#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3khu s PHE 2 N 0.00 3.36 -0.13 3.17 5.36 -1.26 -5.02 117.98 123.47 3khu s PHE 2 Ca 0.00 1.29 0.01 0.00 -0.96 0.00 0.00 56.93 57.28 3khu s PHE 2 Cb 0.00 -3.50 0.02 0.00 -0.34 0.00 0.00 43.02 39.20 3khu s PHE 2 CO 0.00 -1.53 -0.15 -2.00 -1.46 0.00 0.00 175.22 170.08 3khu s GLU 3 N 0.19 2.30 -0.22 10.12 2.12 -1.26 -4.63 118.70 127.32 3khu s GLU 3 Ca 0.56 -0.58 -0.26 0.00 0.36 0.00 0.00 54.97 55.05 3khu s GLU 3 Cb -0.34 -2.01 -0.00 0.00 0.26 0.00 0.00 34.13 32.05 3khu s GLU 3 CO 0.35 -0.12 0.91 0.42 -0.54 0.00 0.00 175.26 176.28 3khu s ILE 4 N 1.16 4.79 -0.01 -3.70 1.01 -1.26 -4.89 121.20 118.30 3khu s ILE 4 Ca -0.02 1.76 0.04 0.00 0.00 0.00 0.00 60.65 62.42 3khu s ILE 4 Cb -0.14 -4.20 -0.05 0.00 0.01 0.00 0.00 42.46 38.08 3khu s ILE 4 CO -0.05 -0.09 0.07 0.29 0.00 0.00 0.00 174.94 175.16 3khu n LYS 5 N 5.93 0.35 -4.26 2.79 5.02 -1.26 -4.88 118.16 121.86 3khu n LYS 5 Ca 0.08 -0.03 -0.21 0.00 -2.02 0.00 0.00 58.31 56.13 3khu n LYS 5 Cb 0.47 -1.09 -0.16 0.00 -0.02 0.00 0.00 35.03 34.23 3khu n LYS 5 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3khu s LYS 6 N -2.24 1.01 -0.08 1.97 1.02 -1.26 -1.10 119.74 119.06 3khu s LYS 6 Ca -0.01 -0.17 0.03 0.00 0.02 0.00 0.00 55.97 55.84 3khu s LYS 6 Cb 0.02 -0.95 0.00 0.00 -0.52 0.00 0.00 37.83 36.39 3khu s LYS 6 CO 0.15 -0.05 -0.18 0.42 -0.92 0.00 0.00 175.35 174.76 3khu s ILE 7 N 0.84 1.60 -0.10 2.17 1.01 0.62 -0.77 121.20 126.56 3khu s ILE 7 Ca -0.12 -0.76 -0.00 0.00 0.00 0.00 0.00 60.65 59.76 3khu s ILE 7 Cb -0.15 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 3khu s ILE 7 CO 0.01 0.46 -0.08 0.00 0.00 0.00 0.00 174.94 175.33 3khu s ILE 10 N 1.16 4.22 0.00 0.00 1.01 0.46 -1.25 121.20 126.80 3khu s ILE 10 Ca -0.08 1.01 0.00 0.00 0.00 0.00 0.00 60.65 61.58 3khu s ILE 10 Cb -0.20 -4.60 0.00 0.00 0.01 0.00 0.00 42.46 37.68 3khu s ILE 10 CO -0.05 -1.06 0.00 0.61 0.00 0.00 0.00 174.94 174.44 3khu n GLY 11 N 4.93 2.31 2.75 6.18 0.00 0.26 -0.28 105.19 121.33 3khu n GLY 11 Ca 0.10 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.83 3khu n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3khu n ALA 12 N 0.34 6.21 -1.98 4.61 0.00 -1.20 -4.16 120.51 124.33 3khu n ALA 12 Ca 0.00 -4.07 0.00 0.00 0.00 0.00 0.00 53.44 49.37 3khu n ALA 12 Cb 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 19.45 17.78 3khu n ALA 12 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3khu n GLY 13 N -0.58 1.88 0.23 0.00 0.00 -1.26 -4.54 105.19 100.91 3khu n GLY 13 Ca 0.52 -1.95 0.03 0.00 0.00 0.00 0.00 46.02 44.62 3khu n GLY 13 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3khu h TYR 14 N 0.00 0.17 0.00 1.61 3.20 -1.93 -2.85 116.97 117.17 3khu h TYR 14 Ca 0.00 -0.02 -0.19 0.00 3.14 0.00 0.00 58.73 61.66 3khu h TYR 14 Cb 0.00 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 3khu h TYR 14 CO 0.00 0.33 -1.14 0.28 -1.64 0.00 0.00 178.16 175.99 3khu n VAL 15 N -4.27 1.51 -0.04 1.81 0.31 -1.26 -4.45 118.33 111.94 3khu n VAL 15 Ca -0.01 0.02 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 3khu n VAL 15 Cb 0.27 -2.12 -0.04 0.00 -0.91 0.00 0.00 33.84 31.04 3khu n VAL 15 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3khu h GLY 16 N -1.00 0.25 0.80 2.92 0.00 -1.72 -2.52 103.07 101.80 3khu h GLY 16 Ca -0.28 -0.11 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 3khu h GLY 16 CO -0.17 0.10 -0.17 -1.33 0.00 0.00 0.00 176.54 174.97 3khu h GLY 17 N 0.20 -0.49 0.98 4.60 0.00 -1.67 -1.17 103.07 105.52 3khu h GLY 17 Ca 0.06 0.18 -0.05 0.00 0.00 0.00 0.00 47.33 47.52 3khu h GLY 17 CO -0.01 -0.18 0.11 -2.55 0.00 0.00 0.00 176.54 173.91 3khu h PRO 18 N -0.68 0.80 -0.12 4.80 0.11 -1.76 -0.30 132.00 134.85 3khu h PRO 18 Ca -0.05 -0.20 -0.00 0.00 0.11 0.00 0.00 66.00 65.86 3khu h PRO 18 Cb 0.48 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 3khu h PRO 18 CO 0.08 0.78 0.06 1.15 -0.21 0.00 0.00 178.00 179.86 3khu h THR 19 N 0.68 1.11 -0.01 -1.15 2.02 -1.42 -1.33 112.91 112.82 3khu h THR 19 Ca 0.15 -0.32 -0.11 0.00 0.77 0.00 0.00 66.41 66.90 3khu h THR 19 Cb 0.35 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 3khu h THR 19 CO 0.00 0.10 -0.51 0.00 0.37 0.00 0.00 175.52 175.49 3khu h SER 21 N 0.01 0.76 -0.50 0.00 0.02 -0.83 -0.93 113.55 112.08 3khu h SER 21 Ca -0.00 -0.22 -0.12 0.00 -0.84 0.00 0.00 61.79 60.61 3khu h SER 21 Cb 0.90 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 3khu h SER 21 CO 0.07 0.77 -0.16 0.58 -1.14 0.00 0.00 176.83 