#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wpm s LYS 3 N 0.00 4.54 0.13 5.31 2.47 -1.26 -4.09 119.74 126.83 1wpm s LYS 3 Ca 0.00 1.14 0.07 0.00 -1.56 0.00 0.00 55.97 55.61 1wpm s LYS 3 Cb 0.00 -3.36 -0.04 0.00 -1.46 0.00 0.00 37.83 32.98 1wpm s LYS 3 CO 0.00 0.30 -0.15 0.96 0.16 0.00 0.00 175.35 176.61 1wpm s ILE 4 N -0.14 1.45 0.06 5.43 -4.36 -0.32 -4.56 121.20 118.77 1wpm s ILE 4 Ca 0.40 -1.73 0.02 0.00 -0.26 0.00 0.00 60.65 59.08 1wpm s ILE 4 Cb -0.21 -1.58 -0.04 0.00 1.25 0.00 0.00 42.46 41.88 1wpm s ILE 4 CO 0.24 -0.36 0.11 -0.76 0.24 0.00 0.00 174.94 174.42 1wpm s LEU 5 N -2.43 3.95 -0.11 0.37 1.43 -1.23 -1.96 118.68 118.70 1wpm s LEU 5 Ca 0.10 0.08 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 1wpm s LEU 5 Cb -0.06 -2.58 0.02 0.00 0.03 0.00 0.00 46.19 43.61 1wpm s LEU 5 CO 0.04 0.18 -0.11 -0.63 0.23 0.00 0.00 176.35 176.06 1wpm s ILE 6 N -1.40 1.21 0.07 -0.59 1.01 -0.61 -1.38 121.20 119.52 1wpm s ILE 6 Ca 0.30 -0.44 -0.09 0.00 0.00 0.00 0.00 60.65 60.42 1wpm s ILE 6 Cb -0.12 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.18 1wpm s ILE 6 CO 0.23 0.39 0.20 0.72 0.00 0.00 0.00 174.94 176.48 1wpm s PHE 7 N 1.35 0.09 0.00 3.97 -0.12 -0.99 -0.91 117.98 121.37 1wpm s PHE 7 Ca -0.01 -0.41 0.00 0.00 -0.05 0.00 0.00 56.93 56.46 1wpm s PHE 7 Cb -0.14 -0.03 0.00 0.00 -0.63 0.00 0.00 43.02 42.22 1wpm s PHE 7 CO -0.05 -0.50 0.00 0.41 -0.05 0.00 0.00 175.22 175.03 1wpm n GLY 8 N 0.29 0.77 3.96 1.99 0.00 -1.25 -1.71 105.19 109.24 1wpm n GLY 8 Ca -0.17 -1.73 -0.24 0.00 0.00 0.00 0.00 46.02 43.89 1wpm n GLY 8 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1wpm s HIS 9 N 0.97 2.61 0.80 1.61 -3.43 -1.26 -4.82 115.29 111.77 1wpm s HIS 9 Ca 0.00 0.13 -0.14 0.00 -0.80 0.00 0.00 55.06 54.26 1wpm s HIS 9 Cb 0.00 -3.03 0.07 0.00 -1.43 0.00 0.00 32.58 28.19 1wpm s HIS 9 CO 0.00 -1.30 1.11 1.04 -2.00 0.00 0.00 174.74 173.59 1wpm n GLN 10 N -2.72 0.19 -3.48 -0.38 1.13 -0.10 -3.77 117.38 108.26 1wpm n GLN 10 Ca 0.09 0.14 -0.17 0.00 -1.94 0.00 0.00 57.00 55.12 1wpm n GLN 10 Cb 0.60 -2.36 0.00 0.00 0.11 0.00 0.00 30.24 28.59 1wpm n GLN 10 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1wpm n ASN 11 N -2.90 -6.02 -4.70 1.08 3.02 -1.26 -4.86 115.26 99.63 1wpm n ASN 11 Ca 0.13 -0.53 -0.44 0.00 -0.03 0.00 0.00 54.58 53.72 1wpm n ASN 11 Cb 0.50 -3.03 -0.02 0.00 -0.61 0.00 0.00 39.78 36.62 1wpm n ASN 11 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1wpm n PRO 12 N -2.00 2.27 -3.00 3.52 -0.02 -1.25 -4.63 135.00 129.90 1wpm n PRO 12 Ca -0.17 0.81 -0.13 0.00 -2.02 0.00 0.00 63.50 61.98 1wpm n PRO 12 Cb 0.62 -2.51 -0.02 0.00 -0.02 0.00 0.00 33.50 31.57 1wpm n PRO 12 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1wpm n ASP 13 N 2.09 2.45 -0.13 2.55 4.64 -1.26 -4.40 116.55 122.49 1wpm n ASP 13 Ca 0.10 -1.89 -0.11 0.00 -1.38 0.00 0.00 54.79 51.50 1wpm n ASP 13 Cb 0.33 0.12 -0.02 0.00 -1.04 0.00 0.00 41.12 40.52 1wpm n ASP 13 CO 0.00 0.00 0.00 0.74 -0.82 0.00 0.00 177.20 177.12 1wpm h THR 14 N 1.03 1.28 -0.46 5.18 2.02 -1.95 -1.96 112.91 118.04 1wpm h THR 14 Ca -0.17 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 65.78 1wpm h THR 14 Cb 0.52 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 1wpm h THR 14 CO 0.28 0.41 0.29 -0.78 0.37 0.00 0.00 175.52 176.09 1wpm h ASP 15 N 0.57 0.48 -0.55 4.18 3.58 -1.90 0.06 116.42 122.84 1wpm h ASP 15 Ca 0.09 -0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 1wpm h ASP 15 Cb 0.67 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.58 1wpm h ASP 15 CO 0.05 0.34 0.28 0.74 -2.88 0.00 0.00 179.24 177.77 1wpm h THR 16 N 0.58 1.19 0.01 2.25 2.02 -1.82 0.83 112.91 117.98 1wpm h THR 16 Ca 0.18 -0.54 -0.00 0.00 0.77 0.00 0.00 66.41 66.82 1wpm h THR 16 Cb -0.02 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 1wpm h THR 16 CO -0.06 0.22 -0.00 0.40 0.37 0.00 0.00 175.52 176.45 1wpm h ILE 17 N 0.82 1.43 -0.59 3.11 1.08 -1.20 -3.20 117.51 118.96 1wpm h ILE 17 Ca 0.20 -2.02 -0.09 0.00 -0.39 0.00 0.00 64.86 62.56 1wpm h ILE 17 Cb 0.09 2.67 -0.02 0.00 -3.07 0.00 0.00 36.82 36.48 1wpm h ILE 17 CO -0.03 0.47 0.02 0.00 -0.69 0.00 0.00 178.15 177.92 1wpm h SER 19 N 0.94 0.00 -0.80 0.00 0.02 -1.02 0.55 113.55 113.24 1wpm h SER 19 Ca 0.17 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 1wpm h SER 19 Cb 0.52 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.02 1wpm h SER 19 CO 0.03 0.79 0.47 0.00 -1.14 0.00 0.00 176.83 176.98 1wpm h ALA 20 N 1.21 1.02 -0.09 3.77 0.00 -1.51 -0.19 119.26 123.46 1wpm h ALA 20 Ca -0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1wpm h ALA 20 Cb 1.45 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1wpm h ALA 20 CO 0.10 0.49 -0.05 0.82 0.00 0.00 0.00 179.25 180.62 1wpm h ILE 21 N 1.10 1.33 -0.53 0.00 2.04 -1.20 -1.86 117.51 118.38 1wpm h ILE 21 Ca 0.28 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 1wpm h ILE 21 Cb -0.02 1.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1wpm h ILE 21 CO -0.05 0.31 0.29 0.00 0.00 0.00 0.00 178.15 178.69 1wpm h ALA 22 N 0.63 0.68 -0.36 1.87 0.00 -0.86 0.07 119.26 121.29 1wpm h ALA 22 Ca 0.02 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 1wpm h ALA 22 Cb 0.51 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1wpm h ALA 22 CO 0.01 0.20 -0.41 -0.92 0.00 0.00 0.00 179.25 178.14 1wpm h TYR 23 N 0.71 1.10 -0.71 0.00 3.20 -1.05 -1.25 116.97 118.97 1wpm h TYR 23 Ca 0.19 -0.34 0.06 0.00 3.14 0.00 0.00 58.73 61.78 1wpm h TYR 23 Cb 0.05 -0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.04 1wpm h TYR 23 CO -0.01 1.16 0.41 0.00 -1.64 0.00 0.00 178.16 178.07 1wpm h ALA 24 N 0.79 0.95 0.03 1.82 0.00 -1.11 -0.68 119.26 121.06 1wpm h ALA 24 Ca 0.05 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1wpm h ALA 24 Cb 1.00 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1wpm h ALA 24 CO 0.10 0.10 -0.21 0.22 0.00 0.00 0.00 179.25 179.46 1wpm h ASP 25 N 0.75 -0.61 -0.54 0.00 1.82 -0.61 -0.32 116.42 116.90 1wpm h ASP 25 Ca 0.31 0.08 0.08 0.00 -0.39 0.00 0.00 57.03 57.12 1wpm h ASP 25 Cb 0.18 0.25 -0.07 0.00 0.68 0.00 0.00 39.33 40.37 1wpm h ASP 25 CO -0.18 -0.28 0.16 0.25 -1.61 0.00 0.00 179.24 177.58 1wpm h LEU 26 N -0.36 0.12 -0.65 2.28 5.85 -0.66 -0.16 115.31 121.73 1wpm h LEU 26 Ca 0.05 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1wpm h LEU 26 Cb 0.42 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1wpm h LEU 26 CO -0.17 0.09 0.24 0.11 -0.34 0.00 0.00 178.44 178.36 1wpm h LYS 27 N 0.32 0.99 -0.32 1.25 1.79 -0.80 -2.44 116.57 117.36 1wpm h LYS 27 Ca 0.27 -0.19 -0.07 0.00 -2.18 0.00 0.00 60.65 58.48 1wpm h LYS 27 Cb 0.33 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.82 1wpm h LYS 27 CO -0.30 0.84 -0.06 -0.91 -1.08 0.00 0.00 179.45 177.95 1wpm h ASN 28 N 0.92 0.60 -0.18 0.86 2.35 -0.41 -0.83 115.58 118.90 1wpm h ASN 28 Ca 0.21 -0.35 0.05 0.00 -0.55 0.00 0.00 56.30 55.66 1wpm h ASN 28 Cb 0.24 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1wpm h ASN 28 CO -0.01 0.81 0.23 0.11 -1.65 0.00 0.00 177.43 176.92 1wpm h LYS 29 N 0.38 0.00 -0.50 0.81 1.79 -0.97 0.97 116.57 119.04 1wpm h LYS 29 Ca 0.08 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1wpm h LYS 29 Cb 0.54 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 1wpm h LYS 29 CO 0.03 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.68 1wpm n LEU 30 N -3.63 2.64 -0.30 2.94 4.32 -0.93 -4.93 117.00 117.11 1wpm n LEU 30 Ca 0.02 -1.32 -0.04 0.00 -0.02 0.00 0.00 56.01 54.64 1wpm n LEU 30 Cb 0.35 -0.36 -0.01 0.00 -1.62 0.00 0.00 43.42 41.78 1wpm n LEU 30 CO 0.25 0.56 -0.04 0.61 -1.22 0.00 0.00 177.39 177.56 1wpm n GLY 31 N 1.02 0.59 3.03 -0.72 0.00 0.34 -5.05 105.19 104.40 1wpm n GLY 31 Ca 0.15 -0.88 -0.15 0.00 0.00 0.00 0.00 46.02 45.14 1wpm n GLY 31 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wpm n PHE 32 N -3.07 -2.44 -3.98 1.61 3.01 -0.35 -5.01 117.46 107.23 1wpm n PHE 32 Ca -0.04 -1.65 -0.31 0.00 1.01 0.00 0.00 57.45 56.47 1wpm n PHE 32 Cb 0.19 -0.43 -0.15 0.00 -0.01 0.00 0.00 39.48 39.08 1wpm n PHE 32 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1wpm s ASN 33 N -3.79 4.61 0.02 4.37 3.04 -1.26 -4.27 114.94 117.67 1wpm s ASN 33 Ca 0.47 -2.26 0.03 0.00 0.04 0.00 0.00 52.86 51.15 1wpm s ASN 33 Cb -0.04 -1.55 -0.02 0.00 -1.54 0.00 0.00 41.25 38.10 1wpm s ASN 33 CO 0.30 -0.36 -0.09 0.00 -3.04 0.00 0.00 177.10 173.91 1wpm s ALA 34 N 0.77 0.76 -0.05 1.71 0.00 -1.26 -1.17 121.76 122.52 1wpm s ALA 34 Ca 0.12 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.51 1wpm s ALA 34 Cb -0.20 -0.11 0.01 0.00 0.00 0.00 0.00 23.12 22.82 1wpm s ALA 34 CO -0.08 0.12 -0.10 -2.00 0.00 0.00 0.00 175.76 173.70 1wpm s GLU 35 N -0.85 1.30 0.19 0.00 2.12 -0.83 -4.90 118.70 115.73 1wpm s GLU 35 Ca -0.01 -0.35 -0.30 0.00 0.36 0.00 0.00 54.97 54.67 1wpm s GLU 35 Cb -0.06 -1.15 -0.08 0.00 0.26 0.00 0.00 34.13 33.10 1wpm s GLU 35 CO 0.00 0.06 1.10 -1.25 -0.54 0.00 0.00 175.26 174.63 1wpm s PRO 36 N 0.47 4.61 0.33 4.30 0.04 -1.26 -1.57 135.00 141.92 1wpm s PRO 36 Ca -0.09 1.72 0.03 0.00 0.04 0.00 0.00 61.00 62.70 1wpm s PRO 36 Cb -0.13 -3.27 -0.05 0.00 0.04 0.00 0.00 34.50 31.09 1wpm s PRO 36 CO 0.02 0.10 0.08 0.14 0.04 0.00 0.00 177.00 177.38 1wpm s VAL 37 N -0.36 0.91 0.23 -0.36 -7.23 -0.09 -4.11 120.40 109.39 1wpm s VAL 37 Ca 0.49 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.72 1wpm s VAL 37 Cb -0.30 -2.66 -0.05 0.00 0.56 0.00 0.00 36.38 33.94 1wpm s VAL 37 CO 0.35 0.00 -0.07 0.00 -0.31 0.00 0.00 175.10 175.07 1wpm s ARG 38 N -3.88 1.39 0.00 4.82 1.70 -0.56 -4.40 118.95 118.02 1wpm s ARG 38 Ca 0.34 -1.67 0.08 0.00 -0.47 0.00 0.00 55.73 54.01 1wpm s ARG 38 Cb 0.07 -0.96 0.00 0.00 -0.57 0.00 0.00 34.95 33.50 1wpm s ARG 38 CO 0.15 0.05 0.57 1.28 -1.08 0.00 0.00 175.30 176.27 1wpm n LEU 39 N -0.45 1.12 0.00 -1.89 4.77 -1.26 -2.33 117.00 116.96 1wpm n LEU 39 Ca -0.07 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.13 1wpm n LEU 39 Cb 0.62 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 1wpm n LEU 39 CO 0.37 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1wpm n GLY 40 N 0.76 1.94 3.77 -0.72 0.00 -1.26 -4.73 105.19 104.95 1wpm n GLY 40 Ca 0.03 -0.79 -0.38 0.00 0.00 0.00 0.00 46.02 44.89 1wpm n GLY 40 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1wpm s GLN 41 N -0.07 4.14 0.10 1.61 0.74 -1.26 -4.76 119.66 120.16 1wpm s GLN 41 Ca 0.00 1.74 -0.23 0.00 0.05 0.00 0.00 55.36 56.92 1wpm s GLN 41 Cb 0.00 -2.69 -0.07 0.00 1.10 0.00 0.00 33.01 31.35 1wpm s GLN 41 CO 0.00 -0.22 0.69 0.14 -0.55 0.00 0.00 175.29 175.35 1wpm s VAL 42 N -1.46 4.60 0.71 1.34 -7.23 -1.26 -4.19 120.40 112.92 1wpm s VAL 42 Ca 0.56 1.48 -0.11 0.00 -1.81 0.00 0.00 61.98 62.11 1wpm s VAL 42 Cb -0.28 -4.03 0.16 0.00 0.56 0.00 0.00 36.38 32.78 1wpm s VAL 42 CO 0.36 0.50 0.97 -0.46 -0.31 0.00 0.00 175.10 176.16 1wpm n ASN 43 N 1.94 0.24 -0.02 4.85 0.23 -1.26 -4.83 115.26 116.41 1wpm n ASN 43 Ca -0.07 -1.45 -0.08 0.00 -0.53 0.00 0.00 54.58 52.45 1wpm n ASN 43 Cb 0.50 -0.73 0.08 0.00 -2.08 0.00 0.00 39.78 37.55 1wpm n ASN 43 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1wpm h GLY 44 N -1.19 0.67 0.90 4.83 0.00 -1.89 -1.16 103.07 105.24 1wpm h GLY 44 Ca -0.32 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.32 1wpm h GLY 44 CO 0.24 0.62 0.08 -2.09 0.00 0.00 0.00 176.54 175.39 1wpm h GLU 45 N 0.50 0.26 -0.25 4.80 4.81 -1.82 -1.39 114.58 121.49 1wpm h GLU 45 Ca 0.04 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1wpm h GLU 45 Cb 0.95 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 1wpm h GLU 45 CO 0.09 0.31 0.05 1.15 -0.73 0.00 0.00 179.01 179.88 1wpm h THR 46 N 0.15 1.22 -0.74 0.32 2.02 -1.88 -2.66 112.91 111.35 1wpm h THR 46 Ca 0.06 -0.75 0.16 0.00 0.77 0.00 0.00 66.41 66.66 1wpm h THR 46 Cb 0.14 1.23 -0.11 0.00 -1.74 0.00 0.00 68.15 67.67 1wpm h THR 46 CO -0.01 0.24 0.16 -0.61 0.37 0.00 0.00 175.52 175.68 1wpm h GLN 47 N 0.23 0.24 -0.15 6.66 5.75 -1.12 0.12 115.11 126.84 1wpm h GLN 47 Ca 0.08 -0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.61 1wpm h GLN 47 Cb 0.31 -0.06 -0.06 0.00 1.07 0.00 0.00 27.48 28.75 1wpm h GLN 47 CO 0.00 0.16 -0.28 -0.92 -2.65 0.00 0.00 178.83 175.15 1wpm h TYR 48 N 0.25 -0.75 0.00 3.99 3.20 -1.03 0.12 116.97 122.75 1wpm h TYR 48 Ca 0.42 0.04 0.03 0.00 3.14 0.00 0.00 58.73 62.35 1wpm h TYR 48 Cb 0.72 0.35 -0.04 0.00 1.54 0.00 0.00 36.73 39.30 1wpm h TYR 48 CO -0.27 -0.36 -0.22 0.00 -1.64 0.00 0.00 178.16 175.66 1wpm h ALA 49 N 0.57 -0.30 -0.58 1.82 0.00 -0.97 0.19 119.26 120.00 1wpm h ALA 49 Ca 0.11 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1wpm h ALA 49 Cb 0.50 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1wpm h ALA 49 CO -0.34 -0.72 0.38 -0.07 0.00 0.00 0.00 179.25 178.50 1wpm h LEU 50 N -0.36 0.59 -0.02 0.00 3.38 -0.76 -2.10 115.31 116.05 1wpm h LEU 50 Ca 0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1wpm h LEU 50 Cb 0.44 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1wpm h LEU 50 CO -0.20 0.41 -0.04 0.44 0.09 0.00 0.00 178.44 179.15 1wpm h ASP 51 N 0.69 0.06 -0.81 -0.43 3.45 -0.25 0.76 116.42 119.90 1wpm h ASP 51 Ca 0.23 -0.57 0.07 0.00 0.43 0.00 0.00 57.03 57.19 1wpm h ASP 51 Cb 0.05 -0.02 -0.05 0.00 -0.56 0.00 0.00 39.33 38.75 1wpm h ASP 51 CO -0.06 0.62 0.53 0.22 -1.57 0.00 0.00 179.24 178.98 1wpm h TYR 52 N -0.49 0.89 -0.40 4.55 5.03 -0.25 -1.84 116.97 124.45 1wpm h TYR 52 Ca 0.00 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.33 1wpm h TYR 52 Cb 0.61 -0.29 0.00 0.00 1.55 0.00 0.00 36.73 38.60 1wpm h TYR 52 CO 0.12 0.46 0.00 1.19 -1.32 0.00 0.00 178.16 178.61 1wpm n PHE 53 N -4.49 1.18 -3.10 -3.82 3.01 -0.82 -4.95 117.46 104.46 1wpm n PHE 53 Ca 0.12 -0.74 -0.20 0.00 1.01 0.00 0.00 57.45 57.64 1wpm n PHE 53 Cb 0.23 -0.29 0.04 0.00 -0.01 0.00 0.00 39.48 39.45 1wpm n PHE 53 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1wpm n LYS 54 N 0.15 -5.17 -4.35 -1.08 5.02 -0.69 -4.83 118.16 107.20 1wpm n LYS 54 Ca 0.22 0.77 -0.32 0.00 -2.02 0.00 0.00 58.31 56.95 1wpm n LYS 54 Cb 0.88 -5.41 -0.09 0.00 -0.02 0.00 0.00 35.03 30.39 1wpm n LYS 54 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1wpm s GLN 55 N -5.75 2.70 0.44 1.97 -1.52 0.21 -5.04 119.66 112.68 1wpm s GLN 55 Ca 0.35 -0.65 -0.08 0.00 -1.95 0.00 0.00 55.36 53.03 1wpm s GLN 55 Cb -0.15 -2.61 -0.05 0.00 -0.22 0.00 0.00 33.01 29.98 1wpm s GLN 55 CO 0.43 0.62 0.78 -1.83 -0.25 0.00 0.00 175.29 175.04 1wpm s GLU 56 N -1.49 3.67 0.32 2.91 -1.05 -1.26 -4.49 118.70 117.31 1wpm s GLU 56 Ca 0.18 0.35 -0.29 0.00 -0.15 0.00 0.00 54.97 55.07 1wpm s GLU 56 Cb -0.11 -2.38 -0.12 0.00 -0.44 0.00 0.00 34.13 31.08 1wpm s GLU 56 CO 0.09 -0.12 1.44 0.43 0.95 0.00 0.00 175.26 178.05 1wpm n SER 57 N -1.76 3.30 -4.72 0.83 7.64 -1.26 -4.99 113.62 112.67 1wpm n SER 57 Ca 0.02 1.19 -0.33 0.00 1.01 0.00 0.00 58.87 60.75 1wpm n SER 57 Cb 0.54 -1.54 0.11 0.00 -1.01 0.00 0.00 64.21 62.32 1wpm n SER 57 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 1wpm s PRO 58 N -1.31 1.85 0.34 1.43 0.02 -1.26 -4.94 135.00 131.13 1wpm s PRO 58 Ca 0.59 1.59 -0.29 0.00 0.02 0.00 0.00 61.00 62.92 1wpm s PRO 58 Cb -0.54 -1.82 -0.11 0.00 0.02 0.00 0.00 34.50 32.05 1wpm s PRO 58 CO 0.57 -2.02 1.44 0.50 -0.33 0.00 0.00 177.00 177.16 1wpm s ARG 59 N -4.28 4.21 -0.15 5.54 3.52 -1.26 -4.49 118.95 122.03 1wpm s ARG 59 Ca 0.70 2.43 -0.24 0.00 -0.13 0.00 0.00 55.73 58.48 1wpm s ARG 59 Cb -0.25 -3.02 -0.02 0.00 -1.56 0.00 0.00 34.95 30.09 1wpm s ARG 59 CO 0.50 -0.42 0.76 -1.17 -0.81 0.00 0.00 175.30 174.17 1wpm s LEU 60 N -1.60 4.20 0.28 -0.88 2.96 -1.26 -1.49 118.68 120.89 1wpm s LEU 60 Ca 0.54 1.11 0.11 0.00 -0.22 0.00 0.00 54.13 55.67 1wpm s LEU 60 Cb -0.44 -3.13 -0.05 0.00 0.50 0.00 0.00 46.19 43.07 1wpm s LEU 60 CO 0.56 -0.32 -0.16 0.68 -1.32 0.00 0.00 176.35 175.79 1wpm s VAL 61 N 1.83 2.61 -0.06 1.68 -7.23 -0.98 -4.96 120.40 113.29 1wpm s VAL 61 Ca 0.36 -2.32 0.05 0.00 -1.81 0.00 0.00 61.98 58.26 1wpm s VAL 61 Cb -0.17 -2.40 -0.08 0.00 0.56 0.00 0.00 36.38 34.29 1wpm s VAL 61 CO 0.13 -0.38 0.02 -0.62 -0.31 0.00 0.00 175.10 173.94 1wpm n GLU 62 N -0.67 2.99 -4.39 4.82 1.02 -1.26 -4.61 120.64 118.53 1wpm n GLU 62 Ca -0.05 -0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.86 1wpm n GLU 62 Cb 0.60 -1.16 -0.08 0.00 -0.02 0.00 0.00 31.44 30.78 1wpm n GLU 62 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1wpm s THR 63 N -2.15 0.29 0.00 2.62 -4.23 -1.26 -3.94 115.64 106.97 1wpm s THR 63 Ca -0.03 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.48 1wpm s THR 63 Cb 0.02 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.44 1wpm s THR 63 CO 0.25 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.33 1wpm n ALA 64 N -0.75 1.04 0.30 3.99 0.00 -1.26 -4.83 120.51 119.01 1wpm n ALA 64 Ca 0.01 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.63 1wpm n ALA 64 Cb 0.64 0.04 0.86 0.00 0.00 0.00 0.00 19.45 20.98 1wpm n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wpm h ALA 65 N 0.00 1.00 0.00 0.00 0.00 -1.85 0.16 119.26 118.56 1wpm h ALA 65 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1wpm h ALA 65 Cb 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1wpm h ALA 65 CO 0.00 0.00 -0.18 -2.95 0.00 0.00 0.00 179.25 176.12 1wpm h ASN 66 N 0.00 0.00 0.00 0.00 -1.07 -1.99 -3.37 115.58 109.15 1wpm h ASN 66 Ca 0.00 0.00 -0.46 0.00 0.07 0.00 0.00 56.30 55.91 1wpm h ASN 66 Cb 0.26 0.00 -0.07 0.00 -2.07 0.00 0.00 38.32 36.44 1wpm h ASN 66 CO 0.00 0.18 -2.52 -0.62 0.07 0.00 0.00 177.43 174.54 1wpm n GLU 67 N -3.16 0.59 -4.39 4.14 1.02 -0.53 -5.08 120.64 113.24 1wpm n GLU 67 Ca 0.03 0.26 -0.19 0.00 -0.02 0.00 0.00 57.16 57.24 1wpm n GLU 67 Cb 0.59 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.40 1wpm n GLU 67 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1wpm s VAL 68 N -2.51 0.89 -0.08 2.62 -7.23 -0.07 -5.03 120.40 109.00 1wpm s VAL 68 Ca -0.38 -2.00 0.21 0.00 -1.81 0.00 0.00 61.98 57.99 1wpm s VAL 68 Cb 0.14 -2.72 -0.31 0.00 0.56 0.00 0.00 36.38 34.05 1wpm s VAL 68 CO 0.50 0.00 0.38 0.59 -0.31 0.00 0.00 175.10 176.26 1wpm n ASN 69 N -0.58 0.01 -4.04 4.85 3.02 -1.26 -4.11 115.26 113.14 1wpm n ASN 69 Ca -0.01 0.01 -0.19 0.00 -0.03 0.00 0.00 54.58 54.35 1wpm n ASN 69 Cb 0.66 1.72 -0.15 0.00 -0.61 0.00 0.00 39.78 41.41 1wpm n ASN 69 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1wpm s GLY 70 N -4.76 0.50 0.24 7.41 0.00 -1.26 -0.82 107.32 108.62 1wpm s GLY 70 Ca -0.08 -0.44 0.03 0.00 0.00 0.00 0.00 44.72 44.23 1wpm s GLY 70 CO 0.89 -0.37 0.02 -1.34 0.00 0.00 0.00 173.10 172.30 1wpm s VAL 71 N -0.24 0.98 -0.08 1.40 -7.23 0.28 -3.57 120.40 111.94 1wpm s VAL 71 Ca 0.04 -2.02 0.03 0.00 -1.81 0.00 0.00 61.98 58.21 1wpm s VAL 71 Cb -0.04 -2.42 0.01 0.00 0.56 0.00 0.00 36.38 34.49 1wpm s VAL 71 CO -0.00 -0.26 -0.17 -0.63 -0.31 0.00 0.00 175.10 173.73 1wpm s ILE 72 N -3.46 1.50 -0.03 -0.62 1.01 -0.48 -0.48 121.20 118.65 1wpm s ILE 72 Ca 0.30 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 60.13 1wpm s ILE 72 Cb 0.06 -1.34 -0.05 0.00 0.01 0.00 0.00 42.46 41.14 1wpm s ILE 72 CO 0.10 0.44 0.37 -0.76 0.00 0.00 0.00 174.94 175.08 1wpm s LEU 73 N 0.62 4.45 0.13 2.97 1.43 -0.44 -2.35 118.68 125.48 1wpm s LEU 73 Ca -0.15 0.87 0.11 0.00 -1.03 0.00 0.00 54.13 53.93 1wpm s LEU 73 Cb -0.16 -2.51 -0.04 0.00 0.03 0.00 0.00 46.19 43.51 1wpm s LEU 73 CO 0.04 0.31 -0.26 0.68 0.23 0.00 0.00 176.35 177.36 1wpm s VAL 74 N -0.92 2.17 -0.12 -1.59 -7.23 -0.69 -1.43 120.40 110.58 1wpm s VAL 74 Ca 0.22 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 1wpm s VAL 74 Cb -0.16 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 34.85 1wpm s VAL 74 CO 0.12 0.06 0.00 -0.67 -0.31 0.00 0.00 175.10 174.30 1wpm n ASP 75 N 0.93 -5.28 -3.64 4.85 4.64 -0.32 -3.98 116.55 113.74 1wpm n ASP 75 Ca -0.18 0.03 -0.04 0.00 -1.38 0.00 0.00 54.79 53.21 1wpm n ASP 75 Cb 0.53 -2.88 -0.01 0.00 -1.04 0.00 0.00 41.12 37.72 1wpm n ASP 75 CO 0.00 0.00 0.00 -1.38 -0.82 0.00 0.00 177.20 175.00 1wpm s HIS 76 N -1.33 -0.18 0.00 -0.67 -3.43 -1.26 -4.75 115.29 103.67 1wpm s HIS 76 Ca 0.00 -0.02 0.00 0.00 -0.80 0.00 0.00 55.06 54.24 1wpm s HIS 76 Cb 0.00 0.58 0.00 0.00 -1.43 0.00 0.00 32.58 31.73 1wpm s HIS 76 CO 0.00 -0.59 0.00 0.27 -2.00 0.00 0.00 174.74 172.42 1wpm n ASN 77 N -0.37 0.28 -4.72 7.38 0.23 -1.26 -4.83 115.26 111.97 1wpm n ASN 77 Ca -0.07 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.56 1wpm n ASN 77 Cb 0.61 0.03 -0.03 0.00 -2.08 0.00 0.00 39.78 38.31 1wpm n ASN 77 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1wpm s GLU 78 N -0.99 4.21 0.26 -3.83 2.02 -1.26 -4.67 118.70 114.44 1wpm s GLU 78 Ca 0.00 2.37 -0.02 0.00 0.02 0.00 0.00 54.97 57.34 1wpm s GLU 78 Cb 0.00 -3.18 0.56 0.00 0.10 0.00 0.00 34.13 31.60 1wpm s GLU 78 CO 0.00 -0.62 1.68 0.00 0.02 0.00 0.00 175.26 176.34 1wpm h ARG 79 N 6.91 0.28 0.00 1.61 3.08 -1.41 -0.80 114.38 124.05 1wpm h ARG 79 Ca -0.43 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.61 1wpm h ARG 79 Cb 1.20 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1wpm h ARG 79 CO 0.92 0.19 0.00 0.00 -1.07 0.00 0.00 179.97 180.00 1wpm n GLN 80 N -5.14 0.01 0.00 0.04 0.00 -1.26 -0.94 117.38 110.08 1wpm n GLN 80 Ca 0.17 0.26 0.11 0.00 0.00 0.00 0.00 57.00 57.54 1wpm n GLN 80 Cb 0.53 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 29.25 