#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktd s ILE 6 N 0.00 4.61 0.29 5.18 1.01 -1.26 -4.88 121.20 126.14 3ktd s ILE 6 Ca 0.00 -0.10 0.05 0.00 0.00 0.00 0.00 60.65 60.60 3ktd s ILE 6 Cb 0.00 -3.07 0.05 0.00 0.01 0.00 0.00 42.46 39.44 3ktd s ILE 6 CO 0.00 0.46 1.71 -1.28 0.00 0.00 0.00 174.94 175.82 3ktd h SER 7 N 6.81 0.35 -2.13 3.58 0.87 -1.96 -3.45 113.55 117.61 3ktd h SER 7 Ca -0.36 -0.13 -0.59 0.00 -1.23 0.00 0.00 61.79 59.47 3ktd h SER 7 Cb 1.17 -0.10 -0.12 0.00 -0.44 0.00 0.00 62.40 62.91 3ktd h SER 7 CO 0.68 0.68 -0.70 -0.13 -0.53 0.00 0.00 176.83 176.83 3ktd s ARG 8 N -4.28 1.91 0.37 2.24 0.52 -1.26 -5.12 118.95 113.33 3ktd s ARG 8 Ca -0.05 -1.70 -0.25 0.00 -0.52 0.00 0.00 55.73 53.20 3ktd s ARG 8 Cb 0.13 -1.89 -0.09 0.00 0.52 0.00 0.00 34.95 33.63 3ktd s ARG 8 CO 0.78 0.29 1.07 -2.14 0.02 0.00 0.00 175.30 175.31 3ktd s PRO 9 N -3.60 4.28 -0.12 3.54 0.02 -1.26 -4.79 135.00 133.08 3ktd s PRO 9 Ca 0.31 1.60 -0.20 0.00 0.02 0.00 0.00 61.00 62.74 3ktd s PRO 9 Cb -0.04 -2.72 -0.04 0.00 0.02 0.00 0.00 34.50 31.72 3ktd s PRO 9 CO 0.17 -0.06 0.57 0.08 -0.33 0.00 0.00 177.00 177.43 3ktd s VAL 10 N -1.51 5.12 -0.37 3.83 1.01 -0.26 -0.78 120.40 127.43 3ktd s VAL 10 Ca 0.54 1.14 -0.03 0.00 0.00 0.00 0.00 61.98 63.63 3ktd s VAL 10 Cb -0.25 -3.90 0.09 0.00 0.00 0.00 0.00 36.38 32.31 3ktd s VAL 10 CO 0.32 0.26 0.13 0.00 0.00 0.00 0.00 175.10 175.81 3ktd s ILE 12 N 1.19 5.13 -0.36 0.00 1.01 0.46 -0.27 121.20 128.35 3ktd s ILE 12 Ca 0.03 0.76 -0.14 0.00 0.00 0.00 0.00 60.65 61.30 3ktd s ILE 12 Cb -0.21 -3.77 -0.00 0.00 0.01 0.00 0.00 42.46 38.48 3ktd s ILE 12 CO -0.03 0.14 0.27 -0.76 0.00 0.00 0.00 174.94 174.56 3ktd s LEU 13 N 2.04 4.72 0.00 2.97 1.02 0.13 -0.88 118.68 128.68 3ktd s LEU 13 Ca 0.19 -0.57 0.00 0.00 0.02 0.00 0.00 54.13 53.77 3ktd s LEU 13 Cb -0.16 -2.16 0.00 0.00 0.02 0.00 0.00 46.19 43.90 3ktd s LEU 13 CO 0.09 -0.32 0.00 0.61 0.02 0.00 0.00 176.35 176.76 3ktd n GLY 14 N 5.12 -1.42 2.61 -3.19 0.00 0.30 -1.21 105.19 107.40 3ktd n GLY 14 Ca -0.12 -0.92 -0.28 0.00 0.00 0.00 0.00 46.02 44.70 3ktd n GLY 14 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ktd n LEU 15 N 0.00 4.25 0.00 0.99 4.77 -1.22 -4.14 117.00 121.65 3ktd n LEU 15 Ca 0.00 -5.51 0.00 0.00 -0.03 0.00 0.00 56.01 50.47 3ktd n LEU 15 Cb 0.00 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.40 3ktd n LEU 15 CO 0.00 2.13 0.00 0.61 -1.33 0.00 0.00 177.39 178.80 3ktd n GLY 16 N 0.52 1.51 0.17 -0.72 0.00 -1.26 -3.50 105.19 101.90 3ktd n GLY 16 Ca 0.31 -1.59 -0.09 0.00 0.00 0.00 0.00 46.02 44.64 3ktd n GLY 16 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ktd h LEU 17 N 0.00 0.46 0.00 0.99 5.85 -1.82 -1.09 115.31 119.70 3ktd h LEU 17 Ca 0.00 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.61 3ktd h LEU 17 Cb 0.00 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.91 3ktd h LEU 17 CO 0.00 0.45 0.00 -0.38 -0.34 0.00 0.00 178.44 178.17 3ktd n ILE 18 N -4.74 0.00 -0.31 4.05 2.08 -1.26 -2.83 119.36 116.36 3ktd n ILE 18 Ca -0.01 0.56 0.12 0.00 0.56 0.00 0.00 62.75 63.99 3ktd n ILE 18 Cb 0.10 -1.31 0.30 0.00 -0.75 0.00 0.00 39.64 37.97 3ktd n ILE 18 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 3ktd h GLY 19 N 0.00 1.53 1.06 7.39 0.00 -1.72 -0.39 103.07 110.94 3ktd h GLY 19 Ca 0.00 -0.19 -0.14 0.00 0.00 0.00 0.00 47.33 47.00 3ktd h GLY 19 CO 0.00 -0.23 -0.35 -1.33 0.00 0.00 0.00 176.54 174.63 3ktd h GLY 20 N 0.45 0.91 1.87 4.60 0.00 -1.32 -1.70 103.07 107.88 3ktd h GLY 20 Ca 0.55 -0.94 -0.12 0.00 0.00 0.00 0.00 47.33 46.82 3ktd h GLY 20 CO -0.50 0.85 -0.52 1.76 0.00 0.00 0.00 176.54 178.13 3ktd h SER 21 N 0.62 0.15 -0.12 0.19 0.02 -1.16 -2.24 113.55 111.02 3ktd h SER 21 Ca 0.05 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 3ktd h SER 21 Cb 0.93 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.43 3ktd h SER 21 CO 0.09 0.64 0.02 0.25 -1.14 0.00 0.00 176.83 176.69 3ktd h LEU 22 N 0.11 0.19 -0.79 5.07 5.85 -1.00 -1.59 115.31 123.15 3ktd h LEU 22 Ca 0.00 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.50 3ktd h LEU 22 Cb 0.95 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.89 3ktd h LEU 22 CO 0.07 0.39 0.51 0.25 -0.34 0.00 0.00 178.44 179.32 3ktd h LEU 23 N -0.02 0.86 -0.86 2.25 6.46 -1.20 -0.62 115.31 122.17 3ktd h LEU 23 Ca 0.04 -0.01 -0.08 0.00 -0.12 0.00 0.00 57.88 57.71 3ktd h LEU 23 Cb 0.28 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 39.99 3ktd h LEU 23 CO 0.00 0.60 -0.01 0.03 -0.62 0.00 0.00 178.44 178.45 3ktd h ARG 24 N 1.01 0.84 -0.07 1.25 3.08 -1.30 -0.57 114.38 118.62 3ktd h ARG 24 Ca 0.31 -0.24 -0.12 0.00 0.07 0.00 0.00 59.98 59.99 3ktd h ARG 24 Cb -0.04 -0.09 0.01 0.00 0.08 0.00 0.00 29.97 29.93 3ktd h ARG 24 CO -0.09 0.85 -0.44 -0.44 -1.07 0.00 0.00 179.97 178.77 3ktd h ASP 25 N 0.78 0.51 -0.80 7.04 3.32 -0.98 -1.71 116.42 124.58 3ktd h ASP 25 Ca 0.15 -0.67 -0.04 0.00 0.02 0.00 0.00 57.03 56.50 3ktd h ASP 25 Cb 0.48 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.84 3ktd h ASP 25 CO 0.02 1.10 0.36 -0.07 -1.72 0.00 0.00 179.24 178.93 3ktd h LEU 26 N -0.04 1.07 -0.36 1.55 3.38 -1.07 0.28 115.31 120.12 3ktd h LEU 26 Ca -0.04 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.64 3ktd h LEU 26 Cb 1.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 3ktd h LEU 26 CO 0.09 0.92 -0.37 -0.74 0.09 0.00 0.00 178.44 178.43 3ktd h HIS 27 N 1.15 1.06 -0.21 1.13 2.76 -1.16 0.60 115.15 120.48 3ktd h HIS 27 Ca 0.27 -0.32 -0.11 0.00 -2.20 0.00 0.00 60.37 58.01 3ktd h HIS 27 Cb 0.15 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 28.88 3ktd h HIS 27 CO 0.02 1.13 -0.36 0.00 -1.30 0.00 0.00 177.93 177.42 3ktd h ALA 28 N 0.75 0.99 0.00 5.26 0.00 -1.00 -2.28 119.26 122.99 3ktd h ALA 28 Ca 0.06 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3ktd h ALA 28 Cb 0.96 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3ktd h ALA 28 CO 0.09 0.61 0.00 0.00 0.00 0.00 0.00 179.25 179.95 3ktd n ALA 29 N -2.49 2.61 -3.00 0.00 0.00 0.94 -4.92 120.51 113.65 3ktd n ALA 29 Ca -0.01 -0.17 -0.12 0.00 0.00 0.00 0.00 53.44 53.13 3ktd n ALA 29 Cb 0.47 -1.45 0.06 0.00 0.00 0.00 0.00 19.45 18.53 3ktd n ALA 29 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3ktd n ASN 30 N -0.96 -2.44 -4.66 0.00 5.15 -0.86 -5.04 115.26 106.46 3ktd n ASN 30 Ca 0.21 -0.41 -0.24 0.00 -0.60 0.00 0.00 54.58 53.54 3ktd n ASN 30 Cb 0.10 -3.60 -0.07 0.00 -0.53 0.00 0.00 39.78 35.67 3ktd n ASN 30 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 3ktd s HIS 31 N -3.24 2.77 -0.58 1.20 3.76 0.18 -5.03 115.29 114.36 3ktd s HIS 31 Ca 0.06 -0.19 -0.28 0.00 -0.15 0.00 0.00 55.06 54.50 3ktd s HIS 31 Cb -0.02 -1.28 0.01 0.00 1.11 0.00 0.00 32.58 32.40 3ktd s HIS 31 CO 0.49 0.57 1.51 0.45 -0.85 0.00 0.00 174.74 176.91 3ktd s SER 32 N -3.39 5.96 -0.02 1.40 0.15 -1.26 -4.45 113.70 112.07 3ktd s SER 32 Ca 0.30 0.28 0.01 0.00 0.70 0.00 0.00 55.95 57.23 3ktd s SER 32 Cb -0.08 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 61.71 3ktd s SER 32 CO 0.20 -1.85 -0.01 0.54 1.20 0.00 0.00 173.24 173.31 3ktd s VAL 33 N 6.64 0.23 0.27 4.45 0.11 -1.26 -1.10 120.40 129.73 3ktd s VAL 33 Ca 0.55 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.62 3ktd s VAL 33 Cb -0.12 -0.28 -0.03 0.00 -1.53 0.00 0.00 36.38 34.43 3ktd s VAL 33 CO 0.24 0.13 0.25 0.72 -3.33 0.00 0.00 175.10 173.10 3ktd s PHE 34 N 0.69 1.36 0.00 1.54 -0.71 -0.18 -4.69 117.98 115.99 3ktd s PHE 34 Ca -0.07 -1.46 0.00 0.00 -1.04 0.00 0.00 56.93 54.36 3ktd s PHE 34 Cb -0.10 -0.53 0.00 0.00 -1.21 0.00 0.00 43.02 41.17 3ktd s PHE 34 CO -0.01 -0.81 0.00 0.41 -1.34 0.00 0.00 175.22 173.47 3ktd n GLY 35 N -0.46 1.41 2.95 1.99 0.00 -1.11 -0.40 105.19 109.58 3ktd n GLY 35 Ca 0.04 -0.75 -0.11 0.00 0.00 0.00 0.00 46.02 45.20 3ktd n GLY 35 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3ktd s TYR 36 N -3.43 0.11 -0.15 1.61 5.04 -0.06 -1.50 117.35 118.97 3ktd s TYR 36 Ca 0.00 -0.23 -0.06 0.00 -2.44 0.00 0.00 57.07 54.35 3ktd s TYR 36 Cb 0.00 -0.09 0.07 0.00 0.35 0.00 0.00 41.96 42.29 3ktd s TYR 36 CO 0.00 -0.12 0.32 1.21 -1.34 0.00 0.00 175.55 175.62 3ktd s ASN 37 N -0.79 0.06 0.10 4.32 2.47 -0.79 -0.54 114.94 119.77 3ktd s ASN 37 Ca -0.09 0.74 -0.25 0.00 0.42 0.00 0.00 52.86 53.68 3ktd s ASN 37 Cb -0.05 0.89 -0.11 0.00 -1.45 0.00 0.00 41.25 40.52 3ktd s ASN 37 CO -0.00 -0.23 1.68 -0.09 -3.72 0.00 0.00 177.10 174.74 3ktd h ARG 38 N 8.09 -0.30 -6.00 0.43 2.43 -1.86 -3.38 114.38 113.79 3ktd h ARG 38 Ca -0.18 0.02 -0.64 0.00 -0.81 0.00 0.00 59.98 58.37 3ktd h ARG 38 Cb 1.12 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 3ktd h ARG 38 CO 0.16 -0.20 1.43 0.43 -1.51 0.00 0.00 179.97 180.28 3ktd n SER 39 N -5.27 2.53 0.11 -3.80 7.64 -1.26 -4.80 113.62 108.77 3ktd n SER 39 Ca -0.07 0.36 0.19 0.00 1.01 0.00 0.00 58.87 60.36 3ktd n SER 39 Cb 0.19 -1.36 0.76 0.00 -1.01 0.00 0.00 64.21 62.79 3ktd n SER 39 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 3ktd h ARG 40 N 13.16 0.00 0.69 1.43 3.08 -1.94 0.32 114.38 131.13 3ktd h ARG 40 Ca -0.32 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.69 3ktd h ARG 40 Cb 1.29 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.35 3ktd h ARG 40 CO 1.00 0.00 -0.33 0.77 -1.07 0.00 0.00 179.97 180.34 3ktd h SER 41 N 0.00 -0.78 -0.50 7.04 0.02 -1.94 -0.08 113.55 117.31 3ktd h SER 41 Ca 0.17 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 61.14 3ktd h SER 41 Cb 0.91 0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.63 3ktd h SER 41 CO -0.00 -0.48 0.33 1.23 -1.14 0.00 0.00 176.83 176.77 3ktd h GLY 42 N -1.06 0.68 0.83 -3.77 0.00 -1.42 0.31 103.07 98.64 3ktd h GLY 42 Ca -0.09 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 46.91 3ktd h GLY 42 CO 0.16 0.23 -0.18 0.00 0.00 0.00 0.00 176.54 176.75 3ktd h ALA 43 N 1.70 0.30 0.00 3.60 0.00 -1.01 -2.34 119.26 121.52 3ktd h ALA 43 Ca 0.19 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 3ktd h ALA 43 Cb -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3ktd h ALA 43 CO -0.04 0.22 -0.38 -0.22 0.00 0.00 0.00 179.25 178.82 3ktd h LYS 44 N 0.18 0.00 0.76 0.00 3.64 -0.53 -1.53 116.57 119.07 3ktd h LYS 44 Ca 0.04 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 3ktd h LYS 44 Cb 0.71 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.54 3ktd h LYS 44 CO 0.05 0.38 -0.36 0.77 -2.27 0.00 0.00 179.45 178.01 3ktd h SER 45 N 0.00 -0.86 -0.51 4.20 0.02 -0.37 -2.04 113.55 113.98 3ktd h SER 45 Ca -0.00 0.03 0.05 0.00 -0.84 0.00 0.00 61.79 61.02 3ktd h SER 45 Cb 0.97 0.22 -0.03 0.00 0.14 0.00 0.00 62.40 63.70 3ktd h SER 45 CO 0.05 -0.49 0.34 0.00 -1.14 0.00 0.00 176.83 175.59 3ktd h ALA 46 N -1.25 1.83 0.01 3.77 0.00 -1.40 -1.06 119.26 121.16 3ktd h ALA 46 Ca -0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3ktd h ALA 46 Cb 0.78 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3ktd h ALA 46 CO 0.17 0.10 -0.01 0.28 0.00 0.00 0.00 179.25 179.79 3ktd h VAL 47 N 0.52 1.20 0.00 0.00 2.07 -1.29 -1.38 116.25 117.37 3ktd h VAL 47 Ca 0.22 -0.65 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 3ktd h VAL 47 Cb 0.21 1.64 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3ktd h VAL 47 CO -0.06 0.17 -0.00 0.44 0.02 0.00 0.00 177.57 178.14 3ktd h ASP 48 N -0.30 0.00 -0.19 0.57 5.19 -0.90 -2.65 116.42 118.15 3ktd h ASP 48 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3ktd h ASP 48 Cb 0.