176.95 3khu h VAL 22 N 0.70 1.27 -0.10 2.27 2.07 -0.96 -1.67 116.25 119.84 3khu h VAL 22 Ca 0.16 -1.32 0.03 0.00 0.82 0.00 0.00 66.70 66.39 3khu h VAL 22 Cb 0.29 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3khu h VAL 22 CO -0.00 0.46 -0.09 0.40 0.02 0.00 0.00 177.57 178.36 3khu h ILE 23 N 0.88 0.74 -0.61 4.57 2.04 -1.05 -1.09 117.51 122.99 3khu h ILE 23 Ca 0.13 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.05 3khu h ILE 23 Cb 0.73 0.74 -0.06 0.00 -0.74 0.00 0.00 36.82 37.49 3khu h ILE 23 CO 0.06 0.00 0.30 0.00 0.00 0.00 0.00 178.15 178.51 3khu h ALA 24 N 0.97 0.80 -0.52 1.87 0.00 -1.07 0.40 119.26 121.71 3khu h ALA 24 Ca 0.07 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3khu h ALA 24 Cb 0.21 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3khu h ALA 24 CO -0.17 -0.05 0.26 1.25 0.00 0.00 0.00 179.25 180.54 3khu h HIS 25 N 0.56 0.71 0.00 0.00 -0.00 -0.97 -2.95 115.15 112.50 3khu h HIS 25 Ca 0.28 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.64 3khu h HIS 25 Cb 0.23 -0.23 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 3khu h HIS 25 CO -0.11 0.52 -0.91 -1.33 -0.00 0.00 0.00 177.93 176.11 3khu n MET 26 N -4.38 0.32 -3.63 5.26 2.81 -0.44 -4.54 117.12 112.50 3khu n MET 26 Ca 0.04 0.03 -0.27 0.00 -1.81 0.00 0.00 57.70 55.69 3khu n MET 26 Cb 0.12 -1.64 -0.11 0.00 -0.71 0.00 0.00 33.22 30.88 3khu n MET 26 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3khu h PRO 28 N 5.22 0.00 -0.01 0.00 0.11 -1.80 -2.09 132.00 133.43 3khu h PRO 28 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3khu h PRO 28 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 3khu h PRO 28 CO 0.60 0.00 -0.13 -0.85 -0.21 0.00 0.00 178.00 177.42 3khu n GLU 29 N -3.91 1.11 -3.87 1.05 0.00 -1.26 -4.79 120.64 108.96 3khu n GLU 29 Ca -0.01 -0.58 -0.35 0.00 0.00 0.00 0.00 57.16 56.21 3khu n GLU 29 Cb 0.17 -1.49 -0.10 0.00 0.00 0.00 0.00 31.44 30.02 3khu n GLU 29 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 3khu s ILE 30 N -2.30 4.93 -0.15 3.84 1.01 -0.79 -4.92 121.20 122.83 3khu s ILE 30 Ca 0.31 0.02 -0.26 0.00 0.00 0.00 0.00 60.65 60.72 3khu s ILE 30 Cb 0.20 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.40 3khu s ILE 30 CO 0.44 0.42 0.86 -0.60 0.00 0.00 0.00 174.94 176.06 3khu s ARG 31 N 0.66 4.34 -0.20 2.79 3.52 -0.26 -4.84 118.95 124.95 3khu s ARG 31 Ca 0.05 1.10 0.01 0.00 -0.13 0.00 0.00 55.73 56.76 3khu s ARG 31 Cb -0.13 -3.56 0.03 0.00 -1.56 0.00 0.00 34.95 29.74 3khu s ARG 31 CO 0.01 -0.30 -0.15 0.08 -0.81 0.00 0.00 175.30 174.13 3khu s VAL 32 N 2.03 1.94 -0.24 7.11 1.01 0.66 -0.28 120.40 132.63 3khu s VAL 32 Ca 0.41 -1.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 3khu s VAL 32 Cb -0.17 -1.89 0.03 0.00 0.00 0.00 0.00 36.38 34.35 3khu s VAL 32 CO 0.14 0.32 -0.08 -0.89 0.00 0.00 0.00 175.10 174.59 3khu s THR 33 N 1.29 2.79 -0.25 3.92 2.01 0.14 -0.82 115.64 124.72 3khu s THR 33 Ca 0.00 -1.02 -0.10 0.00 0.31 0.00 0.00 61.69 60.88 3khu s THR 33 Cb -0.15 -2.40 -0.05 0.00 0.01 0.00 0.00 72.50 69.91 3khu s THR 33 CO -0.10 0.23 0.15 -0.69 -0.69 0.00 0.00 174.62 173.52 3khu s VAL 34 N 1.32 5.17 0.31 3.82 1.01 0.13 -0.57 120.40 131.59 3khu s VAL 34 Ca 0.00 0.12 0.09 0.00 0.00 0.00 0.00 61.98 62.19 3khu s VAL 34 Cb -0.16 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.74 3khu s VAL 34 CO -0.05 0.32 -0.11 0.68 0.00 0.00 0.00 175.10 175.94 3khu s VAL 35 N 1.28 2.12 -0.23 2.92 -7.23 -0.38 -1.69 120.40 117.19 3khu s VAL 35 Ca 0.07 -2.23 -0.27 0.00 -1.81 0.00 0.00 61.98 57.74 3khu s VAL 35 Cb -0.14 -2.50 0.12 0.00 0.56 0.00 0.00 36.38 34.42 3khu s VAL 35 CO 0.06 -0.29 0.98 -0.62 -0.31 0.00 0.00 175.10 174.93 3khu s ASP 36 N -3.53 -0.45 0.47 4.85 -1.08 -1.14 -0.58 116.67 115.21 3khu s ASP 36 Ca 0.31 0.75 0.22 0.00 -0.52 0.00 0.00 52.55 53.30 3khu s ASP 36 Cb 0.01 0.71 1.19 0.00 -1.46 0.00 0.00 42.92 43.37 3khu s ASP 36 CO 0.15 -0.24 1.99 -0.37 0.52 0.00 0.00 175.17 177.22 3khu h VAL 37 N 3.26 0.81 -2.16 1.11 -1.51 -1.91 -3.41 116.25 112.44 3khu h VAL 37 Ca -0.25 -0.73 -0.56 0.00 -1.23 0.00 0.00 66.70 63.92 3khu h VAL 37 Cb 1.17 1.44 -0.09 0.00 -2.13 0.00 0.00 31.29 31.67 3khu h VAL 37 CO 0.18 0.18 1.08 0.21 -1.23 0.00 0.00 177.57 178.00 3khu s ASN 38 N -6.47 6.23 0.16 4.19 3.84 -1.26 -4.87 114.94 116.76 3khu s ASN 38 Ca -0.03 -0.72 -0.15 0.00 0.21 0.00 0.00 52.86 52.17 3khu s ASN 38 Cb 0.14 -2.54 0.05 0.00 -0.55 0.00 0.00 41.25 38.35 3khu s ASN 38 CO 0.64 -1.72 1.80 -0.08 -2.79 0.00 0.00 177.10 174.95 3khu h