1wpm n GLN 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1wpm n GLN 81 N -1.49 1.07 -0.55 2.61 6.02 -0.32 -4.84 117.38 119.88 1wpm n GLN 81 Ca 0.03 -0.82 0.00 0.00 -0.01 0.00 0.00 57.00 56.21 1wpm n GLN 81 Cb 0.16 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 29.95 1wpm n GLN 81 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1wpm n SER 82 N -0.28 0.00 -4.78 1.08 2.88 -0.12 -0.92 113.62 111.48 1wpm n SER 82 Ca 0.08 -0.68 -0.34 0.00 -1.33 0.00 0.00 58.87 56.60 1wpm n SER 82 Cb 0.44 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.89 1wpm n SER 82 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1wpm s ILE 83 N 0.96 3.44 0.40 2.46 2.07 -1.26 -4.66 121.20 124.62 1wpm s ILE 83 Ca 0.00 0.86 0.16 0.00 -1.41 0.00 0.00 60.65 60.26 1wpm s ILE 83 Cb 0.00 -3.34 0.17 0.00 0.13 0.00 0.00 42.46 39.42 1wpm s ILE 83 CO 0.00 -0.23 1.93 0.07 -1.91 0.00 0.00 174.94 174.81 1wpm h LYS 84 N 1.18 0.00 -0.70 3.50 2.10 -1.93 -2.33 116.57 118.39 1wpm h LYS 84 Ca -0.49 0.00 -0.43 0.00 -2.00 0.00 0.00 60.65 57.72 1wpm h LYS 84 Cb 1.24 0.00 -0.25 0.00 -0.90 0.00 0.00 32.23 32.32 1wpm h LYS 84 CO 0.57 0.25 0.14 -0.40 -2.00 0.00 0.00 179.45 178.01 1wpm n ASP 85 N -4.08 4.40 -0.19 7.07 5.75 -1.26 -4.71 116.55 123.53 1wpm n ASP 85 Ca -0.02 -3.76 0.19 0.00 -0.01 0.00 0.00 54.79 51.19 1wpm n ASP 85 Cb 0.31 -0.70 0.54 0.00 -1.03 0.00 0.00 41.12 40.24 1wpm n ASP 85 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1wpm h ILE 86 N 1.22 0.72 0.00 2.12 6.09 -1.79 0.69 117.51 126.56 1wpm h ILE 86 Ca 0.42 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 63.79 1wpm h ILE 86 Cb 1.66 0.34 0.00 0.00 0.47 0.00 0.00 36.82 39.29 1wpm h ILE 86 CO 0.88 0.06 0.00 -0.62 -3.07 0.00 0.00 178.15 175.40 1wpm n GLU 87 N -4.47 0.17 0.15 2.19 1.02 -1.26 -2.14 120.64 116.30 1wpm n GLU 87 Ca 0.17 0.36 0.10 0.00 -0.02 0.00 0.00 57.16 57.77 1wpm n GLU 87 Cb 0.65 -1.81 0.06 0.00 -0.02 0.00 0.00 31.44 30.32 1wpm n GLU 87 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1wpm h GLU 88 N 0.00 0.00 -6.17 3.49 4.39 -1.23 -3.47 114.58 111.59 1wpm h GLU 88 Ca 0.00 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.20 1wpm h GLU 88 Cb 0.40 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 1wpm h GLU 88 CO 0.00 0.05 -0.40 0.14 -1.16 0.00 0.00 179.01 177.64 1wpm s VAL 89 N -3.26 2.83 -0.12 3.13 -7.23 -0.91 -4.91 120.40 109.93 1wpm s VAL 89 Ca 0.02 -1.36 -0.14 0.00 -1.81 0.00 0.00 61.98 58.69 1wpm s VAL 89 Cb 0.08 -3.04 -0.05 0.00 0.56 0.00 0.00 36.38 33.93 1wpm s VAL 89 CO 0.74 -0.04 0.33 -1.58 -0.31 0.00 0.00 175.10 174.25 1wpm s GLN 90 N -4.09 4.16 -0.42 4.82 0.74 -0.00 -4.98 119.66 119.88 1wpm s GLN 90 Ca 0.46 0.20 -0.24 0.00 0.05 0.00 0.00 55.36 55.83 1wpm s GLN 90 Cb -0.04 -3.38 0.02 0.00 1.10 0.00 0.00 33.01 30.72 1wpm s GLN 90 CO 0.27 0.34 0.83 0.08 -0.55 0.00 0.00 175.29 176.26 1wpm s VAL 91 N 0.12 4.62 -0.03 1.34 1.01 -1.26 -0.55 120.40 125.65 1wpm s VAL 91 Ca 0.19 0.68 -0.21 0.00 0.00 0.00 0.00 61.98 62.65 1wpm s VAL 91 Cb -0.14 -4.32 -0.30 0.00 0.00 0.00 0.00 36.38 31.62 1wpm s VAL 91 CO 0.07 -0.66 0.95 -0.07 0.00 0.00 0.00 175.10 175.39 1wpm h LEU 92 N 10.13 0.51 -7.82 3.92 4.07 -1.15 -3.47 115.31 121.50 1wpm h LEU 92 Ca -0.24 -0.91 -0.11 0.00 0.08 0.00 0.00 57.88 56.69 1wpm h LEU 92 Cb 1.08 -0.16 -0.17 0.00 1.08 0.00 0.00 40.66 42.49 1wpm h LEU 92 CO 0.96 1.38 -0.44 -1.61 -1.08 0.00 0.00 178.44 177.65 1wpm s GLU 93 N -2.61 0.68 -0.03 1.13 2.02 -1.23 -2.79 118.70 115.87 1wpm s GLU 93 Ca -0.13 -0.75 0.02 0.00 0.02 0.00 0.00 54.97 54.13 1wpm s GLU 93 Cb 0.02 0.28 0.01 0.00 0.10 0.00 0.00 34.13 34.53 1wpm s GLU 93 CO 0.84 -0.19 -0.08 0.08 0.02 0.00 0.00 175.26 175.93 1wpm s VAL 94 N -2.86 0.71 -0.18 2.63 1.01 -0.21 -1.33 120.40 120.18 1wpm s VAL 94 Ca -0.03 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.67 1wpm s VAL 94 Cb 0.00 -0.66 0.03 0.00 0.00 0.00 0.00 36.38 35.75 1wpm s VAL 94 CO -0.06 0.24 -0.16 -0.63 0.00 0.00 0.00 175.10 174.50 1wpm s ILE 95 N 0.41 1.81 0.32 2.22 -1.09 -0.51 -0.61 121.20 123.75 1wpm s ILE 95 Ca -0.06 -0.87 -0.16 0.00 -2.23 0.00 0.00 60.65 57.33 1wpm s ILE 95 Cb -0.10 -1.71 0.03 0.00 -1.58 0.00 0.00 42.46 39.09 1wpm s ILE 95 CO 0.01 0.42 0.69 -0.62 -1.23 0.00 0.00 174.94 174.21 1wpm s ASP 96 N 1.37 -0.03 0.00 3.58 3.68 -0.69 -1.18 116.67 123.41 1wpm s ASP 96 Ca 0.03 -0.94 0.02 0.00 2.13 0.00 0.00 52.55 53.79 1wpm s ASP 96 Cb -0.14 0.75 0.03 0.00 -1.45 0.00 0.00 42.92 42.11 1wpm s ASP 96 CO -0.11 -1.44 0.82 0.00 0.13 0.00 0.00 175.17 174.56 1wpm n HIS 97 N -0.49 0.00 -3.89 -5.34 1.44 -1.26 -2.48 115.22 103.20 1wpm n HIS 97 Ca -0.05 -0.06 -0.24 0.00 -2.01 0.00 0.00 57.72 55.36 1wpm n HIS 97 Cb 0.60 0.09 -0.04 0.00 0.12 0.00 0.00 29.99 30.76 1wpm n HIS 97 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 1wpm s HIS 98 N 0.00 2.30 0.79 -1.40 3.76 -1.26 -4.71 115.29 114.77 1wpm s HIS 98 Ca 0.02 -0.65 -0.14 0.00 -0.15 0.00 0.00 55.06 54.14 1wpm s HIS 98 Cb 0.03 -2.00 0.03 0.00 1.11 0.00 0.00 32.58 31.75 1wpm s HIS 98 CO -0.01 -0.12 0.89 2.89 -0.85 0.00 0.00 174.74 177.54 1wpm n ARG 99 N -1.50 0.22 -4.14 1.40 1.85 -1.26 -5.01 116.66 108.22 1wpm n ARG 99 Ca -0.00 0.14 -0.35 0.00 -1.00 0.00 0.00 57.85 56.63 1wpm n ARG 99 Cb 0.64 -2.18 -0.09 0.00 -1.05 0.00 0.00 32.46 29.78 1wpm n ARG 99 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 1wpm s ILE 100 N -2.04 4.66 0.03 8.89 1.01 -1.26 -4.83 121.20 127.67 1wpm s ILE 100 Ca 0.69 -0.09 -0.27 0.00 0.00 0.00 0.00 60.65 60.98 1wpm s ILE 100 Cb -0.31 -3.04 0.09 0.00 0.01 0.00 0.00 42.46 39.21 1wpm s ILE 100 CO 0.54 0.53 0.76 0.00 0.00 0.00 0.00 174.94 176.77 1wpm s ALA 101 N -0.21 -1.74 -1.53 9.38 0.00 -1.26 -4.99 121.76 121.41 1wpm s ALA 101 Ca 0.07 0.92 -0.12 0.00 0.00 0.00 0.00 51.96 52.83 1wpm s ALA 101 Cb -0.12 0.42 0.08 0.00 0.00 0.00 0.00 23.12 23.50 1wpm s ALA 101 CO 0.02 -0.63 0.90 0.09 0.00 0.00 0.00 175.76 176.14 1wpm n ASN 102 N -0.02 -3.99 -3.72 0.00 3.02 -1.26 -3.98 115.26 105.30 1wpm n ASN 102 Ca -0.14 -0.83 -0.16 0.00 -0.03 0.00 0.00 54.58 53.43 1wpm n ASN 102 Cb 0.62 -3.71 -0.16 0.00 -0.61 0.00 0.00 39.78 35.91 1wpm n ASN 102 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1wpm s PHE 103 N -3.37 -0.04 -0.05 3.10 2.19 -1.26 -1.28 117.98 117.27 1wpm s PHE 103 Ca 0.57 0.31 -0.13 0.00 0.33 0.00 0.00 56.93 58.01 1wpm s PHE 103 Cb -0.29 -0.27 0.02 0.00 -1.31 0.00 0.00 43.02 41.17 1wpm s PHE 103 CO 0.84 -0.16 0.30 -2.00 1.83 0.00 0.00 175.22 176.03 1wpm s GLU 104 N 1.56 0.54 0.21 10.12 2.12 -1.26 -5.09 118.70 126.89 1wpm s GLU 104 Ca -0.04 0.04 0.08 0.00 0.36 0.00 0.00 54.97 55.41 1wpm s GLU 104 Cb -0.12 0.24 -0.05 0.00 0.26 0.00 0.00 34.13 34.46 1wpm s GLU 104 CO -0.04 -0.12 -0.15 0.95 -0.54 0.00 0.00 175.26 175.35 1wpm s THR 105 N -0.75 1.84 -0.16 -1.70 -4.23 -1.26 -5.04 115.64 104.35 1wpm s THR 105 Ca -0.08 -2.23 0.17 0.00 -1.18 0.00 0.00 61.69 58.36 1wpm s THR 105 Cb -0.04 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.70 1wpm s THR 105 CO 0.03 -0.56 1.12 0.00 -0.54 0.00 0.00 174.62 174.67 1wpm h ALA 106 N 2.54 0.66 -2.22 3.99 0.00 -2.00 -3.47 119.26 118.75 1wpm h ALA 106 Ca -0.38 -0.57 -0.39 0.00 0.00 0.00 0.00 54.91 53.57 1wpm h ALA 106 Cb 1.23 0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.97 1wpm h ALA 106 CO 0.61 0.66 -0.72 -1.21 0.00 0.00 0.00 179.25 178.60 1wpm s GLU 107 N -3.00 1.21 0.67 0.00 2.02 -1.26 -5.13 118.70 113.21 1wpm s GLU 107 Ca 0.00 -1.53 -0.17 0.00 0.02 0.00 0.00 54.97 53.30 1wpm s GLU 107 Cb 0.08 -0.87 -0.04 0.00 0.10 0.00 0.00 34.13 33.40 1wpm s GLU 107 CO 0.78 0.12 0.73 -2.30 0.02 0.00 0.00 175.26 174.61 1wpm n PRO 108 N -0.30 0.51 -3.92 0.39 -0.02 -1.26 -5.03 135.00 125.37 1wpm n PRO 108 Ca -0.09 0.22 -0.09 0.00 -2.02 0.00 0.00 63.50 61.52 1wpm n PRO 108 Cb 0.61 -1.98 -0.03 0.00 -0.02 0.00 0.00 33.50 32.08 1wpm n PRO 108 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1wpm s LEU 109 N -1.20 0.08 -0.46 2.45 2.34 -1.26 -5.05 118.68 115.57 1wpm s LEU 109 Ca 0.70 -0.87 -0.22 0.00 0.06 0.00 0.00 54.13 53.80 1wpm s LEU 109 Cb -0.38 2.32 0.03 0.00 -0.56 0.00 0.00 46.19 47.60 1wpm s LEU 109 CO 0.53 -1.33 0.76 -0.47 -1.06 0.00 0.00 176.35 174.78 1wpm s TYR 110 N -3.63 2.99 -0.17 3.48 5.04 -1.12 -5.02 117.35 118.92 1wpm s TYR 110 Ca 0.17 0.04 0.01 0.00 -2.44 0.00 0.00 57.07 54.85 1wpm s TYR 110 Cb -0.04 -3.64 0.02 0.00 0.35 0.00 0.00 41.96 38.66 1wpm s TYR 110 CO 0.09 -1.01 -0.18 -0.47 -1.34 0.00 0.00 175.55 172.65 1wpm s TYR 111 N 3.22 2.57 -0.35 4.97 6.14 -1.26 -1.04 117.35 131.60 1wpm s TYR 111 Ca 0.27 -1.52 0.01 0.00 0.64 0.00 0.00 57.07 56.47 1wpm s TYR 111 Cb -0.13 -1.80 0.11 0.00 0.42 0.00 0.00 41.96 40.56 1wpm s TYR 111 CO 0.21 -0.76 0.13 0.50 0.64 0.00 0.00 175.55 176.26 1wpm s ARG 112 N 1.36 0.97 -0.04 4.97 3.52 0.22 -4.96 118.95 124.98 1wpm s ARG 112 Ca 0.05 -1.43 0.05 0.00 -0.13 0.00 0.00 55.73 54.27 1wpm s ARG 112 Cb -0.13 -2.25 -0.02 0.00 -1.56 0.00 0.00 34.95 30.99 1wpm s ARG 112 CO -0.12 -1.03 -0.17 0.00 -0.81 0.00 0.00 175.30 173.17 1wpm s ALA 113 N 1.19 2.54 -0.02 6.12 0.00 -1.26 -1.70 121.76 128.63 1wpm s ALA 113 Ca 0.12 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 51.07 1wpm s ALA 113 Cb -0.19 -0.86 0.01 0.00 0.00 0.00 0.00 23.12 22.07 1wpm s ALA 113 CO -0.16 0.55 -0.04 -1.21 0.00 0.00 0.00 175.76 174.90 1wpm s GLU 114 N -0.71 0.49 -1.45 0.00 2.02 -1.03 -4.99 118.70 113.02 1wpm s GLU 114 Ca 0.11 -0.12 -0.09 0.00 0.02 0.00 0.00 54.97 54.89 1wpm s GLU 114 Cb -0.10 -0.51 -0.08 0.00 0.10 0.00 0.00 34.13 33.54 1wpm s GLU 114 CO 0.00 0.03 2.73 -0.35 0.02 0.00 0.00 175.26 177.69 1wpm n PRO 115 N 3.40 3.28 -2.15 0.39 -0.04 -1.26 -4.33 135.00 134.30 1wpm n PRO 115 Ca -0.18 -2.05 -0.07 0.00 -0.04 0.00 0.00 63.50 61.15 1wpm n PRO 115 Cb 0.55 -2.75 0.00 0.00 -0.04 0.00 0.00 33.50 31.26 1wpm n PRO 115 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1wpm n VAL 116 N 3.82 0.00 0.09 0.52 0.24 -1.26 -4.98 118.33 116.75 1wpm n VAL 116 Ca 0.70 -0.62 -0.08 0.00 -2.04 0.00 0.00 64.34 62.30 1wpm n VAL 116 Cb 0.22 -0.38 -0.02 0.00 -1.47 0.00 0.00 33.84 32.19 1wpm n VAL 116 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1wpm h GLY 117 N 0.18 0.15 -1.75 7.63 0.00 -1.89 -3.47 103.07 103.92 1wpm h GLY 117 Ca -0.10 -0.28 0.07 0.00 0.00 0.00 0.00 47.33 47.02 1wpm h GLY 117 CO 0.15 0.25 0.33 0.00 0.00 0.00 0.00 176.54 177.27 1wpm h THR 119 N 2.00 1.21 0.00 0.00 2.02 -1.91 -2.92 112.91 113.32 1wpm h THR 119 Ca -0.25 -0.89 -0.03 0.00 0.77 0.00 0.00 66.41 66.01 1wpm h THR 119 Cb 1.24 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.65 1wpm h THR 119 CO 0.30 0.30 -0.15 0.00 0.37 0.00 0.00 175.52 176.35 1wpm h ALA 120 N 