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.80 3ktd h ASP 48 CO 0.00 0.00 0.00 -0.62 -3.12 0.00 0.00 179.24 175.51 3ktd n GLU 49 N -3.09 1.50 -0.55 3.56 1.02 -0.44 -4.93 120.64 117.71 3ktd n GLU 49 Ca 0.01 -0.77 0.00 0.00 -0.02 0.00 0.00 57.16 56.38 3ktd n GLU 49 Cb 0.31 -1.23 0.00 0.00 -0.02 0.00 0.00 31.44 30.50 3ktd n GLU 49 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ktd n GLY 50 N 0.90 0.76 3.96 0.62 0.00 -1.00 -5.04 105.19 105.39 3ktd n GLY 50 Ca 0.10 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 3ktd n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ktd s PHE 51 N -2.77 3.19 -0.93 1.61 0.08 -0.53 -5.04 117.98 113.60 3ktd s PHE 51 Ca 0.00 0.19 -0.10 0.00 0.12 0.00 0.00 56.93 57.14 3ktd s PHE 51 Cb 0.00 -2.32 0.24 0.00 -0.57 0.00 0.00 43.02 40.37 3ktd s PHE 51 CO 0.00 -0.37 0.87 0.34 -0.10 0.00 0.00 175.22 175.97 3ktd s ASP 52 N -4.23 6.77 -0.01 1.36 2.15 -1.26 -4.19 116.67 117.26 3ktd s ASP 52 Ca 0.49 -3.17 0.05 0.00 0.43 0.00 0.00 52.55 50.35 3ktd s ASP 52 Cb -0.10 -2.15 -0.01 0.00 -0.30 0.00 0.00 42.92 40.36 3ktd s ASP 52 CO 0.37 -0.40 -0.16 -0.69 -0.17 0.00 0.00 175.17 174.13 3ktd s VAL 53 N -0.57 1.23 0.21 1.11 1.01 -1.26 -2.75 120.40 119.37 3ktd s VAL 53 Ca 0.24 -0.66 0.11 0.00 0.00 0.00 0.00 61.98 61.67 3ktd s VAL 53 Cb -0.11 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 3ktd s VAL 53 CO -0.08 0.35 -0.23 -0.55 0.00 0.00 0.00 175.10 174.58 3ktd s SER 54 N -0.31 3.45 0.00 3.32 0.15 -0.56 -4.70 113.70 115.04 3ktd s SER 54 Ca 0.05 -0.89 0.16 0.00 0.70 0.00 0.00 55.95 55.96 3ktd s SER 54 Cb -0.07 -0.26 0.26 0.00 -1.71 0.00 0.00 66.02 64.24 3ktd s SER 54 CO -0.00 0.11 1.16 0.00 1.20 0.00 0.00 173.24 175.70 3ktd n ALA 55 N 0.13 2.38 -3.24 5.45 0.00 -1.26 -1.89 120.51 122.08 3ktd n ALA 55 Ca -0.11 -0.87 -0.37 0.00 0.00 0.00 0.00 53.44 52.08 3ktd n ALA 55 Cb 0.57 -0.57 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 3ktd n ALA 55 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3ktd s ASP 56 N -1.19 5.19 0.42 0.00 2.15 -1.26 -4.75 116.67 117.23 3ktd s ASP 56 Ca 0.25 -0.97 0.23 0.00 0.43 0.00 0.00 52.55 52.49 3ktd s ASP 56 Cb 0.15 -1.86 0.67 0.00 -0.30 0.00 0.00 42.92 41.58 3ktd s ASP 56 CO 0.21 -0.27 1.72 0.25 -0.17 0.00 0.00 175.17 176.91 3ktd h LEU 57 N 8.21 0.00 0.12 -1.34 5.85 -1.97 -2.95 115.31 123.24 3ktd h LEU 57 Ca -0.27 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 3ktd h LEU 57 Cb 1.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.13 3ktd h LEU 57 CO 0.60 0.20 -0.06 -0.08 -0.34 0.00 0.00 178.44 178.76 3ktd h GLU 58 N 0.00 -0.16 0.00 1.25 4.81 -2.00 -3.01 114.58 115.47 3ktd h GLU 58 Ca -0.00 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 3ktd h GLU 58 Cb 0.91 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.31 3ktd h GLU 58 CO 0.03 0.24 -0.55 0.00 -0.73 0.00 0.00 179.01 178.00 3ktd h ALA 59 N 0.18 0.77 -0.51 2.92 0.00 -1.99 -2.60 119.26 118.03 3ktd h ALA 59 Ca -0.02 -0.50 -0.10 0.00 0.00 0.00 0.00 54.91 54.29 3ktd h ALA 59 Cb 0.47 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3ktd h ALA 59 CO 0.03 0.68 -0.09 1.15 0.00 0.00 0.00 179.25 181.02 3ktd h THR 60 N 0.00 1.27 -0.18 0.00 2.02 -1.62 -0.54 112.91 113.86 3ktd h THR 60 Ca -0.01 -1.23 -0.13 0.00 0.77 0.00 0.00 66.41 65.81 3ktd h THR 60 Cb 1.24 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.66 3ktd h THR 60 CO 0.07 0.43 -0.46 -0.07 0.37 0.00 0.00 175.52 175.86 3ktd h LEU 61 N 0.82 0.50 -0.41 2.58 3.38 -1.48 -2.13 115.31 118.56 3ktd h LEU 61 Ca 0.13 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 3ktd h LEU 61 Cb 0.65 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3ktd h LEU 61 CO 0.04 0.88 -0.48 1.56 0.09 0.00 0.00 178.44 180.54 3ktd h GLN 62 N 0.37 0.00 0.22 1.13 4.20 -1.37 -2.54 115.11 117.12 3ktd h GLN 62 Ca 0.02 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 3ktd h GLN 62 Cb 0.95 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.73 3ktd h GLN 62 CO 0.08 0.48 -0.11 -0.09 -0.67 0.00 0.00 178.83 178.52 3ktd h ARG 63 N 0.00 -0.29 -0.26 1.46 2.43 -1.01 -3.09 114.38 113.62 3ktd h ARG 63 Ca -0.00 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.26 3ktd h ARG 63 Cb 1.20 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 3ktd h ARG 63 CO 0.06 0.09 0.23 0.00 -1.51 0.00 0.00 179.97 178.85 3ktd h ALA 64 N -0.26 2.04 0.09 2.80 0.00 -1.43 -0.29 119.26 122.20 3ktd h ALA 64 Ca -0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3ktd h ALA 64 Cb 0.51 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3ktd h ALA 64 CO 0.05 -0.37 -0.04 0.00 0.00 0.00 0.00 179.25 178.89 3ktd h ALA 65 N 1.78 -0.13 0.00 0.00 0.00 -1.44 -0.88 119.26 118.60 3ktd h ALA 65 Ca 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3ktd h ALA 65 Cb 0.59 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3ktd h ALA 65 CO -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.78 3ktd h ALA 66 N 0.57 1.00 -0.12 0.00 0.00 -1.27 -3.10 119.26 116.33 3ktd h ALA 66 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ktd h ALA 66 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3ktd h ALA 66 CO 0.02 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.66 3ktd n GLU 67 N -3.05 2.06 -4.26 0.00 1.02 -0.20 -4.96 120.64 111.25 3ktd n GLU 67 Ca 0.03 -1.57 -0.37 0.00 -0.02 0.00 0.00 57.16 55.23 3ktd n GLU 67 Cb 0.45 -1.46 -0.04 0.00 -0.02 0.00 0.00 31.44 30.37 3ktd n GLU 67 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3ktd n ASP 68 N 0.85 -2.95 -4.74 1.62 2.03 -0.40 -4.63 116.55 108.33 3ktd n ASP 68 Ca 0.17 -1.03 -0.30 0.00 0.52 0.00 0.00 54.79 54.15 3ktd n ASP 68 Cb 0.48 -2.45 0.13 0.00 -0.72 0.00 0.00 41.12 38.56 3ktd n ASP 68 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ktd s ALA 69 N -3.24 1.66 -0.31 -1.67 0.00 -0.83 -4.69 121.76 112.69 3ktd s ALA 69 Ca 0.75 -0.12 -0.19 0.00 0.00 0.00 0.00 51.96 52.40 3ktd s ALA 69 Cb -0.42 -3.17 -0.01 0.00 0.00 0.00 0.00 23.12 19.52 3ktd s ALA 69 CO 0.93 -2.25 0.55 -1.17 0.00 0.00 0.00 175.76 173.82 3ktd s LEU 70 N -6.14 4.17 -0.25 0.00 2.96 0.04 -4.20 118.68 115.27 3ktd s LEU 70 Ca 0.63 0.30 -0.19 0.00 -0.22 0.00 0.00 54.13 54.65 3ktd s LEU 70 Cb -0.17 -2.69 -0.02 0.00 0.50 0.00 0.00 46.19 43.81 3ktd s LEU 70 CO 0.56 -0.42 0.57 -0.63 -1.32 0.00 0.00 176.35 175.11 3ktd s ILE 71 N 2.44 5.04 -0.29 6.68 1.01 -0.55 -0.68 121.20 134.85 3ktd s ILE 71 Ca 0.22 1.01 -0.09 0.00 0.00 0.00 0.00 60.65 61.78 3ktd s ILE 71 Cb -0.15 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.42 3ktd s ILE 71 CO 0.12 0.08 0.14 -0.69 0.00 0.00 0.00 174.94 174.59 3ktd s VAL 72 N 2.27 4.69 -1.24 2.92 1.01 0.62 -0.41 120.40 130.27 3ktd s VAL 72 Ca 0.24 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.83 3ktd s VAL 72 Cb -0.16 -3.32 0.14 0.00 0.00 0.00 0.00 36.38 33.05 3ktd s VAL 72 CO 0.09 0.17 1.53 0.18 0.00 0.00 0.00 175.10 177.06 3ktd n LEU 73 N 4.99 5.17 -3.60 3.92 4.77 0.81 -0.69 117.00 132.38 3ktd n LEU 73 Ca -0.14 -4.32 -0.41 0.00 -0.03 0.00 0.00 56.01 51.11 3ktd n LEU 73 Cb 0.50 -1.65 -0.00 0.00 -2.33 0.00 0.00 43.42 39.94 3ktd n LEU 73 CO 0.33 0.59 2.33 0.00 -1.33 0.00 0.00 177.39 179.31 3ktd n ALA 74 N 6.34 6.37 -2.37 -1.18 0.00 -0.35 -3.37 120.51 125.94 3ktd n ALA 74 Ca 0.40 -4.12 -0.18 0.00 0.00 0.00 0.00 53.44 49.53 3ktd n ALA 74 Cb 0.43 -2.89 -0.10 0.00 0.00 0.00 0.00 19.45 16.89 3ktd n ALA 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3ktd s VAL 75 N -0.36 0.89 0.00 0.00 -7.23 -1.26 -4.39 120.40 108.05 3ktd s VAL 75 Ca 0.50 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.67 3ktd s VAL 75 Cb 0.15 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.45 3ktd s VAL 75 CO -0.06 -0.06 0.00 -0.81 -0.31 0.00 0.00 175.10 173.86 3ktd n PRO 76 N -0.54 0.00 0.00 4.82 -0.04 -1.26 -4.65 135.00 133.33 3ktd n PRO 76 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 3ktd n PRO 76 Cb 0.66 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.12 3ktd n PRO 76 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3ktd n THR 78 N 0.00 0.00 -0.02 0.52 -2.24 -1.26 -2.60 114.28 108.68 3ktd n THR 78 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 3ktd n THR 78 Cb 0.00 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.11 3ktd n THR 78 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ktd n ALA 79 N 0.09 2.46 -0.27 6.98 0.00 -1.26 -4.76 120.51 123.75 3ktd n ALA 79 Ca 0.00 -0.45 0.07 0.00 0.00 0.00 0.00 53.44 53.05 3ktd n ALA 79 Cb 0.00 -0.48 0.21 0.00 0.00 0.00 0.00 19.45 19.18 3ktd n ALA 79 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3ktd h ILE 80 N 0.00 0.64 -0.98 0.00 1.08 -1.85 -2.86 117.51 113.54 3ktd h ILE 80 Ca -0.05 -0.16 0.07 0.00 -0.39 0.00 0.00 64.86 64.33 3ktd h ILE 80 Cb 0.88 0.13 -0.07 0.00 -3.07 0.00 0.00 36.82 34.69 3ktd h ILE 80 CO 0.00 0.08 0.63 0.44 -0.69 0.00 0.00 178.15 178.62 3ktd h ASP 81 N 0.46 0.99 0.45 1.72 3.32 -1.91 -1.53 116.42 119.92 3ktd h ASP 81 Ca 0.44 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.40 3ktd h ASP 81 Cb 0.70 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 3ktd h ASP 81 CO -0.42 0.62 -0.49 0.77 -1.72 0.00 0.00 179.24 178.00 3ktd h SER 82 N 1.12 0.05 -0.32 6.45 4.64 -1.86 -2.71 113.55 120.92 3ktd h SER 82 Ca 0.44 -0.02 -0.16 0.00 -0.47 0.00 0.00 61.79 61.57 3ktd h SER 82 Cb 0.22 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 3ktd h SER 82 CO -0.19 0.53 -0.41 -0.07 -0.87 0.00 0.00 176.83 175.83 3ktd h LEU 83 N 0.04 0.94 -0.09 5.97 -0.00 -1.32 -2.71 115.31 118.14 3ktd h LEU 83 Ca -0.00 -0.44 -0.00 0.00 -0.00 0.00 0.00 57.88 57.44 3ktd h LEU 83 Cb 0.88 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 41.27 3ktd h LEU 83 CO 0.07 1.22 0.04 -0.07 -0.00 0.00 0.00 178.44 179.70 3ktd h LEU 84 N 0.71 0.12 -0.77 1.67 3.38 -1.24 -1.88 115.31 117.30 3ktd h LEU 84 Ca 0.05 -0.11 0.13 0.00 0.09 0.00 0.00 57.88 58.04 3ktd h LEU 84 Cb 0.99 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.62 3ktd h LEU 84 CO 0.10 0.19 0.36 0.44 0.09 0.00 0.00 178.44 179.62 3ktd h ASP 85 N 0.03 0.42 -0.65 -0.43 3.32 -1.47 0.25 116.42 117.89 3ktd h ASP 85 Ca 0.03 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 3ktd h ASP 85 Cb 0.11 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 3ktd h ASP 85 CO -0.00 0.20 0.24 0.00 -1.72 0.00 0.00 179.24 177.95 3ktd h ALA 86 N 1.51 0.84 -0.44 3.45 0.00 -1.29 -2.15 119.26 121.19 3ktd h ALA 86 Ca 0.41 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 3ktd h ALA 86 Cb 0.54 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3ktd h ALA 86 CO -0.34 0.48 -0.25 0.28 0.00 0.00 0.00 179.25 179.41 3ktd h VAL 87 N 0.92 1.27 0.00 0.00 2.07 -0.34 0.19 116.25 120.35 3ktd h VAL 87 Ca 0.21 -1.41 -0.05 0.00 0.82 0.00 0.00 66.70 66.28 3ktd h VAL 87 Cb 0.24 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3ktd h VAL 87 CO -0.01 0.48 -0.22 -0.74 0.02 0.00 0.00 177.57 177.10 3ktd h HIS 88 N 0.78 0.00 0.00 1.57 6.17 -0.42 -1.57 115.15 121.69 3ktd h HIS 88 Ca 0.10 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.18 3ktd h HIS 88 Cb 0.81 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.74 3ktd h HIS 88 CO 0.05 0.22 -0.08 1.15 0.71 0.00 0.00 177.93 179.97 3ktd h THR 89 N 0.00 0.00 0.00 6.26 2.02 -1.12 -3.37 112.91 116.70 3ktd h THR 89 Ca -0.00 -0.62 -0.11 0.00 0.77 0.00 0.00 66.41 66.44 3ktd h THR 89 Cb 0.40 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 3ktd h THR 89 CO 0.03 0.00 -0.86 0.45 0.37 0.00 0.00 175.52 175.51 3ktd h HIS 90 N -0.62 0.00 -2.09 3.16 3.86 -0.72 -3.38 115.15 115.36 3ktd h HIS 90 Ca 0.00 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.67 3ktd h HIS 90 Cb 0.08 0.00 -0.41 0.00 1.06 0.00 0.00 27.41 28.15 3ktd h HIS 90 CO -0.04 0.46 -0.97 0.00 0.86 0.00 0.00 177.93 178.24 3ktd n ALA 91 N -2.28 2.99 0.30 2.45 0.00 -0.61 -4.54 120.51 118.83 3ktd n ALA 91 Ca -0.02 -3.88 0.18 0.00 0.00 0.00 0.00 53.44 49.71 3ktd n ALA 91 Cb 0.75 -0.85 0.86 0.00 0.00 0.00 0.00 19.45 20.20 3ktd n ALA 91 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3ktd h PRO 92 N 3.32 0.00 0.00 0.00 0.13 -1.69 -2.88 132.00 130.88 3ktd h PRO 92 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3ktd h PRO 92 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 3ktd h PRO 92 CO 0.61 0.00 -1.04 -1.71 -0.23 0.00 0.00 178.00 175.63 3ktd n ASN 93 N -2.92 0.87 -4.78 1.44 5.15 -1.26 -4.99 115.26 108.77 3ktd n ASN 93 Ca -0.01 -0.65 -0.36 0.00 -0.60 0.00 0.00 54.58 52.97 3ktd n ASN 93 Cb 0.19 1.21 -0.02 0.00 -0.53 0.00 0.00 39.78 40.63 3ktd n ASN 93 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3ktd s ASN 94 N -2.91 6.18 0.27 1.20 -0.87 -1.09 -5.02 114.94 112.71 3ktd s ASN 94 Ca 0.03 2.13 -0.27 0.00 -1.57 0.00 0.00 52.86 53.18 3ktd s ASN 94 Cb 0.12 -2.58 -0.09 0.00 -0.02 0.00 0.00 41.25 38.67 3ktd s ASN 94 CO 0.68 -0.90 0.92 -0.83 -2.57 0.00 0.00 177.10 174.40 3ktd s GLY 95 N -1.67 2.93 0.18 0.66 0.00 -1.26 -4.85 107.32 103.32 3ktd s GLY 95 Ca 0.66 0.53 -0.08 0.00 0.00 0.00 0.00 44.72 45.83 3ktd s GLY 95 CO 0.28 1.03 0.30 -0.11 0.00 0.00 0.00 173.10 174.59 3ktd s PHE 96 N -1.40 0.50 0.15 1.90 -0.71 -0.24 -1.48 117.98 116.71 3ktd s PHE 96 Ca 0.45 -0.85 -0.14 0.00 -1.04 0.00 0.00 56.93 55.36 3ktd s PHE 96 Cb -0.22 -0.09 0.02 0.00 -1.21 0.00 0.00 43.02 41.52 3ktd s PHE 96 CO 0.27 -0.76 0.39 -0.08 -1.34 0.00 0.00 175.22 173.70 3ktd s THR 97 N -4.00 0.06 0.25 -4.49 -1.32 0.46 -1.88 115.64 104.72 3ktd s THR 97 Ca 0.21 -0.93 0.00 0.00 -1.21 0.00 0.00 61.69 59.77 3ktd s THR 97 Cb 0.03 -1.50 -0.00 0.00 -1.51 0.00 0.00 72.50 69.52 3ktd s THR 97 CO 0.03 -0.28 0.01 -0.90 -2.21 0.00 0.00 174.62 171.27 3ktd n ASP 98 N -0.24 2.50 -0.22 8.08 5.75 -1.26 -0.13 116.55 131.03 3ktd n ASP 98 Ca -0.12 -2.12 0.01 0.00 -0.01 0.00 0.00 54.79 52.55 3ktd n ASP 98 Cb 0.63 0.22 0.01 0.00 -1.03 0.00 0.00 41.12 40.95 3ktd n ASP 98 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 3ktd n VAL 99 N -0.62 0.22 -2.02 2.12 0.24 -1.22 -3.52 118.33 113.53 3ktd n VAL 99 Ca -0.10 -0.24 -0.34 0.00 -2.04 0.00 0.00 64.34 61.62 3ktd n VAL 99 Cb 0.32 0.66 0.02 0.00 -1.47 0.00 0.00 33.84 33.37 3ktd n VAL 99 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3ktd s VAL 100 N -0.29 3.24 -1.03 3.34 1.01 -1.25 -4.42 120.40 121.00 3ktd s VAL 100 Ca 0.02 0.67 0.19 0.00 0.00 0.00 0.00 61.98 62.86 3ktd s VAL 100 Cb 0.02 -3.21 0.17 0.00 0.00 0.00 0.00 36.38 33.36 3ktd s VAL 100 CO 0.00 -0.26 1.61 -0.24 0.00 0.00 0.00 175.10 176.21 3ktd n SER 101 N -1.84 0.00 -4.09 3.32 2.88 -1.26 -4.61 113.62 108.02 3ktd n SER 101 Ca 0.11 0.46 -0.25 0.00 -1.33 0.00 0.00 58.87 57.85 3ktd n SER 101 Cb 0.52 -0.48 -0.16 0.00 -0.75 0.00 0.00 64.21 63.33 3ktd n SER 101 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3ktd s VAL 102 N -2.97 1.30 -0.12 2.46 1.01 -1.26 -4.96 120.40 115.87 3ktd s VAL 102 Ca 0.10 -0.62 0.14 0.00 0.00 0.00 0.00 61.98 61.60 3ktd s VAL 102 Cb 0.12 -1.15 -0.20 0.00 0.00 0.00 0.00 36.38 35.15 3ktd s VAL 102 CO 0.34 0.39 0.12 0.29 0.00 0.00 0.00 175.10 176.24 3ktd n LYS 103 N 3.43 1.29 0.03 2.72 4.76 -1.26 -4.18 118.16 124.95 3ktd n LYS 103 Ca -0.20 -0.04 -0.13 0.00 -2.87 0.00 0.00 58.31 55.07 3ktd n LYS 103 Cb 0.53 -1.39 -0.09 0.00 -1.84 0.00 0.00 35.03 32.24 3ktd n LYS 103 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 3ktd h THR 104 N 0.00 1.15 -0.70 -0.18 2.02 -1.94 -1.12 112.91 112.13 3ktd h THR 104 Ca -0.31 -0.74 0.11 0.00 0.77 0.00 0.00 66.41 66.23 3ktd h THR 104 Cb 1.65 1.64 -0.08 0.00 -1.74 0.00 0.00 68.15 69.62 3ktd h THR 104 CO 0.02 0.18 0.31 0.00 0.37 0.00 0.00 175.52 176.40 3ktd h ALA 105 N 0.49 0.96 -0.44 6.16 0.00 -1.85 0.31 119.26 124.89 3ktd h ALA 105 Ca -0.01 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 3ktd h ALA 105 Cb 0.37 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3ktd h ALA 105 CO 0.01 -0.12 -0.26 0.28 0.00 0.00 0.00 179.25 179.16 3ktd h VAL 106 N 0.51 1.27 -0.20 0.00 2.07 -1.72 -2.95 116.25 115.23 3ktd h VAL 106 Ca 0.36 -1.42 -0.17 0.00 0.82 0.00 0.00 66.70 66.29 3ktd h VAL 106 Cb 0.44 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 3ktd h VAL 106 CO -0.31 0.48 -0.56 0.22 0.02 0.00 0.00 177.57 177.42 3ktd h TYR 107 N 0.80 0.78 -0.45 1.57 3.20 -0.03 -1.81 116.97 121.03 3ktd h TYR 107 Ca 0.10 -0.28 0.02 0.00 3.14 0.00 0.00 58.73 61.70 3ktd h TYR 107 Cb 0.83 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.92 3ktd h TYR 107 CO 0.05 1.04 0.27 -0.44 -1.64 0.00 0.00 178.16 177.44 3ktd h ASP 108 N 0.47 0.43 0.49 -2.11 3.32 -0.46 -0.09 116.42 118.49 3ktd h ASP 108 Ca 0.01 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.99 3ktd h ASP 108 Cb 1.12 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 3ktd h ASP 108 CO 0.11 0.31 -0.32 0.00 -1.72 0.00 0.00 179.24 177.62 3ktd h ALA 109 N 1.20 1.26 -0.16 3.45 0.00 -1.42 0.55 119.26 124.13 3ktd h ALA 109 Ca 0.18 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 3ktd h ALA 109 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3ktd h ALA 109 CO -0.08 0.40 -0.34 0.28 0.00 0.00 0.00 179.25 179.50 3ktd h VAL 110 N 0.00 1.35 -0.53 0.00 2.07 -0.82 -3.01 116.25 115.32 3ktd h VAL 110 Ca -0.00 -1.59 -0.11 0.00 0.82 0.00 0.00 66.70 65.82 3ktd h VAL 110 Cb 0.65 1.96 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 3ktd h VAL 110 CO 0.04 0.48 -0.09 0.11 0.02 0.00 0.00 177.57 178.13 3ktd h LYS 111 N 0.16 0.98 -0.72 1.57 1.57 -0.51 -2.71 116.57 116.89 3ktd h LYS 111 Ca 0.00 -0.34 0.12 0.00 -1.87 0.00 0.00 60.65 58.55 3ktd h LYS 111 Cb 0.94 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.13 3ktd h LYS 111 CO 0.08 1.02 0.48 0.00 -0.57 0.00 0.00 179.45 180.45 3ktd h ALA 112 N 1.01 1.96 -0.70 3.86 0.00 0.05 -1.71 119.26 123.72 3ktd h ALA 112 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ktd h ALA 112 Cb 0.64 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3ktd h ALA 112 CO 0.04 -0.13 0.00 0.54 0.00 0.00 0.00 179.25 179.71 3ktd n ARG 113 N -4.49 2.70 -2.78 0.00 1.74 -1.08 -5.08 116.66 107.67 3ktd n ARG 113 Ca 0.13 -2.55 -0.01 0.00 -0.77 0.00 0.00 57.85 54.64 3ktd n ARG 113 Cb 0.41 -1.57 -0.01 0.00 -1.02 0.00 0.00 32.46 30.28 3ktd n ARG 113 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3ktd n ASN 114 N 1.54 -6.90 0.00 0.55 3.02 -0.65 -5.07 115.26 107.75 3ktd n ASN 114 Ca 0.24 1.27 0.00 0.00 -0.03 0.00 0.00 54.58 56.06 3ktd n ASN 114 Cb 0.61 -4.71 0.00 0.00 -0.61 0.00 0.00 39.78 35.07 3ktd n ASN 114 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ktd n GLN 116 N 0.96 0.00 0.00 3.52 0.00 -1.25 -4.97 117.38 115.64 3ktd n GLN 116 Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 57.00 57.06 3ktd n GLN 116 Cb 0.15 0.00 0.61 0.00 0.00 0.00 0.00 30.24 31.00 3ktd n GLN 116 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 3ktd n HIS 117 N 0.00 0.00 -0.84 2.61 8.25 -1.26 -3.03 115.22 120.95 3ktd n HIS 117 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.49 3ktd n HIS 117 Cb 0.00 -0.26 0.05 0.00 1.12 0.00 0.00 29.99 30.90 3ktd n HIS 117 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3ktd n ARG 118 N -1.26 1.45 -4.78 -0.41 5.12 -1.26 -4.51 116.66 111.02 3ktd n ARG 118 Ca 0.12 -1.62 -0.33 0.00 -1.93 0.00 0.00 57.85 54.09 3ktd n ARG 118 Cb 0.18 -1.01 -0.14 0.00 -1.16 0.00 0.00 32.46 30.33 3ktd n ARG 118 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 3ktd s TYR 119 N -1.30 2.80 -0.27 -1.55 5.04 -1.17 -1.08 117.35 119.83 3ktd s TYR 119 Ca 0.11 -0.52 0.00 0.00 -2.44 0.00 0.00 57.07 54.22 3ktd s TYR 119 Cb 0.09 -1.81 0.08 0.00 0.35 0.00 0.00 41.96 40.67 3ktd s TYR 119 CO 0.01 -0.12 0.02 0.08 -1.34 0.00 0.00 175.55 174.20 3ktd s VAL 120 N 0.13 1.35 0.57 3.14 1.01 -0.79 -4.99 120.40 120.82 3ktd s VAL 120 Ca -0.06 -1.38 -0.19 0.00 0.00 0.00 0.00 61.98 60.35 3ktd s VAL 120 Cb -0.15 -1.82 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 3ktd s VAL 120 CO 0.05 -0.36 1.16 -0.83 0.00 0.00 0.00 175.10 175.11 3ktd s GLY 121 N 1.43 2.65 0.16 4.51 0.00 -1.26 -4.21 107.32 110.59 3ktd s GLY 121 Ca 0.02 0.88 -0.15 0.00 0.00 0.00 0.00 44.72 45.46 3ktd s GLY 121 CO -0.12 1.24 0.43 -1.35 0.00 0.00 0.00 173.10 173.30 3ktd s SER 122 N -1.75 -0.18 -0.29 1.64 1.04 -1.23 -0.83 113.70 112.10 3ktd s SER 122 Ca 0.74 -0.51 0.02 0.00 0.48 0.00 0.00 55.95 56.68 3ktd s SER 122 Cb -0.26 0.51 0.18 0.00 0.10 0.00 0.00 66.02 66.55 3ktd s SER 122 CO 0.30 -0.95 0.51 -2.28 0.98 0.00 0.00 173.24 171.80 3ktd s HIS 123 N -3.87 -1.44 0.00 5.02 2.46 0.10 -3.49 115.29 114.07 3ktd s HIS 123 Ca 0.09 0.98 0.00 0.00 0.47 0.00 0.00 55.06 56.59 3ktd s HIS 123 Cb 0.01 0.20 0.00 0.00 -0.13 0.00 0.00 32.58 32.66 3ktd s HIS 123 CO -0.06 -0.97 0.00 -0.35 -2.47 0.00 0.00 174.74 170.90 3ktd n PRO 124 N 5.40 2.08 0.00 2.88 -0.04 -1.26 -0.63 135.00 143.42 3ktd n PRO 124 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 3ktd n PRO 124 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 3ktd n PRO 124 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ktd n ALA 126 N -3.00 0.00 0.00 0.55 0.00 -1.26 -4.96 120.51 111.84 3ktd n ALA 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3ktd n ALA 126 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3ktd