GLU 39 N 9.92 0.50 -0.81 0.43 4.81 -1.99 -2.31 114.58 125.13 3khu h GLU 39 Ca -0.18 -0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.10 3khu h GLU 39 Cb 1.04 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 30.26 3khu h GLU 39 CO 1.29 0.33 0.53 1.03 -0.73 0.00 0.00 179.01 181.46 3khu h SER 40 N 0.51 0.72 -0.25 1.04 0.87 -1.97 -0.60 113.55 113.87 3khu h SER 40 Ca 0.17 0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.63 3khu h SER 40 Cb 0.01 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 61.83 3khu h SER 40 CO -0.08 0.45 -0.30 -0.09 -0.53 0.00 0.00 176.83 176.27 3khu h ARG 41 N 0.81 0.64 -0.23 2.24 2.43 -1.84 -2.45 114.38 115.98 3khu h ARG 41 Ca 0.36 -0.36 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 3khu h ARG 41 Cb 0.35 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 3khu h ARG 41 CO -0.14 0.97 0.03 0.82 -1.51 0.00 0.00 179.97 180.14 3khu h ILE 42 N 0.36 0.88 -0.89 1.20 1.08 -1.08 -1.22 117.51 117.83 3khu h ILE 42 Ca 0.03 -0.04 0.08 0.00 -0.39 0.00 0.00 64.86 64.55 3khu h ILE 42 Cb 0.88 0.75 -0.07 0.00 -3.07 0.00 0.00 36.82 35.31 3khu h ILE 42 CO 0.07 0.02 0.55 0.78 -0.69 0.00 0.00 178.15 178.88 3khu h ASN 43 N 0.12 0.83 -0.70 1.72 2.35 -1.11 -0.81 115.58 117.97 3khu h ASN 43 Ca 0.11 0.03 -0.07 0.00 -0.55 0.00 0.00 56.30 55.82 3khu h ASN 43 Cb 0.11 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 3khu h ASN 43 CO -0.15 0.50 0.19 0.00 -1.65 0.00 0.00 177.43 176.31 3khu h ALA 44 N 1.45 0.93 -0.43 -0.83 0.00 -0.93 -1.45 119.26 117.99 3khu h ALA 44 Ca 0.41 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3khu h ALA 44 Cb 0.28 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3khu h ALA 44 CO -0.21 0.64 0.29 -1.49 0.00 0.00 0.00 179.25 178.48 3khu h TRP 45 N 1.05 0.54 -0.23 0.00 4.06 -0.33 -2.16 115.95 118.88 3khu h TRP 45 Ca 0.22 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.19 3khu h TRP 45 Cb 0.35 -0.18 0.00 0.00 -1.00 0.00 0.00 29.16 28.33 3khu h TRP 45 CO 0.03 0.33 0.00 0.09 -3.56 0.00 0.00 178.44 175.33 3khu n ASN 46 N -4.47 1.93 -4.79 -3.49 3.02 -0.40 -4.90 115.26 102.16 3khu n ASN 46 Ca 0.04 -2.14 -0.29 0.00 -0.03 0.00 0.00 54.58 52.15 3khu n ASN 46 Cb 0.07 -0.35 -0.06 0.00 -0.61 0.00 0.00 39.78 38.84 3khu n ASN 46 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3khu s SER 47 N -0.68 4.32 0.12 6.41 1.04 -0.76 -5.03 113.70 119.12 3khu s SER 47 Ca 0.18 -1.42 0.27 0.00 0.48 0.00 0.00 55.95 55.46 3khu s SER 47 Cb 0.11 0.29 1.00 0.00 0.10 0.00 0.00 66.02 67.52 3khu s SER 47 CO 0.09 -0.86 1.84 -2.65 0.98 0.00 0.00 173.24 172.64 3khu n PRO 48 N -1.40 0.15 -3.76 4.02 -0.02 -1.26 -4.52 135.00 128.21 3khu n PRO 48 Ca -0.10 0.12 -0.36 0.00 -2.02 0.00 0.00 63.50 61.14 3khu n PRO 48 Cb 0.66 -1.67 -0.11 0.00 -0.02 0.00 0.00 33.50 32.35 3khu n PRO 48 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3khu s THR 49 N -3.06 3.41 0.49 3.45 2.01 -1.26 -5.09 115.64 115.58 3khu s THR 49 Ca 0.12 -2.38 -0.23 0.00 0.31 0.00 0.00 61.69 59.51 3khu s THR 49 Cb 0.15 -3.30 -0.07 0.00 0.01 0.00 0.00 72.50 69.30 3khu s THR 49 CO 0.57 -0.75 1.29 -0.76 -0.69 0.00 0.00 174.62 174.27 3khu s LEU 50 N 0.72 3.98 0.32 4.42 1.43 -1.26 -4.71 118.68 123.59 3khu s LEU 50 Ca 0.11 2.60 0.26 0.00 -1.03 0.00 0.00 54.13 56.07 3khu s LEU 50 Cb -0.22 -4.18 0.90 0.00 0.03 0.00 0.00 46.19 42.72 3khu s LEU 50 CO -0.04 -1.21 1.77 1.55 0.23 0.00 0.00 176.35 178.65 3khu h PRO 51 N 1.91 0.00 -5.26 1.29 0.13 -1.88 -3.41 132.00 124.78 3khu h PRO 51 Ca -0.50 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 63.97 3khu h PRO 51 Cb 1.27 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.12 3khu h PRO 51 CO 0.59 0.00 -0.77 0.42 -0.23 0.00 0.00 178.00 178.01 3khu s ILE 52 N -3.29 3.00 -0.34 -3.56 -1.09 -1.26 -5.10 121.20 109.55 3khu s ILE 52 Ca 0.06 -0.67 -0.17 0.00 -2.23 0.00 0.00 60.65 57.64 3khu s ILE 52 Cb 0.10 -2.27 -0.01 0.00 -1.58 0.00 0.00 42.46 38.70 3khu s ILE 52 CO 0.53 0.51 0.48 -0.47 -1.23 0.00 0.00 174.94 174.76 3khu s TYR 53 N 0.56 3.20 -0.04 3.97 5.04 -1.26 -4.98 117.35 123.83 3khu s TYR 53 Ca -0.08 0.20 -0.03 0.00 -2.44 0.00 0.00 57.07 54.72 3khu s TYR 53 Cb -0.16 -2.85 0.02 0.00 0.35 0.00 0.00 41.96 39.33 3khu s TYR 53 CO 0.03 -0.48 0.10 -1.21 -1.34 0.00 0.00 175.55 172.65 3khu s GLU 54 N 2.31 0.08 0.25 4.97 0.41 -1.26 -4.85 118.70 120.61 3khu s GLU 54 Ca 0.18 0.19 -0.31 0.00 -0.41 0.00 0.00 54.97 54.62 3khu s GLU 54 Cb -0.16 -0.04 -0.12 0.00 -1.78 0.00 0.00 34.13 32.03 3khu s GLU 54 CO 0.12 -0.07 1.61 -2.30 -0.49 0.00 0.00 175.26 174.14 3khu n PRO 55 N 3.46 2.60 0.00 0.39 -0.02 -1.26 -2.13 135.00 138.05 3khu n PRO 55 Ca -0.18 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3khu n PRO 55 Cb 0.56 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 3khu n PRO 55 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3khu n GLY 56 N 2.84 2.72 0.10 -1.23 0.00 -1.26 -4.46 105.19 103.91 3khu n GLY 56 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 3khu n GLY 56 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3khu h LEU 57 N 0.00 0.22 -0.59 0.99 5.85 -1.84 -2.80 115.31 117.13 3khu h LEU 57 Ca 0.00 -0.41 0.12 0.00 0.84 0.00 0.00 57.88 58.43 3khu h LEU 57 Cb 0.00 -0.06 -0.10 0.00 0.37 0.00 0.00 40.66 40.87 3khu h LEU 57 CO 0.00 0.57 0.02 0.50 -0.34 0.00 0.00 178.44 179.19 3khu h LYS 58 N -0.14 0.13 0.00 1.25 3.64 -1.91 -0.56 116.57 118.98 3khu h LYS 58 Ca 0.02 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 3khu h LYS 58 Cb 0.49 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 3khu h LYS 58 CO 0.01 0.09 -0.47 1.05 -2.27 0.00 0.00 179.45 177.86 3khu h GLU 59 N 0.13 0.00 -0.06 1.90 9.09 -1.94 -0.57 114.58 123.12 3khu h GLU 59 Ca 0.31 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.69 3khu h GLU 59 Cb 0.49 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.59 3khu h GLU 59 CO -0.49 0.47 -0.08 0.28 0.05 0.00 0.00 179.01 179.24 3khu h VAL 60 N 0.00 1.39 -0.41 -1.06 2.07 -1.01 -2.83 116.25 114.40 3khu h VAL 60 Ca -0.00 -1.27 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 3khu h VAL 60 Cb 0.93 2.09 -0.02 0.00 -1.52 0.00 0.00 31.29 32.78 3khu h VAL 60 CO 0.06 0.35 0.23 0.58 0.02 0.00 0.00 177.57 178.82 3khu h VAL 61 N -0.29 1.14 0.00 2.57 2.07 -0.88 -2.89 116.25 117.97 3khu h VAL 61 Ca 0.01 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 3khu h VAL 61 Cb 0.60 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 3khu h VAL 61 CO 0.02 0.15 -0.15 -0.33 0.02 0.00 0.00 177.57 177.27 3khu h GLU 62 N 0.53 0.00 0.00 1.57 5.08 -1.18 0.21 114.58 120.79 3khu h GLU 62 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3khu h GLU 62 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3khu h GLU 62 CO -0.02 0.15 0.00 0.66 -1.00 0.00 0.00 179.01 178.80 3khu h SER 63 N 0.00 0.00 0.00 1.42 4.64 -1.27 -3.38 113.55 114.96 3khu h SER 63 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3khu h SER 63 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3khu h SER 63 CO 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 3khu s ARG 65 N 0.00 4.16 0.00 0.00 3.52 0.71 -1.58 118.95 125.76 3khu s ARG 65 Ca 0.00 2.51 0.00 0.00 -0.13 0.00 0.00 55.73 58.11 3khu s ARG 65 Cb 0.00 -3.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.33 3khu s ARG 65 CO 0.00 -0.61 0.00 0.41 -0.81 0.00 0.00 175.30 174.29 3khu n GLY 66 N 2.63 2.55 0.02 8.12 0.00 -0.43 -4.86 105.19 113.23 3khu n GLY 66 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 3khu n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3khu n LYS 67 N -2.00 0.05 0.00 1.61 5.02 -0.61 -4.86 118.16 117.36 3khu n LYS 67 Ca 0.00 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3khu n LYS 67 Cb 0.00 -0.58 0.00 0.00 -0.02 0.00 0.00 35.03 34.43 3khu n LYS 67 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3khu n ASN 68 N -2.68 1.11 -4.14 4.39 6.94 -0.99 -5.03 115.26 114.86 3khu n ASN 68 Ca -0.01 -1.46 -0.32 0.00 -0.02 0.00 0.00 54.58 52.77 3khu n ASN 68 Cb 0.05 0.00 -0.17 0.00 -2.36 0.00 0.00 39.78 37.30 3khu n ASN 68 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3khu s LEU 69 N -0.46 2.01 0.03 -4.53 2.96 -0.93 -0.25 118.68 117.52 3khu s LEU 69 Ca 0.00 -0.56 0.04 0.00 -0.22 0.00 0.00 54.13 53.39 3khu s LEU 69 Cb 0.00 -1.36 -0.02 0.00 0.50 0.00 0.00 46.19 45.31 3khu s LEU 69 CO 0.00 0.06 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.60 3khu s PHE 70 N 0.88 1.13 -0.11 5.38 0.08 0.00 -1.32 117.98 124.02 3khu s PHE 70 Ca -0.06 -0.35 0.02 0.00 0.12 0.00 0.00 56.93 56.66 3khu s PHE 70 Cb -0.15 -0.67 0.01 0.00 -0.57 0.00 0.00 43.02 41.64 3khu s PHE 70 CO -0.02 0.02 -0.17 -0.06 -0.10 0.00 0.00 175.22 174.89 3khu s PHE 71 N -0.84 2.12 0.10 0.36 0.08 -1.26 0.18 117.98 118.72 3khu s PHE 71 Ca 0.01 -0.99 -0.10 0.00 0.12 0.00 0.00 56.93 55.97 3khu s PHE 71 Cb -0.08 -1.50 0.01 0.00 -0.57 0.00 0.00 43.02 40.88 3khu s PHE 71 CO 0.01 -0.48 0.23 0.45 -0.10 0.00 0.00 175.22 175.33 3khu s SER 72 N 0.87 0.05 0.00 1.36 0.15 -0.68 -4.92 113.70 110.53 3khu s SER 72 Ca -0.08 -0.59 