1.44 1.43 -0.46 6.16 0.00 -1.90 -0.60 119.26 125.34 1wpm h ALA 120 Ca 0.11 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1wpm h ALA 120 Cb 0.40 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1wpm h ALA 120 CO 0.02 0.18 -0.17 1.15 0.00 0.00 0.00 179.25 180.43 1wpm h THR 121 N 0.00 1.27 -0.32 0.00 2.02 -1.86 -1.22 112.91 112.80 1wpm h THR 121 Ca -0.00 -1.30 -0.07 0.00 0.77 0.00 0.00 66.41 65.80 1wpm h THR 121 Cb 0.33 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1wpm h THR 121 CO 0.02 0.45 -0.09 0.40 0.37 0.00 0.00 175.52 176.66 1wpm h ILE 122 N 0.78 1.28 -0.25 3.11 2.04 -1.28 -3.05 117.51 120.14 1wpm h ILE 122 Ca 0.11 -1.15 -0.07 0.00 1.00 0.00 0.00 64.86 64.76 1wpm h ILE 122 Cb 0.71 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1wpm h ILE 122 CO 0.05 0.37 -0.15 -0.07 0.00 0.00 0.00 178.15 178.36 1wpm h LEU 123 N 0.39 0.41 -0.85 1.44 3.38 -1.07 -0.74 115.31 118.27 1wpm h LEU 123 Ca 0.08 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.02 1wpm h LEU 123 Cb 0.59 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.16 1wpm h LEU 123 CO 0.03 0.58 0.51 -1.13 0.09 0.00 0.00 178.44 178.52 1wpm h ASN 124 N 0.39 0.76 -0.36 -0.43 -1.24 -1.18 0.12 115.58 113.64 1wpm h ASN 124 Ca 0.07 0.03 -0.10 0.00 0.71 0.00 0.00 56.30 57.02 1wpm h ASN 124 Cb 0.49 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.40 1wpm h ASN 124 CO 0.03 0.46 -0.12 0.50 -1.29 0.00 0.00 177.43 177.01 1wpm h LYS 125 N 0.88 0.80 0.00 6.67 3.64 -1.21 -3.07 116.57 124.29 1wpm h LYS 125 Ca 0.39 -0.28 -0.10 0.00 -1.27 0.00 0.00 60.65 59.39 1wpm h LYS 125 Cb 0.27 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1wpm h LYS 125 CO -0.21 0.89 -0.47 0.52 -2.27 0.00 0.00 179.45 177.91 1wpm h MET 126 N 0.72 0.00 -0.54 1.90 2.86 0.29 -1.23 114.93 118.93 1wpm h MET 126 Ca 0.12 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.71 1wpm h MET 126 Cb 0.62 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.25 1wpm h MET 126 CO 0.04 0.47 0.17 1.88 1.06 0.00 0.00 176.91 180.52 1wpm h TYR 127 N 0.00 0.88 -0.49 -0.22 -1.99 -0.95 -2.69 116.97 111.51 1wpm h TYR 127 Ca -0.00 -0.09 -0.08 0.00 2.00 0.00 0.00 58.73 60.56 1wpm h TYR 127 Cb 0.84 -0.25 -0.02 0.00 2.00 0.00 0.00 36.73 39.30 1wpm h TYR 127 CO 0.00 0.75 0.00 0.87 -0.00 0.00 0.00 178.16 179.78 1wpm h LYS 128 N 0.75 0.86 -0.30 4.88 1.57 -1.39 0.63 116.57 123.58 1wpm h LYS 128 Ca 0.17 -0.27 0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1wpm h LYS 128 Cb 0.28 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1wpm h LYS 128 CO -0.01 0.90 0.20 0.93 -0.57 0.00 0.00 179.45 180.91 1wpm h GLU 129 N 0.72 0.32 -0.02 3.15 5.08 -1.21 -1.91 114.58 120.70 1wpm h GLU 129 Ca 0.14 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1wpm h GLU 129 Cb 0.51 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1wpm h GLU 129 CO 0.02 0.21 -0.19 0.09 -1.00 0.00 0.00 179.01 178.15 1wpm n ASN 130 N -4.49 2.61 -3.44 1.42 3.02 -0.99 -5.00 115.26 108.39 1wpm n ASN 130 Ca 0.02 -1.81 -0.18 0.00 -0.03 0.00 0.00 54.58 52.58 1wpm n ASN 130 Cb 0.13 0.19 0.07 0.00 -0.61 0.00 0.00 39.78 39.56 1wpm n ASN 130 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1wpm n ASN 131 N 0.80 -3.35 -4.14 6.41 4.05 0.10 -5.02 115.26 114.12 1wpm n ASN 131 Ca 0.12 -0.70 -0.30 0.00 0.45 0.00 0.00 54.58 54.15 1wpm n ASN 131 Cb 0.55 -4.87 -0.17 0.00 1.23 0.00 0.00 39.78 36.52 1wpm n ASN 131 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1wpm s VAL 132 N -3.43 1.76 0.34 3.44 1.01 -0.50 -5.04 120.40 117.98 1wpm s VAL 132 Ca 0.15 -0.83 -0.28 0.00 0.00 0.00 0.00 61.98 61.03 1wpm s VAL 132 Cb -0.03 -1.55 -0.10 0.00 0.00 0.00 0.00 36.38 34.70 1wpm s VAL 132 CO 0.75 0.49 1.24 -0.75 0.00 0.00 0.00 175.10 176.84 1wpm s LYS 133 N 0.62 4.34 -0.29 2.72 2.20 -1.26 -4.59 119.74 123.48 1wpm s LYS 133 Ca -0.13 2.07 -0.17 0.00 -0.36 0.00 0.00 55.97 57.37 1wpm s LYS 133 Cb -0.16 -3.01 -0.02 0.00 -1.51 0.00 0.00 37.83 33.12 1wpm s LYS 133 CO 0.04 -0.14 0.49 0.42 -0.36 0.00 0.00 175.35 175.79 1wpm s ILE 134 N -1.20 5.07 0.60 5.43 1.01 -1.26 -5.05 121.20 125.81 1wpm s ILE 134 Ca 0.50 0.65 -0.19 0.00 0.00 0.00 0.00 60.65 61.61 1wpm s ILE 134 Cb -0.37 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 1wpm s ILE 134 CO 0.48 -0.00 1.25 -1.61 0.00 0.00 0.00 174.94 175.06 1wpm s GLU 135 N 2.30 2.85 0.28 2.79 2.02 -1.26 -4.71 118.70 122.98 1wpm s GLU 135 Ca 0.19 1.95 0.02 0.00 0.02 0.00 0.00 54.97 57.15 1wpm s GLU 135 Cb -0.16 -1.94 0.68 0.00 0.10 0.00 0.00 34.13 32.82 1wpm s GLU 135 CO 0.11 -1.33 1.66 -0.22 0.02 0.00 0.00 175.26 175.50 1wpm h LYS 136 N 0.85 0.24 0.10 1.61 3.64 -1.96 0.29 116.57 121.34 1wpm h LYS 136 Ca -0.51 -0.01 -0.27 0.00 -1.27 0.00 0.00 60.65 58.59 1wpm h LYS 136 Cb 1.31 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1wpm h LYS 136 CO 0.55 0.16 -1.27 1.05 -2.27 0.00 0.00 179.45 177.67 1wpm h GLU 137 N 0.25 0.21 -0.77 1.90 9.09 -1.90 -1.88 114.58 121.48 1wpm h GLU 137 Ca 0.54 -0.36 -0.05 0.00 0.05 0.00 0.00 59.36 59.54 1wpm h GLU 137 Cb 1.05 0.13 -0.03 0.00 -1.65 0.00 0.00 28.75 28.26 1wpm h GLU 137 CO -0.61 1.14 0.28 0.82 0.05 0.00 0.00 179.01 180.69 1wpm h ILE 138 N 0.06 1.26 -0.63 -1.06 1.08 -1.75 -1.28 117.51 115.19 1wpm h ILE 138 Ca -0.14 -0.84 -0.03 0.00 -0.39 0.00 0.00 64.86 63.46 1wpm h ILE 138 Cb 1.95 0.37 -0.03 0.00 -3.07 0.00 0.00 36.82 36.03 1wpm h ILE 138 CO 0.18 0.34 0.28 0.00 -0.69 0.00 0.00 178.15 178.26 1wpm h ALA 139 N 1.18 1.30 -0.39 1.87 0.00 -0.82 -0.06 119.26 122.35 1wpm h ALA 139 Ca 0.25 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.86 1wpm h ALA 139 Cb 0.24 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1wpm h ALA 139 CO -0.02 0.53 -0.38 0.78 0.00 0.00 0.00 179.25 180.17 1wpm h GLY 140 N 0.99 1.02 1.04 0.00 0.00 -0.85 -0.61 103.07 104.67 1wpm h GLY 140 Ca 0.22 -1.03 -0.02 0.00 0.00 0.00 0.00 47.33 46.49 1wpm h GLY 140 CO -0.02 0.93 0.46 1.41 0.00 0.00 0.00 176.54 179.32 1wpm h LEU 141 N 0.76 1.12 -0.27 3.11 3.38 -0.70 -0.23 115.31 122.49 1wpm h LEU 141 Ca 0.06 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1wpm h LEU 141 Cb 0.97 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1wpm h LEU 141 CO 0.09 0.91 -0.11 0.24 0.09 0.00 0.00 178.44 179.67 1wpm h MET 142 N 1.24 0.55 -0.88 1.13 2.86 -0.91 -1.98 114.93 116.94 1wpm h MET 142 Ca 0.31 -0.23 0.12 0.00 -2.06 0.00 0.00 59.70 57.84 1wpm h MET 142 Cb 0.06 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 31.62 1wpm h MET 142 CO -0.05 0.79 0.51 1.25 1.06 0.00 0.00 176.91 180.47 1wpm h LEU 143 N 0.29 0.69 -0.17 1.22 5.85 -0.97 -1.02 115.31 121.20 1wpm h LEU 143 Ca 0.06 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.88 1wpm h LEU 143 Cb 0.61 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1wpm h LEU 143 CO 0.04 0.35 -0.04 0.28 -0.34 0.00 0.00 178.44 178.73 1wpm h SER 144 N 0.79 -0.16 -0.33 1.25 0.02 -0.74 0.20 113.55 114.58 1wpm h SER 144 Ca 0.45 0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.51 1wpm h SER 144 Cb 0.51 0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.10 1wpm h SER 144 CO -0.29 -0.06 0.00 0.00 -1.14 0.00 0.00 176.83 175.34 1wpm h ALA 145 N 1.17 0.30 -0.71 3.77 0.00 -0.69 0.23 119.26 123.32 1wpm h ALA 145 Ca 0.08 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1wpm h ALA 145 Cb 0.12 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1wpm h ALA 145 CO -0.18 -0.40 0.38 0.82 0.00 0.00 0.00 179.25 179.87 1wpm h ILE 146 N 0.10 1.22 -0.31 0.00 2.04 -0.85 -1.81 117.51 117.90 1wpm h ILE 146 Ca 0.16 -0.57 -0.07 0.00 1.00 0.00 0.00 64.86 65.37 1wpm h ILE 146 Cb 0.22 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1wpm h ILE 146 CO -0.27 0.25 -0.10 0.40 0.00 0.00 0.00 178.15 178.44 1wpm h ILE 147 N 0.98 1.28 0.13 -0.67 2.04 -0.13 -1.50 117.51 119.64 1wpm h ILE 147 Ca 0.25 -1.15 0.02 0.00 1.00 0.00 0.00 64.86 64.97 1wpm h ILE 147 Cb 0.06 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 1wpm h ILE 147 CO -0.04 0.37 -0.45 -1.28 0.00 0.00 0.00 178.15 176.75 1wpm h SER 148 N 0.38 -1.33 1.49 1.72 0.87 -0.40 0.76 113.55 117.03 1wpm h SER 148 Ca 0.08 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1wpm h SER 148 Cb 0.60 0.50 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1wpm h SER 148 CO 0.03 -0.51 0.00 0.44 -0.53 0.00 0.00 176.83 176.26 1wpm h ASP 149 N -0.69 0.00 0.13 6.23 5.19 -1.34 -2.95 116.42 122.98 1wpm h ASP 149 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1wpm h ASP 149 Cb 0.71 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.22 1wpm h ASP 149 CO -0.25 0.00 -0.67 -1.54 -3.12 0.00 0.00 179.24 173.66 1wpm n SER 150 N -2.89 1.16 -3.73 6.45 3.41 -0.57 -4.84 113.62 112.62 1wpm n SER 150 Ca 0.03 -0.97 -0.33 0.00 -0.26 0.00 0.00 58.87 57.35 1wpm n SER 150 Cb 0.41 0.60 0.04 0.00 -0.26 0.00 0.00 64.21 65.01 1wpm n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1wpm n LEU 151 N -1.02 -2.60 -3.68 1.04 4.77 0.21 -0.67 117.00 115.06 1wpm n LEU 151 Ca 0.07 -1.04 -0.21 0.00 -0.03 0.00 0.00 56.01 54.79 1wpm n LEU 151 Cb 0.37 -2.32 0.04 0.00 -2.33 0.00 0.00 43.42 39.18 1wpm n LEU 151 CO 0.35 0.50 -0.03 0.18 -1.33 0.00 0.00 177.39 177.07 1wpm n LEU 152 N -4.27 -3.19 -0.90 2.23 4.77 -0.88 -2.74 117.00 112.02 1wpm n LEU 152 Ca -0.11 -0.79 -0.10 0.00 -0.03 0.00 0.00 56.01 54.99 1wpm n LEU 152 Cb 0.59 -2.72 -0.02 0.00 -2.33 0.00 0.00 43.42 38.94 1wpm n LEU 152 CO 0.68 0.41 -0.11 0.49 -1.33 0.00 0.00 177.39 177.54 1wpm n PHE 153 N -4.30 -0.20 -0.02 -1.77 3.01 -1.06 -4.88 117.46 108.24 1wpm n PHE 153 Ca -0.27 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.24 1wpm n PHE 153 Cb 0.67 -2.10 -0.13 0.00 -0.01 0.00 0.00 39.48 37.91 1wpm n PHE 153 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1wpm n LYS 154 N -2.37 0.67 -2.19 -1.08 4.76 -0.50 -5.00 118.16 112.45 1wpm n LYS 154 Ca -0.10 -0.13 -0.39 0.00 -2.87 0.00 0.00 58.31 54.82 1wpm n LYS 154 Cb 0.44 -1.39 -0.02 0.00 -1.84 0.00 0.00 35.03 32.22 1wpm n LYS 154 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1wpm s SER 155 N -4.05 6.57 0.00 4.39 0.15 0.16 -4.90 113.70 116.02 1wpm s SER 155 Ca -0.06 2.52 0.11 0.00 0.70 0.00 0.00 55.95 59.21 1wpm s SER 155 Cb 0.09 -2.63 0.53 0.00 -1.71 0.00 0.00 66.02 62.30 1wpm s SER 155 CO 0.67 -0.66 1.24 -0.81 1.20 0.00 0.00 173.24 174.88 1wpm n PRO 156 N 0.35 0.14 0.07 5.44 -0.04 -1.26 -1.71 135.00 137.98 1wpm n PRO 156 Ca 0.03 0.20 0.13 0.00 -0.04 0.00 0.00 63.50 63.81 1wpm n PRO 156 Cb 0.44 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.82 1wpm n PRO 156 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1wpm n THR 157 N -1.30 0.37 -1.95 0.52 -2.24 -1.26 -4.85 114.28 103.57 1wpm n THR 157 