 -2.13 3.84 -1.26 -4.90 114.94 116.17 1tkd s ASN 335 Ca 0.80 -1.77 0.30 0.00 0.21 0.00 0.00 52.86 52.40 1tkd s ASN 335 Cb -0.84 -1.54 1.65 0.00 -0.55 0.00 0.00 41.25 39.97 1tkd s ASN 335 CO 0.46 -0.29 1.99 -0.65 -2.79 0.00 0.00 177.10 175.81 1tkd h PRO 336 N 7.71 0.00 0.00 0.43 0.11 -1.98 0.25 132.00 138.52 1tkd h PRO 336 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1tkd h PRO 336 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1tkd h PRO 336 CO 0.49 0.00 -0.06 0.43 -0.21 0.00 0.00 178.00 178.65 1tkd n SER 337 N -3.34 0.32 -4.45 -2.05 7.64 -1.26 -4.70 113.62 105.79 1tkd n SER 337 Ca 0.02 0.46 -0.44 0.00 1.01 0.00 0.00 58.87 59.92 1tkd n SER 337 Cb 0.42 -0.52 -0.05 0.00 -1.01 0.00 0.00 64.21 63.04 1tkd n SER 337 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1tkd s SER 338 N -3.55 6.23 0.56 6.43 0.15 0.88 -4.89 113.70 119.52 1tkd s SER 338 Ca 0.12 -0.92 0.26 0.00 0.70 0.00 0.00 55.95 56.12 1tkd s SER 338 Cb 0.17 -2.32 1.51 0.00 -1.71 0.00 0.00 66.02 63.66 1tkd s SER 338 CO 0.57 -1.02 2.05 0.03 1.20 0.00 0.00 173.24 176.07 1tkd h ARG 339 N 9.12 0.00 -0.42 5.44 2.47 -1.84 0.23 114.38 129.38 1tkd h ARG 339 Ca -0.28 0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.33 1tkd h ARG 339 Cb 1.09 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.40 1tkd h ARG 339 CO 1.02 0.00 -0.19 0.22 0.56 0.00 0.00 179.97 181.58 1tkd h ASP 340 N 0.00 0.89 -0.34 7.04 3.58 -1.93 -0.88 116.42 124.79 1tkd h ASP 340 Ca 0.14 -0.40 -0.15 0.00 0.42 0.00 0.00 57.03 57.04 1tkd h ASP 340 Cb 0.68 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.48 1tkd h ASP 340 CO -0.00 1.10 -0.38 0.45 -2.88 0.00 0.00 179.24 177.53 1tkd h HIS 341 N 0.69 1.04 -0.03 0.28 3.86 -0.92 -1.70 115.15 118.36 1tkd h HIS 341 Ca 0.09 -0.32 0.00 0.00 -1.16 0.00 0.00 60.37 58.98 1tkd h HIS 341 Cb 0.76 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 29.01 1tkd h HIS 341 CO 0.06 1.13 0.02 0.82 0.86 0.00 0.00 177.93 180.81 1tkd h ILE 342 N 0.65 1.03 -0.55 2.45 2.04 -0.99 -1.78 117.51 120.36 1tkd h ILE 342 Ca 0.05 -0.08 0.03 0.00 1.00 0.00 0.00 64.86 65.86 1tkd h ILE 342 Cb 0.97 1.03 -0.04 0.00 -0.74 0.00 0.00 36.82 38.04 1tkd h ILE 342 CO 0.09 0.02 0.34 -0.61 0.00 0.00 0.00 178.15 177.99 1tkd h GLN 343 N 0.02 0.65 0.58 2.37 -0.00 -1.13 -1.35 115.11 116.24 1tkd h GLN 343 Ca 0.01 -0.04 -0.02 0.00 -0.00 0.00 0.00 58.65 58.60 1tkd h GLN 343 Cb 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 27.35 1tkd h GLN 343 CO -0.00 0.43 -0.41 -0.22 0.00 0.00 0.00 178.83 178.62 1tkd h LYS 344 N 0.66 -0.91 -0.84 1.69 3.64 -1.07 -1.58 116.57 118.16 1tkd h LYS 344 Ca 0.22 0.06 0.09 0.00 -1.27 0.00 0.00 60.65 59.75 1tkd h LYS 344 Cb 0.02 0.21 -0.06 0.00 -0.41 0.00 0.00 32.23 31.99 1tkd h LYS 344 CO -0.10 -0.61 0.55 0.87 -2.27 0.00 0.00 179.45 177.89 1tkd h LYS 345 N -0.94 0.81 -0.08 1.90 1.79 -1.26 -1.03 116.57 117.76 1tkd h LYS 345 Ca -0.08 -0.05 -0.18 0.00 -2.18 0.00 0.00 60.65 58.16 1tkd h LYS 345 Cb 0.78 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 31.24 1tkd h LYS 345 CO 0.04 0.54 -0.72 -0.07 -1.08 0.00 0.00 179.45 178.16 1tkd h LEU 346 N 0.84 0.46 -0.73 2.94 3.38 -1.15 -2.61 115.31 118.45 1tkd h LEU 346 Ca 0.38 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 1tkd h LEU 346 Cb 0.37 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1tkd h LEU 346 CO -0.15 1.03 -0.63 1.56 0.09 0.00 0.00 178.44 180.34 1tkd h GLN 347 N 0.27 0.04 0.00 1.13 4.20 -0.86 -0.75 115.11 119.13 1tkd h GLN 347 Ca -0.03 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1tkd h GLN 347 Cb 1.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.07 1tkd h GLN 347 CO 0.12 0.65 0.00 0.39 -0.67 0.00 0.00 178.83 179.33 1tkd n GLU 348 N -3.80 0.66 -0.07 1.46 1.02 -0.43 -1.57 120.64 117.90 1tkd n GLU 348 Ca -0.01 0.01 0.04 0.00 -0.02 0.00 0.00 57.16 57.18 1tkd n GLU 348 Cb 0.62 -1.50 0.08 0.00 -0.02 0.00 0.00 31.44 30.62 1tkd n GLU 348 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1tkd n ALA 349 N -1.04 2.32 0.00 0.62 0.00 -0.47 -4.97 120.51 116.97 1tkd n ALA 349 Ca 0.16 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.77 1tkd n ALA 349 Cb 0.09 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.21 1tkd n ALA 349 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tkd n GLY 350 N 0.42 0.42 3.72 0.00 0.00 -0.61 -4.34 105.19 104.81 1tkd n GLY 350 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1tkd n GLY 350 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1tkd s TRP 351 N -2.00 3.17 -0.40 1.61 -0.00 -0.41 -4.98 118.94 115.92 1tkd s TRP 351 Ca 0.00 0.94 -0.04 0.00 -0.00 0.00 0.00 56.10 57.00 1tkd s TRP 351 Cb 0.00 -3.75 0.10 0.00 -0.00 0.00 0.00 33.47 29.82 1tkd s TRP 351 CO 0.00 -2.58 0.20 0.08 -0.00 0.00 0.00 176.95 174.66 1tkd s VAL 352 N 0.76 3.46 0.21 5.86 1.01 -1.26 -4.30 120.40 126.14 1tkd s VAL 352 Ca 0.64 -1.88 -0.32 0.00 0.00 0.00 0.00 61.98 60.41 1tkd s VAL 352 Cb -0.39 -3.29 -0.13 0.00 0.00 0.00 0.00 36.38 32.56 1tkd s VAL 352 CO 0.34 -0.62 1.49 -2.65 0.00 0.00 0.00 175.10 173.66 1tkd n PRO 353 N 4.67 2.12 -0.12 2.72 -0.02 -1.26 -4.93 135.00 138.18 1tkd n PRO 353 Ca -0.05 0.76 -0.24 0.00 -2.02 0.00 0.00 63.50 61.95 1tkd n PRO 353 Cb 0.42 -2.47 -0.11 0.00 -0.02 0.00 0.00 33.50 31.32 1tkd n PRO 353 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1tkd n THR 354 N 2.53 1.54 -4.67 3.45 -1.04 -1.26 -4.96 114.28 109.88 1tkd n THR 354 Ca 0.14 -0.41 -0.33 0.00 -2.04 0.00 0.00 64.05 61.40 1tkd n THR 354 Cb 0.31 -1.76 -0.12 0.00 -1.82 0.00 0.00 70.33 66.94 1tkd n THR 354 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1tkd s LYS 355 N -2.50 2.98 0.36 -2.82 -2.85 -1.26 -5.09 119.74 108.56 1tkd s LYS 355 Ca -0.35 -0.60 0.08 0.00 -1.00 0.00 0.00 55.97 54.10 1tkd s LYS 355 Cb 0.11 -2.61 -0.07 0.00 -2.06 0.00 0.00 37.83 33.20 1tkd s LYS 355 CO 0.56 0.50 -0.03 0.71 0.10 0.00 0.00 175.35 177.19 1tkd s TYR 356 N -0.37 2.34 0.55 1.78 1.51 -1.26 -1.59 117.35 120.31 1tkd s TYR 356 Ca 0.05 -0.64 -0.06 0.00 -1.01 0.00 0.00 57.07 55.41 1tkd s TYR 356 Cb -0.12 -1.48 -0.02 0.00 -0.11 0.00 0.00 41.96 40.22 1tkd s TYR 356 CO 0.02 0.43 0.87 0.95 -1.11 0.00 0.00 175.55 176.72 1tkd s THR 357 N -2.78 4.32 0.00 -0.71 -4.23 0.26 -4.71 115.64 107.79 1tkd s THR 357 Ca 0.33 0.21 -0.02 0.00 -1.18 0.00 0.00 61.69 61.03 1tkd s THR 357 Cb 0.06 -3.68 -0.10 0.00 1.34 0.00 0.00 72.50 70.12 1tkd s THR 357 CO 0.16 -0.72 2.09 -0.90 -0.54 0.00 0.00 174.62 174.72 1tkd n ASP 358 N -2.48 3.75 -0.16 3.99 5.75 -1.26 -1.46 116.55 124.68 1tkd n ASP 358 Ca 0.03 -2.10 0.00 0.00 -0.01 0.00 0.00 54.79 52.71 1tkd n ASP 358 Cb 0.56 -0.91 0.00 0.00 -1.03 0.00 0.00 41.12 39.74 1tkd n ASP 358 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1tkd n LYS 359 N 2.16 0.00 0.00 0.11 4.81 -1.26 -5.04 118.16 118.94 1tkd n LYS 359 Ca 0.16 -0.07 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 1tkd n LYS 359 Cb 0.51 -0.06 0.00 0.00 0.02 0.00 0.00 35.03 35.50 1tkd n LYS 359 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1tkd n GLY 360 N 0.00 2.45 3.78 3.14 0.00 -0.53 -5.03 105.19 108.99 1tkd n GLY 360 Ca 0.00 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 1tkd n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tkd s ALA 361 N -0.90 3.53 0.40 4.61 0.00 -1.26 -4.59 121.76 123.54 1tkd s ALA 361 Ca 0.00 1.47 -0.25 0.00 0.00 0.00 0.00 51.96 53.18 1tkd s ALA 361 Cb 0.00 -3.57 -0.09 0.00 0.00 0.00 0.00 23.12 19.47 1tkd s ALA 361 CO 0.00 -0.93 1.13 -1.25 0.00 0.00 0.00 175.76 174.71 1tkd s PRO 362 N -2.02 4.09 0.08 0.00 0.04 -1.26 0.90 135.00 136.84 1tkd s PRO 362 Ca 0.52 1.73 -0.31 0.00 0.04 0.00 0.00 61.00 62.99 1tkd s PRO 362 Cb -0.44 -2.64 -0.06 0.00 0.04 0.00 0.00 34.50 31.39 1tkd s PRO 362 CO 0.59 -0.26 1.25 0.08 0.04 0.00 0.00 177.00 178.70 1tkd s VAL 363 N -1.48 3.81 -0.50 -0.36 1.01 -0.62 -4.73 120.40 117.54 1tkd s VAL 363 Ca 0.57 1.32 0.07 0.00 0.00 0.00 0.00 61.98 63.94 1tkd s VAL 363 Cb -0.28 -3.84 0.25 0.00 0.00 0.00 0.00 36.38 32.51 1tkd s VAL 363 CO 0.35 0.11 0.62 0.52 0.00 0.00 0.00 175.10 176.70 1tkd n VAL 364 N 3.81 0.61 -3.52 2.92 0.31 -1.26 -4.88 118.33 116.31 1tkd n VAL 364 Ca 0.09 -4.53 -0.23 0.00 -0.01 0.00 0.00 64.34 59.66 1tkd n VAL 364 Cb 0.45 -2.00 0.03 0.00 -0.91 0.00 0.00 33.84 31.41 1tkd n VAL 364 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1tkd n ASP 365 N 1.16 2.48 0.14 4.52 5.68 -1.26 -4.95 116.55 124.31 1tkd n ASP 365 Ca 0.25 -2.74 0.04 0.00 -0.50 0.00 0.00 54.79 51.84 1tkd n ASP 365 Cb 0.48 -0.21 0.46 0.00 -1.14 0.00 0.00 41.12 40.71 1tkd n ASP 365 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 1tkd h ASP 366 N 0.41 0.20 0.47 -1.12 3.58 -1.98 -1.81 116.42 116.17 1tkd h ASP 366 Ca -0.31 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.09 1tkd h ASP 366 Cb 1.26 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.26 1tkd h ASP 366 CO 0.48 0.28 -0.23 -0.08 -2.88 0.00 0.00 179.24 176.81 1tkd h GLU 367 N 0.21 -0.61 -0.29 0.28 4.81 -1.99 -0.91 114.58 116.09 1tkd h GLU 367 Ca 0.05 0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.17 1tkd h GLU 367 Cb 0.22 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1tkd h GLU 367 CO 0.01 -0.40 -0.44 -0.24 -0.73 0.00 0.00 179.01 177.20 1tkd h VAL 368 N -0.65 1.29 -0.45 0.32 3.04 -1.87 -2.89 116.25 115.04 1tkd h VAL 368 Ca -0.06 -1.63 0.04 0.00 -1.01 0.00 0.00 66.70 64.04 1tkd h VAL 368 Cb 0.49 1.54 -0.04 0.00 -2.01 0.00 0.00 31.29 31.28 1tkd h VAL 368 CO 0.11 0.53 0.21 -0.07 -1.01 0.00 0.00 177.57 177.33 1tkd h LEU 369 N 0.59 0.29 -2.15 3.16 3.38 -1.27 0.11 115.31 119.42 1tkd h LEU 369 Ca 0.04 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.06 1tkd h LEU 369 Cb 1.00 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 1tkd h LEU 369 CO 0.09 0.21 0.07 -0.08 0.09 0.00 0.00 178.44 178.82 1tkd h GLU 370 N 0.42 0.00 0.00 1.13 4.57 -1.06 -2.29 114.58 117.35 1tkd h GLU 370 Ca 0.20 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 1tkd h GLU 370 Cb 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1tkd h GLU 370 CO -0.15 0.00 -1.08 0.41 -1.18 0.00 0.00 179.01 177.01 1tkd n GLY 371 N -1.48 -1.41 3.70 1.92 0.00 -0.03 -4.95 105.19 102.94 1tkd n GLY 371 Ca -0.01 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1tkd n GLY 371 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1tkd n VAL 372 N -2.58 2.21 -3.98 1.61 0.31 0.19 -5.02 118.33 111.07 1tkd n VAL 372 Ca -0.00 -0.50 -0.16 0.00 -0.01 0.00 0.00 64.34 63.67 1tkd n VAL 372 Cb 0.54 -1.60 -0.16 0.00 -0.91 0.00 0.00 33.84 31.72 1tkd n VAL 372 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1tkd s ARG 373 N -2.02 0.31 0.04 5.55 1.81 -1.26 -5.04 118.95 118.34 1tkd s ARG 373 Ca 0.57 0.01 0.01 0.00 -1.72 0.00 0.00 55.73 54.60 1tkd s ARG 373 Cb -0.54 -0.42 -0.03 0.00 -0.45 0.00 0.00 34.95 33.51 1tkd s ARG 373 CO 0.61 -0.07 -0.05 0.14 -0.68 0.00 0.00 175.30 175.25 1tkd s VAL 374 N 0.67 0.32 0.19 3.52 -7.23 -1.26 -4.51 120.40 112.10 1tkd s VAL 374 Ca -0.07 -1.21 -0.06 0.00 -1.81 0.00 0.00 61.98 58.83 1tkd s VAL 374 Cb -0.10 -0.72 -0.02 0.00 0.56 0.00 0.00 36.38 36.11 1tkd s VAL 374 CO -0.01 -0.59 1.55 0.44 -0.31 0.00 0.00 175.10 176.18 1tkd h ASP 375 N 4.18 0.79 -2.72 4.85 3.32 -1.97 -3.42 116.42 121.45 1tkd h ASP 375 Ca -0.34 -0.35 -0.57 0.00 0.02 0.00 0.00 57.03 55.79 1tkd h ASP 375 Cb 1.19 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.49 1tkd h ASP 375 CO 0.47 1.08 1.21 -0.62 -1.72 0.00 0.00 179.24 179.66 1tkd s ASP 376 N -6.84 6.10 0.51 6.45 2.15 -1.26 -4.87 116.67 118.92 1tkd s ASP 376 Ca -0.09 1.45 0.19 0.00 0.43 0.00 0.00 52.55 54.53 1tkd s ASP 376 Cb 0.12 -2.53 1.28 0.00 -0.30 0.00 0.00 42.92 41.49 1tkd s ASP 376 CO 0.85 -1.51 2.06 1.55 -0.17 0.00 0.00 175.17 177.95 1tkd h PRO 377 N 11.94 0.06 -0.30 4.34 0.13 -1.99 -0.75 132.00 145.43 1tkd h PRO 377 Ca -0.34 -0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.72 1tkd h PRO 377 Cb 1.16 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1tkd h PRO 377 CO 1.02 0.04 -0.08 1.49 -0.23 0.00 0.00 178.00 180.24 1tkd h GLU 378 N 0.07 0.58 -0.27 0.86 4.81 -1.96 -1.64 114.58 117.02 1tkd h GLU 378 Ca 0.14 -0.23 -0.16 0.00 -0.13 0.00 0.00 59.36 58.99 1tkd h GLU 378 Cb 0.48 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1tkd h GLU 378 CO -0.01 0.78 -0.46 0.87 -0.73 0.00 0.00 179.01 179.47 1tkd h LYS 379 N 0.35 0.71 -0.80 1.92 1.57 -1.82 -0.75 116.57 117.75 1tkd h LYS 379 Ca 0.07 -0.40 0.06 0.00 -1.87 0.00 0.00 60.65 58.52 1tkd h LYS 379 Cb 0.58 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.85 1tkd h LYS 379 CO 0.03 1.02 0.48 0.37 -0.57 0.00 0.00 179.45 180.78 1tkd h GLN 380 N 0.57 0.84 -0.09 3.15 5.75 -1.06 -0.22 115.11 124.05 1tkd h GLN 380 Ca 0.03 -0.05 -0.12 