0.23 0.00 0.70 0.00 0.00 55.95 56.21 3khu s SER 72 Cb -0.15 0.37 0.18 0.00 -1.71 0.00 0.00 66.02 64.70 3khu s SER 72 CO -0.00 -0.76 1.19 0.35 1.20 0.00 0.00 173.24 175.22 3khu n THR 73 N -0.10 0.00 -2.50 6.45 -2.24 -1.26 -2.88 114.28 111.76 3khu n THR 73 Ca -0.15 -0.08 -0.40 0.00 -2.27 0.00 0.00 64.05 61.15 3khu n THR 73 Cb 0.63 0.76 -0.02 0.00 -2.10 0.00 0.00 70.33 69.59 3khu n THR 73 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3khu s ASN 74 N -2.80 6.43 0.09 3.42 3.84 -1.26 -4.75 114.94 119.91 3khu s ASN 74 Ca 0.14 -1.80 -0.16 0.00 0.21 0.00 0.00 52.86 51.25 3khu s ASN 74 Cb 0.17 -2.57 -0.09 0.00 -0.55 0.00 0.00 41.25 38.21 3khu s ASN 74 CO 0.70 -1.57 1.43 0.40 -2.79 0.00 0.00 177.10 175.27 3khu h ILE 75 N 6.31 1.30 0.37 -5.21 2.04 -1.92 -3.14 117.51 117.26 3khu h ILE 75 Ca 0.29 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 3khu h ILE 75 Cb 0.95 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 3khu h ILE 75 CO 1.41 0.42 -0.24 0.44 0.00 0.00 0.00 178.15 180.18 3khu h ASP 76 N 0.35 -0.61 -0.12 1.72 3.32 -1.98 -1.71 116.42 117.38 3khu h ASP 76 Ca 0.05 0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.07 3khu h ASP 76 Cb 0.73 0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 3khu h ASP 76 CO 0.05 -0.38 -0.15 0.44 -1.72 0.00 0.00 179.24 177.48 3khu h ASP 77 N -0.59 0.48 -0.71 6.45 3.32 -1.97 -0.45 116.42 122.95 3khu h ASP 77 Ca -0.04 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 3khu h ASP 77 Cb 0.50 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 3khu h ASP 77 CO 0.03 0.66 0.24 0.00 -1.72 0.00 0.00 179.24 178.45 3khu h ALA 78 N 1.39 0.93 -0.33 3.45 0.00 -1.45 -1.17 119.26 122.07 3khu h ALA 78 Ca 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3khu h ALA 78 Cb 0.53 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3khu h ALA 78 CO 0.03 0.60 0.15 0.82 0.00 0.00 0.00 179.25 180.86 3khu h ILE 79 N 1.04 1.17 -0.53 0.00 2.04 -0.88 -3.00 117.51 117.35 3khu h ILE 79 Ca 0.23 -0.48 0.02 0.00 1.00 0.00 0.00 64.86 65.64 3khu h ILE 79 Cb 0.28 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 3khu h ILE 79 CO -0.01 0.17 0.32 0.50 0.00 0.00 0.00 178.15 179.13 3khu h LYS 80 N 0.39 0.61 -0.00 2.37 3.64 -0.32 -2.56 116.57 120.70 3khu h LYS 80 Ca 0.11 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3khu h LYS 80 Cb 0.13 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3khu h LYS 80 CO -0.01 0.41 -0.15 0.39 -2.27 0.00 0.00 179.45 177.82 3khu n GLU 81 N -4.78 0.10 -3.07 1.90 -0.58 -0.52 -4.88 120.64 108.81 3khu n GLU 81 Ca 0.04 -0.02 -0.38 0.00 -0.42 0.00 0.00 57.16 56.38 3khu n GLU 81 Cb 0.08 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.39 3khu n GLU 81 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3khu s ALA 82 N -2.92 3.45 0.01 0.62 0.00 -0.97 -4.83 121.76 117.13 3khu s ALA 82 Ca 0.16 0.23 -0.14 0.00 0.00 0.00 0.00 51.96 52.21 3khu s ALA 82 Cb 0.19 -2.86 -0.34 0.00 0.00 0.00 0.00 23.12 20.11 3khu s ALA 82 CO 0.57 0.32 0.92 -0.44 0.00 0.00 0.00 175.76 177.13 3khu h ASP 83 N 3.95 0.77 -3.33 0.00 3.32 -1.28 -3.46 116.42 116.39 3khu h ASP 83 Ca -0.48 -0.89 -0.56 0.00 0.02 0.00 0.00 57.03 55.12 3khu h ASP 83 Cb 1.20 -0.25 -0.34 0.00 0.22 0.00 0.00 39.33 40.16 3khu h ASP 83 CO 0.65 1.71 -0.83 -0.22 -1.72 0.00 0.00 179.24 178.84 3khu s LEU 84 N -7.49 1.68 -0.29 1.55 2.96 -0.92 -1.15 118.68 115.03 3khu s LEU 84 Ca -0.10 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.41 3khu s LEU 84 Cb 0.05 -0.99 0.04 0.00 0.50 0.00 0.00 46.19 45.79 3khu s LEU 84 CO 0.92 0.02 -0.02 -0.69 -1.32 0.00 0.00 176.35 175.27 3khu s VAL 85 N 0.86 2.97 0.03 1.68 1.01 0.82 -0.91 120.40 126.87 3khu s VAL 85 Ca -0.10 -1.27 -0.27 0.00 0.00 0.00 0.00 61.98 60.34 3khu s VAL 85 Cb -0.15 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 3khu s VAL 85 CO 0.01 -0.02 0.85 -0.36 0.00 0.00 0.00 175.10 175.58 3khu s PHE 86 N 1.28 3.71 -0.36 5.22 0.08 0.11 -1.01 117.98 127.01 3khu s PHE 86 Ca -0.04 1.57 -0.13 0.00 0.12 0.00 0.00 56.93 58.46 3khu s PHE 86 Cb -0.19 -2.94 0.00 0.00 -0.57 0.00 0.00 43.02 39.32 3khu s PHE 86 CO -0.02 0.17 0.24 0.42 -0.10 0.00 0.00 175.22 175.92 3khu s ILE 87 N 0.32 5.06 -0.30 0.64 1.01 0.30 -0.40 121.20 127.84 3khu s ILE 87 Ca 0.43 -0.46 0.14 0.00 0.00 0.00 0.00 60.65 60.77 3khu s ILE 87 Cb -0.21 -3.69 0.48 0.00 0.01 0.00 0.00 42.46 39.05 3khu s ILE 87 CO 0.25 -0.11 1.12 -0.24 0.00 0.00 0.00 174.94 175.96 3khu n SER 88 N 5.08 3.16 -4.97 3.58 2.88 0.61 -0.99 113.62 122.97 3khu n SER 88 Ca -0.12 -2.93 -0.21 0.00 -1.33 0.00 0.00 58.87 54.28 3khu n SER 88 Cb 0.48 -0.43 -0.01 0.00 -0.75 0.00 0.00 64.21 63.50 3khu n SER 88 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3khu s VAL 89 N -4.21 4.68 0.40 2.46 -7.23 -1.24 -4.54 120.40 110.71 3khu s VAL 89 Ca 0.38 -0.91 -0.23 0.00 -1.81 0.00 0.00 61.98 59.42 3khu s VAL 89 Cb 0.38 -3.65 -0.10 0.00 0.56 0.00 0.00 36.38 33.56 3khu s VAL 89 CO -0.02 -0.28 0.97 0.21 -0.31 0.00 0.00 175.10 175.67 3khu s ASN 90 N -4.08 6.98 -0.56 4.85 2.47 -1.26 -4.74 114.94 118.60 3khu s ASN 90 Ca 0.40 1.80 0.01 0.00 0.42 0.00 0.00 52.86 55.49 3khu s ASN 90 Cb -0.09 -2.56 0.14 0.00 -1.45 0.00 0.00 41.25 37.29 3khu s ASN 90 CO 0.31 -0.33 0.33 0.42 -3.72 0.00 0.00 177.10 174.11 3khu s THR 91 N -1.93 3.01 0.62 -5.21 -4.23 -1.26 -4.71 115.64 101.93 3khu s THR 91 Ca 0.59 -3.18 -0.15 0.00 -1.18 0.00 0.00 61.69 57.76 3khu s THR 91 Cb -0.14 -3.04 -0.02 0.00 1.34 0.00 0.00 72.50 70.64 3khu s THR 91 CO 0.19 -0.83 1.08 -2.16 -0.54 0.00 0.00 174.62 172.36 3khu s PRO 92 N -0.20 3.10 0.29 3.99 0.04 -1.26 -4.57 135.00 136.39 3khu s PRO 92 Ca 0.17 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.20 3khu s PRO 92 Cb -0.24 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 32.20 3khu s PRO 92 CO -0.01 -1.00 1.52 0.99 0.04 0.00 0.00 177.00 178.53 3khu s THR 93 N -2.40 2.30 0.27 1.26 2.01 -1.26 -0.39 115.64 117.43 3khu s THR 93 Ca 0.65 0.26 -0.30 0.00 0.31 0.00 0.00 61.69 62.60 3khu s THR 93 Cb -0.18 -3.16 -0.12 0.00 0.01 0.00 0.00 72.50 69.05 3khu s THR 93 CO 0.39 0.04 1.63 -0.54 -0.69 0.00 0.00 174.62 175.45 3khu s LYS 94 N -0.67 4.12 0.01 4.92 1.02 -0.32 -4.77 119.74 124.05 3khu s LYS 94 Ca 0.60 2.59 0.22 0.00 0.02 0.00 0.00 55.97 59.41 3khu s LYS 94 Cb -0.45 -3.03 -0.14 0.00 -0.52 0.00 0.00 37.83 33.68 3khu s LYS 94 CO 0.48 -0.67 0.85 0.25 -0.92 0.00 0.00 175.35 175.34 3khu n THR 95 N 2.62 0.06 -4.18 2.17 -2.24 -1.26 -0.50 114.28 110.95 3khu n THR 95 Ca 0.10 -0.21 -0.11 0.00 -2.27 0.00 0.00 64.05 61.56 3khu n THR 95 Cb 0.37 0.46 -0.10 0.00 -2.10 0.00 0.00 70.33 68.96 3khu n THR 95 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3khu s TYR 96 N -3.20 1.06 0.00 4.78 -0.85 -1.26 -4.79 117.35 113.09 3khu s TYR 96 Ca 0.03 -1.31 0.00 0.00 -0.52 0.00 0.00 57.07 55.26 3khu s TYR 96 Cb 0.15 -0.51 0.00 0.00 0.38 0.00 0.00 41.96 41.98 3khu s TYR 96 CO 0.85 -0.63 0.00 0.41 -1.52 0.00 0.00 175.55 174.66 3khu n GLY 97 N -0.24 -1.19 3.68 5.49 0.00 -1.26 -4.34 105.19 107.33 3khu n GLY 97 Ca 0.00 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 3khu n GLY 97 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3khu s MET 98 N 0.00 4.23 0.00 1.61 -1.94 -1.26 -2.14 119.30 119.80 3khu s MET 98 Ca 0.00 2.10 0.00 0.00 -1.71 0.00 0.00 55.69 56.08 3khu s MET 98 Cb 0.00 -3.71 0.00 0.00 2.01 0.00 0.00 34.83 33.13 3khu s MET 98 CO 0.00 -0.70 0.00 0.41 -0.01 0.00 0.00 175.02 174.72 3khu n GLY 99 N 3.87 0.60 3.58 -0.03 0.00 -1.26 -4.84 105.19 107.11 3khu n GLY 99 Ca 0.15 -0.28 -0.55 0.00 0.00 0.00 0.00 46.02 45.35 3khu n GLY 99 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3khu n LYS 100 N -2.73 0.82 -1.00 1.61 4.81 -0.91 -0.66 118.16 120.11 3khu n LYS 100 Ca 0.00 0.30 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 3khu n LYS 100 Cb 0.00 -1.90 0.00 0.00 0.02 0.00 0.00 35.03 33.15 3khu n LYS 100 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3khu n GLY 101 N 2.41 0.83 0.68 3.14 0.00 0.35 -4.74 105.19 107.86 3khu n GLY 101 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3khu n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3khu n ARG 102 N -2.30 0.00 -2.35 1.61 1.74 -0.12 -4.97 116.66 110.27 3khu n ARG 102 Ca 0.00 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.73 3khu n ARG 102 Cb 0.00 -0.23 -0.01 0.00 -1.02 0.00 0.00 32.46 31.19 3khu n ARG 102 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3khu s ALA 103 N -1.34 2.84 0.36 7.54 0.00 0.17 -3.65 121.76 127.67 3khu s ALA 103 Ca 0.00 0.79 -0.19 0.00 0.00 0.00 0.00 51.96 52.56 3khu s ALA 103 Cb 0.00 -3.33 -0.10 0.00 0.00 0.00 0.00 23.12 19.69 3khu s ALA 103 CO 0.00 -0.59 0.85 0.00 0.00 0.00 0.00 175.76 176.02 3khu s ALA 104 N -1.75 3.19 -0.40 0.00 0.00 -1.26 -1.17 121.76 120.36 3khu s ALA 104 Ca 0.68 0.26 -0.15 0.00 0.00 0.00 0.00 51.96 52.75 3khu s ALA 104 Cb -0.23 -2.98 0.02 0.00 0.00 0.00 0.00 23.12 19.92 3khu s ALA 104 CO 0.27 0.23 0.31 0.34 0.00 0.00 0.00 175.76 176.91 3khu s ASP 105 N -2.10 6.12 -0.02 0.00 -1.08 0.47 -4.70 116.67 115.35 