Ca 0.05 -0.19 -0.43 0.00 -2.27 0.00 0.00 64.05 61.21 1wpm n THR 157 Cb 0.09 -0.45 -0.03 0.00 -2.10 0.00 0.00 70.33 67.84 1wpm n THR 157 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wpm s THR 159 N 5.02 2.54 0.35 0.00 -4.23 -1.26 -4.98 115.64 113.08 1wpm s THR 159 Ca 0.78 -1.25 0.06 0.00 -1.18 0.00 0.00 61.69 60.09 1wpm s THR 159 Cb -0.31 -2.79 0.30 0.00 1.34 0.00 0.00 72.50 71.03 1wpm s THR 159 CO 0.32 0.00 1.94 0.44 -0.54 0.00 0.00 174.62 176.78 1wpm h ASP 160 N 0.82 0.70 -0.73 3.99 3.32 -1.99 -1.74 116.42 120.78 1wpm h ASP 160 Ca -0.39 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.62 1wpm h ASP 160 Cb 1.28 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.65 1wpm h ASP 160 CO 0.53 0.44 0.27 1.56 -1.72 0.00 0.00 179.24 180.31 1wpm h GLN 161 N 0.78 1.12 -0.12 3.56 4.20 -1.98 -0.43 115.11 122.24 1wpm h GLN 161 Ca 0.34 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1wpm h GLN 161 Cb 0.31 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1wpm h GLN 161 CO -0.12 0.93 0.05 -0.44 -0.67 0.00 0.00 178.83 178.57 1wpm h ASP 162 N 1.09 0.17 -0.66 1.46 3.32 -1.76 -0.87 116.42 119.18 1wpm h ASP 162 Ca 0.24 -0.18 0.08 0.00 0.02 0.00 0.00 57.03 57.19 1wpm h ASP 162 Cb 0.25 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.69 1wpm h ASP 162 CO -0.02 0.30 0.34 0.58 -1.72 0.00 0.00 179.24 178.72 1wpm h VAL 163 N 0.03 0.89 -0.21 -1.35 2.07 -1.12 -0.54 116.25 116.03 1wpm h VAL 163 Ca 0.04 -0.21 -0.17 0.00 0.82 0.00 0.00 66.70 67.18 1wpm h VAL 163 Cb 0.19 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1wpm h VAL 163 CO -0.00 0.11 -0.54 0.00 0.02 0.00 0.00 177.57 177.16 1wpm h ALA 164 N 1.38 0.35 -0.49 1.67 0.00 -0.97 -0.94 119.26 120.26 1wpm h ALA 164 Ca 0.31 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1wpm h ALA 164 Cb 0.28 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1wpm h ALA 164 CO -0.23 0.56 0.27 0.00 0.00 0.00 0.00 179.25 179.85 1wpm h ALA 165 N 0.60 0.63 -0.38 0.00 0.00 -1.05 -2.09 119.26 116.97 1wpm h ALA 165 Ca -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1wpm h ALA 165 Cb 1.15 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1wpm h ALA 165 CO 0.12 0.15 0.22 0.00 0.00 0.00 0.00 179.25 179.74 1wpm h ALA 166 N 1.11 0.48 -0.92 0.00 0.00 -0.79 0.62 119.26 119.77 1wpm h ALA 166 Ca 0.17 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1wpm h ALA 166 Cb 0.05 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 1wpm h ALA 166 CO -0.03 -0.00 0.58 -0.22 0.00 0.00 0.00 179.25 179.58 1wpm h LYS 167 N 0.49 1.04 -0.36 0.00 3.64 -1.10 0.19 116.57 120.47 1wpm h LYS 167 Ca 0.13 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.33 1wpm h LYS 167 Cb 0.03 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 1wpm h LYS 167 CO -0.02 0.69 -0.28 0.93 -2.27 0.00 0.00 179.45 178.50 1wpm h GLU 168 N 1.07 0.76 0.13 1.90 5.08 -0.80 -2.99 114.58 119.72 1wpm h GLU 168 Ca 0.39 -0.33 -0.28 0.00 -1.00 0.00 0.00 59.36 58.14 1wpm h GLU 168 Cb 0.14 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 29.39 1wpm h GLU 168 CO -0.16 0.94 -1.23 -0.07 -1.00 0.00 0.00 179.01 177.49 1wpm h LEU 169 N 0.65 0.65 -0.84 1.33 3.38 -0.29 -2.26 115.31 117.93 1wpm h LEU 169 Ca 0.08 -0.64 0.02 0.00 0.09 0.00 0.00 57.88 57.43 1wpm h LEU 169 Cb 0.80 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 1wpm h LEU 169 CO 0.07 1.47 0.55 0.00 0.09 0.00 0.00 178.44 180.61 1wpm h ALA 170 N 0.45 1.08 -0.57 1.53 0.00 -0.71 0.44 119.26 121.48 1wpm h ALA 170 Ca -0.16 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1wpm h ALA 170 Cb 1.92 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 1wpm h ALA 170 CO 0.22 0.42 0.09 1.49 0.00 0.00 0.00 179.25 181.47 1wpm h GLU 171 N 1.09 0.94 -0.42 0.00 4.57 -1.52 0.15 114.58 119.38 1wpm h GLU 171 Ca 0.32 -0.25 -0.06 0.00 -1.18 0.00 0.00 59.36 58.19 1wpm h GLU 171 Cb -0.06 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.41 1wpm h GLU 171 CO -0.09 0.90 0.01 0.82 -1.18 0.00 0.00 179.01 179.47 1wpm h ILE 172 N 0.84 1.26 0.00 2.32 2.04 -1.15 -3.15 117.51 119.66 1wpm h ILE 172 Ca 0.17 -1.00 -0.08 0.00 1.00 0.00 0.00 64.86 64.96 1wpm h ILE 172 Cb 0.41 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1wpm h ILE 172 CO 0.01 0.34 -0.37 0.00 0.00 0.00 0.00 178.15 178.13 1wpm h ALA 173 N 0.90 1.16 -0.05 1.87 0.00 -0.77 -3.43 119.26 118.95 1wpm h ALA 173 Ca 0.12 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1wpm h ALA 173 Cb 0.46 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1wpm h ALA 173 CO 0.02 0.46 0.00 0.41 0.00 0.00 0.00 179.25 180.14 1wpm n GLY 174 N -0.12 0.90 3.39 0.00 0.00 0.45 -4.94 105.19 104.88 1wpm n GLY 174 Ca -0.01 -0.60 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 1wpm n GLY 174 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wpm s VAL 175 N -2.05 2.08 -0.20 1.61 -7.23 -0.81 -5.05 120.40 108.76 1wpm s VAL 175 Ca 0.00 -2.20 -0.25 0.00 -1.81 0.00 0.00 61.98 57.71 1wpm s VAL 175 Cb 0.00 -2.10 -0.01 0.00 0.56 0.00 0.00 36.38 34.83 1wpm s VAL 175 CO 0.00 -0.42 0.86 -0.62 -0.31 0.00 0.00 175.10 174.61 1wpm s ASP 176 N -3.19 6.94 0.21 4.85 2.15 -1.26 -4.58 116.67 121.79 1wpm s ASP 176 Ca 0.24 1.16 -0.09 0.00 0.43 0.00 0.00 52.55 54.29 1wpm s ASP 176 Cb -0.04 -2.46 0.16 0.00 -0.30 0.00 0.00 42.92 40.28 1wpm s ASP 176 CO 0.10 -0.47 1.81 0.00 -0.17 0.00 0.00 175.17 176.44 1wpm h ALA 177 N 7.46 1.01 -0.40 3.66 0.00 -1.96 -0.59 119.26 128.43 1wpm h ALA 177 Ca -0.26 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.36 1wpm h ALA 177 Cb 1.11 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1wpm h ALA 177 CO 0.86 0.57 -0.28 0.93 0.00 0.00 0.00 179.25 181.34 1wpm h GLU 178 N 1.11 0.90 0.24 0.00 4.39 -1.98 -0.43 114.58 118.80 1wpm h GLU 178 Ca 0.27 -0.43 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 1wpm h GLU 178 Cb 0.10 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1wpm h GLU 178 CO -0.04 1.08 -0.11 1.49 -1.16 0.00 0.00 179.01 180.27 1wpm h GLU 179 N 0.72 -0.31 -0.86 2.33 4.81 -1.94 -2.10 114.58 117.24 1wpm h GLU 179 Ca 0.08 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1wpm h GLU 179 Cb 0.86 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.26 1wpm h GLU 179 CO 0.08 0.06 0.53 -0.92 -0.73 0.00 0.00 179.01 178.02 1wpm h TYR 180 N -0.89 1.12 -0.39 0.92 3.20 -1.21 -2.86 116.97 116.87 1wpm h TYR 180 Ca -0.03 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 1wpm h TYR 180 Cb 0.51 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 1wpm h TYR 180 CO 0.06 0.74 0.14 0.78 -1.64 0.00 0.00 178.16 178.24 1wpm h GLY 181 N 1.18 0.64 0.88 1.82 0.00 -1.11 -0.22 103.07 106.26 1wpm h GLY 181 Ca 0.31 -0.36 0.02 0.00 0.00 0.00 0.00 47.33 47.30 1wpm h GLY 181 CO -0.06 0.34 0.23 -2.00 0.00 0.00 0.00 176.54 175.04 1wpm h LEU 182 N 0.49 0.36 -0.88 3.11 7.12 -1.32 -0.48 115.31 123.70 1wpm h LEU 182 Ca 0.13 0.01 -0.05 0.00 0.13 0.00 0.00 57.88 58.10 1wpm h LEU 182 Cb 0.21 -0.07 -0.03 0.00 -0.53 0.00 0.00 40.66 40.25 1wpm h LEU 182 CO -0.01 0.26 0.28 0.78 -0.13 0.00 0.00 178.44 179.62 1wpm h ASN 183 N 0.46 1.01 -0.01 1.25 2.35 -1.30 0.55 115.58 119.89 1wpm h ASN 183 Ca 0.16 -0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1wpm h ASN 183 Cb 0.02 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.13 1wpm h ASN 183 CO -0.08 0.91 0.00 -0.03 -1.65 0.00 0.00 177.43 176.58 1wpm h MET 184 N 1.07 0.01 -0.45 0.81 4.05 -0.78 -1.63 114.93 118.01 1wpm h MET 184 Ca 0.24 -0.00 0.05 0.00 -0.28 0.00 0.00 59.70 59.72 1wpm h MET 184 Cb 0.23 -0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 30.98 1wpm h MET 184 CO -0.02 0.28 0.17 -0.07 0.23 0.00 0.00 176.91 177.50 1wpm h LEU 185 N -0.26 0.18 -0.95 3.39 4.07 -0.92 -2.57 115.31 118.25 1wpm h LEU 185 Ca 0.00 0.05 -0.09 0.00 0.08 0.00 0.00 57.88 57.92 1wpm h LEU 185 Cb 0.27 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.03 1wpm h LEU 185 CO 0.00 0.14 -0.22 0.11 -1.08 0.00 0.00 178.44 177.39 1wpm h LYS 186 N 0.34 0.51 -0.19 1.13 1.57 -0.87 -1.26 116.57 117.80 1wpm h LYS 186 Ca 0.21 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1wpm h LYS 186 Cb 0.19 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1wpm h LYS 186 CO -0.20 0.70 0.12 0.00 -0.57 0.00 0.00 179.45 179.49 1wpm h ALA 187 N 1.31 1.86 0.00 3.86 0.00 -0.93 -1.53 119.26 123.84 1wpm h ALA 187 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1wpm h ALA 187 Cb 0.63 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1wpm h ALA 187 CO 0.05 0.13 -0.35 0.78 0.00 0.00 0.00 179.25 179.85 1wpm h GLY 188 N 0.26 0.00 -1.89 0.00 0.00 -0.97 -3.29 103.07 97.18 1wpm h GLY 188 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1wpm h GLY 188 CO -0.01 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.53 1wpm n ALA 189 N -1.98 2.62 -2.88 3.60 0.00 -0.56 -4.68 120.51 116.64 1wpm n ALA 189 Ca 0.03 -0.89 -0.43 0.00 0.00 0.00 0.00 53.44 52.15 1wpm n ALA 189 Cb 0.49 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 1wpm n ALA 189 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1wpm s ASP 190 N -0.89 6.52 0.00 0.00 3.68 -1.09 -4.60 116.67 120.29 1wpm s ASP 190 Ca 0.32 -1.77 0.23 0.00 2.13 0.00 0.00 52.55 53.45 1wpm s ASP 190 Cb 0.18 -2.42 0.81 0.00 -1.45 0.00 0.00 42.92 40.04 1wpm s ASP 190 CO 0.19 -1.18 1.59 0.18 0.13 0.00 0.00 175.17 176.07 1wpm n LEU 191 N 7.00 1.70 0.13 -1.34 7.99 -1.26 -4.50 117.00 126.72 1wpm n LEU 191 Ca 0.19 -0.67 -0.05 0.00 -0.01 0.00 0.00 56.01 55.46 1wpm n LEU 191 Cb 0.48 -0.08 -0.03 0.00 -0.11 0.00 0.00 43.42 43.69 1wpm n LEU 191 CO 0.55 0.34 0.48 0.77 -1.51 0.00 0.00 177.39 178.02 1wpm h SER 192 N 2.35 -0.29 0.00 -1.43 4.64 -2.01 -2.85 113.55 113.96 1wpm h SER 192 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1wpm h SER 192 Cb 0.51 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1wpm h SER 192 CO 0.00 -0.20 0.00 2.29 -0.87 0.00 0.00 176.83 178.05 1wpm n LYS 193 N -2.96 0.99 -3.63 4.77 2.85 -1.26 -4.78 118.16 114.14 1wpm n LYS 193 Ca -0.04 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.86 1wpm n LYS 193 Cb 0.14 -1.37 -0.07 0.00 -0.65 0.00 0.00 35.03 33.07 1wpm n LYS 193 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1wpm s LYS 194 N -1.26 4.20 0.83 -1.58 -0.14 -1.08 -5.09 119.74 115.62 1wpm s LYS 194 Ca 0.00 -0.04 -0.11 0.00 -1.36 0.00 0.00 55.97 54.46 1wpm s LYS 194 Cb 0.00 -3.41 0.09 0.00 -1.68 0.00 0.00 37.83 32.83 1wpm s LYS 194 CO 0.00 0.29 1.09 0.95 -0.76 0.00 0.00 175.35 176.92 1wpm s THR 195 N 0.35 2.94 0.30 2.17 -4.23 -1.26 -4.88 115.64 111.03 1wpm s THR 195 Ca 0.13 0.30 0.07 0.00 -1.18 0.00 0.00 61.69 61.01 1wpm s THR 195 Cb -0.12 -2.95 0.04 0.00 1.34 0.00 0.00 72.50 70.81 1wpm s