0.00 -0.15 0.00 0.00 58.65 58.37 1tkd h GLN 380 Cb 1.01 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.36 1tkd h GLN 380 CO 0.10 0.56 -0.47 0.00 -2.65 0.00 0.00 178.83 176.36 1tkd h ALA 381 N 1.39 1.04 0.00 3.38 0.00 -0.99 -2.75 119.26 121.33 1tkd h ALA 381 Ca 0.35 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1tkd h ALA 381 Cb 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1tkd h ALA 381 CO -0.18 0.63 -0.01 0.00 0.00 0.00 0.00 179.25 179.69 1tkd h ALA 382 N 1.34 1.45 -0.91 0.00 0.00 0.49 -2.11 119.26 119.51 1tkd h ALA 382 Ca 0.01 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1tkd h ALA 382 Cb 0.90 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 1tkd h ALA 382 CO 0.07 0.02 0.60 0.82 0.00 0.00 0.00 179.25 180.76 1tkd h ILE 383 N 0.00 1.21 -0.53 0.00 2.04 -1.16 0.76 117.51 119.84 1tkd h ILE 383 Ca -0.00 -0.42 -0.11 0.00 1.00 0.00 0.00 64.86 65.34 1tkd h ILE 383 Cb 0.04 -0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.00 1tkd h ILE 383 CO 0.00 0.22 -0.08 0.44 0.00 0.00 0.00 178.15 178.73 1tkd h ASP 384 N 1.21 0.97 -0.84 1.72 3.32 -1.55 -1.42 116.42 119.83 1tkd h ASP 384 Ca 0.34 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1tkd h ASP 384 Cb -0.11 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.14 1tkd h ASP 384 CO -0.08 1.07 0.50 -0.07 -1.72 0.00 0.00 179.24 178.94 1tkd h LEU 385 N 0.88 1.02 -0.51 1.55 3.38 -1.25 -0.71 115.31 119.66 1tkd h LEU 385 Ca 0.14 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1tkd h LEU 385 Cb 0.63 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1tkd h LEU 385 CO 0.04 0.79 0.21 0.40 0.09 0.00 0.00 178.44 179.97 1tkd h ILE 386 N 1.16 1.21 -0.21 1.22 2.04 -0.55 0.04 117.51 122.43 1tkd h ILE 386 Ca 0.30 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 1tkd h ILE 386 Cb -0.03 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1tkd h ILE 386 CO -0.06 0.25 0.13 0.11 0.00 0.00 0.00 178.15 178.58 1tkd h LYS 387 N 0.69 0.28 -0.70 2.37 1.57 -0.71 -1.07 116.57 119.00 1tkd h LYS 387 Ca 0.17 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.94 1tkd h LYS 387 Cb 0.19 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 1tkd h LYS 387 CO -0.01 0.23 0.46 1.49 -0.57 0.00 0.00 179.45 181.04 1tkd h GLU 388 N 0.26 0.91 -0.45 3.15 4.81 -0.92 -2.24 114.58 120.09 1tkd h GLU 388 Ca 0.07 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1tkd h GLU 388 Cb 0.02 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 1tkd h GLU 388 CO -0.01 0.60 0.28 -0.92 -0.73 0.00 0.00 179.01 178.23 1tkd h TYR 389 N 0.93 0.54 -0.80 0.92 5.03 -0.64 0.14 116.97 123.09 1tkd h TYR 389 Ca 0.26 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.60 1tkd h TYR 389 Cb -0.09 -0.18 -0.04 0.00 1.55 0.00 0.00 36.73 37.97 1tkd h TYR 389 CO -0.03 0.33 0.53 -0.07 -1.32 0.00 0.00 178.16 177.60 1tkd h LEU 390 N 0.58 0.91 -0.26 2.82 3.38 -0.89 -0.88 115.31 120.97 1tkd h LEU 390 Ca 0.17 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 1tkd h LEU 390 Cb -0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1tkd h LEU 390 CO -0.05 0.65 -0.06 -0.03 0.09 0.00 0.00 178.44 179.04 1tkd h MET 391 N 1.07 0.51 -0.93 1.13 4.05 -0.91 -2.54 114.93 117.32 1tkd h MET 391 Ca 0.30 -0.19 0.11 0.00 -0.28 0.00 0.00 59.70 59.63 1tkd h MET 391 Cb -0.10 -0.03 -0.07 0.00 -0.80 0.00 0.00 31.60 30.60 1tkd h MET 391 CO -0.07 0.72 0.60 0.82 0.23 0.00 0.00 176.91 179.20 1tkd h ILE 392 N 0.26 0.95 -0.45 1.77 1.08 -0.30 -1.82 117.51 118.99 1tkd h ILE 392 Ca 0.07 -0.31 -0.05 0.00 -0.39 0.00 0.00 64.86 64.18 1tkd h ILE 392 Cb 0.53 -0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 34.22 1tkd h ILE 392 CO 0.03 0.17 0.11 1.56 -0.69 0.00 0.00 178.15 179.32 1tkd h GLN 393 N 0.91 0.73 -0.82 2.37 1.08 -0.90 -0.20 115.11 118.28 1tkd h GLN 393 Ca 0.44 -0.18 0.04 0.00 -1.45 0.00 0.00 58.65 57.50 1tkd h GLN 393 Cb 0.45 -0.09 -0.05 0.00 -0.05 0.00 0.00 27.48 27.73 1tkd h GLN 393 CO -0.20 0.73 0.52 -0.22 -0.95 0.00 0.00 178.83 178.71 1tkd h LYS 394 N 0.61 0.98 -0.30 1.46 3.64 -0.94 0.55 116.57 122.57 1tkd h LYS 394 Ca 0.14 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 1tkd h LYS 394 Cb 0.33 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1tkd h LYS 394 CO 0.00 0.65 -0.10 0.00 -2.27 0.00 0.00 179.45 177.73 1tkd h ARG 395 N 1.01 0.60 -0.30 1.90 2.47 -1.12 -1.25 114.38 117.68 1tkd h ARG 395 Ca 0.34 -0.24 -0.03 0.00 -1.26 0.00 0.00 59.98 58.78 1tkd h ARG 395 Cb 0.04 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.32 1tkd h ARG 395 CO -0.13 0.80 0.07 0.82 0.56 0.00 0.00 179.97 182.09 1tkd h ILE 396 N 0.36 1.22 -0.25 2.04 2.04 -0.55 -0.53 117.51 121.85 1tkd h ILE 396 Ca 0.07 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.20 1tkd h ILE 396 Cb 0.60 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 1tkd h ILE 396 CO 0.03 0.24 0.16 1.23 0.00 0.00 0.00 178.15 179.82 1tkd h GLY 397 N 0.31 0.34 1.79 5.37 0.00 0.15 0.41 103.07 111.45 1tkd h GLY 397 Ca 0.09 -0.12 -0.12 0.00 0.00 0.00 0.00 47.33 47.18 1tkd h GLY 397 CO 0.00 0.12 -0.47 -1.61 0.00 0.00 0.00 176.54 174.58 1tkd h GLN 398 N 0.32 0.23 0.07 4.80 4.15 -1.16 0.15 115.11 123.67 1tkd h GLN 398 Ca 0.09 -0.12 -0.35 0.00 0.77 0.00 0.00 58.65 59.04 1tkd h GLN 398 Cb -0.03 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.63 1tkd h GLN 398 CO -0.03 0.66 -2.03 -1.13 -1.93 0.00 0.00 178.83 174.37 1tkd n SER 399 N -3.98 1.70 0.00 -0.69 3.41 -0.21 -2.24 113.62 111.61 1tkd n SER 399 Ca -0.02 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1tkd n SER 399 Cb 0.52 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1tkd n SER 399 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1tkd n ALA 400 N -2.92 2.32 0.02 7.33 0.00 0.13 -1.98 120.51 125.40 1tkd n ALA 400 Ca -0.31 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.12 1tkd n ALA 400 Cb 1.05 0.22 -0.10 0.00 0.00 0.00 0.00 19.45 20.62 1tkd n ALA 400 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1tkd n GLU 401 N -2.19 0.63 -0.65 0.00 1.02 -0.42 -4.68 120.64 114.35 1tkd n GLU 401 Ca 0.00 0.19 -0.30 0.00 -0.02 0.00 0.00 57.16 57.03 1tkd n GLU 401 Cb 0.22 -1.77 0.19 0.00 -0.02 0.00 0.00 31.44 30.06 1tkd n GLU 401 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1tkd s GLY 402 N -4.86 1.64 0.40 0.62 0.00 0.53 -4.85 107.32 100.80 1tkd s GLY 402 Ca -0.04 0.35 0.09 0.00 0.00 0.00 0.00 44.72 45.12 1tkd s GLY 402 CO 0.82 0.87 1.97 -0.55 0.00 0.00 0.00 173.10 176.21 1tkd h ASP 403 N -2.12 0.30 -0.69 1.64 3.32 -1.94 -2.04 116.42 114.89 1tkd h ASP 403 Ca -0.49 -0.04 -0.24 0.00 0.02 0.00 0.00 57.03 56.28 1tkd h ASP 403 Cb 1.29 -0.08 -0.14 0.00 0.22 0.00 0.00 39.33 40.62 1tkd h ASP 403 CO 0.45 0.36 0.26 0.29 -1.72 0.00 0.00 179.24 178.87 1tkd n LYS 404 N -4.36 3.25 -1.74 3.56 4.76 -1.26 -4.96 118.16 117.42 1tkd n LYS 404 Ca 0.00 -3.07 -0.39 0.00 -2.87 0.00 0.00 58.31 51.98 1tkd n LYS 404 Cb 0.19 -2.14 0.03 0.00 -1.84 0.00 0.00 35.03 31.27 1tkd n LYS 404 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1tkd n ALA 405 N -0.43 1.70 -0.21 7.82 0.00 -0.77 -4.59 120.51 124.02 1tkd n ALA 405 Ca 0.41 0.19 -0.00 0.00 0.00 0.00 0.00 53.44 54.03 1tkd n ALA 405 Cb 1.35 -2.35 0.11 0.00 0.00 0.00 0.00 19.45 18.55 1tkd n ALA 405 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1tkd h TRP 406 N 1.82 0.51 0.00 0.00 6.55 -1.33 -0.75 115.95 122.75 1tkd h TRP 406 Ca -0.50 0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.35 1tkd h TRP 406 Cb 1.29 -0.14 -0.00 0.00 -0.86 0.00 0.00 29.16 29.45 1tkd h TRP 406 CO 0.47 0.18 -0.06 -0.07 -1.05 0.00 0.00 178.44 177.91 1tkd h LEU 407 N 0.51 0.00 0.00 -4.49 3.38 -1.70 -0.88 115.31 112.13 1tkd h LEU 407 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1tkd h LEU 407 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1tkd h LEU 407 CO -0.26 0.06 -0.18 0.54 0.09 0.00 0.00 178.44 178.69 1tkd n ARG 408 N -4.04 0.18 0.00 1.13 1.74 -0.32 -3.88 116.66 111.47 1tkd n ARG 408 Ca -0.03 0.12 0.07 0.00 -0.77 0.00 0.00 57.85 57.24 1tkd n ARG 408 Cb 0.15 -1.68 -0.04 0.00 -1.02 0.00 0.00 32.46 29.87 1tkd n ARG 408 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1tkd n TYR 409 N -1.98 0.00 -1.86 -1.55 4.01 -0.40 -4.98 117.16 110.40 1tkd n TYR 409 Ca 0.05 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.37 1tkd n TYR 409 Cb 0.40 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.40 1tkd n TYR 409 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1tkd s VAL 410 N -2.03 2.39 0.72 -0.72 1.01 -0.79 -4.55 120.40 116.44 1tkd s VAL 410 Ca 0.09 0.28 -0.02 0.00 0.00 0.00 0.00 61.98 62.33 1tkd s VAL 410 Cb 0.11 -3.18 0.12 0.00 0.00 0.00 0.00 36.38 33.43 1tkd s VAL 410 CO 0.46 0.02 1.00 0.00 0.00 0.00 0.00 175.10 176.58 1tkd s ALA 411 N 1.14 3.58 0.35 5.51 0.00 -0.28 -4.93 121.76 127.11 1tkd s ALA 411 Ca 0.72 -1.60 0.04 0.00 0.00 0.00 0.00 51.96 51.11 1tkd s ALA 411 Cb -0.46 -2.11 0.63 0.00 0.00 0.00 0.00 23.12 21.18 1tkd s ALA 411 CO 0.32 -1.45 1.93 0.93 0.00 0.00 0.00 175.76 177.48 1tkd h GLU 412 N -0.56 0.63 -0.17 0.00 4.39 -1.94 -1.67 114.58 115.27 1tkd h GLU 412 Ca -0.38 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1tkd h GLU 412 Cb 1.27 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1tkd h GLU 412 CO 0.42 0.54 0.00 -0.40 -1.16 0.00 0.00 179.01 178.42 1tkd n ASP 413 N -4.35 0.17 -2.31 1.42 5.68 -1.26 -4.81 116.55 111.09 1tkd n ASP 413 Ca 0.03 -1.26 -0.18 0.00 -0.50 0.00 0.00 54.79 52.88 1tkd n ASP 413 Cb 0.17 -0.08 0.02 0.00 -1.14 0.00 0.00 41.12 40.08 1tkd n ASP 413 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1tkd n GLY 414 N 0.14 -0.32 3.09 6.12 0.00 -0.63 -4.98 105.19 108.61 1tkd n GLY 414 Ca 0.00 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 1tkd n GLY 414 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tkd s LYS 415 N -5.25 0.58 -0.25 1.61 1.02 -1.25 -1.80 119.74 114.39 1tkd s LYS 415 Ca 0.15 -0.99 -0.09 0.00 0.02 0.00 0.00 55.97 55.07 1tkd s LYS 415 Cb -0.07 0.21 -0.04 0.00 -0.52 0.00 0.00 37.83 37.42 1tkd s LYS 415 CO 0.19 -0.12 0.11 0.42 -0.92 0.00 0.00 175.35 175.03 1tkd s ILE 416 N -3.21 4.71 -1.13 2.17 1.01 -0.58 -1.12 121.20 123.05 1tkd s ILE 416 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 60.65 60.57 1tkd s ILE 416 Cb 0.03 -3.21 0.28 0.00 0.01 0.00 0.00 42.46 39.56 1tkd s ILE 416 CO -0.07 0.32 1.60 1.41 0.00 0.00 0.00 174.94 178.20 1tkd n HIS 417 N 4.86 2.39 -1.74 3.97 8.25 -1.26 -0.93 115.22 130.76 1tkd n HIS 417 Ca -0.15 -2.61 -0.40 0.00 -0.26 0.00 0.00 57.72 54.29 1tkd n HIS 417 Cb 0.52 -1.41 0.02 0.00 1.12 0.00 0.00 29.99 30.23 1tkd n HIS 417 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1tkd n GLY 418 N 1.59 0.81 3.85 -1.41 0.00 -1.26 -4.86 105.19 103.90 1tkd n GLY 418 Ca 0.30 0.17 -0.34 0.00 0.00 0.00 0.00 46.02 46.16 1tkd n GLY 418 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tkd s SER 419 N -0.53 6.82 -0.04 1.61 0.15 -0.11 -4.68 113.70 116.92 1tkd s SER 419 Ca 0.62 1.16 0.02 0.00 0.70 0.00 0.00 55.95 58.44 1tkd s SER 419 Cb -0.47 -2.32 0.01 0.00 -1.71 0.00 0.00 66.02 61.53 1tkd s SER 419 CO 0.57 -0.02 -0.07 -0.69 1.20 0.00 0.00 173.24 174.24 1tkd s VAL 420 N -1.66 0.66 -0.56 4.45 1.01 -1.26 -1.72 120.40 121.31 1tkd s VAL 420 Ca 0.44 -0.24 -0.12 0.00 0.00 0.00 0.00 61.98 62.06 1tkd s VAL 420 Cb -0.13 -0.63 0.14 0.00 0.00 0.00 0.00 36.38 35.76 1tkd s VAL 420 CO 0.20 0.23 0.48 0.21 0.00 0.00 0.00 175.10 176.22 1tkd s ASN 421 N 0.54 6.03 0.45 3.32 3.84 -0.54 -4.96 114.94 123.62 1tkd s ASN 421 Ca -0.08 -2.04 0.30 0.00 0.21 0.00 0.00 52.86 51.25 1tkd s ASN 421 Cb -0.11 -2.11 1.41 0.00 -0.55 0.00 0.00 41.25 39.89 1tkd s ASN 421 CO 0.01 -0.72 1.65 -0.65 -2.79 0.00 0.00 177.10 174.59 1tkd h PRO 422 N 8.43 0.11 -0.68 0.43 0.11 -1.91 -1.20 132.00 137.30 1tkd h PRO 422 Ca -0.18 -0.01 -0.37 0.00 0.11 0.00 0.00 66.00 65.55 1tkd h PRO 422 Cb 1.07 -0.02 -0.41 0.00 0.11 0.00 0.00 31.00 31.75 1tkd h PRO 422 CO 0.91 0.07 -1.02 -1.71 -0.21 0.00 0.00 178.00 176.04 1tkd n ASN 423 N -4.60 2.75 0.22 -2.05 5.15 -1.26 -3.78 115.26 111.69 1tkd n ASN 423 Ca 0.36 -2.73 0.09 0.00 -0.60 0.00 0.00 54.58 51.70 1tkd n ASN 423 Cb 1.40 -0.44 0.47 0.00 -0.53 0.00 0.00 39.78 40.67 1tkd n ASN 423 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1tkd h GLY 424 N 2.53 0.00 -4.59 8.20 0.00 -1.15 -3.45 103.07 104.61 1tkd h GLY 424 Ca 0.04 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.78 1tkd h GLY 424 CO 0.44 0.00 -0.33 0.00 0.00 0.00 0.00 176.54 176.65 1tkd s ALA 425 N -3.74 3.80 0.34 3.60 0.00 -0.76 -4.86 121.76 120.15 1tkd s ALA 425 Ca -0.00 -0.54 0.08 0.00 0.00 0.00 0.00 51.96 51.51 1tkd s ALA 425 Cb 0.11 -2.13 0.80 0.00 0.00 0.00 0.00 23.12 21.90 1tkd s ALA 425 CO 0.64 0.65 1.83 -0.39 0.00 0.00 0.00 175.76 178.49 1tkd h VAL 426 N 2.53 0.77 0.00 0.00 -1.51 -1.86 -1.17 116.25 115.01 1tkd h VAL 426 Ca -0.48 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 1tkd h VAL 426 Cb 1.18 -0.