3khu s ASP 105 Ca 0.56 -0.81 0.04 0.00 -0.52 0.00 0.00 52.55 51.82 3khu s ASP 105 Cb -0.11 -2.17 0.15 0.00 -1.46 0.00 0.00 42.92 39.33 3khu s ASP 105 CO 0.16 -0.44 0.94 0.18 0.52 0.00 0.00 175.17 176.53 3khu n LEU 106 N 5.22 1.39 -0.36 -1.34 4.77 -1.26 -4.10 117.00 121.31 3khu n LEU 106 Ca -0.11 -0.70 0.02 0.00 -0.03 0.00 0.00 56.01 55.20 3khu n LEU 106 Cb 0.47 -0.31 0.18 0.00 -2.33 0.00 0.00 43.42 41.43 3khu n LEU 106 CO 0.41 0.27 1.27 0.07 -1.33 0.00 0.00 177.39 178.08 3khu h LYS 107 N 0.86 1.15 0.05 3.23 2.10 -1.93 -0.71 116.57 121.32 3khu h LYS 107 Ca 0.00 -0.07 -0.26 0.00 -2.00 0.00 0.00 60.65 58.32 3khu h LYS 107 Cb 0.50 -0.26 0.01 0.00 -0.90 0.00 0.00 32.23 31.58 3khu h LYS 107 CO 0.05 0.76 -1.08 1.88 -2.00 0.00 0.00 179.45 179.06 3khu h TYR 108 N 1.18 0.72 -0.65 0.07 0.05 -1.84 -1.40 116.97 115.10 3khu h TYR 108 Ca 0.42 -0.43 0.01 0.00 0.05 0.00 0.00 58.73 58.78 3khu h TYR 108 Cb 0.12 -0.07 -0.03 0.00 1.01 0.00 0.00 36.73 37.76 3khu h TYR 108 CO -0.00 1.28 0.43 0.82 -1.05 0.00 0.00 178.16 179.63 3khu h ILE 109 N 0.23 1.15 -0.40 -2.88 1.08 -1.74 -1.73 117.51 113.21 3khu h ILE 109 Ca -0.12 -0.30 -0.04 0.00 -0.39 0.00 0.00 64.86 64.01 3khu h ILE 109 Cb 1.75 0.21 -0.02 0.00 -3.07 0.00 0.00 36.82 35.69 3khu h ILE 109 CO 0.19 0.16 0.08 -0.08 -0.69 0.00 0.00 178.15 177.82 3khu h GLU 110 N 0.87 0.65 -0.82 2.37 4.81 -1.09 -0.45 114.58 120.92 3khu h GLU 110 Ca 0.24 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3khu h GLU 110 Cb -0.08 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.17 3khu h GLU 110 CO -0.06 0.69 0.51 0.00 -0.73 0.00 0.00 179.01 179.42 3khu h ALA 111 N 0.94 1.35 -0.19 2.92 0.00 -1.08 -0.67 119.26 122.53 3khu h ALA 111 Ca 0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3khu h ALA 111 Cb 0.33 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3khu h ALA 111 CO 0.00 0.57 0.05 0.00 0.00 0.00 0.00 179.25 179.88 3khu h ALA 113 N 0.87 0.65 -0.46 0.00 0.00 -0.45 0.13 119.26 119.99 3khu h ALA 113 Ca 0.06 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 3khu h ALA 113 Cb 0.25 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3khu h ALA 113 CO -0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 179.25 179.11 3khu h ARG 114 N 0.47 0.83 -0.87 0.00 3.08 -1.09 -2.29 114.38 114.51 3khu h ARG 114 Ca 0.23 -0.27 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 3khu h ARG 114 Cb 0.17 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 3khu h ARG 114 CO -0.18 0.89 0.45 -0.09 -1.07 0.00 0.00 179.97 179.97 3khu h ARG 115 N 0.68 1.23 -0.01 0.04 9.65 -0.84 -1.55 114.38 123.58 3khu h ARG 115 Ca 0.13 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 3khu h ARG 115 Cb 0.53 -0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 28.87 3khu h ARG 115 CO 0.03 0.92 0.01 0.82 2.80 0.00 0.00 179.97 184.55 3khu h ILE 116 N 1.23 1.01 -0.29 1.20 2.04 -0.47 -2.12 117.51 120.11 3khu h ILE 116 Ca 0.30 -0.02 -0.10 0.00 1.00 0.00 0.00 64.86 66.05 3khu h ILE 116 Cb 0.07 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3khu h ILE 116 CO -0.04 0.01 -0.23 1.62 0.00 0.00 0.00 178.15 179.50 3khu h VAL 117 N 0.01 1.26 -0.79 1.67 3.04 -1.29 -2.34 116.25 117.81 3khu h VAL 117 Ca 0.00 -1.26 0.00 0.00 -1.01 0.00 0.00 66.70 64.44 3khu h VAL 117 Cb 0.00 1.29 -0.04 0.00 -2.01 0.00 0.00 31.29 30.54 3khu h VAL 117 CO -0.00 0.41 0.51 -0.61 -1.01 0.00 0.00 177.57 176.86 3khu h GLN 118 N 0.49 1.05 -0.58 4.17 4.15 -1.05 -3.12 115.11 120.22 3khu h GLN 118 Ca 0.07 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3khu h GLN 118 Cb 0.66 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.12 3khu h GLN 118 CO 0.05 0.71 0.00 0.09 -1.93 0.00 0.00 178.83 177.75 3khu n ASN 119 N -4.40 4.97 -4.27 -0.69 3.02 -0.82 -5.00 115.26 108.08 3khu n ASN 119 Ca 0.09 -2.66 -0.25 0.00 -0.03 0.00 0.00 54.58 51.73 3khu n ASN 119 Cb 0.04 -0.60 -0.13 0.00 -0.61 0.00 0.00 39.78 38.47 3khu n ASN 119 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3khu s SER 120 N -0.98 2.53 0.07 6.41 0.01 -0.92 -4.02 113.70 116.80 3khu s SER 120 Ca 0.51 -0.59 -0.01 0.00 1.31 0.00 0.00 55.95 57.17 3khu s SER 120 Cb 0.36 -0.18 -0.04 0.00 0.21 0.00 0.00 66.02 66.36 3khu s SER 120 CO 0.20 0.12 -0.02 0.20 0.41 0.00 0.00 173.24 174.15 3khu s ASN 121 N -1.48 0.54 0.69 2.44 0.01 -1.26 -4.96 114.94 110.92 3khu s ASN 121 Ca 0.07 -1.04 0.00 0.00 -0.71 0.00 0.00 52.86 51.18 3khu s ASN 121 Cb -0.09 0.20 0.00 0.00 0.41 0.00 0.00 41.25 41.77 3khu s ASN 121 CO 0.03 -0.61 0.00 0.61 -1.51 