THR 195 CO 0.02 -0.40 1.71 -0.37 -0.54 0.00 0.00 174.62 175.04 1wpm h VAL 196 N -1.25 1.30 -0.91 2.29 -1.51 -1.97 -0.50 116.25 113.70 1wpm h VAL 196 Ca -0.48 -1.48 0.08 0.00 -1.23 0.00 0.00 66.70 63.59 1wpm h VAL 196 Cb 1.27 1.66 -0.07 0.00 -2.13 0.00 0.00 31.29 32.02 1wpm h VAL 196 CO 0.57 0.44 0.57 -0.33 -1.23 0.00 0.00 177.57 177.59 1wpm h GLU 197 N 0.20 0.96 -0.26 5.19 3.07 -1.93 -1.94 114.58 119.87 1wpm h GLU 197 Ca 0.02 -0.06 -0.19 0.00 -0.50 0.00 0.00 59.36 58.63 1wpm h GLU 197 Cb 0.79 -0.22 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1wpm h GLU 197 CO 0.06 0.63 -0.57 0.93 -1.40 0.00 0.00 179.01 178.66 1wpm h GLU 198 N 0.98 0.85 -0.93 2.33 5.08 -1.72 -3.13 114.58 118.05 1wpm h GLU 198 Ca 0.42 -0.56 0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1wpm h GLU 198 Cb 0.28 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 1wpm h GLU 198 CO -0.21 1.19 0.61 -0.07 -1.00 0.00 0.00 179.01 179.53 1wpm h LEU 199 N 0.62 1.02 -0.67 1.33 3.38 -0.45 -0.80 115.31 119.72 1wpm h LEU 199 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1wpm h LEU 199 Cb 1.19 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1wpm h LEU 199 CO 0.13 0.71 -0.11 2.30 0.09 0.00 0.00 178.44 181.55 1wpm n ILE 200 N -4.43 0.00 0.00 1.22 -5.35 -0.79 -4.18 119.36 105.83 1wpm n ILE 200 Ca 0.12 -0.17 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1wpm n ILE 200 Cb 0.08 0.36 0.00 0.00 -1.74 0.00 0.00 39.64 38.35 1wpm n ILE 200 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1wpm n SER 201 N -0.30 4.30 -0.22 7.28 3.41 -1.04 -4.58 113.62 122.47 1wpm n SER 201 Ca 0.16 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.86 1wpm n SER 201 Cb 0.34 0.79 0.37 0.00 -0.26 0.00 0.00 64.21 65.44 1wpm n SER 201 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 1wpm h LEU 202 N 0.00 0.65 -6.00 1.04 8.10 -1.32 -3.12 115.31 114.67 1wpm h LEU 202 Ca 0.00 0.02 -0.54 0.00 0.11 0.00 0.00 57.88 57.47 1wpm h LEU 202 Cb 0.15 -0.11 -0.39 0.00 -0.44 0.00 0.00 40.66 39.86 1wpm h LEU 202 CO 0.00 0.38 -1.10 -0.67 -4.11 0.00 0.00 178.44 172.94 1wpm n ASP 203 N -4.51 0.55 -4.40 0.17 2.03 -1.26 -4.53 116.55 104.60 1wpm n ASP 203 Ca 0.14 -2.81 -0.32 0.00 0.52 0.00 0.00 54.79 52.31 1wpm n ASP 203 Cb 0.35 -0.64 -0.14 0.00 -0.72 0.00 0.00 41.12 39.97 1wpm n ASP 203 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1wpm s ALA 204 N -1.55 2.48 -0.00 -1.67 0.00 -1.18 -1.03 121.76 118.81 1wpm s ALA 204 Ca 0.37 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 51.34 1wpm s ALA 204 Cb 0.21 -0.87 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 1wpm s ALA 204 CO -0.10 0.49 -0.08 0.15 0.00 0.00 0.00 175.76 176.22 1wpm s LYS 205 N -0.49 0.65 0.05 0.00 1.02 -0.40 -4.71 119.74 115.86 1wpm s LYS 205 Ca 0.06 -0.34 0.00 0.00 0.02 0.00 0.00 55.97 55.72 1wpm s LYS 205 Cb -0.12 -0.61 -0.04 0.00 -0.52 0.00 0.00 37.83 36.54 1wpm s LYS 205 CO 0.01 0.16 0.16 -1.21 -0.92 0.00 0.00 175.35 173.56 1wpm s GLU 206 N -0.33 3.27 0.07 1.68 2.02 -1.26 -0.65 118.70 123.50 1wpm s GLU 206 Ca 0.02 -0.50 -0.06 0.00 0.02 0.00 0.00 54.97 54.45 1wpm s GLU 206 Cb -0.04 -2.95 -0.01 0.00 0.10 0.00 0.00 34.13 31.23 1wpm s GLU 206 CO -0.00 0.61 0.13 -0.06 0.02 0.00 0.00 175.26 175.95 1wpm s PHE 207 N -1.44 0.25 -0.23 1.61 0.40 -0.68 -4.77 117.98 113.13 1wpm s PHE 207 Ca 0.32 -0.70 -0.04 0.00 -0.60 0.00 0.00 56.93 55.91 1wpm s PHE 207 Cb -0.13 -0.15 -0.01 0.00 0.51 0.00 0.00 43.02 43.24 1wpm s PHE 207 CO 0.25 -0.49 -0.03 0.99 0.70 0.00 0.00 175.22 176.64 1wpm s THR 208 N -3.77 3.45 -0.35 0.64 2.01 -1.26 -1.34 115.64 115.01 1wpm s THR 208 Ca 0.05 -0.49 -0.06 0.00 0.31 0.00 0.00 61.69 61.49 1wpm s THR 208 Cb 0.05 -2.59 0.05 0.00 0.01 0.00 0.00 72.50 70.03 1wpm s THR 208 CO -0.10 0.40 0.13 -0.76 -0.69 0.00 0.00 174.62 173.59 1wpm s LEU 209 N 1.49 4.48 0.00 4.42 1.43 0.64 -4.91 118.68 126.22 1wpm s LEU 209 Ca 0.06 -1.25 0.00 0.00 -1.03 0.00 0.00 54.13 51.90 1wpm s LEU 209 Cb -0.14 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.20 1wpm s LEU 209 CO -0.03 -0.37 0.00 0.61 0.23 0.00 0.00 176.35 176.80 1wpm n GLY 210 N 4.81 3.08 0.00 -3.19 0.00 -1.26 -1.06 105.19 107.56 1wpm n GLY 210 Ca -0.11 0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.06 1wpm n GLY 210 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wpm n SER 211 N 9.73 0.81 -4.77 1.61 3.41 -1.26 -4.99 113.62 118.16 1wpm n SER 211 Ca 0.00 -0.71 -0.39 0.00 -0.26 0.00 0.00 58.87 57.50 1wpm n SER 211 Cb 0.00 0.78 -0.06 0.00 -0.26 0.00 0.00 64.21 64.67 1wpm n SER 211 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1wpm s LYS 212 N -3.02 4.39 -0.31 4.33 -0.14 -0.22 -5.03 119.74 119.74 1wpm s LYS 212 Ca 0.08 0.90 -0.20 0.00 -1.36 0.00 0.00 55.97 55.40 1wpm s LYS 212 Cb 0.16 -3.32 -0.01 0.00 -1.68 0.00 0.00 37.83 32.98 1wpm s LYS 212 CO 0.81 0.41 0.61 0.21 -0.76 0.00 0.00 175.35 176.63 1wpm s LYS 213 N -0.41 3.86 0.25 1.68 2.20 -1.26 -0.26 119.74 125.80 1wpm s LYS 213 Ca 0.34 0.22 0.09 0.00 -0.36 0.00 0.00 55.97 56.26 1wpm s LYS 213 Cb -0.20 -3.74 -0.05 0.00 -1.51 0.00 0.00 37.83 32.33 1wpm s LYS 213 CO 0.21 -0.58 -0.15 0.14 -0.36 0.00 0.00 175.35 174.61 1wpm s VAL 214 N 2.57 2.01 -0.02 4.02 -7.23 -0.45 -0.32 120.40 120.99 1wpm s VAL 214 Ca 0.24 -2.27 0.01 0.00 -1.81 0.00 0.00 61.98 58.16 1wpm s VAL 214 Cb -0.15 -2.24 0.01 0.00 0.56 0.00 0.00 36.38 34.57 1wpm s VAL 214 CO 0.12 -0.46 -0.03 -0.70 -0.31 0.00 0.00 175.10 173.72 1wpm s GLU 215 N -3.61 0.47 -0.11 4.82 2.12 -0.78 -1.68 118.70 119.92 1wpm s GLU 215 Ca 0.27 -0.09 -0.00 0.00 0.36 0.00 0.00 54.97 55.50 1wpm s GLU 215 Cb -0.01 -0.51 0.02 0.00 0.26 0.00 0.00 34.13 33.89 1wpm s GLU 215 CO 0.11 -0.00 -0.09 0.42 -0.54 0.00 0.00 175.26 175.16 1wpm s ILE 216 N 0.42 1.10 0.11 -3.70 1.01 0.18 -1.54 121.20 118.77 1wpm s ILE 216 Ca -0.05 -0.34 0.10 0.00 0.00 0.00 0.00 60.65 60.36 1wpm s ILE 216 Cb -0.08 -1.09 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 1wpm s ILE 216 CO -0.00 0.38 -0.22 0.00 0.00 0.00 0.00 174.94 175.09 1wpm s ALA 217 N 1.62 2.53 -0.01 9.38 0.00 -0.13 -1.27 121.76 133.88 1wpm s ALA 217 Ca 0.04 -1.37 0.05 0.00 0.00 0.00 0.00 51.96 50.67 1wpm s ALA 217 Cb -0.13 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.43 1wpm s ALA 217 CO -0.08 0.57 -0.15 -1.14 0.00 0.00 0.00 175.76 174.96 1wpm s GLN 218 N -1.96 1.19 -0.00 0.00 0.74 -0.20 -0.18 119.66 119.25 1wpm s GLN 218 Ca 0.16 -0.54 0.03 0.00 0.05 0.00 0.00 55.36 55.05 1wpm s GLN 218 Cb -0.10 -1.15 -0.01 0.00 1.10 0.00 0.00 33.01 32.85 1wpm s GLN 218 CO 0.07 0.32 -0.08 0.14 -0.55 0.00 0.00 175.29 175.19 1wpm s VAL 219 N -0.37 0.63 0.04 1.34 -7.23 -0.45 -4.30 120.40 110.06 1wpm s VAL 219 Ca 0.06 -0.42 -0.17 0.00 -1.81 0.00 0.00 61.98 59.64 1wpm s VAL 219 Cb -0.06 -0.55 -0.06 0.00 0.56 0.00 0.00 36.38 36.27 1wpm s VAL 219 CO -0.00 0.13 0.48 0.20 -0.31 0.00 0.00 175.10 175.59 1wpm s ASN 220 N -0.33 6.92 0.13 4.85 0.01 -1.26 -0.29 114.94 124.98 1wpm s ASN 220 Ca 0.02 1.09 -0.08 0.00 -0.71 0.00 0.00 52.86 53.18 1wpm s ASN 220 Cb -0.04 -2.30 -0.01 0.00 0.41 0.00 0.00 41.25 39.32 1wpm s ASN 220 CO -0.00 0.30 0.23 0.28 -1.51 0.00 0.00 177.10 176.39 1wpm s THR 221 N -1.10 0.10 -1.24 1.60 -1.32 0.90 -4.35 115.64 110.22 1wpm s THR 221 Ca 0.26 -1.36 0.12 0.00 -1.21 0.00 0.00 61.69 59.51 1wpm s THR 221 Cb -0.18 -1.67 0.02 0.00 -1.51 0.00 0.00 72.50 69.16 1wpm s THR 221 CO 0.16 -0.45 0.76 1.33 -2.21 0.00 0.00 174.62 174.21 1wpm n VAL 222 N -0.14 0.00 -3.54 5.08 0.24 -1.26 -1.49 118.33 117.22 1wpm n VAL 222 Ca -0.10 -0.40 -0.18 0.00 -2.04 0.00 0.00 64.34 61.61 1wpm n VAL 222 Cb 0.63 1.17 -0.14 0.00 -1.47 0.00 0.00 33.84 34.03 1wpm n VAL 222 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1wpm s ASP 223 N -1.45 1.31 0.18 -1.34 2.15 -1.26 -4.97 116.67 111.29 1wpm s ASP 223 Ca 0.11 -0.13 -0.09 0.00 0.43 0.00 0.00 52.55 52.87 1wpm s ASP 223 Cb 0.10 0.33 0.08 0.00 -0.30 0.00 0.00 42.92 43.14 1wpm s ASP 223 CO 0.28 -0.31 1.68 0.40 -0.17 0.00 0.00 175.17 177.04 1wpm h ILE 224 N 6.33 1.26 -0.04 4.11 2.04 -1.94 -2.93 117.51 126.34 1wpm h ILE 224 Ca -0.16 -1.04 0.01 0.00 1.00 0.00 0.00 64.86 64.67 1wpm h ILE 224 Cb 1.14 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1wpm h ILE 224 CO 0.25 0.39 0.06 -0.08 0.00 0.00 0.00 178.15 178.77 1wpm h GLU 225 N 0.99 0.00 -0.19 2.37 4.57 -1.98 -0.66 114.58 119.69 1wpm h GLU 225 Ca 0.20 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.17 1wpm h GLU 225 Cb 0.45 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.04 1wpm h GLU 225 CO 0.01 0.00 -0.69 -0.44 -1.18 0.00 0.00 179.01 176.72 1wpm h ASP 226 N 0.00 0.93 1.38 1.04 3.45 -1.95 -2.90 116.42 118.37 1wpm h ASP 226 Ca 0.02 -0.60 -0.11 0.00 0.43 0.00 0.00 57.03 56.76 1wpm h ASP 226 Cb 0.15 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 38.63 1wpm h ASP 226 CO -0.00 1.37 -0.64 1.62 -1.57 0.00 0.00 179.24 180.02 1wpm h VAL 227 N 0.54 0.82 0.00 -1.35 3.04 -1.31 -3.18 116.25 114.80 1wpm h VAL 227 Ca -0.03 -2.19 -0.04 0.00 -1.01 0.00 0.00 66.70 63.42 1wpm h VAL 227 Cb 1.31 2.37 -0.01 0.00 -2.01 0.00 0.00 31.29 32.96 1wpm h VAL 227 CO 0.15 0.47 -0.21 0.50 -1.01 0.00 0.00 177.57 177.46 1wpm h LYS 228 N 0.00 0.00 0.00 4.17 3.64 -1.21 -2.02 116.57 121.15 1wpm h LYS 228 Ca -0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1wpm h LYS 228 Cb 1.41 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.23 1wpm h LYS 228 CO 0.06 0.21 0.00 1.63 -2.27 0.00 0.00 179.45 179.08 1wpm n LYS 229 N -3.95 0.14 -0.66 1.90 5.02 -1.09 -2.15 118.16 117.36 1wpm n LYS 229 Ca -0.02 0.45 0.07 0.00 -2.02 0.00 0.00 58.31 56.79 1wpm n LYS 229 Cb 0.29 -1.80 0.32 0.00 -0.02 0.00 0.00 35.03 33.82 1wpm n LYS 229 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1wpm n ARG 230 N -2.06 3.68 -0.20 1.97 1.74 -0.76 -4.74 116.66 116.30 1wpm n ARG 230 Ca 0.01 -2.99 -0.01 0.00 -0.77 0.00 0.00 57.85 54.09 1wpm n ARG 230 Cb 0.16 -2.03 0.10 0.00 -1.02 0.00 0.00 32.46 29.67 1wpm n ARG 230 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 1wpm h GLN 231 N 2.65 0.42 -0.88 5.56 4.15 -1.54 0.63 115.11 126.10 1wpm h GLN 231 Ca 0.02 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.45 1wpm h GLN 231 Cb 1.71 -0.10 -0.05 0.00 0.21 0.00 0.00 27.48 29.25 1wpm h GLN 231 CO 0.36 0.28 0.57 0.00 -1.93 0.00 0.00 178.83 178.11 1wpm h ALA 232 N 1.38 1.15 -0.18 3.38 0.00 -1.86 0.33 119.26 123.46 1wpm h ALA 232 Ca 0.29 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 1wpm h ALA 232 Cb 0.32 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1wpm h ALA 232 CO -0.27 0.43 -0.56 0.93 0.00 0.00 0.00 179.25 179.78 1wpm h GLU 233 N 1.11 0.56 -0.41 0.00 3.07 -1.65 -2.28 114.58 114.97 1wpm h GLU 233 