n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ktd n GLY 127 N 0.00 -0.61 2.69 0.00 0.00 -1.26 -5.03 105.19 100.97 3ktd n GLY 127 Ca 0.00 -2.22 -0.20 0.00 0.00 0.00 0.00 46.02 43.60 3ktd n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ktd s THR 128 N -0.14 -0.05 0.10 2.61 -4.23 -1.26 -4.94 115.64 107.73 3ktd s THR 128 Ca 0.00 0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.89 3ktd s THR 128 Cb 0.00 -0.19 0.00 0.00 1.34 0.00 0.00 72.50 73.65 3ktd s THR 128 CO 0.00 0.18 0.00 0.00 -0.54 0.00 0.00 174.62 174.26 3ktd n ALA 129 N 5.20 3.00 0.00 3.99 0.00 -1.26 -4.89 120.51 126.54 3ktd n ALA 129 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3ktd n ALA 129 Cb 0.50 0.25 0.00 0.00 0.00 0.00 0.00 19.45 20.20 3ktd n ALA 129 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3ktd n ASN 130 N -3.48 0.00 -4.56 0.00 2.85 -1.26 -4.76 115.26 104.05 3ktd n ASN 130 Ca 0.00 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.18 3ktd n ASN 130 Cb 0.02 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 40.95 3ktd n ASN 130 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 3ktd s GLY 132 N 0.00 2.71 0.38 8.20 0.00 -1.26 -4.81 107.32 112.54 3ktd s GLY 132 Ca 0.00 -1.20 0.12 0.00 0.00 0.00 0.00 44.72 43.64 3ktd s GLY 132 CO 0.00 -2.06 1.86 -0.25 0.00 0.00 0.00 173.10 172.65 3ktd h TRP 133 N 1.63 0.06 0.00 1.90 2.91 -1.86 -2.26 115.95 118.33 3ktd h TRP 133 Ca -0.42 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 59.58 3ktd h TRP 133 Cb 1.28 -0.02 -0.00 0.00 -0.51 0.00 0.00 29.16 29.91 3ktd h TRP 133 CO 1.22 0.36 -0.07 0.66 -1.03 0.00 0.00 178.44 179.58 3ktd h SER 134 N 0.05 0.00 1.08 2.65 4.64 -1.93 -2.57 113.55 117.47 3ktd h SER 134 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3ktd h SER 134 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 3ktd h SER 134 CO 0.04 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.07 3ktd h ALA 135 N 1.93 1.00 -2.25 5.18 0.00 -1.72 -3.51 119.26 119.88 3ktd h ALA 135 Ca -0.00 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.44 3ktd h ALA 135 Cb 0.37 0.00 0.18 0.00 0.00 0.00 0.00 17.79 18.34 3ktd h ALA 135 CO 0.01 0.00 0.15 -1.54 0.00 0.00 0.00 179.25 177.87 3ktd s SER 136 N -4.96 2.31 -0.06 0.00 1.04 -0.97 -4.61 113.70 106.45 3ktd s SER 136 Ca 0.05 1.60 0.02 0.00 0.48 0.00 0.00 55.95 58.09 3ktd s SER 136 Cb 0.09 -2.26 -0.03 0.00 0.10 0.00 0.00 66.02 63.92 3ktd s SER 136 CO 0.50 -3.39 -0.09 -1.81 0.98 0.00 0.00 173.24 169.43 3ktd s ASP 138 N -2.94 4.44 -1.26 7.02 -0.00 -1.26 -4.90 116.67 117.77 3ktd s ASP 138 Ca 0.66 -0.08 -0.02 0.00 -0.00 0.00 0.00 52.55 53.11 3ktd s ASP 138 Cb -0.22 -1.07 0.00 0.00 -0.00 0.00 0.00 42.92 41.64 3ktd s ASP 138 CO 0.60 0.36 0.31 0.61 -0.00 0.00 0.00 175.17 177.04 3ktd n GLY 139 N 2.26 -0.26 0.17 0.21 0.00 -1.26 -4.92 105.19 101.38 3ktd n GLY 139 Ca -0.18 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.65 3ktd n GLY 139 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ktd h LEU 140 N -0.70 0.32 0.00 0.99 5.85 -1.91 -3.25 115.31 116.61 3ktd h LEU 140 Ca -0.40 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.13 3ktd h LEU 140 Cb 1.28 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.22 3ktd h LEU 140 CO 0.44 0.87 -0.75 0.49 -0.34 0.00 0.00 178.44 179.15 3ktd n PHE 141 N -3.85 0.17 -1.62 1.25 3.72 -1.26 -4.78 117.46 111.08 3ktd n PHE 141 Ca -0.03 0.05 -0.48 0.00 -0.05 0.00 0.00 57.45 56.94 3ktd n PHE 141 Cb 0.65 -0.35 -0.05 0.00 -0.94 0.00 0.00 39.48 38.79 3ktd n PHE 141 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3ktd n LYS 142 N -1.75 1.94 -1.35 -1.08 4.01 -1.23 -0.18 118.16 118.53 3ktd n LYS 142 Ca 0.04 0.66 -0.12 0.00 -0.51 0.00 0.00 58.31 58.38 3ktd n LYS 142 Cb 0.38 -2.71 -0.05 0.00 -0.51 0.00 0.00 35.03 32.14 3ktd n LYS 142 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 3ktd n ARG 143 N 7.31 -0.90 -3.93 1.97 1.74 -0.62 -4.97 116.66 117.28 3ktd n ARG 143 Ca 0.27 0.91 -0.33 0.00 -0.77 0.00 0.00 57.85 57.93 3ktd n ARG 143 Cb 0.31 -4.93 -0.05 0.00 -1.02 0.00 0.00 32.46 26.76 3ktd n ARG 143 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ktd s ALA 144 N -2.41 3.92 0.26 7.54 0.00 0.74 -4.86 121.76 126.96 3ktd s ALA 144 Ca 0.00 -0.77 -0.29 0.00 0.00 0.00 0.00 51.96 50.89 3ktd s ALA 144 Cb 0.00 -1.85 -0.09 0.00 0.00 0.00 0.00 23.12 21.18 3ktd s ALA 144 CO 0.00 0.74 1.12 0.08 0.00 0.00 0.00 175.76 177.70 3ktd s VAL 145 N -1.30 3.48 -0.16 0.00 1.01 -1.26 -0.13 120.40 122.03 3ktd s VAL 145 Ca 0.26 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.69 3ktd s VAL 145 Cb -0.13 -3.92 0.04 0.00 0.00 0.00 0.00 36.38 32.37 3ktd s VAL 145 CO 0.18 0.33 -0.09 0.86 0.00 0.00 0.00 175.10 176.38 3ktd s TRP 146 N -0.96 1.96 0.05 5.22 -0.11 0.29 -4.59 118.94 120.80 3ktd s TRP 146 Ca 0.46 -1.21 -0.24 0.00 1.22 0.00 0.00 56.10 56.34 3ktd s TRP 146 Cb -0.32 -1.45 -0.06 0.00 -1.50 0.00 0.00 33.47 30.14 3ktd s TRP 146 CO 0.41 -0.65 0.71 0.08 -4.62 0.00 0.00 176.95 172.88 3ktd s VAL 147 N 1.55 4.72 -0.10 5.86 1.01 0.19 -1.52 120.40 132.12 3ktd s VAL 147 Ca 0.02 1.52 0.02 0.00 0.00 0.00 0.00 61.98 63.53 3ktd s VAL 147 Cb -0.15 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 32.19 3ktd s VAL 147 CO -0.08 0.41 -0.14 -0.69 0.00 0.00 0.00 175.10 174.60 3ktd s VAL 148 N -0.31 1.38 0.60 2.92 1.01 -0.90 -0.72 120.40 124.38 3ktd s VAL 148 Ca 0.36 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.66 3ktd s VAL 148 Cb -0.20 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 3ktd s VAL 148 CO 0.22 0.42 0.98 0.42 0.00 0.00 0.00 175.10 177.13 3ktd s THR 149 N 0.94 4.49 0.00 3.92 -4.23 -0.01 -1.96 115.64 118.77 3ktd s THR 149 Ca -0.08 0.61 0.12 0.00 -1.18 0.00 0.00 61.69 61.16 3ktd s THR 149 Cb -0.15 -3.78 0.19 0.00 1.34 0.00 0.00 72.50 70.10 3ktd s THR 149 CO -0.00 -0.96 1.07 2.22 -0.54 0.00 0.00 174.62 176.41 3ktd n PHE 150 N -2.68 0.00 -0.33 3.99 -1.74 -1.22 -4.60 117.46 110.88 3ktd n PHE 150 Ca 0.05 -0.49 0.04 0.00 -0.56 0.00 0.00 57.45 56.48 3ktd n PHE 150 Cb 0.55 0.21 0.22 0.00 1.52 0.00 0.00 39.48 41.98 3ktd n PHE 150 CO 0.00 0.00 0.00 -0.44 -0.56 0.00 0.00 176.76 175.76 3ktd h ASP 151 N 0.45 0.94 -1.32 5.98 5.19 -1.96 -2.31 116.42 123.39 3ktd h ASP 151 Ca -0.41 0.01 0.39 0.00 -0.62 0.00 0.00 57.03 56.39 3ktd h ASP 151 Cb 1.63 -0.19 -0.08 0.00 0.18 0.00 0.00 39.33 40.87 3ktd h ASP 151 CO -0.11 0.60 0.92 1.56 -3.12 0.00 0.00 179.24 179.08 3ktd h GLN 152 N 1.07 0.09 0.00 3.56 7.50 -1.93 0.29 115.11 125.68 3ktd h GLN 152 Ca 0.41 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.56 3ktd h GLN 152 Cb 0.22 -0.02 0.00 0.00 0.05 0.00 0.00 27.48 27.73 3ktd h GLN 152 CO -0.16 0.06 0.00 1.28 -1.50 0.00 0.00 178.83 178.51 3ktd n LEU 153 N -4.31 0.00 0.00 1.46 4.77 -0.87 -4.13 117.00 113.93 3ktd n LEU 153 Ca 0.31 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.65 3ktd n LEU 153 Cb 1.35 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 42.08 3ktd n LEU 153 CO 0.35 -0.07 -0.10 0.49 -1.33 0.00 0.00 177.39 176.73 3ktd n PHE 154 N -1.36 0.00 -2.53 -1.77 3.72 0.97 -5.07 117.46 111.42 3ktd n PHE 154 Ca 0.09 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.40 3ktd n PHE 154 Cb 0.22 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.80 3ktd n PHE 154 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3ktd n ASP 155 N -0.48 0.62 -3.44 4.37 5.68 -0.92 -4.95 116.55 117.42 3ktd n ASP 155 Ca 0.00 -1.50 -0.35 0.00 -0.50 0.00 0.00 54.79 52.44 3ktd n ASP 155 Cb 0.00 -0.25 -0.03 0.00 -1.14 0.00 0.00 41.12 39.70 3ktd n ASP 155 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3ktd n GLY 156 N 1.90 3.24 2.80 6.12 0.00 -1.26 -4.83 105.19 113.16 3ktd n GLY 156 Ca 0.07 -1.19 -0.22 0.00 0.00 0.00 0.00 46.02 44.67 3ktd n GLY 156 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ktd s THR 157 N 3.84 0.42 -1.14 2.61 2.01 -1.26 -5.08 115.64 117.03 3ktd s THR 157 Ca 0.51 0.06 -0.07 0.00 0.31 0.00 0.00 61.69 62.49 3ktd s THR 157 Cb 0.13 -0.54 0.26 0.00 0.01 0.00 0.00 72.50 72.36 3ktd s THR 157 CO 0.01 0.25 1.48 -0.90 -0.69 0.00 0.00 174.62 174.77 3ktd n ASP 158 N 4.88 5.83 -4.77 3.53 5.75 -1.26 -4.81 116.55 125.68 3ktd n ASP 158 Ca -0.12 -3.22 -0.35 0.00 -0.01 0.00 0.00 54.79 51.09 3ktd n ASP 158 Cb 0.50 -1.37 0.00 0.00 -1.03 0.00 0.00 41.12 39.23 3ktd n ASP 158 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 3ktd s ILE 159 N -1.35 3.19 0.00 2.12 -5.25 -1.26 -5.07 121.20 113.59 3ktd s ILE 159 Ca 0.34 0.73 0.00 0.00 -0.99 0.00 0.00 60.65 60.73 3ktd s ILE 159 Cb 0.02 -3.28 0.00 0.00 2.95 0.00 0.00 42.46 42.14 3ktd s ILE 159 CO 0.03 -0.17 0.00 0.59 -1.79 0.00 0.00 174.94 173.60 3ktd n ASN 160 N -1.37 0.00 0.04 4.36 4.13 -1.26 -4.98 115.26 116.18 3ktd n ASN 160 Ca 0.11 -0.54 0.12 0.00 1.68 0.00 0.00 54.58 55.96 3ktd n ASN 160 Cb 0.51 0.00 0.29 0.00 -1.54 0.00 0.00 39.78 39.04 3ktd n ASN 160 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 3ktd n SER 161 N -1.62 0.55 -0.11 6.41 3.41 -1.26 -3.88 113.62 117.12 3ktd n SER 161 Ca 0.00 0.12 -0.09 0.00 -0.26 0.00 0.00 58.87 58.64 3ktd n SER 161 Cb 0.00 -0.03 0.06 0.00 -0.26 0.00 0.00 64.21 63.98 3ktd n SER 161 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3ktd h THR 162 N 0.00 1.27 -0.19 6.66 2.02 -1.95 -1.37 112.91 119.35 3ktd h THR 162 Ca 0.00 -1.36 -0.01 0.00 0.77 0.00 0.00 66.41 65.80 3ktd h THR 162 Cb 0.63 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 3ktd h THR 162 CO 0.00 0.46 0.06 -0.25 0.37 0.00 0.00 175.52 176.16 3ktd h TRP 163 N 0.74 0.30 -0.99 3.16 7.01 -1.79 -1.87 115.95 122.51 3ktd h TRP 163 Ca 0.10 -0.03 0.17 0.00 2.11 0.00 0.00 58.89 61.24 3ktd h TRP 163 Cb 0.76 -0.09 -0.10 0.00 -2.10 0.00 0.00 29.16 27.63 3ktd h TRP 163 CO 0.04 0.38 0.60 0.82 -2.79 0.00 0.00 178.44 177.49 3ktd h ILE 164 N 0.13 0.75 -0.65 2.65 2.04 -1.66 -0.68 117.51 120.09 3ktd h ILE 164 Ca 0.06 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.59 3ktd h ILE 164 Cb 0.22 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.16 3ktd h ILE 164 CO -0.00 0.14 0.17 -1.28 0.00 0.00 0.00 178.15 177.18 3ktd h SER 165 N 0.79 0.98 0.01 1.72 0.87 -0.74 -1.62 113.55 115.57 3ktd h SER 165 Ca 0.55 -0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.88 3ktd h SER 165 Cb 0.80 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 3ktd h SER 165 CO -0.36 0.95 -0.00 0.40 -0.53 0.00 0.00 176.83 177.29 3ktd h ILE 166 N 0.96 1.26 -0.70 2.23 2.04 -0.42 -2.63 117.51 120.25 3ktd h ILE 166 Ca 0.21 -0.82 0.15 0.00 1.00 0.00 0.00 64.86 65.40 3ktd h ILE 166 Cb 0.35 1.82 -0.11 0.00 -0.74 0.00 0.00 36.82 38.14 3ktd h ILE 166 CO 0.00 0.21 0.12 -0.25 0.00 0.00 0.00 178.15 178.23 3ktd h TRP 167 N -0.36 0.17 -0.21 1.37 7.01 -1.14 -0.55 115.95 122.24 3ktd h TRP 167 Ca -0.00 0.04 0.05 0.00 2.11 0.00 0.00 58.89 61.09 3ktd h TRP 167 Cb 0.36 0.03 -0.05 0.00 -2.10 0.00 