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.34 1tkd h VAL 426 CO 0.69 0.13 0.00 0.35 -1.23 0.00 0.00 177.57 177.51 1tkd n THR 427 N -4.63 0.84 0.00 7.19 -2.24 -1.26 -4.58 114.28 109.60 1tkd n THR 427 Ca 0.20 0.19 0.00 0.00 -2.27 0.00 0.00 64.05 62.17 1tkd n THR 427 Cb 0.54 -1.02 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 1tkd n THR 427 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tkd n GLY 428 N 0.16 0.87 3.85 3.38 0.00 -0.44 -4.09 105.19 108.92 1tkd n GLY 428 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1tkd n GLY 428 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tkd s ARG 429 N -0.54 1.76 0.37 1.61 0.52 -1.25 -4.67 118.95 116.75 1tkd s ARG 429 Ca 0.00 0.26 0.05 0.00 -0.52 0.00 0.00 55.73 55.52 1tkd s ARG 429 Cb 0.00 -1.91 -0.01 0.00 0.52 0.00 0.00 34.95 33.55 1tkd s ARG 429 CO 0.00 -1.76 0.53 0.00 0.02 0.00 0.00 175.30 174.09 1tkd s ALA 430 N -3.40 4.09 0.22 2.13 0.00 -1.25 -1.82 121.76 121.73 1tkd s ALA 430 Ca 0.62 -1.34 0.11 0.00 0.00 0.00 0.00 51.96 51.36 1tkd s ALA 430 Cb -0.13 -1.82 -0.05 0.00 0.00 0.00 0.00 23.12 21.13 1tkd s ALA 430 CO 0.51 -0.14 -0.22 0.95 0.00 0.00 0.00 175.76 176.87 1tkd s THR 431 N -2.29 2.33 0.00 0.00 -4.23 -0.53 -4.56 115.64 106.36 1tkd s THR 431 Ca 0.46 -2.15 0.02 0.00 -1.18 0.00 0.00 61.69 58.84 1tkd s THR 431 Cb -0.10 -2.16 -0.01 0.00 1.34 0.00 0.00 72.50 71.58 1tkd s THR 431 CO 0.33 -0.24 -0.08 -1.00 -0.54 0.00 0.00 174.62 173.09 1tkd s HIS 432 N -2.02 0.69 0.21 3.99 3.76 -1.26 -1.46 115.29 119.20 1tkd s HIS 432 Ca 0.23 -0.17 -0.23 0.00 -0.15 0.00 0.00 55.06 54.75 1tkd s HIS 432 Cb -0.07 -0.44 0.05 0.00 1.11 0.00 0.00 32.58 33.24 1tkd s HIS 432 CO 0.11 -0.01 0.88 0.00 -0.85 0.00 0.00 174.74 174.86 1tkd s ALA 433 N -0.31 -1.44 -1.21 -1.40 0.00 -0.70 -4.34 121.76 112.37 1tkd s ALA 433 Ca 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 51.96 51.83 1tkd s ALA 433 Cb -0.04 0.72 -0.01 0.00 0.00 0.00 0.00 23.12 23.79 1tkd s ALA 433 CO -0.00 -1.04 0.87 1.19 0.00 0.00 0.00 175.76 176.78 1tkd n PHE 434 N -0.49 -2.13 -2.90 0.00 3.72 -1.26 -0.93 117.46 113.47 1tkd n PHE 434 Ca -0.05 0.86 -0.20 0.00 -0.05 0.00 0.00 57.45 58.01 1tkd n PHE 434 Cb 0.60 -4.59 0.02 0.00 -0.94 0.00 0.00 39.48 34.57 1tkd n PHE 434 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1tkd s PRO 435 N -5.43 2.76 -0.73 -1.08 0.04 -1.26 -3.96 135.00 125.34 1tkd s PRO 435 Ca 0.11 -0.94 -0.26 0.00 0.04 0.00 0.00 61.00 59.95 1tkd s PRO 435 Cb -0.02 -2.63 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1tkd s PRO 435 CO 0.77 -0.42 1.62 1.21 0.04 0.00 0.00 177.00 180.22 1tkd s ASN 436 N -4.35 5.69 0.00 6.66 3.84 -1.26 -4.46 114.94 121.07 1tkd s ASN 436 Ca 0.54 -0.24 0.15 0.00 0.21 0.00 0.00 52.86 53.52 1tkd s ASN 436 Cb -0.10 -2.55 0.92 0.00 -0.55 0.00 0.00 41.25 38.97 1tkd s ASN 436 CO 0.36 -2.14 1.38 0.18 -2.79 0.00 0.00 177.10 174.08 1tkd n LEU 437 N 11.32 0.00 -1.53 3.21 4.77 -1.26 -2.70 117.00 130.80 1tkd n LEU 437 Ca 0.18 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.24 1tkd n LEU 437 Cb 0.50 0.00 0.35 0.00 -2.33 0.00 0.00 43.42 41.94 1tkd n LEU 437 CO 0.69 0.00 0.81 0.00 -1.33 0.00 0.00 177.39 177.57 1tkd n ALA 438 N -0.86 3.45 -2.58 -1.18 0.00 -1.26 -4.32 120.51 113.74 1tkd n ALA 438 Ca 0.12 -1.94 0.03 0.00 0.00 0.00 0.00 53.44 51.64 1tkd n ALA 438 Cb 0.05 -0.97 0.03 0.00 0.00 0.00 0.00 19.45 18.56 1tkd n ALA 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tkd n GLN 439 N 0.42 0.48 -2.30 0.00 10.64 -1.10 -5.09 117.38 120.43 1tkd n GLN 439 Ca 0.25 -2.38 -0.41 0.00 -1.83 0.00 0.00 57.00 52.63 1tkd n GLN 439 Cb 1.04 -0.42 -0.03 0.00 -0.86 0.00 0.00 30.24 29.96 1tkd n GLN 439 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 1tkd s ILE 440 N -1.03 3.42 0.31 -0.39 -1.09 -1.26 -4.94 121.20 116.22 1tkd s ILE 440 Ca 0.31 1.17 -0.28 0.00 -2.23 0.00 0.00 60.65 59.62 1tkd s ILE 440 Cb 0.36 -3.75 -0.13 0.00 -1.58 0.00 0.00 42.46 37.36 1tkd s ILE 440 CO -0.13 0.17 1.13 -2.65 -1.23 0.00 0.00 174.94 172.23 1tkd n PRO 441 N 2.67 1.68 -2.16 2.79 -0.02 -1.26 -4.93 135.00 133.76 1tkd n PRO 441 Ca 0.06 0.59 -0.33 0.00 -2.02 0.00 0.00 63.50 61.79 1tkd n PRO 441 Cb 0.44 -2.05 -0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1tkd n PRO 441 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1tkd s GLY 442 N -0.45 2.20 0.61 -1.23 0.00 -1.26 -4.55 107.32 102.64 1tkd s GLY 442 Ca 0.57 0.42 0.31 0.00 0.00 0.00 0.00 44.72 46.03 1tkd s GLY 442 CO 0.61 0.74 2.13 -0.39 0.00 0.00 0.00 173.10 176.19 1tkd h VAL 443 N 0.67 0.36 -0.00 1.40 -1.51 -1.92 -1.42 116.25 113.83 1tkd h VAL 443 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 1tkd h VAL 443 Cb 1.22 0.85 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 1tkd h VAL 443 CO 0.58 0.00 -0.26 0.54 -1.23 0.00 0.00 177.57 177.20 1tkd n ARG 444 N -3.61 0.24 -2.99 5.19 1.74 -1.26 -3.65 116.66 112.31 1tkd n ARG 444 Ca 0.00 -0.10 -0.23 0.00 -0.77 0.00 0.00 57.85 56.75 1tkd n ARG 444 Cb 0.28 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.23 1tkd n ARG 444 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1tkd s SER 445 N -2.83 5.91 0.19 0.55 1.04 -0.53 -4.97 113.70 113.06 1tkd s SER 445 Ca 0.17 0.37 -0.33 0.00 0.48 0.00 0.00 55.95 56.64 1tkd s SER 445 Cb 0.19 -1.66 -0.14 0.00 0.10 0.00 0.00 66.02 64.51 1tkd s SER 445 CO 0.59 -0.65 1.40 -2.65 0.98 0.00 0.00 173.24 172.90 1tkd n PRO 446 N -2.07 1.81 -0.76 4.02 -0.02 -1.26 -0.69 135.00 136.03 1tkd n PRO 446 Ca 0.01 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1tkd n PRO 446 Cb 0.57 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1tkd n PRO 446 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1tkd n TYR 447 N 2.27 0.00 -0.17 6.00 4.01 -1.26 -4.86 117.16 123.15 1tkd n TYR 447 Ca 0.14 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.84 1tkd n TYR 447 Cb 0.28 -1.29 0.05 0.00 -0.31 0.00 0.00 39.34 38.07 1tkd n TYR 447 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1tkd h GLY 448 N 0.00 0.73 0.94 2.72 0.00 -1.05 -1.98 103.07 104.43 1tkd h GLY 448 Ca 0.00 -0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.16 1tkd h GLY 448 CO 0.00 0.13 0.39 0.83 0.00 0.00 0.00 176.54 177.89 1tkd h GLU 449 N 0.53 0.76 -0.37 4.80 5.08 -1.78 0.16 114.58 123.77 1tkd h GLU 449 Ca 0.23 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1tkd h GLU 449 Cb 0.12 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1tkd h GLU 449 CO -0.15 0.50 0.13 1.96 -1.00 0.00 0.00 179.01 180.46 1tkd h GLN 450 N 0.79 0.56 -0.10 2.33 4.20 -1.90 0.20 115.11 121.19 1tkd h GLN 450 Ca 0.24 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1tkd h GLN 450 Cb -0.04 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.65 1tkd h GLN 450 CO -0.08 0.56 0.06 0.00 -0.67 0.00 0.00 178.83 178.70 1tkd h ARG 452 N 0.13 0.72 0.00 0.00 9.65 -0.59 -2.85 114.38 121.45 1tkd h ARG 452 Ca 0.04 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.75 1tkd h ARG 452 Cb -0.01 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.47 1tkd h ARG 452 CO -0.01 0.70 0.00 0.00 2.80 0.00 0.00 179.97 183.46 1tkd h ALA 453 N 0.99 1.00 0.00 2.80 0.00 -0.89 -2.31 119.26 120.85 1tkd h ALA 453 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1tkd h ALA 453 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1tkd h ALA 453 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1tkd h ALA 454 N 2.04 1.00 -2.82 0.00 0.00 -1.20 -3.40 119.26 114.89 1tkd h ALA 454 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.22 1tkd h ALA 454 Cb 0.40 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 17.96 1tkd h ALA 454 CO 0.00 0.00 -0.53 -0.06 0.00 0.00 0.00 179.25 178.66 1tkd s PHE 455 N -3.59 3.21 -0.23 0.00 0.40 -0.87 -0.07 117.98 116.82 1tkd s PHE 455 Ca 0.02 -0.70 -0.32 0.00 -0.60 0.00 0.00 56.93 55.34 1tkd s PHE 455 Cb 0.09 -2.41 0.16 0.00 0.51 0.00 0.00 43.02 41.37 1tkd s PHE 455 CO 0.54 -0.53 1.25 0.20 0.70 0.00 0.00 175.22 177.37 1tkd s GLY 456 N 1.60 -0.11 0.48 4.36 0.00 -0.59 -0.42 107.32 112.64 1tkd s GLY 456 Ca 0.04 2.27 0.14 0.00 0.00 0.00 0.00 44.72 47.16 1tkd s GLY 456 CO 0.07 0.90 2.09 0.00 0.00 0.00 0.00 173.10 176.16 1tkd h ALA 457 N 2.13 1.95 -0.54 3.20 0.00 -1.74 -1.83 119.26 122.43 1tkd h ALA 457 Ca -0.10 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.90 1tkd h ALA 457 Cb 1.17 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1tkd h ALA 457 CO 0.24 0.02 0.37 1.05 0.00 0.00 0.00 179.25 180.93 1tkd h GLU 458 N 0.23 0.28 0.00 0.00 4.11 -0.98 0.21 114.58 118.44 1tkd h GLU 458 Ca 0.10 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.51 1tkd h GLU 458 Cb 0.12 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1tkd h GLU 458 CO -0.02 0.19 0.00 0.72 0.07 0.00 0.00 179.01 179.97 1tkd n HIS 459 N -4.46 0.00 -4.16 2.06 8.25 -0.69 -4.37 115.22 111.85 1tkd n HIS 459 Ca 0.09 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.21 1tkd n HIS 459 Cb 0.40 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.37 1tkd n HIS 459 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1tkd s HIS 460 N -2.00 2.87 -0.13 4.41 5.65 0.05 -4.75 115.29 121.39 1tkd s HIS 460 Ca 0.20 -1.09 -0.12 0.00 0.25 0.00 0.00 55.06 54.30 1tkd s HIS 460 Cb 0.09 -1.99 -0.05 0.00 -1.18 0.00 0.00 32.58 29.45 1tkd s HIS 460 CO 0.16 -0.56 0.27 -0.51 -0.65 0.00 0.00 174.74 173.45 1tkd s LEU 461 N 1.19 4.30 0.27 8.88 1.43 -1.26 -1.13 118.68 132.36 1tkd s LEU 461 Ca 0.02 0.55 -0.30 0.00 -1.03 0.00 0.00 54.13 53.36 1tkd s LEU 461 Cb -0.14 -2.32 -0.13 0.00 0.03 0.00 0.00 46.19 43.62 1tkd s LEU 461 CO -0.04 0.20 1.37 -0.67 0.23 0.00 0.00 176.35 177.44 1tkd n ASP 462 N 2.99 2.73 0.15 2.29 2.03 0.02 -4.78 116.55 121.99 1tkd n ASP 462 Ca -0.14 1.16 0.17 0.00 0.52 0.00 0.00 54.79 56.50 1tkd n ASP 462 Cb 0.52 -1.44 0.77 0.00 -0.72 0.00 0.00 41.12 40.25 1tkd n ASP 462 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1tkd h GLY 463 N 3.73 0.00 0.00 0.27 0.00 -1.91 0.26 103.07 105.41 1tkd h GLY 463 Ca -0.45 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.57 1tkd h GLY 463 CO 0.72 0.00 -2.01 1.39 0.00 0.00 0.00 176.54 176.64 1tkd n ILE 464 N -4.02 1.44 0.62 2.60 5.41 -1.26 -4.69 119.36 119.46 1tkd n ILE 464 Ca 0.03 -0.21 0.12 0.00 1.00 0.00 0.00 62.75 63.69 1tkd n ILE 464 Cb 0.39 -1.98 0.15 0.00 -0.71 0.00 0.00 39.64 37.49 1tkd n ILE 464 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1tkd n THR 465 N -4.23 0.27 -0.97 1.39 -2.24 -1.24 -4.94 114.28 102.33 1tkd n THR 465 Ca -0.40 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 1tkd n THR 465 Cb 0.75 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 1tkd n THR 465 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tkd n GLY 466 N 1.36 0.31 3.76 3.38 0.00 0.08 -4.91 105.19 109.16 1tkd n GLY 466 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1tkd n GLY 466 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tkd s LYS 467 N -0.86 4.45 0.56 1.61 -0.14 -1.26 -4.42 119.74 119.68 1tkd s LYS 467 Ca 0.00 0.98 -0.21 0.00 -1.36 0.00 0.00 55.97 55.38 1tkd s LYS 467 Cb 0.00 -3.33 -0.04 0.00 -1.68 0.00 0.00 37.83 32.77 1tkd s LYS 467 CO 0.00 0.38 1.37 -1.25 -0.76 0.00 0.00 175.35 175.08 1tkd s PRO 468 N -0.34 3.07 0.75 -1.68 0.04 -1.26 -0.80 135.00 134.79 1tkd s PRO 468 Ca 0.36 2.26 -0.10 0.00 0.04 0.00 0.00 61.00 63.56 1tkd s PRO 468 Cb -0.20 -2.23 0.07 0.00 0.04 0.00 0.00 34.50 32.18 1tkd s PRO 468 CO 0.22 -1.25 1.10 -1.58 0.04 0.00 0.00 177.00 175.53 1tkd s TRP 469 N -1.29 2.96 0.18 0.56 0.52 -0.29 -4.85 118.94 116.73 1tkd s TRP 469 Ca 0.73 0.63 0.09 0.00 0.02 0.00 0.00 56.10 57.57 1tkd s TRP 469 Cb -0.41 -3.33 -0.04 0.00 -1.15 0.00 0.00 33.47 28.54 1tkd s TRP 469 CO 0.48 -1.57 -0.11 0.08 0.02 0.00 0.00 176.95 175.86 1tkd s VAL 470 N -3.41 3.14 -0.08 4.03 1.01 0.11 -2.74 120.40 122.45 1tkd s VAL 470 Ca 0.61 -1.67 0.01 0.00 0.00 0.00 0.00 61.98 60.92 1tkd s VAL 470 Cb -0.11 -2.55 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 1tkd s VAL 470 CO 0.47 -0.10 -0.07 -1.58 0.00 0.00 0.00 175.10 173.82 1tkd s GLN 471 N -2.79 2.85 -0.26 2.72 0.74 0.12 0.11 119.66 123.15 1tkd s GLN 471 Ca 0.24 -0.56 0.03 0.00 0.05 0.00 0.00 55.36 55.12 1tkd s GLN 471 Cb -0.09 -2.61 0.06 0.00 1.10 0.00 0.00 33.01 31.47 1tkd s GLN 471 CO 0.15 0.60 -0.11 0.00 -0.55 0.00 0.00 175.29 175.38 1tkd s ALA 472 N -0.63 2.58 -0.18 1.58 0.00 0.31 -1.13 121.76 124.29 1tkd s ALA 472 Ca 0.09 -1.76 -0.07 0.00 0.00 0.00 0.00 51.96 50.22 1tkd s ALA 472 Cb -0.12 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.37 1tkd