Ca 0.35 -0.35 -0.12 0.00 -0.50 0.00 0.00 59.36 58.73 1wpm h GLU 233 Cb -0.01 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.93 1wpm h GLU 233 CO -0.11 0.96 -0.21 -0.07 -1.40 0.00 0.00 179.01 178.18 1wpm h LEU 234 N 0.43 0.89 -1.68 1.33 3.38 -0.03 -2.69 115.31 116.94 1wpm h LEU 234 Ca 0.01 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.53 1wpm h LEU 234 Cb 1.10 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1wpm h LEU 234 CO 0.10 1.10 -0.17 -0.33 0.09 0.00 0.00 178.44 179.24 1wpm h GLU 235 N 0.68 0.00 -0.12 1.13 5.08 -0.26 -0.74 114.58 120.34 1wpm h GLU 235 Ca 0.09 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.29 1wpm h GLU 235 Cb 0.77 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.03 1wpm h GLU 235 CO 0.06 0.17 -0.56 0.00 -1.00 0.00 0.00 179.01 177.68 1wpm h ALA 236 N 1.83 0.23 -0.09 3.43 0.00 -1.15 -1.64 119.26 121.88 1wpm h ALA 236 Ca -0.00 -0.52 -0.18 0.00 0.00 0.00 0.00 54.91 54.21 1wpm h ALA 236 Cb 0.30 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1wpm h ALA 236 CO 0.02 0.46 -0.70 -0.39 0.00 0.00 0.00 179.25 178.63 1wpm h VAL 237 N 0.24 1.37 -0.21 0.00 -1.51 -1.21 -2.32 116.25 112.60 1wpm h VAL 237 Ca -0.03 -2.09 -0.04 0.00 -1.23 0.00 0.00 66.70 63.31 1wpm h VAL 237 Cb 1.20 2.07 -0.01 0.00 -2.13 0.00 0.00 31.29 32.42 1wpm h VAL 237 CO 0.12 0.63 -0.01 0.40 -1.23 0.00 0.00 177.57 177.47 1wpm h ILE 238 N 0.29 1.26 -0.98 7.19 2.04 -1.23 -2.41 117.51 123.67 1wpm h ILE 238 Ca -0.03 -0.92 0.08 0.00 1.00 0.00 0.00 64.86 64.99 1wpm h ILE 238 Cb 1.27 1.45 -0.07 0.00 -0.74 0.00 0.00 36.82 38.73 1wpm h ILE 238 CO 0.12 0.28 0.63 0.28 0.00 0.00 0.00 178.15 179.46 1wpm h SER 239 N 0.13 0.98 -0.01 1.72 0.02 -1.30 0.06 113.55 115.15 1wpm h SER 239 Ca 0.06 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1wpm h SER 239 Cb 0.43 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.78 1wpm h SER 239 CO 0.01 0.60 0.01 0.50 -1.14 0.00 0.00 176.83 176.81 1wpm h LYS 240 N 1.10 0.01 -0.57 3.45 3.64 -1.23 -1.99 116.57 120.99 1wpm h LYS 240 Ca 0.44 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.87 1wpm h LYS 240 Cb 0.25 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.02 1wpm h LYS 240 CO -0.20 0.06 0.29 0.28 -2.27 0.00 0.00 179.45 177.62 1wpm h VAL 241 N -0.04 0.95 -0.84 2.00 2.07 -0.90 0.06 116.25 119.55 1wpm h VAL 241 Ca 0.00 -0.19 0.08 0.00 0.82 0.00 0.00 66.70 67.41 1wpm h VAL 241 Cb 0.05 0.34 -0.07 0.00 -1.52 0.00 0.00 31.29 30.10 1wpm h VAL 241 CO -0.00 0.10 0.50 0.58 0.02 0.00 0.00 177.57 178.77 1wpm h VAL 242 N 0.56 0.96 -0.18 2.57 2.07 -0.87 -0.83 116.25 120.53 1wpm h VAL 242 Ca 0.25 -0.30 -0.16 0.00 0.82 0.00 0.00 66.70 67.32 1wpm h VAL 242 Cb 0.16 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 1wpm h VAL 242 CO -0.17 0.16 -0.51 0.00 0.02 0.00 0.00 177.57 177.07 1wpm h ALA 243 N 1.44 0.30 -0.10 1.67 0.00 -0.86 -0.70 119.26 121.01 1wpm h ALA 243 Ca 0.39 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1wpm h ALA 243 Cb 0.29 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1wpm h ALA 243 CO -0.22 0.48 -0.36 0.93 0.00 0.00 0.00 179.25 180.09 1wpm h GLU 244 N 0.34 0.19 -0.12 0.00 5.08 -0.34 -3.07 114.58 116.66 1wpm h GLU 244 Ca -0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1wpm h GLU 244 Cb 1.12 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1wpm h GLU 244 CO 0.11 0.53 0.00 1.63 -1.00 0.00 0.00 179.01 180.28 1wpm n LYS 245 N -4.08 1.44 -3.61 2.33 5.02 -0.38 -4.98 118.16 113.91 1wpm n LYS 245 Ca -0.01 -1.56 -0.22 0.00 -2.02 0.00 0.00 58.31 54.49 1wpm n LYS 245 Cb 0.43 -1.29 0.07 0.00 -0.02 0.00 0.00 35.03 34.22 1wpm n LYS 245 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1wpm n ASN 246 N 0.80 -3.79 -4.77 4.39 3.02 -0.90 -4.95 115.26 109.06 1wpm n ASN 246 Ca 0.10 -0.65 -0.38 0.00 -0.03 0.00 0.00 54.58 53.62 1wpm n ASN 246 Cb 0.39 -4.72 -0.05 0.00 -0.61 0.00 0.00 39.78 34.78 1wpm n ASN 246 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wpm s LEU 247 N -6.88 4.39 0.28 3.41 1.02 -0.32 -4.75 118.68 115.83 1wpm s LEU 247 Ca 0.30 2.03 0.18 0.00 0.02 0.00 0.00 54.13 56.66 1wpm s LEU 247 Cb -0.14 -3.90 0.10 0.00 0.02 0.00 0.00 46.19 42.28 1wpm s LEU 247 CO 0.76 -0.18 1.36 0.44 0.02 0.00 0.00 176.35 178.75 1wpm h ASP 248 N 3.30 0.00 -3.12 2.29 3.32 -1.00 -3.43 116.42 117.77 1wpm h ASP 248 Ca -0.47 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.58 1wpm h ASP 248 Cb 1.21 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.54 1wpm h ASP 248 CO 0.65 0.32 -0.02 -0.22 -1.72 0.00 0.00 179.24 178.25 1wpm s LEU 249 N -6.17 -0.79 -0.11 1.55 2.96 -1.17 -1.11 118.68 113.84 1wpm s LEU 249 Ca 0.03 1.42 0.03 0.00 -0.22 0.00 0.00 54.13 55.39 1wpm s LEU 249 Cb 0.07 2.24 -0.00 0.00 0.50 0.00 0.00 46.19 49.00 1wpm s LEU 249 CO 0.74 -0.23 -0.22 0.12 -1.32 0.00 0.00 176.35 175.44 1wpm s PHE 250 N 1.49 2.62 -0.16 5.38 2.19 0.17 -1.86 117.98 127.80 1wpm s PHE 250 Ca -0.09 -0.97 0.00 0.00 0.33 0.00 0.00 56.93 56.20 1wpm s PHE 250 Cb -0.05 -1.74 0.03 0.00 -1.31 0.00 0.00 43.02 39.95 1wpm s PHE 250 CO -0.17 -0.38 -0.10 -1.17 1.83 0.00 0.00 175.22 175.23 1wpm s LEU 251 N 0.35 1.77 -0.20 6.12 2.96 -0.59 -1.26 118.68 127.84 1wpm s LEU 251 Ca -0.17 -0.61 -0.14 0.00 -0.22 0.00 0.00 54.13 52.99 1wpm s LEU 251 Cb -0.18 -1.09 -0.04 0.00 0.50 0.00 0.00 46.19 45.38 1wpm s LEU 251 CO 0.08 -0.12 0.30 -0.22 -1.32 0.00 0.00 176.35 175.07 1wpm s LEU 252 N 1.52 4.17 -0.38 -0.68 2.96 -0.23 -0.96 118.68 125.09 1wpm s LEU 252 Ca 0.02 0.40 -0.11 0.00 -0.22 0.00 0.00 54.13 54.22 1wpm s LEU 252 Cb -0.14 -2.36 0.03 0.00 0.50 0.00 0.00 46.19 44.22 1wpm s LEU 252 CO -0.09 0.02 0.21 -0.69 -1.32 0.00 0.00 176.35 174.48 1wpm s VAL 253 N 0.98 4.62 -0.47 1.68 1.01 0.75 -0.89 120.40 128.09 1wpm s VAL 253 Ca 0.15 -0.84 -0.16 0.00 0.00 0.00 0.00 61.98 61.13 1wpm s VAL 253 Cb -0.14 -3.58 0.06 0.00 0.00 0.00 0.00 36.38 32.72 1wpm s VAL 253 CO 0.06 -0.24 0.43 -0.63 0.00 0.00 0.00 175.10 174.72 1wpm s ILE 254 N 1.56 5.15 -0.28 2.22 1.01 0.44 -1.34 121.20 129.96 1wpm s ILE 254 Ca 0.02 -0.82 -0.12 0.00 0.00 0.00 0.00 60.65 59.73 1wpm s ILE 254 Cb -0.19 -4.13 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 1wpm s ILE 254 CO 0.07 -0.57 0.26 -0.89 0.00 0.00 0.00 174.94 173.80 1wpm s THR 255 N 1.90 5.26 -0.62 2.92 2.01 0.60 -0.41 115.64 127.30 1wpm s THR 255 Ca 0.07 0.29 -0.28 0.00 0.31 0.00 0.00 61.69 62.08 1wpm s THR 255 Cb -0.22 -3.60 0.02 0.00 0.01 0.00 0.00 72.50 68.72 1wpm s THR 255 CO 0.09 0.20 1.34 -0.62 -0.69 0.00 0.00 174.62 174.94 1wpm s ASP 256 N 1.72 6.19 0.09 3.53 -1.08 0.41 -0.07 116.67 127.45 1wpm s ASP 256 Ca 0.10 0.04 0.14 0.00 -0.52 0.00 0.00 52.55 52.30 1wpm s ASP 256 Cb -0.16 -2.55 0.61 0.00 -1.46 0.00 0.00 42.92 39.36 1wpm s ASP 256 CO 0.11 -1.71 1.43 2.30 0.52 0.00 0.00 175.17 177.82 1wpm n ILE 257 N 6.69 1.19 -0.12 4.11 -5.35 -0.55 -1.28 119.36 124.05 1wpm n ILE 257 Ca 0.09 0.35 -0.25 0.00 -0.27 0.00 0.00 62.75 62.67 1wpm n ILE 257 Cb 0.49 -1.22 -0.10 0.00 -1.74 0.00 0.00 39.64 37.07 1wpm n ILE 257 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1wpm n LEU 258 N -1.73 1.92 -0.01 7.28 4.77 -1.26 -4.52 117.00 123.45 1wpm n LEU 258 Ca 0.02 0.38 0.14 0.00 -0.03 0.00 0.00 56.01 56.52 1wpm n LEU 258 Cb 0.13 -0.87 0.64 0.00 -2.33 0.00 0.00 43.42 41.00 1wpm n LEU 258 CO 0.11 0.39 0.95 -0.62 -1.33 0.00 0.00 177.39 176.89 1wpm n GLU 259 N -4.34 0.17 -2.94 3.23 -0.58 -1.15 -4.92 120.64 110.12 1wpm n GLU 259 Ca -0.43 -0.01 -0.22 0.00 -0.42 0.00 0.00 57.16 56.08 1wpm n GLU 259 Cb 0.78 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 30.18 1wpm n GLU 259 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1wpm n ASN 260 N -1.40 -6.01 -4.43 1.62 4.05 -0.40 -4.86 115.26 103.83 1wpm n ASN 260 Ca 0.10 -0.26 -0.25 0.00 0.45 0.00 0.00 54.58 54.62 1wpm n ASN 260 Cb 0.31 -4.84 -0.11 0.00 1.23 0.00 0.00 39.78 36.37 1wpm n ASN 260 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 1wpm s ASP 261 N -2.66 3.37 -0.00 1.20 -0.00 -1.22 -2.68 116.67 114.67 1wpm s ASP 261 Ca 0.27 -0.94 0.04 0.00 -0.00 0.00 0.00 52.55 51.93 1wpm s ASP 261 Cb -0.12 -0.26 -0.01 0.00 -0.00 0.00 0.00 42.92 42.53 1wpm s ASP 261 CO 0.33 0.06 -0.14 -0.44 -0.00 0.00 0.00 175.17 174.98 1wpm s SER 262 N -3.02 1.65 -0.25 0.27 0.01 -0.68 -0.44 113.70 111.24 1wpm s SER 262 Ca 0.24 -0.28 -0.17 0.00 1.31 0.00 0.00 55.95 57.04 1wpm s SER 262 Cb -0.06 -0.17 -0.03 0.00 0.21 0.00 0.00 66.02 65.97 1wpm s SER 262 CO 0.11 0.15 0.49 -0.22 0.41 0.00 0.00 173.24 174.19 1wpm s LEU 263 N -0.45 4.06 0.19 2.44 0.20 0.45 0.11 118.68 125.68 1wpm s LEU 263 Ca 0.05 0.51 -0.19 0.00 0.69 0.00 0.00 54.13 55.19 1wpm s LEU 263 Cb -0.06 -2.63 -0.08 0.00 -0.43 0.00 0.00 46.19 42.99 1wpm s LEU 263 CO -0.00 -0.25 0.67 0.00 -0.29 0.00 0.00 176.35 176.48 1wpm s ALA 264 N 2.16 3.47 -0.18 5.97 0.00 0.17 -0.42 121.76 132.91 1wpm s ALA 264 Ca 0.21 0.10 -0.00 0.00 0.00 0.00 0.00 51.96 52.26 1wpm s ALA 264 Cb -0.16 -2.74 0.04 0.00 0.00 0.00 0.00 23.12 20.26 1wpm s ALA 264 CO 0.09 0.36 -0.06 -1.17 0.00 0.00 0.00 175.76 174.98 1wpm s LEU 265 N -1.86 1.91 -0.13 0.00 2.96 -0.07 -2.62 118.68 118.87 1wpm s LEU 265 Ca 0.40 -0.80 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 1wpm s LEU 265 Cb -0.17 -1.03 -0.01 0.00 0.50 0.00 0.00 46.19 45.49 1wpm s LEU 265 CO 0.21 -0.18 -0.16 0.00 -1.32 0.00 0.00 176.35 174.89 1wpm s ALA 266 N 1.54 2.48 -0.02 5.97 0.00 -0.46 -1.07 121.76 130.21 1wpm s ALA 266 Ca -0.01 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 51.01 1wpm s ALA 266 Cb -0.16 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.82 1wpm s ALA 266 CO -0.08 0.14 -0.09 0.42 0.00 0.00 0.00 175.76 176.15 1wpm s ILE 267 N 0.54 0.79 0.00 0.00 -1.09 -0.39 -4.83 121.20 116.22 1wpm s ILE 267 Ca -0.10 -0.37 0.00 0.00 -2.23 0.00 0.00 60.65 57.94 1wpm s ILE 267 Cb -0.16 -0.69 0.00 0.00 -1.58 0.00 0.00 42.46 40.03 1wpm s ILE 267 CO 0.04 0.24 0.00 0.61 -1.23 0.00 0.00 174.94 174.60 1wpm n GLY 268 N 3.20 3.02 0.36 6.18 0.00 -1.26 -0.65 105.19 116.04 1wpm n GLY 268 Ca -0.17 -1.94 0.14 0.00 0.00 0.00 0.00 46.02 44.05 1wpm n GLY 268 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1wpm h ASN 269 N 0.00 0.26 -0.52 1.61 -0.26 -1.70 -2.29 115.58 112.68 1wpm h ASN 269 Ca 0.00 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 1wpm h ASN 269 Cb 0.00 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.21 1wpm h ASN 269 CO 0.00 0.15 0.00 -0.62 -1.06 0.00 0.00 177.43 175.90 1wpm n GLU 270 N -4.45 4.35 -0.06 0.81 -0.58 -0.27 -4.53 120.64 115.91 1wpm n GLU 270 Ca 0.10 -2.78 0.14 0.00 -0.42 0.00 0.00 57.16 54.20 1wpm n GLU 270 Cb 0.43 -2.14 0.55 0.00 -0.57 0.00 0.00 31.44 29.71 1wpm n GLU 270 