0.00 29.16 27.40 3ktd h TRP 167 CO 0.05 -0.12 -0.10 0.87 -2.79 0.00 0.00 178.44 176.35 3ktd h LYS 168 N 0.22 -0.07 -0.76 2.65 1.57 -1.13 -1.99 116.57 117.06 3ktd h LYS 168 Ca 0.39 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.13 3ktd h LYS 168 Cb 0.65 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.95 3ktd h LYS 168 CO -0.52 -0.05 0.32 -0.44 -0.57 0.00 0.00 179.45 178.19 3ktd h ASP 169 N -0.07 1.03 -0.58 0.86 3.32 -0.82 0.35 116.42 120.51 3ktd h ASP 169 Ca 0.11 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 57.02 3ktd h ASP 169 Cb 0.24 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 3ktd h ASP 169 CO -0.25 0.90 0.38 0.58 -1.72 0.00 0.00 179.24 179.13 3ktd h VAL 170 N 1.10 1.14 -0.60 -1.35 2.07 -0.88 -2.38 116.25 115.35 3ktd h VAL 170 Ca 0.26 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 3ktd h VAL 170 Cb 0.18 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 3ktd h VAL 170 CO -0.02 0.14 0.19 0.58 0.02 0.00 0.00 177.57 178.48 3ktd h VAL 171 N 0.77 1.24 0.00 2.57 2.07 -0.94 -1.98 116.25 119.98 3ktd h VAL 171 Ca 0.21 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.91 3ktd h VAL 171 Cb -0.08 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3ktd h VAL 171 CO -0.05 0.31 0.00 0.00 0.02 0.00 0.00 177.57 177.85 3ktd n GLN 172 N -4.40 0.15 0.00 1.57 1.13 0.07 -1.44 117.38 114.46 3ktd n GLN 172 Ca 0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 3ktd n GLN 172 Cb 0.21 -1.31 0.00 0.00 0.11 0.00 0.00 30.24 29.25 3ktd n GLN 172 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3ktd n ALA 174 N 0.76 0.00 -0.08 -1.58 0.00 -0.75 -0.05 120.51 118.81 3ktd n ALA 174 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 3ktd n ALA 174 Cb 0.06 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.67 3ktd n ALA 174 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3ktd h LEU 175 N 0.00 0.70 -1.46 0.00 3.38 -1.44 -1.74 115.31 114.75 3ktd h LEU 175 Ca 0.00 -0.20 0.05 0.00 0.09 0.00 0.00 57.88 57.82 3ktd h LEU 175 Cb 0.00 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 3ktd h LEU 175 CO 0.00 0.83 0.42 0.00 0.09 0.00 0.00 178.44 179.78 3ktd h ALA 176 N 1.24 1.73 -0.34 1.53 0.00 -0.72 -0.75 119.26 121.95 3ktd h ALA 176 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3ktd h ALA 176 Cb 0.55 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3ktd h ALA 176 CO 0.03 0.19 0.00 1.33 0.00 0.00 0.00 179.25 180.80 3ktd n VAL 177 N -4.47 1.56 -0.96 0.00 0.24 -1.11 -4.90 118.33 108.69 3ktd n VAL 177 Ca 0.08 -0.80 0.00 0.00 -2.04 0.00 0.00 64.34 61.58 3ktd n VAL 177 Cb 0.19 -0.34 0.00 0.00 -1.47 0.00 0.00 33.84 32.21 3ktd n VAL 177 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ktd n GLY 178 N 0.40 0.73 3.84 7.63 0.00 -0.29 -3.64 105.19 113.85 3ktd n GLY 178 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 3ktd n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktd s ALA 179 N -2.88 2.78 -0.37 4.61 0.00 -0.67 -1.58 121.76 123.64 3ktd s ALA 179 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 51.96 51.86 3ktd s ALA 179 Cb 0.00 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 20.01 3ktd s ALA 179 CO 0.00 -1.10 0.20 -1.21 0.00 0.00 0.00 175.76 173.64 3ktd s GLU 180 N -5.10 2.82 -0.14 0.00 2.02 0.81 -4.35 118.70 114.76 3ktd s GLU 180 Ca 0.57 -1.08 -0.28 0.00 0.02 0.00 0.00 54.97 54.21 3ktd s GLU 180 Cb -0.13 -3.71 -0.01 0.00 0.10 0.00 0.00 34.13 30.38 3ktd s GLU 180 CO 0.55 -0.69 0.93 0.08 0.02 0.00 0.00 175.26 176.14 3ktd s VAL 181 N 1.54 4.82 -0.17 2.63 1.01 -1.26 -0.54 120.40 128.43 3ktd s VAL 181 Ca 0.02 1.85 0.01 0.00 0.00 0.00 0.00 61.98 63.86 3ktd s VAL 181 Cb -0.19 -4.23 0.01 0.00 0.00 0.00 0.00 36.38 31.97 3ktd s VAL 181 CO 0.06 0.00 -0.19 -0.69 0.00 0.00 0.00 175.10 174.29 3ktd s VAL 182 N 2.14 2.21 0.42 2.92 1.01 -0.57 -0.30 120.40 128.22 3ktd s VAL 182 Ca 0.43 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 61.32 3ktd s VAL 182 Cb -0.17 -1.93 -0.10 0.00 0.00 0.00 0.00 36.38 34.18 3ktd s VAL 182 CO 0.14 0.53 0.91 -2.16 0.00 0.00 0.00 175.10 174.53 3ktd s PRO 183 N 1.18 4.17 -0.03 2.72 0.04 -1.26 -2.11 135.00 139.71 3ktd s PRO 183 Ca 0.02 1.03 -0.29 0.00 0.04 0.00 0.00 61.00 61.80 3ktd s PRO 183 Cb -0.14 -2.22 0.10 0.00 0.04 0.00 0.00 34.50 32.29 3ktd s PRO 183 CO -0.09 -0.01 0.89 0.45 0.04 0.00 0.00 177.00 178.28 3ktd s SER 184 N -2.26 -0.38 0.59 6.66 0.15 -0.83 -4.00 113.70 113.63 3ktd s SER 184 Ca 0.60 0.10 0.03 0.00 0.70 0.00 0.00 55.95 57.39 3ktd s SER 184 Cb -0.09 0.38 0.07 0.00 -1.71 0.00 0.00 66.02 64.67 3ktd s SER 184 CO 0.15 -0.58 0.81 -0.13 1.20 0.00 0.00 173.24 174.69 3ktd s ARG 185 N -2.72 2.28 0.05 5.44 0.52 -1.26 -3.44 118.95 119.82 3ktd s ARG 185 Ca 0.03 -1.13 -0.23 0.00 -0.52 0.00 0.00 55.73 53.87 3ktd s ARG 185 Cb -0.01 -2.52 -0.16 0.00 0.52 0.00 0.00 34.95 32.79 3ktd s ARG 185 CO -0.07 -0.90 1.52 -0.39 0.02 0.00 0.00 175.30 175.48 3ktd h VAL 186 N 0.00 1.20 0.46 3.52 -1.51 -1.99 -1.45 116.25 116.48 3ktd h VAL 186 Ca -0.37 -0.61 -0.02 0.00 -1.23 0.00 0.00 66.70 64.47 3ktd h VAL 186 Cb 1.28 1.52 -0.00 0.00 -2.13 0.00 0.00 31.29 31.96 3ktd h VAL 186 CO 0.45 0.17 -0.28 1.23 -1.23 0.00 0.00 177.57 177.91 3ktd h GLY 187 N -0.15 -0.74 0.99 5.19 0.00 -1.97 0.20 103.07 106.59 3ktd h GLY 187 Ca 0.02 0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.67 3ktd h GLY 187 CO 0.00 -0.28 0.64 -2.55 0.00 0.00 0.00 176.54 174.35 3ktd h PRO 188 N -0.70 1.26 -0.05 4.80 0.11 -1.98 -0.47 132.00 134.98 3ktd h PRO 188 Ca -0.05 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 3ktd h PRO 188 Cb 0.57 -0.28 -0.00 0.00 0.11 0.00 0.00 31.00 31.40 3ktd h PRO 188 CO 0.06 0.83 0.01 1.25 -0.21 0.00 0.00 178.00 179.94 3ktd h HIS 189 N 1.30 0.08 0.00 0.65 -0.00 -1.12 -2.15 115.15 113.91 3ktd h HIS 189 Ca 0.36 -0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.67 3ktd h HIS 189 Cb -0.13 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.25 3ktd h HIS 189 CO -0.00 0.30 -0.23 -0.44 -0.00 0.00 0.00 177.93 177.55 3ktd h ASP 190 N -0.16 0.00 0.08 3.26 3.32 -0.73 0.37 116.42 122.56 3ktd h ASP 190 Ca 0.01 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 3ktd h ASP 190 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3ktd h ASP 190 CO 0.00 0.23 -0.04 0.00 -1.72 0.00 0.00 179.24 177.71 3ktd h ALA 191 N 1.77 -0.11 -0.13 3.45 0.00 -1.02 -0.75 119.26 122.47 3ktd h ALA 191 Ca -0.00 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.73 3ktd h ALA 191 Cb 0.42 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3ktd h ALA 191 CO 0.03 -0.38 0.04 0.00 0.00 0.00 0.00 179.25 178.95 3ktd h ALA 192 N 0.39 0.14 -0.45 0.00 0.00 -0.98 -2.52 119.26 115.85 3ktd h ALA 192 Ca -0.01 0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.97 3ktd h ALA 192 Cb 0.41 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 3ktd h ALA 192 CO 0.02 -0.40 0.16 0.00 0.00 0.00 0.00 179.25 179.02 3ktd h ALA 193 N 1.08 0.54 -0.89 0.00 0.00 -0.30 0.45 119.26 120.13 3ktd h ALA 193 Ca 0.05 0.06 0.17 0.00 0.00 0.00 0.00 54.91 55.19 3ktd h ALA 193 Cb 0.03 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.75 3ktd h ALA 193 CO -0.05 -0.23 0.46 0.00 0.00 0.00 0.00 179.25 179.43 3ktd h ALA 194 N 1.30 1.39 0.06 0.00 0.00 -0.89 0.38 119.26 121.50 3ktd h ALA 194 Ca 0.21 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 3ktd h ALA 194 Cb 0.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3ktd h ALA 194 CO -0.22 -0.14 -0.03 0.00 0.00 0.00 0.00 179.25 178.86 3ktd h ARG 195 N 0.60 -0.08 0.00 0.00 3.08 -0.57 -0.45 114.38 116.96 3ktd h ARG 195 Ca 0.51 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.56 3ktd h ARG 195 Cb 0.79 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.86 3ktd h ARG 195 CO -0.40 0.52 -1.00 1.33 -1.07 0.00 0.00 179.97 179.35 3ktd n VAL 196 N -4.79 0.52 0.02 2.04 0.24 -0.08 -4.26 118.33 112.02 3ktd n VAL 196 Ca -0.08 -0.48 -0.02 0.00 -2.04 0.00 0.00 64.34 61.72 3ktd n VAL 196 Cb 0.31 -0.24 -0.01 0.00 -1.47 0.00 0.00 33.84 32.43 3ktd n VAL 196 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3ktd n SER 197 N -2.51 0.81 -0.03 -1.34 2.88 0.04 -4.56 113.62 108.91 3ktd n SER 197 Ca 0.00 0.11 -0.13 0.00 -1.33 0.00 0.00 58.87 57.52 3ktd n SER 197 Cb 0.52 -0.26 -0.09 0.00 -0.75 0.00 0.00 64.21 63.63 3ktd n SER 197 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 3ktd h HIS 198 N -0.09 0.11 -0.87 0.66 3.86 -1.41 -2.01 115.15 115.40 3ktd h HIS 198 Ca -0.03 -0.04 0.11 0.00 -1.16 0.00 0.00 60.37 59.26 3ktd h HIS 198 Cb 0.46 -0.02 -0.06 0.00 1.06 0.00 0.00 27.41 28.85 3ktd h HIS 198 CO -0.03 0.59 0.56 1.25 0.86 0.00 0.00 177.93 181.17 3ktd h LEU 199 N -0.41 0.72 -0.39 2.43 5.85 -1.26 -0.22 115.31 122.03 3ktd h LEU 199 Ca 0.00 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.80 3ktd h LEU 199 Cb 0.58 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 3ktd h LEU 199 CO 0.01 0.41 0.15 0.74 -0.34 0.00 0.00 178.44 179.40 3ktd h THR 200 N 0.79 0.90 0.03 1.05 2.02 -1.68 0.11 112.91 116.12 3ktd h THR 200 Ca 0.42 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.49 3ktd h THR 200 Cb 0.53 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 3ktd h THR 200 CO -0.18 0.06 -0.02 0.45 0.37 0.00 0.00 175.52 176.19 3ktd h HIS 201 N 0.31 -0.06 -0.43 3.16 3.86 -0.41 -0.38 115.15 121.21 3ktd h HIS 201 Ca 0.18 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.43 3ktd h HIS 201 Cb 0.14 0.02 -0.04 0.00 1.06 0.00 0.00 27.41 28.60 3ktd h HIS 201 CO -0.14 -0.04 0.20 0.82 0.86 0.00 0.00 177.93 179.64 3ktd h ILE 202 N -0.05 0.95 -0.42 2.45 1.08 -0.70 -0.64 117.51 120.17 3ktd h ILE 202 Ca 0.00 -0.14 -0.08 0.00 -0.39 0.00 0.00 64.86 64.25 3ktd h ILE 202 Cb 0.05 0.51 -0.02 0.00 -3.07 0.00 0.00 36.82 34.29 3ktd h ILE 202 CO -0.00 0.07 -0.06 -0.07 -0.69 0.00 0.00 178.15 177.40 3ktd h LEU 203 N 0.41 0.69 -0.39 1.44 3.38 -0.70 -2.08 115.31 118.05 3ktd h LEU 203 Ca 0.19 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 3ktd h LEU 203 Cb 0.11 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3ktd h LEU 203 CO -0.14 0.80 -0.27 0.00 0.09 0.00 0.00 178.44 178.91 3ktd h ALA 204 N 1.28 0.56 -0.72 1.53 0.00 -0.38 -0.49 119.26 121.05 3ktd h ALA 204 Ca 0.12 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 3ktd h ALA 204 Cb 0.49 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3ktd h ALA 204 CO 0.03 0.58 0.43 0.93 0.00 0.00 0.00 179.25 181.22 3ktd h GLU 205 N 0.69 0.97 -0.19 0.00 4.39 -1.05 -0.98 114.58 118.42 3ktd h GLU 205 Ca 0.08 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 3ktd h GLU 205 Cb 0.85 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 3ktd h GLU 205 CO 0.07 0.69 0.07 1.15 -1.16 0.00 0.00 179.01 179.84 3ktd h THR 206 N 0.98 1.18 -0.45 1.13 2.02 -1.10 -1.60 112.91 115.05 3ktd h THR 206 Ca 0.26 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 