s ALA 472 CO 0.02 -1.19 0.05 0.20 0.00 0.00 0.00 175.76 174.83 1tkd s GLY 473 N 1.11 1.87 -0.04 0.00 0.00 0.18 -0.81 107.32 109.63 1tkd s GLY 473 Ca -0.09 -0.77 0.02 0.00 0.00 0.00 0.00 44.72 43.88 1tkd s GLY 473 CO -0.05 0.05 -0.08 -0.42 0.00 0.00 0.00 173.10 172.61 1tkd s ILE 474 N 0.41 0.72 -0.03 0.90 1.09 -0.44 0.09 121.20 123.94 1tkd s ILE 474 Ca 0.02 -0.28 0.02 0.00 -1.10 0.00 0.00 60.65 59.31 1tkd s ILE 474 Cb -0.13 -0.68 0.01 0.00 -1.06 0.00 0.00 42.46 40.59 1tkd s ILE 474 CO 0.01 0.25 -0.08 -0.62 -0.10 0.00 0.00 174.94 174.40 1tkd s ASP 475 N 0.55 1.11 0.10 3.58 -1.08 -0.32 -0.60 116.67 120.01 1tkd s ASP 475 Ca -0.09 -0.17 -0.31 0.00 -0.52 0.00 0.00 52.55 51.47 1tkd s ASP 475 Cb -0.12 -0.32 -0.08 0.00 -1.46 0.00 0.00 42.92 40.94 1tkd s ASP 475 CO 0.01 0.05 1.47 0.00 0.52 0.00 0.00 175.17 177.22 1tkd s ALA 476 N 0.27 3.64 -0.16 3.66 0.00 0.97 -1.00 121.76 129.14 1tkd s ALA 476 Ca -0.04 1.15 -0.29 0.00 0.00 0.00 0.00 51.96 52.78 1tkd s ALA 476 Cb -0.09 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.42 1tkd s ALA 476 CO 0.00 -0.77 1.41 -1.12 0.00 0.00 0.00 175.76 175.29 1tkd s SER 477 N 1.43 6.76 -1.56 0.00 0.01 -0.13 -3.93 113.70 116.29 1tkd s SER 477 Ca 0.67 1.75 -0.11 0.00 1.31 0.00 0.00 55.95 59.57 1tkd s SER 477 Cb -0.38 -2.54 0.11 0.00 0.21 0.00 0.00 66.02 63.42 1tkd s SER 477 CO 0.30 -0.91 0.26 0.61 0.41 0.00 0.00 173.24 173.91 1tkd n GLY 478 N 3.98 -0.23 0.31 3.44 0.00 -1.26 -4.72 105.19 106.71 1tkd n GLY 478 Ca 0.16 0.11 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 1tkd n GLY 478 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1tkd h LEU 479 N -1.17 -1.40 -2.24 0.99 5.85 -1.93 -2.14 115.31 113.26 1tkd h LEU 479 Ca -0.57 0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.34 1tkd h LEU 479 Cb 1.27 0.59 -0.00 0.00 0.37 0.00 0.00 40.66 42.89 1tkd h LEU 479 CO 0.73 -0.23 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.22 1tkd h GLU 480 N -0.17 0.00 0.05 1.25 5.08 -1.89 -0.68 114.58 118.22 1tkd h GLU 480 Ca 0.08 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.20 1tkd h GLU 480 Cb 0.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1tkd h GLU 480 CO -0.52 0.04 -1.04 -0.07 -1.00 0.00 0.00 179.01 176.42 1tkd h LEU 481 N 0.00 0.34 -0.91 1.33 3.38 -1.83 -2.16 115.31 115.46 1tkd h LEU 481 Ca -0.00 -0.31 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 1tkd h LEU 481 Cb 0.23 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1tkd h LEU 481 CO 0.01 1.18 -0.54 0.03 0.09 0.00 0.00 178.44 179.21 1tkd h ARG 482 N 0.10 0.00 -0.50 1.13 3.08 -0.55 -0.55 114.38 117.09 1tkd h ARG 482 Ca -0.08 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.87 1tkd h ARG 482 Cb 1.73 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.76 1tkd h ARG 482 CO 0.16 0.54 -0.08 0.00 -1.07 0.00 0.00 179.97 179.52 1tkd h LEU 484 N 0.80 0.25 -0.77 0.00 5.85 -0.86 -1.67 115.31 118.91 1tkd h LEU 484 Ca 0.13 -0.06 0.10 0.00 0.84 0.00 0.00 57.88 58.90 1tkd h LEU 484 Cb 0.63 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.52 1tkd h LEU 484 CO 0.04 0.24 0.40 0.00 -0.34 0.00 0.00 178.44 178.78 1tkd h ALA 485 N 1.02 1.09 0.31 1.25 0.00 -0.85 -0.78 119.26 121.31 1tkd h ALA 485 Ca 0.07 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1tkd h ALA 485 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1tkd h ALA 485 CO -0.01 -0.01 -0.15 1.25 0.00 0.00 0.00 179.25 180.32 1tkd h HIS 486 N 0.66 -0.39 0.00 0.00 -0.00 -0.76 -2.09 115.15 112.57 1tkd h HIS 486 Ca 0.38 -0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.73 1tkd h HIS 486 Cb 0.42 0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 27.95 1tkd h HIS 486 CO -0.09 -0.22 -0.07 0.74 -0.00 0.00 0.00 177.93 178.29 1tkd h PHE 487 N -0.46 0.00 -0.27 5.26 0.04 -0.93 -2.87 116.94 117.72 1tkd h PHE 487 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1tkd h PHE 487 Cb 0.35 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.50 1tkd h PHE 487 CO -0.05 0.07 0.00 0.00 -0.60 0.00 0.00 178.31 177.73 1tkd n MET 488 N -3.23 2.35 0.26 1.51 0.00 -0.33 -4.31 117.12 113.36 1tkd n MET 488 Ca -0.00 -2.12 0.08 0.00 0.00 0.00 0.00 57.70 55.66 1tkd n MET 488 Cb 0.31 -1.47 0.65 0.00 0.00 0.00 0.00 33.22 32.70 1tkd n MET 488 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1tkd h ALA 489 N 4.32 2.00 0.00 3.17 0.00 -1.14 0.25 119.26 127.85 1tkd h ALA 489 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tkd h ALA 489 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1tkd h ALA 489 CO 0.00 -0.01 0.00 2.89 0.00 0.00 0.00 179.25 182.13 1tkd n ARG 490 N -4.51 0.06 -0.08 0.00 1.85 -1.26 0.61 116.66 113.33 1tkd n ARG 490 Ca -0.03 0.25 -0.09 0.00 -1.00 0.00 0.00 57.85 56.98 1tkd n ARG 490 Cb 0.10 -1.60 -0.12 0.00 -1.05 0.00 0.00 32.46 29.79 1tkd n ARG 490 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1tkd n PHE 491 N -1.72 0.00 -0.68 2.89 3.72 0.73 -4.66 117.46 117.74 1tkd n PHE 491 Ca 0.04 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.48 1tkd n PHE 491 Cb 0.23 -0.77 0.06 0.00 -0.94 0.00 0.00 39.48 38.05 1tkd n PHE 491 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1tkd n ASP 492 N -2.67 1.87 -3.87 4.37 5.75 -0.28 -4.99 116.55 116.72 1tkd n ASP 492 Ca -0.27 -2.40 -0.28 0.00 -0.01 0.00 0.00 54.79 51.83 1tkd n ASP 492 Cb 0.99 -0.20 0.02 0.00 -1.03 0.00 0.00 41.12 40.90 1tkd n ASP 492 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1tkd n ASN 493 N -0.84 -3.60 -0.62 -1.12 3.02 0.20 -1.62 115.26 110.69 1tkd n ASN 493 Ca 0.07 -0.81 -0.08 0.00 -0.03 0.00 0.00 54.58 53.73 1tkd n ASN 493 Cb 0.47 -3.87 -0.03 0.00 -0.61 0.00 0.00 39.78 35.74 1tkd n ASN 493 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1tkd n GLY 494 N -1.67 0.96 0.30 7.41 0.00 -1.14 -4.91 105.19 106.13 1tkd n GLY 494 Ca -0.07 -0.37 -0.15 0.00 0.00 0.00 0.00 46.02 45.44 1tkd n GLY 494 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1tkd h GLU 495 N 0.13 -0.58 -0.40 1.61 4.81 -1.64 -1.69 114.58 116.82 1tkd h GLU 495 Ca -0.17 0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.06 1tkd h GLU 495 Cb 0.68 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1tkd h GLU 495 CO 0.24 -0.39 0.06 -0.92 -0.73 0.00 0.00 179.01 177.27 1tkd h TYR 496 N -0.61 0.63 0.00 0.92 3.20 -1.91 -1.62 116.97 117.58 1tkd h TYR 496 Ca -0.03 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.78 1tkd h TYR 496 Cb 0.52 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 1tkd h TYR 496 CO -0.13 0.57 -0.03 0.00 -1.64 0.00 0.00 178.16 176.93 1tkd h ALA 497 N 1.48 1.28 0.07 1.82 0.00 -1.69 -0.23 119.26 121.99 1tkd h ALA 497 Ca 0.13 -0.03 -0.37 0.00 0.00 0.00 0.00 54.91 54.64 1tkd h ALA 497 Cb 0.29 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1tkd h ALA 497 CO 0.00 0.04 -2.14 1.58 0.00 0.00 0.00 179.25 178.73 1tkd n HIS 498 N -3.53 0.80 -0.19 0.00 -0.00 -0.68 -4.38 115.22 107.25 1tkd n HIS 498 Ca -0.02 0.18 -0.10 0.00 -0.00 0.00 0.00 57.72 57.77 1tkd n HIS 498 Cb 0.14 -1.11 0.01 0.00 -0.00 0.00 0.00 29.99 29.03 1tkd n HIS 498 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.34 177.83 1tkd h GLU 499 N 0.04 1.04 -0.06 1.57 4.57 -0.95 -2.99 114.58 117.81 1tkd h GLU 499 Ca -0.47 -0.39 0.02 0.00 -1.18 0.00 0.00 59.36 57.34 1tkd h GLU 499 Cb 2.00 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 30.52 1tkd h GLU 499 CO 0.03 1.08 0.13 0.97 -1.18 0.00 0.00 179.01 180.04 1tkd h ILE 500 N 0.93 0.24 0.00 2.32 2.10 -1.25 -0.02 117.51 121.83 1tkd h ILE 500 Ca 0.14 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.08 1tkd h ILE 500 Cb 0.68 0.89 0.00 0.00 -1.09 0.00 0.00 36.82 37.30 1tkd h ILE 500 CO 0.05 0.00 -0.25 0.18 -1.08 0.00 0.00 178.15 177.05 1tkd n LEU 501 N -3.41 0.33 -4.58 2.19 4.32 -1.13 -4.26 117.00 110.47 1tkd n LEU 501 Ca -0.01 0.29 -0.39 0.00 -0.02 0.00 0.00 56.01 55.88 1tkd n LEU 501 Cb 0.21 -0.36 -0.02 0.00 -1.62 0.00 0.00 43.42 41.64 1tkd n LEU 501 CO 0.22 0.02 1.84 0.21 -1.22 0.00 0.00 177.39 178.46 1tkd s ASN 502 N -3.27 6.35 0.07 -1.43 2.47 -0.02 -4.81 114.94 114.30 1tkd s ASN 502 Ca 0.12 -2.20 0.00 0.00 0.42 0.00 0.00 52.86 51.20 1tkd s ASN 502 Cb 0.17 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 37.39 1tkd s ASN 502 CO 0.62 -1.69 0.00 0.61 -3.72 0.00 0.00 177.10 172.92 1tkd n GLY 503 N 5.57 -2.09 3.69 1.21 0.00 -1.26 -4.79 105.19 107.51 1tkd n GLY 503 Ca 0.47 -1.44 -0.44 0.00 0.00 0.00 0.00 46.02 44.61 1tkd n GLY 503 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1tkd n ASP 504 N -2.72 3.70 -0.15 1.61 2.03 -1.26 -4.89 116.55 114.88 1tkd n ASP 504 Ca -0.01 1.01 -0.06 0.00 0.52 0.00 0.00 54.79 56.26 1tkd n ASP 504 Cb 0.09 -1.49 0.11 0.00 -0.72 0.00 0.00 41.12 39.12 1tkd n ASP 504 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1tkd h ILE 505 N 4.47 1.25 -0.08 5.18 6.09 -1.87 -1.64 117.51 130.91 1tkd h ILE 505 Ca -0.46 -1.06 -0.18 0.00 -1.37 0.00 0.00 64.86 61.79 1tkd h ILE 505 Cb 1.24 0.84 -0.01 0.00 0.47 0.00 0.00 36.82 39.36 1tkd h ILE 505 CO 0.93 0.38 -0.70 0.45 -3.07 0.00 0.00 178.15 176.14 1tkd h HIS 506 N 0.83 0.53 -0.38 2.19 3.86 -1.95 -1.43 115.15 118.80 1tkd h HIS 506 Ca 0.16 -0.23 -0.16 0.00 -1.16 0.00 0.00 60.37 58.99 1tkd h HIS 506 Cb 0.49 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1tkd h HIS 506 CO 0.03 0.97 -0.37 1.15 0.86 0.00 0.00 177.93 180.57 1tkd h THR 507 N 0.27 1.27 0.01 2.45 2.02 -1.88 0.58 112.91 117.63 1tkd h THR 507 Ca -0.02 -1.55 -0.00 0.00 0.77 0.00 0.00 66.41 65.61 1tkd h THR 507 Cb 1.27 1.37 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 1tkd h THR 507 CO 0.12 0.52 -0.01 0.50 0.37 0.00 0.00 175.52 177.02 1tkd h LYS 508 N 0.74 -0.02 -0.49 6.66 3.64 -1.21 -2.33 116.57 123.57 1tkd h LYS 508 Ca 0.06 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1tkd h LYS 508 Cb 0.96 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 1tkd h LYS 508 CO 0.09 0.03 0.29 -0.91 -2.27 0.00 0.00 179.45 176.67 1tkd h ASN 509 N -0.06 0.60 -0.56 4.20 2.35 -1.14 -1.81 115.58 119.17 1tkd h ASN 509 Ca -0.00 -0.07 0.11 0.00 -0.55 0.00 0.00 56.30 55.79 1tkd h ASN 509 Cb 0.05 -0.15 -0.11 0.00 0.05 0.00 0.00 38.32 38.16 1tkd h ASN 509 CO 0.00 0.49 -0.20 -0.61 -1.65 0.00 0.00 177.43 175.46 1tkd h GLN 510 N 0.66 -0.07 0.66 0.81 4.15 -0.62 0.41 115.11 121.11 1tkd h GLN 510 Ca 0.18 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.57 1tkd h GLN 510 Cb 0.01 0.02 0.01 0.00 0.21 0.00 0.00 27.48 27.72 1tkd h GLN 510 CO -0.03 -0.04 -0.32 0.82 -1.93 0.00 0.00 178.83 177.33 1tkd h ILE 511 N -0.07 0.29 -0.86 2.39 2.04 -1.18 0.35 117.51 120.47 1tkd h ILE 511 Ca 0.26 -0.16 0.16 0.00 1.00 0.00 0.00 64.86 66.12 1tkd h ILE 511 Cb 0.47 0.34 -0.06 0.00 -0.74 0.00 0.00 36.82 36.83 1tkd h ILE 511 CO -0.61 0.02 0.56 0.00 0.00 0.00 0.00 178.15 178.12 1tkd h ALA 512 N -0.74 2.02 0.00 1.87 0.00 -0.77 0.24 119.26 121.89 1tkd h ALA 512 Ca -0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1tkd h ALA 512 Cb 0.71 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1tkd h ALA 512 CO 0.15 -0.27 -0.42 0.00 0.00 0.00 0.00 179.25 178.71 1tkd n ALA 513 N -2.48 2.75 -3.04 0.00 0.00 0.14 -4.95 120.51 112.93 1tkd n ALA 513 Ca 0.17 -0.18 -0.13 0.00 0.00 0.00 0.00 53.44 53.30 1tkd n ALA 513 Cb 0.56 -1.26 0.06 0.00 0.00 0.00 0.00 19.45 18.81 1tkd n ALA 513 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1tkd n GLU 514 N -2.10 -4.76 -3.95 0.00 1.02 0.88 -5.02 120.64 106.71 1tkd n GLU 514 Ca 0.04 0.59 -0.33 0.00 -0.02 0.00 0.00 57.16 57.44 1tkd n GLU 514 Cb 0.43 -4.83 -0.05 0.00 -0.02 0.00 0.00 31.44 26.96 1tkd n GLU 514 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1tkd s LEU 515 N -5.08 4.27 0.11 -4.62 1.43 0.68 -5.02 118.68 110.44 1tkd s LEU 515 Ca 0.08 0.30 -0.22 0.00 -1.03 0.00 0.00 54.13 53.25 1tkd s LEU 515 Cb -0.03 -2.57 -0.08 0.00 0.03 0.00 0.00 46.19 43.54 1tkd s LEU 515 CO 0.50 0.26 1.70 1.55 0.23 0.00 0.00 176.35 180.59 1tkd h PRO 516 N 3.81 -0.11 -5.86 1.29 0.13 -1.95 -3.44 132.00 125.89 1tkd h PRO 516 Ca -0.49 0.01 -0.57 0.00 -0.87 0.00 0.00 66.00 64.08 1tkd h PRO 516 Cb 1.18 0.02 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 1tkd h PRO 516 CO 0.68 -0.07 -0.70 0.95 -0.23 0.00 0.00 178.00 178.62 1tkd s THR 517 N -6.17 2.10 0.27 1.56 -4.23 -1.26 -5.02 115.64 102.89 1tkd s THR 517 Ca -0.14 -2.23 0.16 0.00 -1.18 0.00 0.00 61.69 58.30 1tkd s THR 517 Cb 0.08 -2.46 0.11 0.00 1.34 0.00 0.00 72.50 71.58 1tkd s THR 517 CO 0.67 -0.31 1.78 -0.09 -0.54 0.00 0.00 174.62 176.12 1tkd h ARG 518 N 2.20 0.00 -0.08 3.99 2.43 -1.91 -2.57 114.38 118.44 1tkd h ARG 518 Ca -0.41 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.75 1tkd h ARG 518 Cb 1.25 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1tkd h ARG 518 CO 0.66 0.39 -0.01 -0.44 -1.51 0.00 0.00 179.97 179.06 1tkd h ASP 519 N 0.00 0.14 -0.93 -3.80 3.32 -1.95 -2.30 116.42 110.90 1tkd h ASP 519 Ca -0.00 -0.34 0.09 0.00 0.02 0.00 0.00 57.03 56.80 1tkd h ASP 519 Cb 0.80 -0.04 -0.07 0.00 0.22 0.00 0.00 39.33 40.25 1tkd h ASP 519 CO 0.05 0.45 0.60 -1.13 -1.72 0.00 0.00 179.24 177.49 1tkd h ASN 520 N -0.17 0.88 -0.89 6.45 -0.00 -1.91 -0.41 115.58 119.52 1tkd h ASN 520 Ca 0.02 0.02 -0.02 0.00 -0.00 0.00 0.00 56.30 56.33 1tkd h ASN 520 Cb 0.38 -0.16 -0.04 0.00 -0.00 0.00 0.00 38.32 38.50 1tkd h ASN 520 CO 0.01 0.52 0.49 0.00 -0.00 0.00 0.00 177.43 178.44 1tkd h ALA 521 N 1.53 1.14 0.27 1.57 0.00 -1.22 -0.55 119.26 122.00 1tkd h ALA 521 Ca 0.43 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1tkd h ALA 521 Cb 0.36 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1tkd h ALA 521 CO -0.19 0.65 -0.13 0.87 0.00 0.00 0.00 179.25 180.45 1tkd h LYS 522 N 1.24 -0.35 0.00 0.00 1.57 -0.53 0.16 116.57 118.66 1tkd h LYS 522 Ca 0.31 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.12 1tkd h LYS 522 Cb 0.03 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 1tkd h LYS 522 CO -0.05 -0.11 -0.01 0.00 -0.57 0.00 0.00 179.45 178.72 1tkd h THR 523 N -0.56 0.04 0.02 -0.16 1.03 -1.25 -1.39 112.91 110.64 1tkd h THR 523 Ca -0.04 -0.19 -0.00 0.00 -0.01 0.00 0.00 66.41 66.17 1tkd h THR 523 Cb 0.41 1.18 0.00 0.00 -1.07 0.00 0.00 68.15 68.67 1tkd h THR 523 CO 0.06 0.01 -0.01 0.15 -0.01 0.00 0.00 175.52 175.72 1tkd h PHE 524 N 0.00 -0.03 -0.84 0.00 3.57 -0.54 -2.79 116.94 116.31 1tkd h PHE 524 Ca -0.00 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1tkd h PHE 524 Cb 0.18 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.89 1tkd h PHE 524 CO 0.00 0.49 0.47 0.97 -2.23 0.00 0.00 178.31 178.01 1tkd h ILE 525 N -0.98 1.24 -0.09 1.41 6.09 -0.43 0.89 117.51 125.64 1tkd h ILE 525 Ca -0.00 -0.58 -0.22 0.00 -1.37 0.00 0.00 64.86 62.70 1tkd h ILE 525 Cb 0.53 0.09 0.01 0.00 0.47 0.00 0.00 36.82 37.92 1tkd h ILE 525 CO 0.01 0.26 -0.82 1.88 -3.07 0.00 0.00 178.15 176.41 1tkd h TYR 526 N 1.16 0.82 -0.69 2.19 0.05 -1.41 0.19 116.97 119.28 1tkd h TYR 526 Ca 0.30 -0.38 -0.05 0.00 0.05 0.00 0.00 58.73 58.64 1tkd h TYR 526 Cb 0.00 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 37.60 1tkd h TYR 526 CO 0.01 1.19 0.23 0.78 -1.05 0.00 0.00 178.16 179.32 1tkd h GLY 527 N 0.90 1.13 0.83 3.88 0.00 -1.20 -1.06 103.07 107.56 1tkd h GLY 527 Ca -0.06 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.57 1tkd h GLY 527 CO 0.15 0.62 -0.40 -2.75 0.00 0.00 0.00 176.54 174.16 1tkd h PHE 528 N 1.00 -1.03 -0.99 5.60 3.57 -0.72 -0.26 116.94 124.11 1tkd h PHE 528 Ca 0.22 -0.02 0.23 0.00 3.53 0.00 0.00 57.97 61.93 1tkd h PHE 528 Cb 0.28 0.34 -0.09 0.00 2.79 0.00 0.00 35.95 39.27 1tkd h PHE 528 CO 0.02 -0.64 0.63 1.25 -2.23 0.00 0.00 178.31 177.34 1tkd h LEU 529 N -1.29 0.51 -2.13 0.59 5.85 -0.55 -1.83 115.31 116.46 1tkd h LEU 529 Ca -0.11 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1tkd h LEU 529 Cb 0.85 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.87 1tkd h LEU 529 CO 0.19 0.15 0.00 -1.22 -0.34 0.00 0.00 178.44 177.22 1tkd n TYR 530 N -4.61 0.93 -0.27 1.25 4.01 -0.41 -4.95 117.16 113.11 1tkd n TYR 530 Ca 0.23 -0.38 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 1tkd n TYR 530 Cb 0.75 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 39.63 1tkd n TYR 530 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tkd n GLY 531 N 0.90 1.10 3.77 2.72 0.00 -0.69 -4.90 105.19 108.09 1tkd n GLY 531 Ca 0.17 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 1tkd n GLY 531 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tkd s ALA 532 N -2.00 3.02 0.97 4.61 0.00 -0.12 -5.01 121.76 123.23 1tkd s ALA 532 Ca 0.00 1.05 -0.14 0.00 0.00 0.00 0.00 51.96 52.87 1tkd s ALA 532 Cb 0.00 -3.43 0.17 0.00 0.00 0.00 0.00 23.12 19.87 1tkd s ALA 532 CO 0.00 -0.78 1.17 0.20 0.00 0.00 0.00 175.76 176.35 1tkd s GLY 533 N -1.17 1.61 0.21 0.00 0.00 -1.26 -4.76 107.32 101.96 1tkd s GLY 533 Ca 0.63 -0.71 -0.09 0.00 0.00 0.00 0.00 44.72 44.55 1tkd s GLY 533 CO 0.39 -0.06 1.82 -0.55 0.00 0.00 0.00 173.10 174.70 1tkd h ASP 534 N -1.70 0.62 -0.14 1.64 3.32 -1.90 0.08 116.42 118.33 1tkd h ASP 534 Ca -0.48 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.52 1tkd h ASP 534 Cb 1.31 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.76 1tkd h ASP 534 CO 0.53 0.40 -0.17 -0.08 -1.72 0.00 0.00 179.24 178.21 1tkd h GLU 535 N 0.75 0.37 -0.94 3.56 4.81 -1.87 -1.44 114.58 119.82 1tkd h GLU 535 Ca 0.31 -0.20 0.13 0.00 -0.13 0.00 0.00 59.36 59.47 1tkd h GLU 535 Cb 0.16 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.47 1tkd h GLU 535 CO -0.17 0.77 0.60 -0.22 -0.73 0.00 0.00 179.01 179.26 1tkd h LYS 536 N -0.01 0.81 -0.27 1.92 1.63 -1.81 0.11 116.57 118.94 1tkd h LYS 536 Ca 0.02 -0.05 -0.10 0.00 -0.85 0.00 0.00 60.65 59.67 1tkd h LYS 536 Cb 0.71 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 1tkd h LYS 536 CO 0.04 0.54 -0.23 0.82 -3.45 0.00 0.00 179.45 177.17 1tkd h ILE 537 N 0.84 1.31 -0.69 2.00 1.08 -0.86 -2.66 117.51 118.52 1tkd h ILE 537 Ca 0.47 -1.37 0.06 0.00 -0.39 0.00 0.00 64.86 63.63 1tkd h ILE 537 Cb 0.61 1.59 -0.06 0.00 -3.07 0.00 0.00 36.82 35.89 1tkd h ILE 537 CO -0.24 0.43 0.38 1.23 -0.69 0.00 0.00 178.15 179.27 1tkd h GLY 538 N 0.36 1.01 1.01 5.37 0.00 0.13 -1.44 103.07 109.51 1tkd h GLY 538 Ca 0.05 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 1tkd h GLY 538 CO 0.06 0.16 0.50 -1.61 0.00 0.00 0.00 176.54 175.65 1tkd h GLN 539 N 0.70 1.13 -0.76 4.80 4.15 -0.83 0.72 115.11 125.02 1tkd h GLN 539 Ca 0.31 -0.10 -0.02 0.00 0.77 0.00 0.00 58.65 59.61 1tkd h GLN 539 Cb 0.20 -0.24 -0.04 0.00 0.21 0.00 0.00 27.48 27.61 1tkd h GLN 539 CO -0.19 0.79 0.40 0.82 -1.93 0.00 0.00 178.83 178.73 1tkd h ILE 540 N 1.14 1.23 0.00 2.39 2.04 -0.93 -2.80 117.51 120.58 1tkd h ILE 540 Ca 0.30 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1tkd h ILE 540 Cb -0.05 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.24 1tkd h ILE 540 CO -0.06 0.26 -0.94 1.33 0.00 0.00 0.00 178.15 178.75 1tkd n VAL 541 N -4.35 0.09 -0.65 1.67 0.24 -0.79 -4.94 118.33 109.60 1tkd n VAL 541 Ca 0.08 -0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 1tkd n VAL 541 Cb 0.11 0.39 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 1tkd n VAL 541 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tkd n GLY 542 N 1.42 1.40 0.00 7.63 0.00 0.12 -5.00 105.19 110.77 1tkd n GLY 542 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1tkd n GLY 542 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tkd n ALA 543 N -0.96 0.00 -4.66 4.61 0.00 0.21 -4.99 120.51 114.72 1tkd n ALA 543 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1tkd n ALA 543 Cb 0.15 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.54 1tkd n ALA 543 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tkd n GLY 544 N 1.66 3.47 0.44 0.00 0.00 -1.26 -3.88 105.19 105.61 1tkd n GLY 544 Ca 0.00 -2.29 0.24 0.00 0.00 0.00 0.00 46.02 43.96 1tkd n GLY 544 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1tkd h LYS 545 N 0.00 0.00 0.24 1.61 2.10 -1.83 0.68 116.57 119.36 1tkd h LYS 545 Ca -0.39 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.25 1tkd h LYS 545 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 1tkd h LYS 545 CO 0.63 0.00 -0.11 0.93 -2.00 0.00 0.00 179.45 178.90 1tkd h GLU 546 N 0.00 -0.31 -0.13 0.07 4.39 -1.94 -2.31 114.58 114.35 1tkd h GLU 546 Ca 0.30 0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.98 1tkd h GLU 546 Cb 1.74 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 30.44 1tkd h GLU 546 CO -0.00 0.02 -0.14 -0.09 -1.16 0.00 0.00 179.01 177.63 1tkd h ARG 547 N -0.67 0.20 0.21 2.33 9.65 -1.28 -3.00 114.38 121.83 1tkd h ARG 547 Ca -0.03 -0.05 0.01 0.00 -1.10 0.00 0.00 59.98 58.81 1tkd h ARG 547 Cb 0.47 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.99 1tkd h ARG 547 CO 0.05 0.35 -0.31 0.78 2.80 0.00 0.00 179.97 183.64 1tkd h GLY 548 N 0.73 -0.66 0.60 2.80 0.00 -0.94 -2.22 103.07 103.39 1tkd h GLY 548 Ca 0.04 0.37 0.07 0.00 0.00 0.00 0.00 47.33 47.80 1tkd h GLY 548 CO 0.02 -0.26 0.30 0.50 0.00 0.00 0.00 176.54 177.11 1tkd h LYS 549 N -0.59 0.54 0.15 4.80 1.57 -1.28 -1.09 116.57 120.66 1tkd h LYS 549 Ca 0.01 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1tkd h LYS 549 Cb 0.58 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 1tkd h LYS 549 CO -0.12 0.36 -0.30 0.93 -0.57 0.00 0.00 179.45 179.74 1tkd h GLU 550 N 0.55 -0.53 -0.59 3.15 5.08 -1.40 -0.75 114.58 120.10 1tkd h GLU 550 Ca 0.28 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.72 1tkd h GLU 550 Cb 0.24 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 1tkd h GLU 550 CO -0.21 -0.35 0.33 -0.07 -1.00 0.00 0.00 179.01 177.71 1tkd h LEU 551 N -0.55 0.51 -0.43 1.33 4.07 -1.14 0.13 115.31 119.23 1tkd h LEU 551 Ca 0.02 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 57.98 1tkd h LEU 551 Cb 0.56 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.20 1tkd h LEU 551 CO -0.16 0.35 0.17 0.11 -1.08 0.00 0.00 178.44 177.83 1tkd h LYS 552 N 0.64 0.64 -0.08 1.13 1.57 -0.93 -1.84 116.57 117.69 1tkd h LYS 552 Ca 0.25 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 58.79 1tkd h LYS 552 Cb 0.10 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1tkd h LYS 552 CO -0.14 0.60 -0.50 1.57 -0.57 0.00 0.00 179.45 180.40 1tkd h LYS 553 N 0.55 0.22 -0.47 3.15 2.10 -0.92 -1.01 116.57 120.19 1tkd h LYS 553 Ca 0.14 -0.13 -0.11 0.00 -2.00 0.00 0.00 60.65 58.55 1tkd h LYS 553 Cb 0.20 0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 31.52 1tkd h LYS 553 CO -0.01 0.67 -0.16 -0.22 -2.00 0.00 0.00 179.45 177.73 1tkd h LYS 554 N 0.18 0.91 0.00 0.07 3.64 -0.71 0.46 116.57 121.13 1tkd h LYS 554 Ca 0.01 -0.35 -0.17 0.00 -1.27 0.00 0.00 60.65 58.87 1tkd h LYS 554 Cb 0.95 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.69 1tkd h LYS 554 CO 0.08 1.00 -1.02 0.74 -2.27 0.00 0.00 179.45 177.98 1tkd h PHE 555 N 0.80 0.00 0.01 1.91 -1.00 -1.27 -2.72 116.94 114.67 1tkd h PHE 555 Ca 0.12 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.71 1tkd h PHE 555 Cb 0.70 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.24 1tkd h PHE 555 CO 0.04 0.71 -0.89 1.25 -1.61 0.00 0.00 178.31 177.82 1tkd h LEU 556 N 0.00 0.13 -0.04 1.54 5.85 -1.12 -2.87 115.31 118.80 1tkd h LEU 556 Ca -0.08 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1tkd h LEU 556 Cb 1.61 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.60 1tkd h LEU 556 CO 0.08 0.95 -0.01 -0.08 -0.34 0.00 0.00 178.44 179.04 1tkd h GLU 557 N 0.05 0.08 -0.63 1.25 4.57 -0.96 -2.23 114.58 116.71 1tkd h GLU 557 Ca -0.03 -0.03 0.12 0.00 -1.18 0.00 0.00 59.36 58.24 1tkd h GLU 557 Cb 1.54 -0.00 -0.09 0.00 -0.16 0.00 0.00 28.75 30.03 1tkd h GLU 557 CO 0.13 0.42 0.15 -0.97 -1.18 0.00 0.00 179.01 177.56 1tkd h ASN 558 N -0.27 0.03 -2.81 1.04 -1.24 -1.47 -3.31 115.58 107.56 1tkd h ASN 558 Ca 0.01 0.12 -0.60 0.00 0.71 0.00 0.00 56.30 56.54 1tkd h ASN 558 Cb 0.39 0.15 -0.40 0.00 0.73 0.00 0.00 38.32 39.20 1tkd h ASN 558 CO 0.00 0.02 -0.81 0.42 -1.29 0.00 0.00 177.43 175.77 1tkd s THR 559 N -6.09 1.16 -0.33 -3.57 -4.23 -1.09 -4.97 115.64 96.52 1tkd s THR 559 Ca -0.13 -2.92 0.21 0.00 -1.18 0.00 0.00 61.69 57.67 1tkd s THR 559 Cb 0.18 -1.79 0.21 0.00 1.34 0.00 0.00 72.50 72.45 1tkd s THR 559 CO 0.74 -1.08 1.64 -0.81 -0.54 0.00 0.00 174.62 174.57 1tkd n PRO 560 N 2.92 0.15 0.32 3.99 -0.04 -0.85 -2.47 135.00 139.02 1tkd n PRO 560 Ca 0.21 0.56 0.20 0.00 -0.04 0.00 0.00 63.50 64.44 1tkd n PRO 560 Cb 0.41 -1.91 1.10 0.00 -0.04 0.00 0.00 33.50 33.06 1tkd n PRO 560 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1tkd h ALA 561 N 2.08 1.11 -0.86 0.55 0.00 -1.93 -0.89 119.26 119.33 1tkd h ALA 561 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tkd h ALA 561 Cb 0.11 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1tkd h ALA 561 CO 0.00 0.01 0.56 0.82 0.00 0.00 0.00 179.25 180.64 1tkd h ILE 562 N 0.00 1.23 -0.54 0.00 2.04 -1.83 0.45 117.51 118.86 1tkd h ILE 562 Ca -0.00 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 1tkd h ILE 562 Cb 0.06 -0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.09 1tkd h ILE 562 CO 0.00 0.23 0.27 0.00 0.00 0.00 0.00 178.15 178.65 1tkd h ALA 563 N 1.31 0.70 -0.40 1.87 0.00 -1.41 -1.05 119.26 120.28 1tkd h ALA 563 Ca 0.31 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.13 1tkd h ALA 563 Cb -0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 1tkd h ALA 563 CO -0.07 0.26 0.22 0.00 0.00 0.00 0.00 179.25 179.66 1tkd h ALA 564 N 1.11 0.51 -0.51 0.00 0.00 -1.25 -0.24 119.26 118.88 1tkd h ALA 564 