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wpm h ALA 271 N 3.83 2.15 0.00 0.62 0.00 -1.63 -0.21 119.26 124.03 1wpm h ALA 271 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wpm h ALA 271 Cb 1.76 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.50 1wpm h ALA 271 CO 0.41 -0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1wpm h ALA 272 N 1.71 1.00 0.00 0.00 0.00 -1.86 -2.69 119.26 117.42 1wpm h ALA 272 Ca 0.28 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1wpm h ALA 272 Cb 0.70 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1wpm h ALA 272 CO -0.06 0.00 -0.07 0.87 0.00 0.00 0.00 179.25 179.99 1wpm h LYS 273 N 0.00 0.00 -0.26 0.00 1.79 -1.38 -1.87 116.57 114.85 1wpm h LYS 273 Ca 0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 1wpm h LYS 273 Cb 0.35 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.99 1wpm h LYS 273 CO 0.00 0.07 -0.04 0.28 -1.08 0.00 0.00 179.45 178.68 1wpm h VAL 274 N 0.00 1.18 -0.17 0.50 2.07 -1.62 0.13 116.25 118.34 1wpm h VAL 274 Ca -0.00 -0.75 -0.03 0.00 0.82 0.00 0.00 66.70 66.74 1wpm h VAL 274 Cb 0.51 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1wpm h VAL 274 CO 0.01 0.25 0.00 -0.33 0.02 0.00 0.00 177.57 177.52 1wpm h GLU 275 N 0.38 0.30 -0.53 1.57 5.08 -1.49 -1.77 114.58 118.12 1wpm h GLU 275 Ca 0.08 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1wpm h GLU 275 Cb 0.33 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1wpm h GLU 275 CO 0.01 0.51 0.12 -0.22 -1.00 0.00 0.00 179.01 178.43 1wpm h LYS 276 N 0.06 0.86 -0.34 2.33 3.64 -1.43 0.10 116.57 121.79 1wpm h LYS 276 Ca 0.05 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 59.14 1wpm h LYS 276 Cb 0.37 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1wpm h LYS 276 CO 0.01 0.82 -0.09 0.00 -2.27 0.00 0.00 179.45 177.92 1wpm h ALA 277 N 1.00 1.21 -0.15 5.00 0.00 -0.63 -3.17 119.26 122.53 1wpm h ALA 277 Ca 0.17 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1wpm h ALA 277 Cb 0.36 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1wpm h ALA 277 CO 0.00 0.51 0.00 1.19 0.00 0.00 0.00 179.25 180.95 1wpm n PHE 278 N -4.21 0.19 -4.00 0.00 3.01 -0.67 -4.84 117.46 106.94 1wpm n PHE 278 Ca 0.01 -0.28 -0.30 0.00 1.01 0.00 0.00 57.45 57.89 1wpm n PHE 278 Cb 0.32 -0.02 -0.02 0.00 -0.01 0.00 0.00 39.48 39.75 1wpm n PHE 278 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1wpm n ASN 279 N 0.33 -1.28 -4.32 4.37 4.05 -0.08 -5.00 115.26 113.34 1wpm n ASN 279 Ca 0.07 -1.10 -0.28 0.00 0.45 0.00 0.00 54.58 53.72 1wpm n ASN 279 Cb 0.30 -2.65 -0.08 0.00 1.23 0.00 0.00 39.78 38.58 1wpm n ASN 279 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1wpm s VAL 280 N -3.92 0.80 -0.10 3.44 -7.23 -0.62 -5.04 120.40 107.73 1wpm s VAL 280 Ca 0.13 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.33 1wpm s VAL 280 Cb -0.06 -2.31 0.01 0.00 0.56 0.00 0.00 36.38 34.58 1wpm s VAL 280 CO 0.92 0.00 -0.18 -0.89 -0.31 0.00 0.00 175.10 174.64 1wpm s THR 281 N -3.10 1.66 -0.01 5.32 2.01 -1.26 -4.52 115.64 115.74 1wpm s THR 281 Ca 0.19 -0.76 -0.30 0.00 0.31 0.00 0.00 61.69 61.13 1wpm s THR 281 Cb 0.02 -1.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.01 1wpm s THR 281 CO 0.11 0.47 1.17 -0.76 -0.69 0.00 0.00 174.62 174.92 1wpm s LEU 282 N 0.76 4.32 -0.21 4.42 1.43 -1.26 -4.61 118.68 123.52 1wpm s LEU 282 Ca -0.11 1.86 0.02 0.00 -1.03 0.00 0.00 54.13 54.87 1wpm s LEU 282 Cb -0.16 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.53 1wpm s LEU 282 CO 0.02 -0.50 -0.14 -1.61 0.23 0.00 0.00 176.35 174.34 1wpm s GLU 283 N 1.66 2.47 -1.34 1.70 2.02 0.35 -4.71 118.70 120.84 1wpm s GLU 283 Ca 0.56 -1.00 -0.01 0.00 0.02 0.00 0.00 54.97 54.53 1wpm s GLU 283 Cb -0.26 -2.63 0.01 0.00 0.10 0.00 0.00 34.13 31.36 1wpm s GLU 283 CO 0.25 -0.39 0.69 -1.71 0.02 0.00 0.00 175.26 174.12 1wpm n ASN 284 N 4.58 -1.40 0.00 -0.19 4.05 -1.26 -1.99 115.26 119.05 1wpm n ASN 284 Ca -0.17 -0.84 0.00 0.00 0.45 0.00 0.00 54.58 54.02 1wpm n ASN 284 Cb 0.46 -3.89 0.00 0.00 1.23 0.00 0.00 39.78 37.58 1wpm n ASN 284 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1wpm n ASN 285 N -3.02 -3.69 -4.27 1.20 3.02 -1.26 -4.99 115.26 102.25 1wpm n ASN 285 Ca -0.27 0.00 -0.17 0.00 -0.03 0.00 0.00 54.58 54.12 1wpm n ASN 285 Cb 0.66 -2.15 -0.10 0.00 -0.61 0.00 0.00 39.78 37.58 1wpm n ASN 285 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1wpm s THR 286 N -1.57 1.35 -0.27 3.41 -4.23 -0.84 -1.35 115.64 112.13 1wpm s THR 286 Ca 0.00 -1.95 -0.24 0.00 -1.18 0.00 0.00 61.69 58.32 1wpm s THR 286 Cb 0.00 -1.75 0.08 0.00 1.34 0.00 0.00 72.50 72.16 1wpm s THR 286 CO 0.00 -0.58 0.75 0.00 -0.54 0.00 0.00 174.62 174.25 1wpm s ALA 287 N -2.76 -1.81 0.04 3.99 0.00 -1.08 -0.49 121.76 119.66 1wpm s ALA 287 Ca 0.15 2.05 -0.30 0.00 0.00 0.00 0.00 51.96 53.85 1wpm s ALA 287 Cb -0.01 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.83 1wpm s ALA 287 CO 0.03 -0.33 1.04 -1.17 0.00 0.00 0.00 175.76 175.32 1wpm s LEU 288 N 0.48 4.40 -0.52 0.00 2.96 -1.26 -0.66 118.68 124.08 1wpm s LEU 288 Ca -0.01 1.79 -0.08 0.00 -0.22 0.00 0.00 54.13 55.61 1wpm s LEU 288 Cb -0.05 -3.58 0.13 0.00 0.50 0.00 0.00 46.19 43.20 1wpm s LEU 288 CO -0.02 -0.27 0.38 -0.76 -1.32 0.00 0.00 176.35 174.36 1wpm s LEU 289 N 0.77 5.70 0.03 -0.68 1.43 0.31 -4.93 118.68 121.31 1wpm s LEU 289 Ca 0.53 -2.12 -0.30 0.00 -1.03 0.00 0.00 54.13 51.20 1wpm s LEU 289 Cb -0.24 -1.99 -0.06 0.00 0.03 0.00 0.00 46.19 43.93 1wpm s LEU 289 CO 0.29 -0.63 1.38 -0.54 0.23 0.00 0.00 176.35 177.08 1wpm s LYS 290 N 1.05 4.31 0.00 1.70 1.02 -1.26 -1.68 119.74 124.88 1wpm s LYS 290 Ca 0.08 1.97 0.00 0.00 0.02 0.00 0.00 55.97 58.04 1wpm s LYS 290 Cb -0.24 -3.48 0.00 0.00 -0.52 0.00 0.00 37.83 33.59 1wpm s LYS 290 CO -0.02 -0.51 0.00 0.41 -0.92 0.00 0.00 175.35 174.31 1wpm n GLY 291 N 3.57 1.25 3.64 -3.33 0.00 -1.09 -4.96 105.19 104.27 1wpm n GLY 291 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1wpm n GLY 291 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wpm s VAL 292 N -3.16 4.92 0.00 1.61 1.01 -1.10 -4.81 120.40 118.88 1wpm s VAL 292 Ca 0.00 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.33 1wpm s VAL 292 Cb 0.00 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.36 1wpm s VAL 292 CO 0.00 -0.01 0.00 0.52 0.00 0.00 0.00 175.10 175.61 1wpm n VAL 293 N 5.16 0.00 -3.76 2.92 0.31 -1.26 -3.44 118.33 118.25 1wpm n VAL 293 Ca 0.02 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 63.98 1wpm n VAL 293 Cb 0.48 -0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.28 1wpm n VAL 293 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1wpm s SER 294 N -0.51 5.10 0.07 4.52 0.15 -1.26 -4.99 113.70 116.78 1wpm s SER 294 Ca 0.00 -0.35 -0.28 0.00 0.70 0.00 0.00 55.95 56.02 1wpm s SER 294 Cb 0.00 -1.91 -0.17 0.00 -1.71 0.00 0.00 66.02 62.23 1wpm s SER 294 CO 0.00 -0.08 1.61 -0.09 1.20 0.00 0.00 173.24 175.88 1wpm h ARG 295 N 8.24 -0.45 -0.09 5.44 2.43 -1.97 -0.04 114.38 127.95 1wpm h ARG 295 Ca -0.37 0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 58.75 1wpm h ARG 295 Cb 1.16 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 1wpm h ARG 295 CO 0.59 -0.26 -0.32 1.57 -1.51 0.00 0.00 179.97 180.04 1wpm h LYS 296 N -0.52 0.17 0.00 0.20 2.10 -1.96 0.27 116.57 116.83 1wpm h LYS 296 Ca -0.05 -0.06 -0.35 0.00 -2.00 0.00 0.00 60.65 58.19 1wpm h LYS 296 Cb 0.39 -0.01 -0.06 0.00 -0.90 0.00 0.00 32.23 31.65 1wpm h LYS 296 CO 0.08 0.48 -2.33 1.17 -2.00 0.00 0.00 179.45 176.84 1wpm n LYS 297 N -4.11 0.66 0.00 0.07 4.81 -1.23 -4.42 118.16 113.94 1wpm n LYS 297 Ca -0.01 0.11 0.06 0.00 -0.87 0.00 0.00 58.31 57.59 1wpm n LYS 297 Cb 0.40 -1.47 -0.05 0.00 0.02 0.00 0.00 35.03 33.93 1wpm n LYS 297 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1wpm n GLN 298 N -3.10 2.85 0.00 1.64 6.02 -0.08 -4.63 117.38 120.08 1wpm n GLN 298 Ca -0.40 -0.19 -0.02 0.00 -0.01 0.00 0.00 57.00 56.38 1wpm n GLN 298 Cb 0.97 -1.07 -0.01 0.00 1.02 0.00 0.00 30.24 31.15 1wpm n GLN 298 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1wpm n VAL 299 N -0.97 0.93 -0.18 5.09 0.31 -0.87 -4.68 118.33 117.95 1wpm n VAL 299 Ca 0.03 0.27 -0.01 0.00 -0.01 0.00 0.00 64.34 64.62 1wpm n VAL 299 Cb 0.20 -1.65 0.07 0.00 -0.91 0.00 0.00 33.84 31.54 1wpm n VAL 299 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1wpm h VAL 300 N -0.25 0.52 -0.06 2.52 2.07 -1.19 -1.85 116.25 118.01 1wpm h VAL 300 Ca 0.00 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1wpm h VAL 300 Cb 0.25 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1wpm h VAL 300 CO 0.00 0.01 0.03 -0.65 0.02 0.00 0.00 177.57 176.98 1wpm h PRO 301 N 0.07 0.09 -0.29 1.57 0.11 -1.82 -0.65 132.00 131.07 1wpm h PRO 301 Ca 0.27 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.29 1wpm h PRO 301 Cb 0.43 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 1wpm h PRO 301 CO -0.50 0.19 -0.14 -0.39 -0.21 0.00 0.00 178.00 176.96 1wpm h VAL 302 N -0.04 1.24 -0.53 3.15 -1.51 -1.81 -2.20 116.25 114.55 1wpm h VAL 302 Ca 0.02 -1.06 -0.07 0.00 -1.23 0.00 0.00 66.70 64.35 1wpm h VAL 302 Cb 0.14 1.17 -0.02 0.00 -2.13 0.00 0.00 31.29 30.45 1wpm h VAL 302 CO -0.00 0.35 0.05 -0.07 -1.23 0.00 0.00 177.57 176.67 1wpm h LEU 303 N 0.47 0.88 -0.55 4.19 3.38 -1.31 -0.93 115.31 121.43 1wpm h LEU 303 Ca 0.08 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.82 1wpm h LEU 303 Cb 0.53 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 1wpm h LEU 303 CO 0.03 0.94 0.28 0.74 0.09 0.00 0.00 178.44 180.52 1wpm h THR 304 N 0.79 0.94 -0.34 0.22 2.02 -0.81 -0.77 112.91 114.95 1wpm h THR 304 Ca 0.16 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1wpm h THR 304 Cb 0.46 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1wpm h THR 304 CO 0.02 0.10 0.12 0.44 0.37 0.00 0.00 175.52 176.57 1wpm h ASP 305 N 0.53 0.48 0.30 4.18 3.45 -1.20 -2.36 116.42 121.80 1wpm h ASP 305 Ca 0.25 -0.18 -0.05 0.00 0.43 0.00 0.00 57.03 57.47 1wpm h ASP 305 Cb 0.16 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.80 1wpm h ASP 305 CO -0.17 0.54 -0.25 0.00 -1.57 0.00 0.00 179.24 177.79 1wpm h ALA 306 N 0.96 1.50 0.00 3.45 0.00 -0.95 -2.98 119.26 121.25 1wpm h ALA 306 Ca 0.11 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1wpm h ALA 306 Cb 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1wpm h ALA 306 CO -0.01 0.31 -0.94 -1.33 0.00 0.00 0.00 179.25 177.28 1wpm n MET 307 N -4.11 0.26 0.00 0.00 2.81 -0.32 -4.93 117.12 110.83 1wpm n MET 307 Ca -0.02 0.01 0.04 0.00 -1.81 0.00 0.00 57.70 55.92 1wpm n MET 307 Cb 0.31 -1.60 0.25 0.00 -0.71 0.00 0.00 33.22 31.47 1wpm n MET 307 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48