3ktd h THR 206 Cb -0.03 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 3ktd h THR 206 CO -0.05 0.17 0.26 0.25 0.37 0.00 0.00 175.52 176.53 3ktd h LEU 207 N 0.15 0.56 -1.37 2.58 5.85 -0.92 -1.73 115.31 120.42 3ktd h LEU 207 Ca 0.06 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3ktd h LEU 207 Cb 0.21 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 3ktd h LEU 207 CO -0.00 0.47 0.47 0.00 -0.34 0.00 0.00 178.44 179.04 3ktd h ALA 208 N 1.11 1.68 -0.09 1.25 0.00 -0.95 -0.76 119.26 121.51 3ktd h ALA 208 Ca 0.16 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.85 3ktd h ALA 208 Cb 0.02 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.62 3ktd h ALA 208 CO -0.03 0.21 -0.71 0.82 0.00 0.00 0.00 179.25 179.54 3ktd h ILE 209 N 0.77 1.33 -0.61 0.00 2.04 -0.74 -2.10 117.51 118.21 3ktd h ILE 209 Ca 0.31 -1.99 -0.06 0.00 1.00 0.00 0.00 64.86 64.12 3ktd h ILE 209 Cb 0.22 2.20 -0.03 0.00 -0.74 0.00 0.00 36.82 38.47 3ktd h ILE 209 CO -0.10 0.61 0.14 0.58 0.00 0.00 0.00 178.15 179.38 3ktd h VAL 210 N 0.29 1.24 -0.63 1.67 2.07 -0.88 0.22 116.25 120.24 3ktd h VAL 210 Ca -0.06 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.51 3ktd h VAL 210 Cb 1.36 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 3ktd h VAL 210 CO 0.15 0.34 0.23 1.23 0.02 0.00 0.00 177.57 179.53 3ktd h GLY 211 N 1.03 1.03 0.86 2.17 0.00 -1.15 -2.67 103.07 104.34 3ktd h GLY 211 Ca 0.19 -0.58 -0.04 0.00 0.00 0.00 0.00 47.33 46.90 3ktd h GLY 211 CO 0.00 0.55 0.02 -1.80 0.00 0.00 0.00 176.54 175.31 3ktd h ASP 212 N 0.89 0.44 -0.29 0.19 3.58 -0.65 -2.58 116.42 118.00 3ktd h ASP 212 Ca 0.21 -0.29 0.08 0.00 0.42 0.00 0.00 57.03 57.45 3ktd h ASP 212 Cb 0.24 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 3ktd h ASP 212 CO -0.01 0.62 0.24 0.78 -2.88 0.00 0.00 179.24 177.99 3ktd h ASN 213 N 0.25 0.00 0.03 2.28 2.35 -0.52 -0.36 115.58 119.61 3ktd h ASN 213 Ca 0.08 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 3ktd h ASN 213 Cb 0.38 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 3ktd h ASN 213 CO 0.01 0.00 -0.09 1.23 -1.65 0.00 0.00 177.43 176.93 3ktd h GLY 214 N 0.00 0.17 0.00 2.83 0.00 -1.10 -3.49 103.07 101.48 3ktd h GLY 214 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.38 3ktd h GLY 214 CO -0.00 0.09 0.00 0.61 0.00 0.00 0.00 176.54 177.24 3ktd n GLY 215 N -1.07 -1.31 0.38 4.60 0.00 -0.15 -4.45 105.19 103.20 3ktd n GLY 215 Ca -0.01 -2.09 -0.02 0.00 0.00 0.00 0.00 46.02 43.89 3ktd n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktd h ALA 216 N 0.00 1.28 -0.53 4.61 0.00 -1.92 -2.65 119.26 120.05 3ktd h ALA 216 Ca 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3ktd h ALA 216 Cb 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 3ktd h ALA 216 CO 0.00 0.67 0.10 1.25 0.00 0.00 0.00 179.25 181.27 3ktd h LEU 217 N 1.37 0.83 -0.15 0.00 5.85 -1.97 0.75 115.31 121.99 3ktd h LEU 217 Ca 0.37 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3ktd h LEU 217 Cb -0.16 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.64 3ktd h LEU 217 CO -0.08 0.87 0.06 0.28 -0.34 0.00 0.00 178.44 179.23 3ktd h SER 218 N 0.76 0.21 -0.05 1.25 0.02 -1.74 -0.72 113.55 113.28 3ktd h SER 218 Ca 0.16 -0.16 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 3ktd h SER 218 Cb 0.39 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 3ktd h SER 218 CO 0.01 0.31 -0.21 -0.07 -1.14 0.00 0.00 176.83 175.73 3ktd h LEU 219 N 0.09 0.44 -1.32 5.07 3.38 -1.39 -1.47 115.31 120.11 3ktd h LEU 219 Ca 0.05 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 3ktd h LEU 219 Cb 0.17 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3ktd h LEU 219 CO -0.00 0.66 -0.30 -1.28 0.09 0.00 0.00 178.44 177.60 3ktd h SER 220 N 0.40 0.00 0.36 -0.43 0.87 -0.52 -3.18 113.55 111.05 3ktd h SER 220 Ca 0.07 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 3ktd h SER 220 Cb 0.59 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 3ktd h SER 220 CO 0.04 0.30 -1.39 0.18 -0.53 0.00 0.00 176.83 175.43 3ktd n LEU 221 N -3.77 0.46 -4.64 2.23 4.77 -0.30 -4.95 117.00 110.80 3ktd n LEU 221 Ca -0.01 0.03 -0.44 0.00 -0.03 0.00 0.00 56.01 55.55 3ktd n LEU 221 Cb 0.40 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.42 3ktd n LEU 221 CO 0.36 -0.01 0.80 0.00 -1.33 0.00 0.00 177.39 177.20 3ktd n ALA 222 N -2.04 0.52 -3.00 -1.18 0.00 -0.59 -4.98 120.51 109.24 3ktd n ALA 222 Ca -0.01 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.83 3ktd n ALA 222 Cb 0.50 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.80 3ktd n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ktd n ALA 223 N 0.80 0.00 -0.31 0.00 0.00 -1.26 -4.96 120.51 114.77 3ktd n ALA 223 Ca 0.09 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.57 3ktd n ALA 223 Cb 0.32 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.88 3ktd n ALA 223 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3ktd h GLY 224 N 0.00 0.59 0.99 0.00 0.00 -1.99 -1.76 103.07 100.91 3ktd h GLY 224 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.64 3ktd h GLY 224 CO 0.00 -0.33 0.25 1.48 0.00 0.00 0.00 176.54 177.94 3ktd h SER 225 N -0.00 0.46 -0.42 0.19 4.64 -2.00 -1.88 113.55 114.54 3ktd h SER 225 Ca 0.42 -0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.63 3ktd h SER 225 Cb 0.64 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 3ktd h SER 225 CO -0.91 0.36 -0.01 0.22 -0.87 0.00 0.00 176.83 175.62 3ktd h TYR 226 N 0.52 0.82 -0.43 4.77 3.20 -1.83 -0.15 116.97 123.87 3ktd h TYR 226 Ca 0.14 -0.14 0.09 0.00 3.14 0.00 0.00 58.73 61.95 3ktd h TYR 226 Cb -0.03 -0.21 -0.08 0.00 1.54 0.00 0.00 36.73 37.95 3ktd h TYR 226 CO -0.04 0.82 -0.10 -0.09 -1.64 0.00 0.00 178.16 177.11 3ktd h ARG 227 N 0.59 0.01 -0.22 1.82 2.43 -1.05 -0.47 114.38 117.49 3ktd h ARG 227 Ca 0.12 -0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.15 3ktd h ARG 227 Cb 0.50 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 3ktd h ARG 227 CO 0.02 0.01 -0.39 -0.44 -1.51 0.00 0.00 179.97 177.66 3ktd h ASP 228 N 0.01 0.72 0.98 -3.80 3.32 -1.21 -2.90 116.42 113.54 3ktd h ASP 228 Ca 0.21 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.72 3ktd h ASP 228 Cb 0.32 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3ktd h ASP 228 CO -0.43 1.12 0.00 -1.20 -1.72 0.00 0.00 179.24 177.01 3ktd n SER 229 N -4.23 0.55 -0.39 6.45 7.64 -0.08 -2.91 113.62 120.64 3ktd n SER 229 Ca -0.05 0.59 0.05 0.00 1.01 0.00 0.00 58.87 60.47 3ktd n SER 229 Cb 0.53 -0.72 0.04 0.00 -1.01 0.00 0.00 64.21 63.05 3ktd n SER 229 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3ktd n THR 230 N -2.06 0.05 -0.07 0.44 -2.24 -0.21 -4.42 114.28 105.78 3ktd n THR 230 Ca 0.04 -0.53 -0.07 0.00 -2.27 0.00 0.00 64.05 61.22 3ktd n THR 230 Cb 0.30 1.16 -0.01 0.00 -2.10 0.00 0.00 70.33 69.68 3ktd n THR 230 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3ktd h ARG 231 N 1.85 -0.01 0.00 -0.78 2.43 -1.38 -1.02 114.38 115.47 3ktd h ARG 231 Ca 0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ktd h ARG 231 Cb 0.41 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 3ktd h ARG 231 CO 0.00 -0.00 -0.00 -0.39 -1.51 0.00 0.00 179.97 178.06 3ktd h VAL 232 N -0.01 0.49 0.00 0.20 -1.51 -1.86 -0.64 116.25 112.92 3ktd h VAL 232 Ca 0.13 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 65.59 3ktd h VAL 232 Cb 0.21 1.01 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 3ktd h VAL 232 CO -0.28 0.00 0.11 0.00 -1.23 0.00 0.00 177.57 176.17 3ktd h ALA 233 N 2.00 1.09 -0.00 5.19 0.00 -1.47 0.19 119.26 126.26 3ktd h ALA 233 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ktd h ALA 233 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3ktd h ALA 233 CO 0.00 -0.09 -0.02 0.41 0.00 0.00 0.00 179.25 179.55 3ktd n GLY 234 N -1.21 -0.99 3.75 0.00 0.00 -0.25 -4.87 105.19 101.61 3ktd n GLY 234 Ca -0.02 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 3ktd n GLY 234 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ktd s THR 235 N -2.22 3.81 -0.24 2.61 -4.23 0.05 -4.90 115.64 110.52 3ktd s THR 235 Ca 0.39 1.72 -0.35 0.00 -1.18 0.00 0.00 61.69 62.27 3ktd s THR 235 Cb 0.21 -4.10 -0.16 0.00 1.34 0.00 0.00 72.50 69.80 3ktd s THR 235 CO 0.41 0.37 1.10 -0.67 -0.54 0.00 0.00 174.62 175.29 3ktd n ASP 236 N 1.70 0.58 0.13 3.99 2.03 -1.26 -4.74 116.55 118.98 3ktd n ASP 236 Ca -0.00 0.94 0.14 0.00 0.52 0.00 0.00 54.79 56.39 3ktd n ASP 236 Cb 0.46 -0.71 0.67 0.00 -0.72 0.00 0.00 41.12 40.82 3ktd n ASP 236 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3ktd h PRO 237 N 3.34 0.00 -0.66 -0.67 0.13 -1.91 -1.21 132.00 131.01 3ktd h PRO 237 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3ktd h PRO 237 Cb 1.11 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 3ktd h PRO 237 CO 0.67 0.00 0.42 0.78 -0.23 0.00 0.00 178.00 179.64 3ktd h GLY 238 N 0.00 0.95 1.30 1.56 0.00 -1.99 -0.45 103.07 104.43 3ktd h GLY 238 Ca 0.13 -0.37 -0.18 0.00 0.00 0.00 0.00 47.33 46.90 3ktd h GLY 238 CO -0.00 0.36 -0.60 1.41 0.00 0.00 0.00 176.54 177.71 3ktd h LEU 239 N 0.91 0.82 -0.49 3.11 3.38 -1.56 -1.90 115.31 119.57 3ktd h LEU 239 Ca 0.24 -0.46 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 3ktd h LEU 239 Cb -0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 3ktd h LEU 239 CO -0.05 1.23 0.05 0.58 0.09 0.00 0.00 178.44 180.34 3ktd h VAL 240 N 0.54 1.26 0.18 1.22 2.07 -1.22 -3.21 116.25 117.09 3ktd h VAL 240 Ca -0.00 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 3ktd h VAL 240 Cb 1.19 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 3ktd h VAL 240 CO 0.12 0.35 -0.23 0.03 0.02 0.00 0.00 177.57 177.86 3ktd h ARG 241 N 0.70 -0.40 0.00 1.57 3.08 -1.02 -1.68 114.38 116.63 3ktd h ARG 241 Ca 0.15 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.22 3ktd h ARG 241 Cb 0.44 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.58 3ktd h ARG 241 CO 0.02 -0.27 0.00 0.00 -1.07 0.00 0.00 179.97 178.65 3ktd n ALA 242 N -2.54 0.35 0.00 0.04 0.00 -0.72 -0.36 120.51 117.28 3ktd n ALA 242 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3ktd n ALA 242 Cb 0.20 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.34 3ktd n ALA 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ktd h GLU 245 N 0.00 1.02 0.00 0.00 5.08 -0.93 -1.80 114.58 117.95 3ktd h GLU 245 Ca 0.00 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 3ktd h GLU 245 Cb 0.00 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.08 3ktd h GLU 245 CO 0.00 0.83 -0.08 0.77 -1.00 0.00 0.00 179.01 179.53 3ktd h SER 246 N 0.97 0.00 -0.42 1.42 0.02 -1.60 -2.64 113.55 111.30 3ktd h SER 246 Ca 0.23 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.91 3ktd h SER 246 Cb 0.18 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 62.54 3ktd h SER 246 CO -0.02 0.08 -0.31 -3.20 -1.14 0.00 0.00 176.83 