Ca 0.19 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1tkd h ALA 564 Cb 0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1tkd h ALA 564 CO -0.03 -0.13 0.20 1.25 0.00 0.00 0.00 179.25 180.54 1tkd h LEU 565 N 0.44 0.71 -1.21 0.00 5.85 -0.70 -1.76 115.31 118.64 1tkd h LEU 565 Ca 0.17 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1tkd h LEU 565 Cb 0.05 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 1tkd h LEU 565 CO -0.10 0.68 0.43 0.03 -0.34 0.00 0.00 178.44 179.15 1tkd h ARG 566 N 0.68 0.97 -0.07 1.25 3.08 -0.71 -2.09 114.38 117.50 1tkd h ARG 566 Ca 0.17 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 1tkd h ARG 566 Cb 0.20 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 1tkd h ARG 566 CO -0.01 0.68 -0.06 0.93 -1.07 0.00 0.00 179.97 180.43 1tkd h GLU 567 N 0.99 0.16 -0.95 0.04 5.08 -0.71 -2.33 114.58 116.87 1tkd h GLU 567 Ca 0.26 -0.08 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1tkd h GLU 567 Cb -0.04 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.16 1tkd h GLU 567 CO -0.05 0.60 0.63 0.66 -1.00 0.00 0.00 179.01 179.85 1tkd h SER 568 N -0.26 1.08 -0.06 1.42 4.64 -1.14 0.26 113.55 119.48 1tkd h SER 568 Ca 0.01 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1tkd h SER 568 Cb 0.56 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1tkd h SER 568 CO 0.02 0.77 0.04 0.40 -0.87 0.00 0.00 176.83 177.18 1tkd h ILE 569 N 1.27 1.07 0.27 0.95 2.04 -1.39 -0.39 117.51 121.33 1tkd h ILE 569 Ca 0.36 -0.21 0.01 0.00 1.00 0.00 0.00 64.86 66.02 1tkd h ILE 569 Cb -0.10 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1tkd h ILE 569 CO -0.09 0.06 -0.38 1.56 0.00 0.00 0.00 178.15 179.30 1tkd h GLN 570 N 0.02 -0.69 -1.01 2.37 1.08 -0.78 -0.19 115.11 115.92 1tkd h GLN 570 Ca 0.02 0.05 0.23 0.00 -1.45 0.00 0.00 58.65 57.50 1tkd h GLN 570 Cb 0.07 0.16 -0.11 0.00 -0.05 0.00 0.00 27.48 27.54 1tkd h GLN 570 CO -0.00 -0.46 0.61 0.37 -0.95 0.00 0.00 178.83 178.40 1tkd h GLN 571 N -0.71 0.59 -0.14 1.46 5.75 -0.36 0.24 115.11 121.94 1tkd h GLN 571 Ca -0.01 -0.04 -0.21 0.00 -0.15 0.00 0.00 58.65 58.25 1tkd h GLN 571 Cb 0.68 -0.13 0.01 0.00 1.07 0.00 0.00 27.48 29.11 1tkd h GLN 571 CO -0.14 0.39 -0.72 1.15 -2.65 0.00 0.00 178.83 176.86 1tkd h THR 572 N 0.61 1.30 0.01 2.39 2.02 -0.38 -3.39 112.91 115.46 1tkd h THR 572 Ca 0.61 -1.94 -0.25 0.00 0.77 0.00 0.00 66.41 65.61 1tkd h THR 572 Cb 1.16 2.03 -0.03 0.00 -1.74 0.00 0.00 68.15 69.57 1tkd h THR 572 CO -0.41 0.61 -1.33 -0.07 0.37 0.00 0.00 175.52 174.69 1tkd h LEU 573 N 0.45 0.04 -9.75 2.58 3.38 -0.15 -3.39 115.31 108.47 1tkd h LEU 573 Ca -0.05 -0.54 -0.58 0.00 0.09 0.00 0.00 57.88 56.80 1tkd h LEU 573 Cb 1.36 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 42.05 1tkd h LEU 573 CO 0.15 1.53 -0.13 -0.69 0.09 0.00 0.00 178.44 179.39 1tkd s VAL 574 N -2.38 4.91 -0.20 1.22 1.01 0.77 -0.05 120.40 125.68 1tkd s VAL 574 Ca -0.28 0.88 -0.01 0.00 0.00 0.00 0.00 61.98 62.57 1tkd s VAL 574 Cb 0.06 -3.76 -0.12 0.00 0.00 0.00 0.00 36.38 32.56 1tkd s VAL 574 CO 0.61 0.44 -0.19 1.21 0.00 0.00 0.00 175.10 177.16 1tkd n GLU 575 N 1.38 0.48 -3.58 2.72 4.07 -0.29 -4.64 120.64 120.79 1tkd n GLU 575 Ca -0.10 0.13 -0.07 0.00 -0.06 0.00 0.00 57.16 57.06 1tkd n GLU 575 Cb 0.52 -1.36 -0.04 0.00 -0.06 0.00 0.00 31.44 30.50 1tkd n GLU 575 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 1tkd s SER 576 N -6.08 -0.26 0.16 4.31 1.04 -1.15 -5.02 113.70 106.69 1tkd s SER 576 Ca -0.27 0.18 -0.14 0.00 0.48 0.00 0.00 55.95 56.20 1tkd s SER 576 Cb 0.08 0.24 0.02 0.00 0.10 0.00 0.00 66.02 66.45 1tkd s SER 576 CO 0.44 -0.32 0.40 -0.94 0.98 0.00 0.00 173.24 173.80 1tkd s SER 577 N -1.60 -0.15 -0.20 7.02 1.04 -1.26 0.19 113.70 118.74 1tkd s SER 577 Ca 0.04 -0.55 -0.29 0.00 0.48 0.00 0.00 55.95 55.63 1tkd s SER 577 Cb -0.01 0.50 0.14 0.00 0.10 0.00 0.00 66.02 66.75 1tkd s SER 577 CO -0.03 -0.93 1.07 -1.10 0.98 0.00 0.00 173.24 173.23 1tkd s GLN 578 N -3.88 0.48 0.02 4.02 -0.21 -0.10 -5.00 119.66 114.99 1tkd s GLN 578 Ca 0.09 0.17 -0.22 0.00 0.02 0.00 0.00 55.36 55.42 1tkd s GLN 578 Cb 0.01 0.23 -0.06 0.00 1.00 0.00 0.00 33.01 34.20 1tkd s GLN 578 CO -0.05 -0.14 0.65 -1.58 -2.12 0.00 0.00 175.29 172.05 1tkd s TRP 579 N -0.90 3.71 -0.12 0.91 0.51 -1.26 0.14 118.94 121.93 1tkd s TRP 579 Ca 0.01 1.30 -0.10 0.00 -2.12 0.00 0.00 56.10 55.20 1tkd s TRP 579 Cb -0.01 -2.67 -0.03 0.00 -0.81 0.00 0.00 33.47 29.94 1tkd s TRP 579 CO -0.01 0.35 -0.19 0.28 -0.51 0.00 0.00 176.95 176.87 1tkd n VAL 580 N 2.65 1.06 0.00 4.03 0.31 0.12 -4.90 118.33 121.60 1tkd n VAL 580 Ca -0.06 0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.54 1tkd n VAL 580 Cb 0.51 -2.14 0.00 0.00 -0.91 0.00 0.00 33.84 31.30 1tkd n VAL 580 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1tkd n ALA 581 N -3.56 1.53 -1.42 3.52 0.00 -1.26 -4.93 120.51 114.39 1tkd n ALA 581 Ca -0.07 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.20 1tkd n ALA 581 Cb 0.28 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.89 1tkd n ALA 581 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tkd n GLY 582 N 0.77 5.04 3.51 0.00 0.00 -1.26 -4.98 105.19 108.27 1tkd n GLY 582 Ca 0.00 -1.45 -0.09 0.00 0.00 0.00 0.00 46.02 44.48 1tkd n GLY 582 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1tkd s GLU 583 N -3.38 1.04 -0.35 1.61 4.04 -1.26 -5.14 118.70 115.27 1tkd s GLU 583 Ca 0.52 -0.41 -0.05 0.00 0.04 0.00 0.00 54.97 55.07 1tkd s GLU 583 Cb 0.44 0.46 0.06 0.00 0.02 0.00 0.00 34.13 35.11 1tkd s GLU 583 CO 0.03 -0.46 0.10 -1.14 -1.84 0.00 0.00 175.26 171.96 1tkd s GLN 584 N -3.37 2.49 -0.07 -4.83 0.74 -1.26 -0.70 119.66 112.66 1tkd s GLN 584 Ca 0.05 -1.31 -0.30 0.00 0.05 0.00 0.00 55.36 53.85 1tkd s GLN 584 Cb -0.01 -3.43 -0.02 0.00 1.10 0.00 0.00 33.01 30.64 1tkd s GLN 584 CO -0.09 -0.73 1.05 -0.65 -0.55 0.00 0.00 175.29 174.32 1tkd s GLN 585 N 1.33 4.44 0.01 1.67 -1.52 0.37 -4.81 119.66 121.14 1tkd s GLN 585 Ca -0.01 1.47 0.06 0.00 -1.95 0.00 0.00 55.36 54.93 1tkd s GLN 585 Cb -0.20 -3.52 -0.03 0.00 -0.22 0.00 0.00 33.01 29.04 1tkd s GLN 585 CO 0.01 -0.29 -0.18 0.08 -0.25 0.00 0.00 175.29 174.66 1tkd s VAL 586 N 1.82 2.81 -0.33 1.09 1.01 -1.26 -0.93 120.40 124.60 1tkd s VAL 586 Ca 0.51 -1.06 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 1tkd s VAL 586 Cb -0.20 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.04 1tkd s VAL 586 CO 0.21 0.42 0.15 -0.54 0.00 0.00 0.00 175.10 175.34 1tkd s LYS 587 N -1.20 3.05 0.13 2.72 1.02 0.13 -4.99 119.74 120.59 1tkd s LYS 587 Ca 0.14 -0.91 -0.07 0.00 0.02 0.00 0.00 55.97 55.15 1tkd s LYS 587 Cb -0.10 -3.57 -0.06 0.00 -0.52 0.00 0.00 37.83 33.57 1tkd s LYS 587 CO 0.04 -0.54 0.40 -1.58 -0.92 0.00 0.00 175.35 172.75 1tkd s TRP 588 N 1.55 3.51 -0.15 3.18 0.52 -1.26 -1.13 118.94 125.16 1tkd s TRP 588 Ca 0.03 0.67 -0.16 0.00 0.02 0.00 0.00 56.10 56.65 1tkd s TRP 588 Cb -0.18 -2.08 -0.24 0.00 -1.15 0.00 0.00 33.47 29.82 1tkd s TRP 588 CO 0.05 0.45 0.40 0.87 0.02 0.00 0.00 176.95 178.74 1tkd h LYS 589 N 3.13 0.15 -2.73 4.98 1.57 -0.74 -3.45 116.57 119.47 1tkd h LYS 589 Ca -0.47 -0.25 -0.12 0.00 -1.87 0.00 0.00 60.65 57.93 1tkd h LYS 589 Cb 1.18 0.09 -0.25 0.00 0.08 0.00 0.00 32.23 33.33 1tkd h LYS 589 CO 0.70 1.12 -0.28 0.50 -0.57 0.00 0.00 179.45 180.92 1tkd s ARG 590 N -2.44 0.42 -0.35 3.15 3.52 -1.19 -5.07 118.95 116.99 1tkd s ARG 590 Ca -0.24 0.65 0.08 0.00 -0.13 0.00 0.00 55.73 56.09 1tkd s ARG 590 Cb 0.05 0.10 0.61 0.00 -1.56 0.00 0.00 34.95 34.15 1tkd s ARG 590 CO 0.70 -0.10 1.69 -2.13 -0.81 0.00 0.00 175.30 174.64 1tkd n ARG 591 N 3.52 2.33 -3.77 5.12 0.63 -1.26 -4.59 116.66 118.63 1tkd n ARG 591 Ca -0.18 -3.08 -0.13 0.00 -0.92 0.00 0.00 57.85 53.54 1tkd n ARG 591 Cb 0.56 -2.01 -0.08 0.00 0.45 0.00 0.00 32.46 31.37 1tkd n ARG 591 CO 0.00 0.00 0.00 1.67 -2.51 0.00 0.00 177.63 176.79 1tkd s TRP 592 N -3.21 -0.14 -0.02 -0.14 1.48 -1.26 -1.50 118.94 114.16 1tkd s TRP 592 Ca 0.51 0.14 -0.02 0.00 -1.06 0.00 0.00 56.10 55.67 1tkd s TRP 592 Cb 0.44 0.08 -0.04 0.00 -1.16 0.00 0.00 33.47 32.79 1tkd s TRP 592 CO 0.07 -0.41 0.12 0.42 -4.06 0.00 0.00 176.95 173.08 1tkd s ILE 593 N -1.70 5.02 -0.43 0.66 -1.09 0.92 -4.82 121.20 119.77 1tkd s ILE 593 Ca -0.11 -0.27 -0.24 0.00 -2.23 0.00 0.00 60.65 57.79 1tkd s ILE 593 Cb -0.04 -3.30 0.02 0.00 -1.58 0.00 0.00 42.46 37.56 1tkd s ILE 593 CO 0.02 0.37 0.86 -0.75 -1.23 0.00 0.00 174.94 174.21 1tkd s LYS 594 N -1.74 3.58 1.06 2.79 2.20 -1.26 0.79 119.74 127.16 1tkd s LYS 594 Ca 0.24 0.17 -0.12 0.00 -0.36 0.00 0.00 55.97 55.89 1tkd s LYS 594 Cb -0.12 -3.89 0.22 0.00 -1.51 0.00 0.00 37.83 32.53 1tkd s LYS 594 CO 0.15 -1.09 1.07 0.20 -0.36 0.00 0.00 175.35 175.31 1tkd s GLY 595 N 2.11 1.56 0.52 5.54 0.00 0.14 -4.83 107.32 112.36 1tkd s GLY 595 Ca 0.34 -0.22 0.23 0.00 0.00 0.00 0.00 44.72 45.07 1tkd s GLY 595 CO 0.23 0.43 2.02 1.41 0.00 0.00 0.00 173.10 177.18 1tkd h LEU 596 N -2.17 0.04 -3.22 0.66 3.38 -1.91 0.12 115.31 112.21 1tkd h LEU 596 Ca -0.57 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.40 1tkd h LEU 596 Cb 1.33 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1tkd h LEU 596 CO 0.54 0.02 0.00 -0.90 0.09 0.00 0.00 178.44 178.19 1tkd n ASP 597 N -4.41 4.87 0.00 -0.43 5.68 -1.26 -4.95 116.55 116.05 1tkd n ASP 597 Ca 0.08 -2.56 0.00 0.00 -0.50 0.00 0.00 54.79 51.81 1tkd n ASP 597 Cb 0.50 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 39.89 1tkd n ASP 597 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1tkd n GLY 598 N 0.94 2.30 3.72 6.12 0.00 0.03 -2.65 105.19 115.65 1tkd n GLY 598 Ca 0.26 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 1tkd n GLY 598 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1tkd s ARG 599 N -0.69 1.57 -0.04 1.61 1.70 -1.26 -4.51 118.95 117.33 1tkd s ARG 599 Ca 0.00 1.13 -0.24 0.00 -0.47 0.00 0.00 55.73 56.14 1tkd s ARG 599 Cb 0.00 -1.82 -0.04 0.00 -0.57 0.00 0.00 34.95 32.52 1tkd s ARG 599 CO 0.00 -2.11 0.74 0.15 -1.08 0.00 0.00 175.30 173.00 1tkd s LYS 600 N -4.84 4.46 -0.33 3.89 1.02 -1.26 0.28 119.74 122.96 1tkd s LYS 600 Ca 0.63 0.98 -0.00 0.00 0.02 0.00 0.00 55.97 57.59 1tkd s LYS 600 Cb -0.19 -3.43 0.07 0.00 -0.52 0.00 0.00 37.83 33.76 1tkd s LYS 600 CO 0.57 0.09 0.04 0.08 -0.92 0.00 0.00 175.35 175.22 1tkd s VAL 601 N 0.66 2.83 0.21 3.17 1.01 0.24 -4.88 120.40 123.63 1tkd s VAL 601 Ca 0.39 -1.73 -0.32 0.00 0.00 0.00 0.00 61.98 60.32 1tkd s VAL 601 Cb -0.19 -2.78 -0.13 0.00 0.00 0.00 0.00 36.38 33.29 1tkd s VAL 601 CO 0.20 -0.31 1.59 1.57 0.00 0.00 0.00 175.10 178.15 1tkd n HIS 602 N 4.53 2.47 -3.71 5.22 -0.00 -1.26 -0.06 115.22 122.42 1tkd n HIS 602 Ca -0.08 0.24 -0.37 0.00 0.46 0.00 0.00 57.72 57.97 1tkd n HIS 602 Cb 0.42 -2.57 -0.11 0.00 -0.12 0.00 0.00 29.99 27.61 1tkd n HIS 602 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1tkd s VAL 603 N 0.65 4.90 0.07 3.57 1.01 -0.56 -4.86 120.40 125.18 1tkd s VAL 603 Ca 0.73 0.03 -0.13 0.00 0.00 0.00 0.00 61.98 62.61 1tkd s VAL 603 Cb -0.60 -3.30 -0.24 0.00 0.00 0.00 0.00 36.38 32.24 1tkd s VAL 603 CO 0.40 0.32 1.18 0.03 0.00 0.00 0.00 175.10 177.03 1tkd h ARG 604 N 8.02 0.67 -3.10 2.72 3.08 -1.94 -3.47 114.38 120.37 1tkd h ARG 604 Ca -0.37 -0.76 -0.12 0.00 0.07 0.00 0.00 59.98 58.81 1tkd h ARG 604 Cb 1.18 0.22 -0.20 0.00 0.08 0.00 0.00 29.97 31.25 1tkd h ARG 604 CO 0.59 1.33 -0.29 -1.54 -1.07 0.00 0.00 179.97 178.99 1tkd s SER 605 N -7.31 -0.16 0.47 7.04 1.04 -1.26 -5.02 113.70 108.50 1tkd s SER 605 Ca -0.09 0.03 0.17 0.00 0.48 0.00 0.00 55.95 56.54 1tkd s SER 605 Cb 0.07 0.30 1.15 0.00 0.10 0.00 0.00 66.02 67.64 1tkd s SER 605 CO 0.92 -0.46 2.00 -0.65 0.98 0.00 0.00 173.24 176.04 1tkd h PRO 606 N 3.84 0.26 -0.28 4.02 0.11 -1.99 -2.13 132.00 135.84 1tkd h PRO 606 Ca -0.30 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.68 1tkd h PRO 606 Cb 1.18 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1tkd h PRO 606 CO 0.41 0.17 -0.27 1.25 -0.21 0.00 0.00 178.00 179.34 1tkd h HIS 607 N 0.26 0.81 -0.00 0.65 2.76 -2.00 -3.05 115.15 114.59 1tkd h HIS 607 Ca 0.24 -0.24 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1tkd h HIS 607 Cb 0.61 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 29.40 1tkd h HIS 607 CO -0.00 0.98 -0.00 0.00 -1.30 0.00 0.00 177.93 177.60 1tkd n ALA 608 N -2.49 2.64 -0.15 5.26 0.00 -0.86 -4.30 120.51 120.62 1tkd n ALA 608 Ca -0.04 -0.20 -0.07 0.00 0.00 0.00 0.00 53.44 53.13 1tkd n ALA 608 Cb 0.46 -1.49 -0.02 0.00 0.00 0.00 0.00 19.45 18.40 1tkd n ALA 608 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tkd h ALA 609 N 3.88 -0.19 -0.91 0.00 0.00 -1.29 0.25 119.26 120.99 1tkd h ALA 609 Ca 0.00 0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1tkd h ALA 609 Cb 0.09 0.78 -0.07 0.00 0.00 0.00 0.00 17.79 18.59 1tkd h ALA 609 CO 0.00 -0.74 0.59 1.25 0.00 0.00 0.00 179.25 180.35 1tkd h LEU 610 N -0.24 0.85 -0.96 0.00 5.85 -1.82 0.71 115.31 119.71 1tkd h LEU 610 Ca 0.18 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.83 1tkd h LEU 610 Cb 0.55 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1tkd h LEU 610 CO -0.60 0.51 -0.29 -1.13 -0.34 0.00 0.00 178.44 176.59 1tkd h ASN 611 N 0.94 0.42 -0.18 1.25 -0.73 -1.36 -1.20 115.58 114.71 1tkd h ASN 611 Ca 0.42 -0.15 -0.02 0.00 1.87 0.00 0.00 56.30 58.42 1tkd h ASN 611 Cb 0.36 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 38.83 1tkd h ASN 611 CO -0.18 0.69 0.02 0.74 -0.37 0.00 0.00 177.43 178.33 1tkd h THR 612 N 0.36 1.24 0.16 -3.57 2.02 0.94 0.46 112.91 114.52 1tkd h THR 612 Ca 0.05 -0.78 -0.00 0.00 0.77 0.00 0.00 66.41 66.45 1tkd h THR 612 Cb 0.69 1.