172.24 3ktd n ASN 247 N -3.24 3.31 -0.31 3.07 5.15 -0.92 -4.73 115.26 117.59 3ktd n ASN 247 Ca -0.00 -3.81 0.05 0.00 -0.60 0.00 0.00 54.58 50.22 3ktd n ASN 247 Cb 0.32 -0.56 0.20 0.00 -0.53 0.00 0.00 39.78 39.21 3ktd n ASN 247 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3ktd h ALA 248 N 1.39 1.30 0.48 5.20 0.00 -0.96 -1.42 119.26 125.25 3ktd h ALA 248 Ca 0.24 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 3ktd h ALA 248 Cb 1.40 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3ktd h ALA 248 CO 0.48 0.09 -0.23 0.78 0.00 0.00 0.00 179.25 180.37 3ktd h GLY 249 N 0.81 -0.67 1.53 0.00 0.00 -1.88 -0.87 103.07 101.99 3ktd h GLY 249 Ca 0.44 0.25 0.04 0.00 0.00 0.00 0.00 47.33 48.07 3ktd h GLY 249 CO -0.28 -0.25 0.22 -2.55 0.00 0.00 0.00 176.54 173.69 3ktd h PRO 250 N -0.66 0.25 -0.44 4.80 0.11 -1.88 -2.60 132.00 131.59 3ktd h PRO 250 Ca -0.07 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.89 3ktd h PRO 250 Cb 0.49 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 3ktd h PRO 250 CO 0.11 0.17 -0.27 1.25 -0.21 0.00 0.00 178.00 179.05 3ktd h LEU 251 N 0.26 1.00 -0.45 2.35 5.85 -1.17 -1.97 115.31 121.19 3ktd h LEU 251 Ca 0.14 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.47 3ktd h LEU 251 Cb 0.23 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 3ktd h LEU 251 CO -0.03 1.20 0.24 0.58 -0.34 0.00 0.00 178.44 180.09 3ktd h VAL 252 N 0.80 0.99 0.00 1.05 2.07 -0.77 0.13 116.25 120.52 3ktd h VAL 252 Ca 0.09 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.47 3ktd h VAL 252 Cb 0.85 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3ktd h VAL 252 CO 0.08 0.09 -0.13 0.11 0.02 0.00 0.00 177.57 177.73 3ktd h LYS 253 N 0.47 -0.22 -0.33 1.57 1.57 -1.35 0.17 116.57 118.46 3ktd h LYS 253 Ca 0.19 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 59.01 3ktd h LYS 253 Cb 0.08 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 3ktd h LYS 253 CO -0.12 -0.15 0.14 0.00 -0.57 0.00 0.00 179.45 178.76 3ktd h ALA 254 N 0.72 0.39 -0.31 3.86 0.00 -1.07 -2.44 119.26 120.43 3ktd h ALA 254 Ca 0.05 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.02 3ktd h ALA 254 Cb 0.29 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3ktd h ALA 254 CO -0.13 -0.25 0.09 1.25 0.00 0.00 0.00 179.25 180.21 3ktd h LEU 255 N 0.30 0.08 -1.06 0.00 5.85 -0.53 -2.43 115.31 117.52 3ktd h LEU 255 Ca 0.14 0.04 0.13 0.00 0.84 0.00 0.00 57.88 59.04 3ktd h LEU 255 Cb 0.08 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.07 3ktd h LEU 255 CO -0.12 0.08 0.62 0.44 -0.34 0.00 0.00 178.44 179.12 3ktd h ASP 256 N 0.22 0.86 -0.65 1.25 3.32 -0.28 0.24 116.42 121.37 3ktd h ASP 256 Ca 0.14 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.18 3ktd h ASP 256 Cb 0.13 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 3ktd h ASP 256 CO -0.16 0.43 0.17 -0.33 -1.72 0.00 0.00 179.24 177.64 3ktd h GLU 257 N 0.91 1.06 -0.53 3.56 5.08 -1.07 -1.88 114.58 121.70 3ktd h GLU 257 Ca 0.50 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.59 3ktd h GLU 257 Cb 0.59 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 3ktd h GLU 257 CO -0.27 0.93 0.20 0.00 -1.00 0.00 0.00 179.01 178.87 3ktd h ALA 258 N 1.17 0.69 -0.25 3.43 0.00 -0.31 -2.19 119.26 121.80 3ktd h ALA 258 Ca 0.21 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3ktd h ALA 258 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3ktd h ALA 258 CO -0.00 0.32 0.14 -0.07 0.00 0.00 0.00 179.25 179.64 3ktd h LEU 259 N 0.72 0.31 -1.13 0.00 3.38 -0.46 -0.09 115.31 118.04 3ktd h LEU 259 Ca 0.18 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.13 3ktd h LEU 259 Cb 0.22 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 3ktd h LEU 259 CO -0.01 0.29 0.60 0.00 0.09 0.00 0.00 178.44 179.41 3ktd h ALA 260 N 1.03 1.47 -0.15 1.53 0.00 -1.19 0.18 119.26 122.13 3ktd h ALA 260 Ca 0.09 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3ktd h ALA 260 Cb 0.05 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3ktd h ALA 260 CO -0.02 0.41 -0.27 0.82 0.00 0.00 0.00 179.25 180.19 3ktd h ILE 261 N 1.08 1.36 -0.81 0.00 2.04 -1.09 -2.22 117.51 117.88 3ktd h ILE 261 Ca 0.38 -1.52 -0.01 0.00 1.00 0.00 0.00 64.86 64.71 3ktd h ILE 261 Cb 0.13 1.98 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 3ktd h ILE 261 CO -0.13 0.45 0.47 -0.07 0.00 0.00 0.00 178.15 178.87 3ktd h LEU 262 N 0.06 0.98 -0.58 1.44 3.38 -0.47 -0.50 115.31 119.61 3ktd h LEU 262 Ca 0.01 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3ktd h LEU 262 Cb 0.86 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 3ktd h LEU 262 CO 0.06 0.77 0.17 0.45 0.09 0.00 0.00 178.44 179.98 3ktd h HIS 263 N 1.11 0.95 -0.49 1.13 3.86 -0.66 -0.29 115.15 120.76 3ktd h HIS 263 Ca 0.29 -0.10 -0.02 0.00 -1.16 0.00 0.00 60.37 59.38 3ktd h HIS 263 Cb -0.02 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.15 3ktd h HIS 263 CO -0.00 0.80 0.24 1.49 0.86 0.00 0.00 177.93 181.32 3ktd h GLU 264 N 0.83 0.68 -0.49 2.45 4.22 -1.03 0.09 114.58 121.34 3ktd h GLU 264 Ca 0.19 -0.08 -0.11 0.00 0.08 0.00 0.00 59.36 59.44 3ktd h GLU 264 Cb 0.30 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 3ktd h GLU 264 CO -0.00 0.53 -0.14 0.00 -2.18 0.00 0.00 179.01 177.21 3ktd h ALA 265 N 1.58 0.83 -0.40 2.92 0.00 -0.43 -1.19 119.26 122.57 3ktd h ALA 265 Ca 0.17 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 3ktd h ALA 265 Cb 0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3ktd h ALA 265 CO -0.02 0.65 -0.11 -0.09 0.00 0.00 0.00 179.25 179.67 3ktd h ARG 266 N 0.82 0.78 -0.57 0.00 2.43 -0.38 -1.77 114.38 115.69 3ktd h ARG 266 Ca 0.12 -0.31 0.08 0.00 -0.81 0.00 0.00 59.98 59.07 3ktd h ARG 266 Cb 0.68 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.12 3ktd h ARG 266 CO 0.05 0.92 0.21 0.93 -1.51 0.00 0.00 179.97 180.57 3ktd h GLU 267 N 0.60 0.39 -0.19 0.20 3.07 -0.81 -1.83 114.58 116.00 3ktd h GLU 267 Ca 0.10 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 58.89 3ktd h GLU 267 Cb 0.64 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.45 3ktd h GLU 267 CO 0.04 0.26 -0.10 0.78 -1.40 0.00 0.00 179.01 178.59 3ktd h GLY 268 N 0.40 0.32 1.73 -3.84 0.00 -0.96 -3.02 103.07 97.70 3ktd h GLY 268 Ca 0.28 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3ktd h GLY 268 CO -0.28 0.18 -0.17 1.04 0.00 0.00 0.00 176.54 177.31 3ktd n LEU 269 N -4.28 0.48 -0.00 3.11 4.77 -0.69 -1.14 117.00 119.25 3ktd n LEU 269 Ca -0.00 0.42 0.09 0.00 -0.03 0.00 0.00 56.01 56.48 3ktd n LEU 269 Cb 0.26 -0.35 -0.11 0.00 -2.33 0.00 0.00 43.42 40.89 3ktd n LEU 269 CO 0.38 -0.06 -0.08 0.35 -1.33 0.00 0.00 177.39 176.66 3ktd n THR 270 N -1.88 0.00 -1.00 -5.08 -2.24 -0.92 -4.70 114.28 98.45 3ktd n THR 270 Ca 0.06 -0.08 -0.34 0.00 -2.27 0.00 0.00 64.05 61.42 3ktd n THR 270 Cb 0.39 0.96 0.12 0.00 -2.10 0.00 0.00 70.33 69.69 3ktd n THR 270 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ktd n ALA 271 N -1.47 -1.22 -0.28 6.98 0.00 -1.19 -4.87 120.51 118.46 3ktd n ALA 271 Ca 0.03 -0.42 0.10 0.00 0.00 0.00 0.00 53.44 53.15 3ktd n ALA 271 Cb 0.30 -2.02 0.25 0.00 0.00 0.00 0.00 19.45 17.98 3ktd n ALA 271 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3ktd h GLU 272 N -1.09 0.26 -4.57 0.00 3.07 -1.94 -3.11 114.58 107.21 3ktd h GLU 272 Ca -0.45 -0.02 -0.67 0.00 -0.50 0.00 0.00 59.36 57.73 3ktd h GLU 272 Cb 1.30 -0.06 -0.38 0.00 -0.84 0.00 0.00 28.75 28.77 3ktd h GLU 272 CO 0.41 0.17 -0.66 -1.14 -1.40 0.00 0.00 179.01 176.39 3ktd s GLN 273 N -5.97 1.67 0.10 2.33 0.74 -1.26 -5.09 119.66 112.17 3ktd s GLN 273 Ca -0.12 -1.90 -0.36 0.00 0.05 0.00 0.00 55.36 53.02 3ktd s GLN 273 Cb 0.24 -3.33 -0.16 0.00 1.10 0.00 0.00 33.01 30.86 3ktd s GLN 273 CO 0.77 -0.99 1.38 -2.30 -0.55 0.00 0.00 175.29 173.59 3ktd n PRO 274 N 4.30 1.30 -3.71 1.67 -0.02 -1.18 -5.00 135.00 132.35 3ktd n PRO 274 Ca 0.02 0.47 -0.11 0.00 -2.02 0.00 0.00 63.50 61.86 3ktd n PRO 274 Cb 0.41 -2.13 -0.11 0.00 -0.02 0.00 0.00 33.50 31.65 3ktd n PRO 274 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3ktd s ASN 275 N 0.55 -0.43 -0.16 2.55 3.84 -0.29 -4.99 114.94 116.00 3ktd s ASN 275 Ca 0.84 0.77 0.16 0.00 0.21 0.00 0.00 52.86 54.84 3ktd s ASN 275 Cb -0.91 0.68 0.44 0.00 -0.55 0.00 0.00 41.25 40.90 3ktd s ASN 275 CO 0.45 -0.17 1.19 2.30 -2.79 0.00 0.00 177.10 178.08 3ktd n ILE 276 N 3.98 1.50 0.04 -5.21 -5.35 -1.26 -4.12 119.36 108.94 3ktd n ILE 276 Ca -0.22 -2.67 -0.13 0.00 -0.27 0.00 0.00 62.75 59.46 3ktd n ILE 276 Cb 0.55 0.15 -0.08 0.00 -1.74 0.00 0.00 39.64 38.51 3ktd n ILE 276 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 3ktd h GLU 277 N 1.29 -0.53 -0.76 6.28 5.08 -1.97 -0.26 114.58 123.71 3ktd h GLU 277 Ca -0.03 0.04 0.13 0.00 -1.00 0.00 0.00 59.36 58.50 3ktd h GLU 277 Cb 1.37 0.12 -0.14 0.00 0.50 0.00 0.00 28.75 30.60 3ktd h GLU 277 CO 0.15 -0.35 -0.32 1.96 -1.00 0.00 0.00 179.01 179.44 3ktd h GLN 278 N -0.55 -0.08 0.85 2.33 1.08 -1.99 0.21 115.11 116.97 3ktd h GLN 278 Ca 0.01 0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.18 3ktd h GLN 278 Cb 0.60 0.02 0.01 0.00 -0.05 0.00 0.00 27.48 28.05 3ktd h GLN 278 CO -0.31 -0.05 -0.41 1.25 -0.95 0.00 0.00 178.83 178.36 3ktd h LEU 279 N -0.08 -0.96 -0.40 1.46 5.85 -1.88 0.60 115.31 119.90 3ktd h LEU 279 Ca 0.30 0.03 0.08 0.00 0.84 0.00 0.00 57.88 59.13 3ktd h LEU 279 Cb 0.57 0.25 -0.08 0.00 0.37 0.00 0.00 40.66 41.78 3ktd h LEU 279 CO -0.81 -0.65 -0.09 0.00 -0.34 0.00 0.00 178.44 176.55 3ktd h ALA 280 N -1.09 0.27 -0.30 1.25 0.00 -0.34 0.27 119.26 119.32 3ktd h ALA 280 Ca -0.12 0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3ktd h ALA 280 Cb 0.88 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3ktd h ALA 280 CO 0.19 -0.45 -0.01 -0.44 0.00 0.00 0.00 179.25 178.55 3ktd h ASP 281 N 0.01 0.53 -0.33 0.00 5.19 -0.58 -0.76 116.42 120.48 3ktd h ASP 281 Ca 0.19 -0.31 -0.13 0.00 -0.62 0.00 0.00 57.03 56.16 3ktd h ASP 281 Cb 0.29 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.65 3ktd h ASP 281 CO -0.41 0.72 -0.28 0.78 -3.12 0.00 0.00 179.24 176.93 3ktd h ASN 282 N 0.33 0.87 -0.11 6.45 2.35 -0.49 -0.45 115.58 124.54 3ktd h ASN 282 Ca 0.09 -0.34 -0.01 0.00 -0.55 0.00 0.00 56.30 55.48 3ktd h ASN 282 Cb 0.45 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.57 3ktd h ASN 282 CO 0.02 1.09 0.04 1.23 -1.65 0.00 0.00 177.43 178.16 3ktd h GLY 283 N 0.92 0.17 0.99 2.83 0.00 -0.43 -1.18 103.07 106.38 3ktd h GLY 283 Ca 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 3ktd h GLY 283 CO 0.07 0.09 0.32 -1.82 0.00 0.00 0.00 176.54 175.20 3ktd h TYR 284 N 0.02 0.77 -0.76 5.60 3.20 -1.08 -1.55 116.97 123.17 3ktd h TYR 284 Ca 0.04 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.91 3ktd h TYR 284 Cb 0.17 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 3ktd h TYR 284 CO -0.02 0.55 0.50 -0.09 -1.64 0.00 0.00 178.16 177.46 3ktd h ARG 285 N 0.77 0.97 -0.62 1.82 9.65 -1.00 -2.52 114.38 123.45 3ktd h ARG 285 Ca 0.20 -0.06 -0.10 0.00 -1.10 0.00 0.00 59.98 58.93 3ktd h ARG 285 Cb 0.02 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.36 3ktd h ARG 285 CO -0.03 0.64 0.01 0.77 2.80 0.00 0.00 179.97 184.16 3ktd h SER 286 N 1.00 1.06 -0.45 -3.80 0.02 -0.81 -2.61 113.55 107.97 3ktd h SER 286 Ca 0.29 -0.30 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 3ktd h SER 286 Cb -0.08 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.15 3ktd h SER 286 CO -0.08 1.10 0.20 -0.09 -1.14 0.00 0.00 176.83 176.83 3ktd h ARG 287 N 0.99 0.65 -0.87 3.45 9.65 -1.09 -1.47 114.38 125.69 3ktd h ARG 287 Ca 0.18 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.94 3ktd h ARG 287 Cb 0.56 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.98 3ktd h ARG 287 CO 0.03 0.57 0.49 0.82 2.80 0.00 0.00 179.97 184.68 3ktd h ILE 288 N 0.58 1.25 -0.74 1.20 1.08 -1.35 0.14 117.51 119.66 3ktd h ILE 288 Ca 0.15 -0.61 -0.05 0.00 -0.39 0.00 0.00 64.86 63.96 3ktd h ILE 288 Cb 0.14 0.06 -0.03 0.00 -3.07 0.00 0.00 36.82 33.92 3ktd h ILE 288 CO -0.02 0.28 0.27 0.03 -0.69 0.00 0.00 178.15 178.02 3ktd h ARG 289 N 1.22 1.13 -0.39 2.37 3.08 -1.19 -2.78 114.38 117.82 3ktd h ARG 289 Ca 0.31 -0.22 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 3ktd h ARG 289 Cb 0.01 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 3ktd h ARG 289 CO -0.05 0.93 0.07 -0.92 -1.07 0.00 0.00 179.97 178.93 3ktd h TYR 290 N 1.09 0.69 0.00 3.04 3.20 -0.44 -3.03 116.97 121.52 3ktd h TYR 290 Ca 0.24 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 62.02 3ktd h TYR 290 Cb 0.25 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.33 3ktd h TYR 290 CO 0.02 0.68 0.00 0.39 -1.64 0.00 0.00 178.16 177.61 3ktd n GLU 291 N -4.54 0.13 -1.09 1.82 1.02 -0.04 -1.64 120.64 116.30 3ktd n GLU 291 Ca -0.01 0.55 -0.25 0.00 -0.02 0.00 0.00 57.16 57.44 3ktd n GLU 291 Cb 0.23 -1.86 0.09 0.00 -0.02 0.00 0.00 31.44 29.87 3ktd n GLU 291 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ktd n ALA 292 N -1.73 5.57 -3.59 0.62 0.00 -1.10 -5.09 120.51 115.18 3ktd n ALA 292 Ca -0.00 -2.58 -0.14 0.00 0.00 0.00 0.00 53.44 50.72 3ktd n ALA 292 Cb 0.08 -1.53 -0.07 0.00 0.00 0.00 0.00 19.45 17.93 3ktd n ALA 292 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3ktd s ARG 293 N -2.87 0.81 -0.29 0.00 3.03 -0.65 -5.08 118.95 113.91 3ktd s ARG 293 Ca 0.49 0.63 -0.15 0.00 2.03 0.00 0.00 55.73 58.72 3ktd s ARG 293 Cb 0.39 0.39 0.15 0.00 -1.03 0.00 0.00 34.95 34.85 3ktd s ARG 293 CO 0.02 -0.17 0.96 1.03 -1.13 0.00 0.00 175.30 176.01 3ktd s ARG 311 N -0.25 0.37 0.78 3.89 0.52 -1.26 -5.01 118.95 117.99 3ktd s ARG 311 Ca -0.03 0.73 -0.12 0.00 -0.52 0.00 0.00 55.73 55.79 3ktd s ARG 311 Cb -0.03 0.21 0.07 0.00 0.52 0.00 0.00 34.95 35.72 3ktd s ARG 311 CO 0.02 -0.09 1.14 -1.25 0.02 0.00 0.00 175.30 175.14 3ktd s PRO 312 N 1.73 1.94 -0.14 3.54 0.04 -1.26 -4.72 135.00 136.13 3ktd s PRO 312 Ca -0.07 1.48 -0.00 0.00 0.04 0.00 0.00 61.00 62.44 3ktd s PRO 312 Cb -0.05 -1.84 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 3ktd s PRO 312 CO -0.16 -1.93 -0.13 0.54 0.04 0.00 0.00 177.00 175.36 3ktd s VAL 313 N -2.49 3.01 -0.18 -0.36 0.11 -1.26 -1.11 120.40 118.12 3ktd s VAL 313 Ca 0.67 -0.67 -0.01 0.00 -2.93 0.00 0.00 61.98 59.04 3ktd s VAL 313 Cb -0.23 -2.27 -0.00 0.00 -1.53 0.00 0.00 36.38 32.35 3ktd s VAL 313 CO 0.51 0.52 -0.11 -0.76 -3.33 0.00 0.00 175.10 171.93 3ktd s LEU 314 N 0.48 2.62 -0.15 2.54 1.02 -0.42 -4.98 118.68 119.79 3ktd s LEU 314 Ca -0.09 -0.44 -0.17 0.00 0.02 0.00 0.00 54.13 53.44 3ktd s LEU 314 Cb -0.16 -1.63 -0.04 0.00 0.02 0.00 0.00 46.19 44.39 3ktd s LEU 314 CO 0.04 0.04 0.44 -0.13 0.02 0.00 0.00 176.35 176.77 3ktd s ARG 315 N 1.07 4.28 0.09 1.70 0.52 -1.26 -2.41 118.95 122.94 3ktd s ARG 315 Ca -0.00 0.35 0.07 0.00 -0.52 0.00 0.00 55.73 55.63 3ktd s ARG 315 Cb -0.15 -3.47 -0.03 0.00 0.52 0.00 0.00 34.95 31.82 3ktd s ARG 315 CO -0.03 0.08 -0.19 -0.51 0.02 0.00 0.00 175.30 174.68 3ktd s LEU 316 N 0.89 2.28 -0.27 2.53 1.43 -0.90 -4.99 118.68 119.66 3ktd s LEU 316 Ca 0.23 -0.65 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 3ktd s LEU 316 Cb -0.15 -0.76 0.07 0.00 0.03 0.00 0.00 46.19 45.38 3ktd s LEU 316 CO 0.09 0.02 -0.05 -2.28 0.23 0.00 0.00 176.35 174.36 3ktd s HIS 317 N -1.17 2.94 0.14 0.29 5.65 -1.26 -1.99 115.29 119.89 3ktd s HIS 317 Ca 0.04 -2.21 -0.34 0.00 0.25 0.00 0.00 55.06 52.80 3ktd s HIS 317 Cb -0.10 -1.97 -0.14 0.00 -1.18 0.00 0.00 32.58 29.19 3ktd s HIS 317 CO 0.03 -0.85 1.56 -2.30 -0.65 0.00 0.00 174.74 172.53 3ktd n PRO 318 N 4.51 2.02 0.00 2.88 -0.02 -1.26 -1.99 135.00 141.13 3ktd n PRO 318 Ca -0.09 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 3ktd n PRO 318 Cb 0.43 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 3ktd n PRO 318 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ktd n GLY 319 N 3.35 2.65 3.72 -1.23 0.00 -1.26 -5.09 105.19 107.32 3ktd n GLY 319 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3ktd n GLY 319 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ktd s THR 320 N -2.35 3.86 0.09 2.61 2.01 -0.84 -4.93 115.64 116.09 3ktd s THR 320 Ca 0.00 1.37 -0.36 0.00 0.31 0.00 0.00 61.69 63.01 3ktd s THR 320 Cb 0.00 -3.87 -0.18 0.00 0.01 0.00 0.00 72.50 68.46 3ktd s THR 320 CO 0.00 0.12 1.07 -2.65 -0.69 0.00 0.00 174.62 172.47 3ktd n PRO 321 N 3.70 0.53 -1.65 4.92 -0.02 -1.26 -0.47 135.00 140.76 3ktd n PRO 321 Ca 0.09 0.19 -0.16 0.00 -2.02 0.00 0.00 63.50 61.60 3ktd n PRO 321 Cb 0.45 -1.65 -0.05 0.00 -0.02 0.00 0.00 33.50 32.24 3ktd n PRO 321 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ktd n ASN 322 N 1.90 -4.84 0.12 2.55 3.02 -1.26 -4.88 115.26 111.87 3ktd n ASN 322 Ca 0.18 0.30 -0.00 0.00 -0.03 0.00 0.00 54.58 55.03 3ktd n ASN 322 Cb 0.17 -3.78 0.29 0.00 -0.61 0.00 0.00 39.78 35.85 3ktd n ASN 322 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 3ktd h TRP 323 N 0.00 0.21 -0.48 3.10 5.08 -1.11 -2.41 115.95 120.33 3ktd h TRP 323 Ca -0.33 -0.05 -0.01 0.00 1.08 0.00 0.00 58.89 59.59 3ktd h TRP 323 Cb 1.08 -0.05 -0.02 0.00 -3.00 0.00 0.00 29.16 27.17 3ktd h TRP 323 CO 0.43 0.51 0.28 1.05 -1.28 0.00 0.00 178.44 179.43 3ktd h GLU 324 N 0.16 0.65 -0.03 0.12 9.09 -1.90 -1.82 114.58 120.85 3ktd h GLU 324 Ca 0.02 -0.06 -0.12 0.00 0.05 0.00 0.00 59.36 59.26 3ktd h GLU 324 Cb 0.69 -0.14 -0.01 0.00 -1.65 0.00 0.00 28.75 27.64 3ktd h GLU 324 CO 0.05 0.47 -0.52 0.87 0.05 0.00 0.00 179.01 179.93 3ktd h LYS 325 N 0.66 0.08 -0.05 1.06 1.57 -1.83 -2.88 116.57 115.16 3ktd h LYS 325 Ca 0.17 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 3ktd h LYS 325 Cb -0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3ktd h LYS 325 CO -0.03 0.58 -0.24 1.96 -0.57 0.00 0.00 179.45 181.15 3ktd h GLN 326 N 0.06 0.09 -0.33 3.15 1.08 -1.20 -1.24 115.11 116.72 3ktd h GLN 326 Ca -0.00 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 3ktd h GLN 326 Cb 0.94 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.35 3ktd h GLN 326 CO 0.07 0.33 0.13 -0.07 -0.95 0.00 0.00 178.83 178.34 3ktd h LEU 327 N 0.08 0.45 -1.39 1.46 3.38 -1.40 0.27 115.31 118.17 3ktd h LEU 327 Ca 0.01 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.85 3ktd h LEU 327 Cb 0.47 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 3ktd h LEU 327 CO 0.03 0.50 0.44 0.40 0.09 0.00 0.00 178.44 179.90 3ktd h ILE 328 N 0.39 1.10 -0.29 1.22 2.04 -1.39 0.23 117.51 120.80 3ktd h ILE 328 Ca 0.11 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.64 3ktd h ILE 328 Cb 0.18 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 3ktd h ILE 328 CO -0.01 0.14 -0.05 -0.74 0.00 0.00 0.00 178.15 177.50 3ktd h HIS 329 N 0.79 0.61 -0.48 1.37 2.76 -0.48 -2.33 115.15 117.39 3ktd h HIS 329 Ca 0.26 -0.12 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 3ktd h HIS 329 Cb 0.07 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 28.85 3ktd h HIS 329 CO -0.00 0.73 0.03 0.00 -1.30 0.00 0.00 177.93 177.39 3ktd h ALA 330 N 0.80 1.15 -0.36 5.26 0.00 0.28 -2.02 119.26 124.37 3ktd h ALA 330 Ca 0.08 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.78 3ktd h ALA 330 Cb 0.52 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3ktd h ALA 330 CO 0.02 0.55 0.14 1.49 0.00 0.00 0.00 179.25 181.46 3ktd h GLU 331 N 0.73 0.29 -0.78 0.00 4.81 -0.47 0.17 114.58 119.33 3ktd h GLU 331 Ca 0.15 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 3ktd h GLU 331 Cb 0.40 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 3ktd h GLU 331 CO 0.01 0.19 0.32 1.15 -0.73 0.00 0.00 179.01 179.95 3ktd h THR 332 N 0.30 1.26 0.00 0.32 2.02 -1.00 -2.78 112.91 113.03 3ktd h THR 332 Ca 0.16 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.54 3ktd h THR 332 Cb 0.12 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 3ktd h THR 332 CO -0.15 0.33 0.00 -0.07 0.37 0.00 0.00 175.52 176.00 3ktd h LEU 333 N 1.13 0.00 2.18 2.58 3.38 -1.03 -3.47 115.31 120.08 3ktd h LEU 333 Ca 0.26 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.90 3ktd h LEU 333 Cb 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3ktd h LEU 333 CO -0.02 0.00 -0.44 0.61 0.09 0.00 0.00 178.44 178.68 3ktd n GLY 334 N 1.22 -0.32 3.80 0.83 0.00 0.37 -4.87 105.19 106.22 3ktd n GLY 334 Ca 0.05 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 3ktd n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktd s ALA 335 N -2.87 3.14 0.43 4.61 0.00 0.07 -4.73 121.76 122.42 3ktd s ALA 335 Ca 0.03 0.47 -0.02 0.00 0.00 0.00 0.00 51.96 52.44 3ktd s ALA 335 Cb -0.01 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 3ktd s ALA 335 CO 0.04 0.16 0.68 -0.98 0.00 0.00 0.00 175.76 175.66 3ktd s ARG 336 N -2.52 3.38 0.13 0.00 1.70 -0.27 -4.20 118.95 117.17 3ktd s ARG 336 Ca 0.55 -0.15 0.06 0.00 -0.47 0.00 0.00 55.73 55.71 3ktd s ARG 336 Cb -0.15 -2.51 -0.04 0.00 -0.57 0.00 0.00 34.95 31.68 3ktd s ARG 336 CO 0.19 -0.12 -0.13 0.96 -1.08 0.00 0.00 175.30 175.12 3ktd s ILE 337 N -2.57 1.29 -0.02 4.99 -4.36 0.58 -1.30 121.20 119.81 3ktd s ILE 337 Ca 0.45 -1.80 0.04 0.00 -0.26 0.00 0.00 60.65 59.08 3ktd s ILE 337 Cb -0.10 -1.60 -0.01 0.00 1.25 0.00 0.00 42.46 42.00 3ktd s ILE 337 CO 0.40 -0.50 -0.14 -1.61 0.24 0.00 0.00 174.94 173.33 3ktd s GLU 338 N -2.94 1.27 -0.01 0.37 0.41 -1.01 -4.47 118.70 112.31 3ktd s GLU 338 Ca 0.11 -0.48 0.02 0.00 -0.41 0.00 0.00 54.97 54.21 3ktd s GLU 338 Cb -0.03 -1.17 -0.03 0.00 -1.78 0.00 0.00 34.13 31.11 3ktd s GLU 338 CO 0.03 0.24 -0.05 0.14 -0.49 0.00 0.00 175.26 175.12 3ktd s VAL 339 N -0.10 3.77 0.00 2.63 -7.23 -1.26 -2.11 120.40 116.10 3ktd s VAL 339 Ca 0.01 -0.69 0.00 0.00 -1.81 0.00 0.00 61.98 59.49 3ktd s VAL 339 Cb -0.08 -2.63 0.00 0.00 0.56 0.00 0.00 36.38 34.23 3ktd s VAL 339 CO 0.00 0.43 0.04 2.22 -0.31 0.00 0.00 175.10 177.48