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.50 1tkd h THR 612 CO 0.05 0.24 -0.12 0.25 0.37 0.00 0.00 175.52 176.31 1tkd h LEU 613 N 0.08 -0.29 -0.15 2.58 5.85 -0.75 -1.50 115.31 121.12 1tkd h LEU 613 Ca 0.05 0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.60 1tkd h LEU 613 Cb 0.34 0.10 0.01 0.00 0.37 0.00 0.00 40.66 41.48 1tkd h LEU 613 CO 0.01 -0.18 -0.66 -0.07 -0.34 0.00 0.00 178.44 177.19 1tkd h LEU 614 N -0.28 0.85 -0.64 2.25 3.38 -1.24 -2.38 115.31 117.25 1tkd h LEU 614 Ca -0.01 -0.62 -0.09 0.00 0.09 0.00 0.00 57.88 57.25 1tkd h LEU 614 Cb 0.25 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1tkd h LEU 614 CO -0.00 1.33 0.05 -0.61 0.09 0.00 0.00 178.44 179.29 1tkd h GLN 615 N 0.42 1.10 -0.06 1.13 4.15 -0.94 -1.21 115.11 119.69 1tkd h GLN 615 Ca -0.04 -0.33 -0.00 0.00 0.77 0.00 0.00 58.65 59.05 1tkd h GLN 615 Cb 1.29 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.86 1tkd h GLN 615 CO 0.14 1.04 0.03 1.03 -1.93 0.00 0.00 178.83 179.14 1tkd h SER 616 N 1.01 0.08 -0.49 -0.69 0.87 -1.30 0.93 113.55 113.96 1tkd h SER 616 Ca 0.19 -0.12 0.06 0.00 -1.23 0.00 0.00 61.79 60.69 1tkd h SER 616 Cb 0.51 -0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.40 1tkd h SER 616 CO 0.02 0.18 0.20 0.00 -0.53 0.00 0.00 176.83 176.70 1tkd h ALA 617 N 0.91 0.62 -0.39 6.23 0.00 -1.27 0.22 119.26 125.58 1tkd h ALA 617 Ca 0.02 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1tkd h ALA 617 Cb 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1tkd h ALA 617 CO -0.00 -0.18 -0.04 0.78 0.00 0.00 0.00 179.25 179.81 1tkd h GLY 618 N 0.40 0.69 0.83 0.00 0.00 -1.00 -0.55 103.07 103.44 1tkd h GLY 618 Ca 0.23 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 47.05 1tkd h GLY 618 CO -0.21 0.42 -0.07 0.00 0.00 0.00 0.00 176.54 176.68 1tkd h ALA 619 N 1.36 0.31 -0.10 3.60 0.00 0.48 -1.60 119.26 123.30 1tkd h ALA 619 Ca 0.12 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 1tkd h ALA 619 Cb 0.44 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1tkd h ALA 619 CO 0.02 0.12 -0.50 -0.07 0.00 0.00 0.00 179.25 178.82 1tkd h LEU 620 N 0.18 0.29 -0.01 0.00 3.38 -0.47 -0.77 115.31 117.91 1tkd h LEU 620 Ca 0.06 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1tkd h LEU 620 Cb 0.53 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1tkd h LEU 620 CO 0.02 0.75 0.00 0.40 0.09 0.00 0.00 178.44 179.70 1tkd h ILE 621 N 0.22 1.16 -0.36 1.22 2.04 -1.04 -1.34 117.51 119.40 1tkd h ILE 621 Ca 0.01 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.35 1tkd h ILE 621 Cb 0.96 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 1tkd h ILE 621 CO 0.08 0.12 0.02 0.00 0.00 0.00 0.00 178.15 178.37 1tkd h LYS 623 N 0.54 -0.07 -0.23 0.00 3.64 -0.95 -0.69 116.57 118.81 1tkd h LYS 623 Ca 0.12 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1tkd h LYS 623 Cb 0.32 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1tkd h LYS 623 CO 0.01 0.16 -0.02 1.25 -2.27 0.00 0.00 179.45 178.58 1tkd h LEU 624 N -0.30 0.31 0.02 5.20 6.46 -1.01 -2.72 115.31 123.27 1tkd h LEU 624 Ca -0.01 -0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 57.70 1tkd h LEU 624 Cb 0.27 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.12 1tkd h LEU 624 CO 0.01 0.38 -0.01 -0.25 -0.62 0.00 0.00 178.44 177.95 1tkd h TRP 625 N 0.33 -0.03 0.00 1.25 7.01 -0.16 0.27 115.95 124.62 1tkd h TRP 625 Ca 0.07 -0.00 -0.08 0.00 2.11 0.00 0.00 58.89 61.00 1tkd h TRP 625 Cb 0.25 0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.31 1tkd h TRP 625 CO 0.01 -0.02 -0.37 -0.84 -2.79 0.00 0.00 178.44 174.43 1tkd h ILE 626 N -0.03 1.14 0.08 2.65 3.07 -0.95 -0.48 117.51 122.98 1tkd h ILE 626 Ca -0.00 -1.31 -0.00 0.00 1.55 0.00 0.00 64.86 65.09 1tkd h ILE 626 Cb 0.02 1.73 0.00 0.00 -0.27 0.00 0.00 36.82 38.31 1tkd h ILE 626 CO 0.00 0.36 -0.04 0.40 -1.05 0.00 0.00 178.15 177.83 1tkd h ILE 627 N 0.00 1.18 -0.60 0.16 2.04 -1.17 -2.51 117.51 116.62 1tkd h ILE 627 Ca -0.00 -1.10 -0.06 0.00 1.00 0.00 0.00 64.86 64.70 1tkd h ILE 627 Cb 0.70 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.63 1tkd h ILE 627 CO 0.05 0.26 0.12 0.50 0.00 0.00 0.00 178.15 179.08 1tkd h LYS 628 N -0.62 0.94 0.05 2.37 1.63 -0.85 -1.85 116.57 118.23 1tkd h LYS 628 Ca -0.01 -0.22 0.01 0.00 -0.85 0.00 0.00 60.65 59.58 1tkd h LYS 628 Cb 0.51 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 32.00 1tkd h LYS 628 CO 0.02 0.86 -0.08 1.15 -3.45 0.00 0.00 179.45 177.94 1tkd h THR 629 N 0.90 0.80 -0.36 1.00 2.02 -1.11 0.24 112.91 116.40 1tkd h THR 629 Ca 0.19 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.31 1tkd h THR 629 Cb 0.36 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 1tkd h THR 629 CO 0.00 0.00 -0.02 -0.08 0.37 0.00 0.00 175.52 175.80 1tkd h GLU 630 N -0.17 0.56 -0.49 6.66 4.81 -1.27 -1.75 114.58 122.93 1tkd h GLU 630 Ca 0.02 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 59.03 1tkd h GLU 630 Cb 0.18 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1tkd h GLU 630 CO -0.05 0.60 -0.04 1.49 -0.73 0.00 0.00 179.01 180.28 1tkd h GLU 631 N 0.54 0.90 -0.23 1.92 4.81 -0.73 -0.74 114.58 121.04 1tkd h GLU 631 Ca 0.11 -0.31 -0.08 0.00 -0.13 0.00 0.00 59.36 58.96 1tkd h GLU 631 Cb 0.37 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1tkd h GLU 631 CO 0.01 0.95 -0.19 0.52 -0.73 0.00 0.00 179.01 179.57 1tkd h MET 632 N 0.75 0.40 -0.21 1.92 2.86 -0.19 -1.39 114.93 119.08 1tkd h MET 632 Ca 0.14 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.58 1tkd h MET 632 Cb 0.57 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.19 1tkd h MET 632 CO 0.03 0.59 -0.15 -0.07 1.06 0.00 0.00 176.91 178.37 1tkd h LEU 633 N 0.37 0.49 -1.14 1.22 3.38 -0.99 -2.66 115.31 115.98 1tkd h LEU 633 Ca 0.06 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1tkd h LEU 633 Cb 0.55 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 1tkd h LEU 633 CO 0.04 0.83 0.45 0.58 0.09 0.00 0.00 178.44 180.43 1tkd h VAL 634 N 0.16 1.22 0.00 1.22 2.07 -0.90 -0.55 116.25 119.46 1tkd h VAL 634 Ca 0.04 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1tkd h VAL 634 Cb 0.67 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1tkd h VAL 634 CO 0.04 0.23 0.00 1.05 0.02 0.00 0.00 177.57 178.91 1tkd h GLU 635 N 1.06 0.00 -0.25 1.57 4.11 -1.19 -1.34 114.58 118.53 1tkd h GLU 635 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.70 1tkd h GLU 635 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1tkd h GLU 635 CO -0.05 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.66 1tkd n LYS 636 N -2.71 1.69 -0.19 1.06 5.02 -0.26 -4.90 118.16 117.88 1tkd n LYS 636 Ca 0.01 -1.06 0.00 0.00 -2.02 0.00 0.00 58.31 55.24 1tkd n LYS 636 Cb 0.28 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 1tkd n LYS 636 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tkd n GLY 637 N 1.03 1.38 3.77 0.72 0.00 -0.50 -5.04 105.19 106.54 1tkd n GLY 637 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1tkd n GLY 637 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tkd s LEU 638 N 0.00 4.39 -0.13 0.99 1.02 -0.94 -4.99 118.68 119.01 1tkd s LEU 638 Ca 0.00 2.33 -0.04 0.00 0.02 0.00 0.00 54.13 56.44 1tkd s LEU 638 Cb 0.00 -3.80 -0.04 0.00 0.02 0.00 0.00 46.19 42.37 1tkd s LEU 638 CO 0.00 -0.39 0.03 -0.75 0.02 0.00 0.00 176.35 175.25 1tkd s LYS 639 N -1.86 3.45 -0.51 1.70 2.20 -1.26 -4.10 119.74 119.36 1tkd s LYS 639 Ca 0.50 -0.38 -0.23 0.00 -0.36 0.00 0.00 55.97 55.50 1tkd s LYS 639 Cb -0.32 -2.98 0.04 0.00 -1.51 0.00 0.00 37.83 33.06 1tkd s LYS 639 CO 0.41 0.50 0.84 -1.58 -0.36 0.00 0.00 175.35 175.15 1tkd s HIS 640 N -0.30 2.91 0.00 4.03 5.65 -1.26 -0.76 115.29 125.56 1tkd s HIS 640 Ca 0.07 -0.01 0.00 0.00 0.25 0.00 0.00 55.06 55.37 1tkd s HIS 640 Cb -0.12 -3.84 0.00 0.00 -1.18 0.00 0.00 32.58 27.43 1tkd s HIS 640 CO 0.02 -1.17 0.00 0.41 -0.65 0.00 0.00 174.74 173.35 1tkd n GLY 641 N 5.07 2.73 0.18 1.59 0.00 0.18 -4.88 105.19 110.06 1tkd n GLY 641 Ca 0.01 -1.11 0.14 0.00 0.00 0.00 0.00 46.02 45.05 1tkd n GLY 641 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1tkd h TRP 642 N 0.00 0.00 -0.66 1.61 4.06 -1.92 -0.78 115.95 118.26 1tkd h TRP 642 Ca 0.00 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 60.85 1tkd h TRP 642 Cb 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 28.10 1tkd h TRP 642 CO 0.00 0.00 0.13 -0.40 -3.56 0.00 0.00 178.44 174.61 1tkd n ASP 643 N -2.57 5.32 0.00 -3.49 5.75 -1.26 -4.60 116.55 115.70 1tkd n ASP 643 Ca 0.02 -3.06 0.00 0.00 -0.01 0.00 0.00 54.79 51.74 1tkd n ASP 643 Cb 0.31 -0.72 0.00 0.00 -1.03 0.00 0.00 41.12 39.68 1tkd n ASP 643 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tkd n GLY 644 N 0.27 4.15 0.04 6.12 0.00 -0.30 -5.06 105.19 110.40 1tkd n GLY 644 Ca 0.34 -0.51 -0.04 0.00 0.00 0.00 0.00 46.02 45.81 1tkd n GLY 644 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tkd n ASP 645 N 0.00 3.43 -4.01 1.61 8.00 0.06 -4.82 116.55 120.82 1tkd n ASP 645 Ca 0.00 -0.02 -0.08 0.00 0.71 0.00 0.00 54.79 55.40 1tkd n ASP 645 Cb 0.00 0.22 -0.09 0.00 -0.02 0.00 0.00 41.12 41.23 1tkd n ASP 645 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1tkd s PHE 646 N -2.15 0.39 -0.15 1.24 -0.71 -0.95 -0.95 117.98 114.70 1tkd s PHE 646 Ca -0.07 -0.90 -0.06 0.00 -1.04 0.00 0.00 56.93 54.86 1tkd s PHE 646 Cb 0.02 -0.28 0.07 0.00 -1.21 0.00 0.00 43.02 41.63 1tkd s PHE 646 CO 0.21 -0.44 0.32 0.00 -1.34 0.00 0.00 175.22 173.98 1tkd s ALA 647 N -3.90 -0.79 0.21 1.99 0.00 0.54 0.48 121.76 120.28 1tkd s ALA 647 Ca 0.06 1.17 -0.31 0.00 0.00 0.00 0.00 51.96 52.89 1tkd s ALA 647 Cb 0.07 -1.09 -0.11 0.00 0.00 0.00 0.00 23.12 21.99 1tkd s ALA 647 CO -0.10 -0.62 1.58 0.71 0.00 0.00 0.00 175.76 177.32 1tkd s TYR 648 N 2.34 2.98 -0.06 0.00 1.51 -1.26 -0.44 117.35 122.41 1tkd s TYR 648 Ca -0.01 0.68 0.02 0.00 -1.01 0.00 0.00 57.07 56.75 1tkd s TYR 648 Cb -0.12 -3.97 -0.06 0.00 -0.11 0.00 0.00 41.96 37.71 1tkd s TYR 648 CO -0.10 -3.46 -0.03 -1.33 -1.11 0.00 0.00 175.55 169.51 1tkd n MET 649 N 3.38 1.36 -3.59 -0.62 2.81 -0.62 -4.59 117.12 115.25 1tkd n MET 649 Ca 0.12 0.02 -0.16 0.00 -1.81 0.00 0.00 57.70 55.87 1tkd n MET 649 Cb 0.38 -1.14 -0.07 0.00 -0.71 0.00 0.00 33.22 31.68 1tkd n MET 649 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1tkd s ALA 650 N -2.14 -1.66 -0.21 3.04 0.00 -1.09 -4.48 121.76 115.21 1tkd s ALA 650 Ca -0.07 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1tkd s ALA 650 Cb 0.02 -0.42 0.05 0.00 0.00 0.00 0.00 23.12 22.78 1tkd s ALA 650 CO 0.19 -0.34 -0.05 -0.46 0.00 0.00 0.00 175.76 175.09 1tkd s TRP 651 N -0.61 2.18 -0.74 0.00 -0.00 -1.26 -1.41 118.94 117.10 1tkd s TRP 651 Ca -0.07 -1.55 0.04 0.00 -0.00 0.00 0.00 56.10 54.52 1tkd s TRP 651 Cb -0.02 -1.50 0.20 0.00 -0.00 0.00 0.00 33.47 32.14 1tkd s TRP 651 CO 0.06 -0.73 0.61 0.28 -0.00 0.00 0.00 176.95 177.17 1tkd n VAL 652 N 4.74 2.09 0.00 5.86 0.31 0.27 -4.95 118.33 126.64 1tkd n VAL 652 Ca -0.12 -5.00 0.00 0.00 -0.01 0.00 0.00 64.34 59.21 1tkd n VAL 652 Cb 0.45 -2.20 0.00 0.00 -0.91 0.00 0.00 33.84 31.18 1tkd n VAL 652 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1tkd n HIS 653 N 1.80 0.00 -1.25 3.52 8.25 -1.26 -2.83 115.22 123.45 1tkd n HIS 653 Ca 0.22 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.77 1tkd n HIS 653 Cb 0.36 0.00 0.13 0.00 1.12 0.00 0.00 29.99 31.60 1tkd n HIS 653 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1tkd n ASP 654 N 1.99 2.00 -3.91 0.41 5.75 -1.26 -4.81 116.55 116.73 1tkd n ASP 654 Ca 0.00 -3.03 -0.11 0.00 -0.01 0.00 0.00 54.79 51.64 1tkd n ASP 654 Cb 0.00 -0.41 -0.12 0.00 -1.03 0.00 0.00 41.12 39.56 1tkd n ASP 654 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 1tkd s GLU 655 N -2.55 0.20 0.09 0.11 -1.05 -1.13 -0.02 118.70 114.35 1tkd s GLU 655 Ca 0.29 -0.27 0.07 0.00 -0.15 0.00 0.00 54.97 54.91 1tkd s GLU 655 Cb 0.26 0.08 -0.03 0.00 -0.44 0.00 0.00 34.13 33.99 1tkd s GLU 655 CO 0.01 -0.04 -0.19 0.96 0.95 0.00 0.00 175.26 176.96 1tkd s ILE 656 N -0.74 1.57 -0.15 1.83 -4.36 0.23 -0.57 121.20 119.01 1tkd s ILE 656 Ca -0.08 -1.43 0.01 0.00 -0.26 0.00 0.00 60.65 58.89 1tkd s ILE 656 Cb -0.05 -1.43 0.02 0.00 1.25 0.00 0.00 42.46 42.25 1tkd s ILE 656 CO -0.00 -0.05 -0.16 -1.10 0.24 0.00 0.00 174.94 173.86 1tkd s GLN 657 N -1.74 2.51 -0.09 0.37 -1.52 -0.50 -1.32 119.66 117.37 1tkd s GLN 657 Ca 0.05 -0.64 0.04 0.00 -1.95 0.00 0.00 55.36 52.86 1tkd s GLN 657 Cb -0.10 -2.23 -0.00 0.00 -0.22 0.00 0.00 33.01 30.46 1tkd s GLN 657 CO 0.03 -0.21 -0.22 0.08 -0.25 0.00 0.00 175.29 174.72 1tkd s VAL 658 N 1.37 1.91 0.13 1.09 1.01 0.01 -1.60 120.40 124.33 1tkd s VAL 658 Ca 0.04 -0.94 -0.27 0.00 0.00 0.00 0.00 61.98 60.80 1tkd s VAL 658 Cb -0.13 -1.65 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 1tkd s VAL 658 CO -0.10 0.53 0.86 -0.83 0.00 0.00 0.00 175.10 175.55 1tkd s GLY 659 N 0.28 2.95 0.01 4.51 0.00 0.41 -0.53 107.32 114.95 1tkd s GLY 659 Ca -0.15 0.45 0.05 0.00 0.00 0.00 0.00 44.72 45.06 1tkd s GLY 659 CO 0.07 1.15 -0.14 0.00 0.00 0.00 0.00 173.10 174.18 1tkd h ARG 661 N 5.49 0.00 -4.28 0.00 2.43 -1.32 0.31 114.38 117.02 1tkd h ARG 661 Ca -0.36 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 58.66 1tkd h ARG 661 Cb 1.17 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 30.57 1tkd h ARG 661 CO 0.47 0.36 -0.61 0.95 -1.51 0.00 0.00 179.97 179.63 1tkd s THR 662 N -3.99 0.14 0.24 0.20 -4.23 -1.26 -4.64 115.64 102.10 1tkd s THR 662 Ca -0.02 -1.78 -0.05 0.00 -1.18 0.00 0.00 61.69 58.66 1tkd s THR 662 Cb 0.13 -1.81 0.14 0.00 1.34 0.00 0.00 72.50 72.30 1tkd s THR 662 CO 0.70 -0.63 1.77 -0.33 -0.54 0.00 0.00 174.62 175.58 1tkd h GLU 663 N 2.92 1.00 -0.36 3.99 5.08 -1.96 -1.46 114.58 123.78 1tkd h GLU 663 Ca -0.34 -0.22 0.03 0.00 -1.00 0.00 0.00 59.36 57.82 1tkd h GLU 663 Cb 1.18 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 1tkd h GLU 663 CO 0.60 0.89 0.18 1.49 -1.00 0.00 0.00 179.01 181.17 1tkd h GLU 664 N 0.95 0.36 -0.64 2.33 4.81 -1.99 0.21 114.58 120.62 1tkd h GLU 664 Ca 0.20 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 1tkd h GLU 664 Cb 0.34 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 1tkd h GLU 664 CO 0.00 0.24 0.24 0.82 -0.73 0.00 0.00 179.01 179.58 1tkd h ILE 665 N 0.37 1.24 -0.87 2.32 2.04 -1.88 -1.39 117.51 119.35 1tkd h ILE 665 Ca 0.15 -0.77 0.05 0.00 1.00 0.00 0.00 64.86 65.29 1tkd h ILE 665 Cb 0.06 0.54 -0.06 0.00 -0.74 0.00 0.00 36.82 36.63 1tkd h ILE 665 CO -0.11 0.30 0.55 0.00 0.00 0.00 0.00 178.15 178.90 1tkd h ALA 666 N 1.10 1.17 -0.58 1.87 0.00 -0.67 0.40 119.26 122.55 1tkd h ALA 666 Ca 0.21 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1tkd h ALA 666 Cb 0.23 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1tkd h ALA 666 CO -0.01 0.35 0.20 0.37 0.00 0.00 0.00 179.25 180.16 1tkd h GLN 667 N 1.04 0.85 -0.07 0.00 4.15 -0.36 -1.07 115.11 119.66 1tkd h GLN 667 Ca 0.36 -0.15 -0.19 0.00 0.77 0.00 0.00 58.65 59.45 1tkd h GLN 667 Cb 0.08 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 27.62 1tkd h GLN 667 CO -0.14 0.72 -0.74 0.28 -1.93 0.00 0.00 178.83 177.02 1tkd h VAL 668 N 0.84 1.38 -0.38 2.39 2.07 0.05 -1.93 116.25 120.66 1tkd h VAL 668 Ca 0.19 -2.16 -0.01 0.00 0.82 0.00 0.00 66.70 65.54 1tkd h VAL 668 Cb 0.21 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1tkd h VAL 668 CO -0.01 0.65 0.19 0.58 0.02 0.00 0.00 177.57 179.00 1tkd h VAL 669 N 0.27 1.16 -0.43 2.57 2.07 0.22 0.13 116.25 122.25 1tkd h VAL 669 Ca -0.03 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 1tkd h VAL 669 Cb 1.32 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 1tkd h VAL 669 CO 0.13 0.18 0.21 0.40 0.02 0.00 0.00 177.57 178.50 1tkd h ILE 670 N 0.48 1.18 -0.49 4.57 2.04 -1.16 -0.10 117.51 124.04 1tkd h ILE 670 Ca 0.13 -0.52 -0.13 0.00 1.00 0.00 0.00 64.86 65.35 1tkd h ILE 670 Cb 0.11 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1tkd h ILE 670 CO -0.02 0.20 -0.20 -0.33 0.00 0.00 0.00 178.15 177.80 1tkd h GLU 671 N 0.56 0.99 -0.45 2.37 5.08 -1.16 -2.89 114.58 119.07 1tkd h GLU 671 Ca 0.15 -0.41 -0.09 0.00 -1.00 0.00 0.00 59.36 58.01 1tkd h GLU 671 Cb 0.12 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1tkd h GLU 671 CO -0.02 1.08 -0.08 1.15 -1.00 0.00 0.00 179.01 180.15 1tkd h THR 672 N 0.86 1.25 -0.77 1.13 2.02 -0.56 -1.89 112.91 114.96 1tkd h THR 672 Ca 0.12 -1.12 0.01 0.00 0.77 0.00 0.00 66.41 66.18 1tkd h THR 672 Cb 0.77 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 1tkd h THR 672 CO 0.06 0.39 0.50 0.00 0.37 0.00 0.00 175.52 176.84 1tkd h ALA 673 N 1.19 0.98 -0.64 6.16 0.00 -0.88 0.63 119.26 126.70 1tkd h ALA 673 Ca 0.13 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1tkd h ALA 673 Cb 0.55 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1tkd h ALA 673 CO 0.03 0.37 0.07 0.37 0.00 0.00 0.00 179.25 180.09 1tkd h GLN 674 N 1.02 1.08 -0.39 0.00 5.75 -1.28 -1.34 115.11 119.95 1tkd h GLN 674 Ca 0.29 -0.31 -0.02 0.00 -0.15 0.00 0.00 58.65 58.46 1tkd h GLN 674 Cb -0.09 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.33 1tkd h GLN 674 CO -0.07 1.01 0.17 0.93 -2.65 0.00 0.00 178.83 178.22 1tkd h GLU 675 N 0.99 0.57 -0.91 1.69 5.08 -0.71 -2.42 114.58 118.87 1tkd h GLU 675 Ca 0.19 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1tkd h GLU 675 Cb 0.48 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1tkd h GLU 675 CO 0.02 0.52 0.56 0.00 -1.00 0.00 0.00 179.01 179.11 1tkd h ALA 676 N 1.02 1.16 -0.47 3.43 0.00 -0.66 -0.47 119.26 123.27 1tkd h ALA 676 Ca 0.13 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1tkd h ALA 676 Cb 0.15 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1tkd h ALA 676 CO -0.01 0.60 0.19 1.98 0.00 0.00 0.00 179.25 182.00 1tkd h MET 677 N 1.24 0.70 -0.23 0.00 1.85 -1.04 0.43 114.93 117.87 1tkd h MET 677 Ca 0.33 -0.13 -0.07 0.00 -0.61 0.00 0.00 59.70 59.22 1tkd h MET 677 Cb -0.08 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 31.83 1tkd h MET 677 CO -0.06 0.63 -0.18 0.00 -0.40 0.00 0.00 176.91 176.90 1tkd h ARG 678 N 0.61 0.41 -0.40 0.39 2.47 -1.13 -0.73 114.38 116.00 1tkd h ARG 678 Ca 0.16 -0.12 -0.05 0.00 -1.26 0.00 0.00 59.98 58.70 1tkd h ARG 678 Cb 0.20 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.46 1tkd h ARG 678 CO -0.01 0.57 0.05 2.35 0.56 0.00 0.00 179.97 183.49 1tkd h TRP 679 N 0.37 0.72 -0.23 3.04 7.01 -0.51 -1.41 115.95 124.95 1tkd h TRP 679 Ca 0.07 -0.11 0.01 0.00 2.11 0.00 0.00 58.89 60.97 1tkd h TRP 679 Cb 0.53 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.38 1tkd h TRP 679 CO 0.01 0.72 0.13 0.28 -2.79 0.00 0.00 178.44 176.79 1tkd h VAL 680 N 0.51 1.01 -0.71 2.65 2.07 -0.31 0.24 116.25 121.72 1tkd h VAL 680 Ca 0.12 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.62 1tkd h VAL 680 Cb 0.40 0.73 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 1tkd h VAL 680 CO 0.01 0.05 0.39 1.23 0.02 0.00 0.00 177.57 179.27 1tkd h GLY 681 N 0.26 1.05 1.24 2.17 0.00 -0.97 -1.39 103.07 105.44 1tkd h GLY 681 Ca 0.09 -0.27 -0.14 0.00 0.00 0.00 0.00 47.33 47.01 1tkd h GLY 681 CO -0.05 0.15 -0.32 -1.80 0.00 0.00 0.00 176.54 174.52 1tkd h ASP 682 N 0.70 0.88 -0.94 0.19 3.58 -0.85 -0.65 116.42 119.33 1tkd h ASP 682 Ca 0.32 -0.37 0.12 0.00 0.42 0.00 0.00 57.03 57.53 1tkd h ASP 682 Cb 0.23 -0.25 -0.07 0.00 1.72 0.00 0.00 39.33 40.96 1tkd h ASP 682 CO -0.20 1.12 0.60 -0.74 -2.88 0.00 0.00 179.24 177.14 1tkd h HIS 683 N 0.71 0.98 -0.42 0.28 2.76 0.56 -2.33 115.15 117.70 1tkd h HIS 683 Ca 0.08 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.15 1tkd h HIS 683 Cb 0.87 -0.31 -0.07 0.00 1.55 0.00 0.00 27.41 29.45 1tkd h HIS 683 CO 0.05 0.39 0.06 0.91 -1.30 0.00 0.00 177.93 178.04 1tkd n TRP 684 N -4.58 1.38 -4.06 5.26 8.01 -0.90 -4.96 117.44 117.59 1tkd n TRP 684 Ca 0.17 -1.22 -0.28 0.00 -1.31 0.00 0.00 57.50 54.86 1tkd n TRP 684 Cb 0.39 -0.47 -0.04 0.00 -2.01 0.00 0.00 31.31 29.18 1tkd n TRP 684 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 1tkd n ASN 685 N -0.68 -0.55 -4.75 -0.99 3.02 -0.88 -4.87 115.26 105.57 1tkd n ASN 685 Ca 0.31 -1.05 -0.41 0.00 -0.03 0.00 0.00 54.58 53.39 1tkd n ASN 685 Cb 1.07 -2.76 -0.03 0.00 -0.61 0.00 0.00 39.78 37.46 1tkd n ASN 685 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1tkd s PHE 686 N -3.93 3.24 -2.10 3.10 5.36 -0.27 -4.91 117.98 118.48 1tkd s PHE 686 Ca 0.12 1.39 0.19 0.00 -0.96 0.00 0.00 56.93 57.67 1tkd s PHE 686 Cb -0.06 -3.57 0.93 0.00 -0.34 0.00 0.00 43.02 39.98 1tkd s PHE 686 CO 0.91 -1.60 1.62 0.54 -1.46 0.00 0.00 175.22 175.24 1tkd n ARG 687 N 1.65 1.27 -4.23 10.12 5.12 -1.26 -4.71 116.66 124.62 1tkd n ARG 687 Ca 0.02 -0.41 -0.20 0.00 -1.93 0.00 0.00 57.85 55.33 1tkd n ARG 687 Cb 0.43 -1.32 -0.16 0.00 -1.16 0.00 0.00 32.46 30.25 1tkd n ARG 687 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1tkd s LEU 689 N 0.73 4.34 -0.06 0.00 2.96 -1.26 -4.99 118.68 120.40 1tkd s LEU 689 Ca -0.10 2.99 -0.01 0.00 -0.22 0.00 0.00 54.13 56.78 1tkd s LEU 689 Cb -0.13 -3.66 -0.03 0.00 0.50 0.00 0.00 46.19 42.87 1tkd s LEU 689 CO 0.01 -0.86 0.02 -0.76 -1.32 0.00 0.00 176.35 173.44 1tkd s LEU 690 N -1.58 3.63 0.12 -0.68 1.43 -1.26 -5.04 118.68 115.30 1tkd s LEU 690 Ca 0.56 0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.76 1tkd s LEU 690 Cb -0.46 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 1tkd s LEU 690 CO 0.58 0.34 0.05 -1.81 0.23 0.00 0.00 176.35 175.73 1tkd s ASP 691 N -1.16 0.33 0.11 2.29 1.01 -1.26 -4.50 116.67 113.49 1tkd s ASP 691 Ca 0.16 -1.16 0.03 0.00 0.71 0.00 0.00 52.55 52.29 1tkd s ASP 691 Cb -0.11 0.28 -0.04 0.00 1.01 0.00 0.00 42.92 44.06 1tkd s ASP 691 CO 0.06 -0.71 -0.08 0.42 0.21 0.00 0.00 175.17 175.07 1tkd s THR 692 N -4.02 0.85 -0.08 -1.27 -4.23 -1.26 -0.95 115.64 104.68 1tkd s THR 692 Ca 0.21 -1.96 0.02 0.00 -1.18 0.00 0.00 61.69 58.78 1tkd s THR 692 Cb 0.07 -1.71 0.02 0.00 1.34 0.00 0.00 72.50 72.22 1tkd s THR 692 CO -0.01 -0.82 -0.12 -0.70 -0.54 0.00 0.00 174.62 172.44 1tkd s GLU 693 N -3.74 1.75 0.18 3.99 2.12 -0.17 -4.83 118.70 117.99 1tkd s GLU 693 Ca 0.13 -0.40 0.11 0.00 0.36 0.00 0.00 54.97 55.16 1tkd s GLU 693 Cb 0.04 -1.52 -0.04 0.00 0.26 0.00 0.00 34.13 32.87 1tkd s GLU 693 CO -0.03 -0.05 -0.20 0.20 -0.54 0.00 0.00 175.26 174.65 1tkd s GLY 694 N 0.92 1.71 -0.02 -1.50 0.00 -1.26 -1.17 107.32 106.00 1tkd s GLY 694 Ca -0.09 -1.57 -0.01 0.00 0.00 0.00 0.00 44.72 43.05 1tkd s GLY 694 CO 0.00 -1.59 0.04 0.54 0.00 0.00 0.00 173.10 172.10 1tkd s LYS 695 N -2.65 0.02 -0.03 2.90 1.02 0.11 -4.98 119.74 116.12 1tkd s LYS 695 Ca 0.21 0.12 -0.03 0.00 0.02 0.00 0.00 55.97 56.30 1tkd s LYS 695 Cb -0.08 -0.09 -0.04 0.00 -0.52 0.00 0.00 37.83 37.10 1tkd s LYS 695 CO 0.11 -0.07 0.14 1.41 -0.92 0.00 0.00 175.35 176.02 1tkd s MET 696 N 0.47 3.32 0.00 1.68 -2.45 -1.26 -0.64 119.30 120.41 1tkd s MET 696 Ca -0.04 -0.33 0.00 0.00 -1.25 0.00 0.00 55.69 54.07 1tkd s MET 696 Cb -0.05 -3.04 0.00 0.00 1.25 0.00 0.00 34.83 32.99 1tkd s MET 696 CO -0.02 0.69 0.00 0.41 1.05 0.00 0.00 175.02 177.15 1tkd n GLY 697 N 1.26 -0.73 0.15 2.11 0.00 -0.28 -4.83 105.19 102.86 1tkd n GLY 697 Ca -0.14 -0.99 -0.16 0.00 0.00 0.00 0.00 46.02 44.73 1tkd n GLY 697 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tkd h PRO 698 N 0.00 0.42 0.00 1.61 0.13 -1.91 0.35 132.00 132.60 1tkd h PRO 698 Ca 0.00 -0.55 -0.12 0.00 -0.87 0.00 0.00 66.00 64.47 1tkd h PRO 698 Cb 0.00 0.18 -0.03 0.00 0.13 0.00 0.00 31.00 31.28 1tkd h PRO 698 CO 0.00 1.21 -0.10 0.27 -0.23 0.00 0.00 178.00 179.14 1tkd n ASN 699 N -3.70 -0.25 0.18 1.44 0.23 -1.26 -1.26 115.26 110.65 1tkd n ASN 699 Ca -0.09 -1.58 0.04 0.00 -0.53 0.00 0.00 54.58 52.42 1tkd n ASN 699 Cb 0.93 0.53 0.33 0.00 -2.08 0.00 0.00 39.78 39.49 1tkd n ASN 699 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 1tkd h TRP 700 N 1.29 0.00 -0.52 -2.53 2.91 -0.76 -1.74 115.95 114.60 1tkd h TRP 700 Ca -0.07 0.00 -0.05 0.00 1.13 0.00 0.00 58.89 59.90 1tkd h TRP 700 Cb 0.33 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 28.95 1tkd h TRP 700 CO 0.00 0.42 0.11 0.00 -1.03 0.00 0.00 178.44 177.94 1tkd h ALA 701 N 1.58 1.21 0.00 2.65 0.00 -1.79 -3.03 119.26 119.88 1tkd h ALA 701 Ca -0.00 -0.21 -0.21 0.00 0.00 0.00 0.00 54.91 54.49 1tkd h ALA 701 Cb 0.84 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1tkd h ALA 701 CO 0.05 0.54 -1.50 -0.89 0.00 0.00 0.00 179.25 177.45 1tkd n ILE 702 N -4.27 1.33 0.07 0.00 5.41 -1.16 -4.32 119.36 116.41 1tkd n ILE 702 Ca 0.04 -0.72 0.04 0.00 1.00 0.00 0.00 62.75 63.10 1tkd n ILE 702 Cb 0.24 -0.84 0.21 0.00 -0.71 0.00 0.00 39.64 38.54 1tkd n ILE 702 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55