0.00 0.00 177.10 175.62 3khu n GLY 122 N 0.05 0.54 3.71 0.66 0.00 -1.09 -4.75 105.19 104.31 3khu n GLY 122 Ca -0.12 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 44.76 3khu n GLY 122 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3khu s TYR 123 N 0.00 3.38 0.03 1.61 5.04 -1.26 -1.19 117.35 124.96 3khu s TYR 123 Ca 0.00 0.28 -0.09 0.00 -2.44 0.00 0.00 57.07 54.82 3khu s TYR 123 Cb 0.00 -2.14 0.00 0.00 0.35 0.00 0.00 41.96 40.17 3khu s TYR 123 CO 0.00 0.27 0.19 0.15 -1.34 0.00 0.00 175.55 174.82 3khu s LYS 124 N 0.35 0.65 -0.20 4.97 1.02 -0.95 -4.85 119.74 120.73 3khu s LYS 124 Ca 0.07 -0.57 -0.08 0.00 0.02 0.00 0.00 55.97 55.42 3khu s LYS 124 Cb -0.11 0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 37.43 3khu s LYS 124 CO -0.02 -0.18 0.07 0.42 -0.92 0.00 0.00 175.35 174.72 3khu s ILE 125 N -2.28 4.70 -0.18 2.17 1.01 -0.30 -1.12 121.20 125.21 3khu s ILE 125 Ca -0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 60.65 60.52 3khu s ILE 125 Cb -0.02 -3.14 0.01 0.00 0.01 0.00 0.00 42.46 39.31 3khu s ILE 125 CO -0.02 0.42 -0.16 -0.69 0.00 0.00 0.00 174.94 174.49 3khu s VAL 126 N 0.74 2.47 -0.13 2.92 1.01 0.25 -0.12 120.40 127.53 3khu s VAL 126 Ca 0.04 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.22 3khu s VAL 126 Cb -0.13 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.21 3khu s VAL 126 CO 0.02 0.51 -0.15 -0.89 0.00 0.00 0.00 175.10 174.59 3khu s THR 127 N 1.22 1.55 -0.12 3.92 2.01 -0.18 -0.90 115.64 123.14 3khu s THR 127 Ca 0.03 -0.64 -0.30 0.00 0.31 0.00 0.00 61.69 61.09 3khu s THR 127 Cb -0.14 -1.44 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 3khu s THR 127 CO -0.08 0.45 1.26 -1.61 -0.69 0.00 0.00 174.62 173.96 3khu s GLU 128 N 1.31 4.27 -0.07 4.92 2.02 -0.37 -0.54 118.70 130.24 3khu s GLU 128 Ca 0.01 1.70 0.02 0.00 0.02 0.00 0.00 54.97 56.71 3khu s GLU 128 Cb -0.14 -3.69 -0.06 0.00 0.10 0.00 0.00 34.13 30.35 3khu s GLU 128 CO -0.07 -0.62 -0.05 1.17 0.02 0.00 0.00 175.26 175.71 3khu n LYS 129 N 6.08 0.76 -1.89 1.61 4.81 -0.16 -0.30 118.16 129.06 3khu n LYS 129 Ca 0.13 0.04 -0.29 0.00 -0.87 0.00 0.00 58.31 57.31 3khu n LYS 129 Cb 0.45 -1.16 0.08 0.00 0.02 0.00 0.00 35.03 34.42 3khu n LYS 129 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 3khu s SER 130 N -4.56 4.81 0.05 3.14 0.01 -1.18 -3.38 113.70 112.59 3khu s SER 130 Ca -0.09 0.90 -0.30 0.00 1.31 0.00 0.00 55.95 57.76 3khu s SER 130 Cb 0.03 -1.49 -0.05 0.00 0.21 0.00 0.00 66.02 64.72 3khu s SER 130 CO 0.20 -1.72 1.18 -0.89 0.41 0.00 0.00 173.24 172.41 3khu s THR 131 N -3.51 4.13 0.12 1.44 2.01 -1.26 -4.90 115.64 113.68 3khu s THR 131 Ca 0.61 1.52 0.05 0.00 0.31 0.00 0.00 61.69 64.18 3khu s THR 131 Cb -0.11 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 3khu s THR 131 CO 0.50 0.11 -0.13 0.68 -0.69 0.00 0.00 174.62 175.09 3khu s VAL 132 N 1.16 1.24 0.70 3.82 -7.23 -1.26 -4.49 120.40 114.34 3khu s VAL 132 Ca 0.58 -1.76 -0.12 0.00 -1.81 0.00 0.00 61.98 58.86 3khu s VAL 132 Cb -0.28 -1.55 0.02 0.00 0.56 0.00 0.00 36.38 35.12 3khu s VAL 132 CO 0.28 -0.50 1.08 -2.16 -0.31 0.00 0.00 175.10 173.50 3khu s PRO 133 N -2.88 2.70 0.36 4.82 0.04 -1.26 -4.95 135.00 133.84 3khu s PRO 133 Ca 0.10 1.18 -0.28 0.00 0.04 0.00 0.00 61.00 62.03 3khu s PRO 133 Cb -0.03 -1.95 -0.11 0.00 0.04 0.00 0.00 34.50 32.45 3khu s PRO 133 CO 0.02 -1.30 1.44 0.08 0.04 0.00 0.00 177.00 177.28 3khu s VAL 134 N -2.73 2.24 0.00 -0.36 1.01 -1.26 -1.98 120.40 117.31 3khu s VAL 134 Ca 0.62 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.84 3khu s VAL 134 Cb -0.17 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.06 3khu s VAL 134 CO 0.49 0.06 0.00 0.54 0.00 0.00 0.00 175.10 176.19 3khu n ARG 135 N 0.56 0.00 -0.18 2.72 3.00 -1.26 -4.96 116.66 116.54 3khu n ARG 135 Ca 0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 57.85 57.84 3khu n ARG 135 Cb 0.40 -0.69 0.09 0.00 0.00 0.00 0.00 32.46 32.26 3khu n ARG 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3khu h ALA 136 N 0.00 0.69 -0.85 7.54 0.00 -1.76 -2.11 119.26 122.77 3khu h ALA 136 Ca 0.00 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3khu h ALA 136 Cb 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3khu h ALA 136 CO 0.00 -0.25 0.56 0.00 0.00 0.00 0.00 179.25 179.56 3khu h ALA 137 N 1.41 1.40 -0.47 0.00 0.00 -1.93 -0.77 119.26 118.91 3khu h ALA 137 Ca 0.29 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3khu h ALA 137 Cb 0.37 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3khu h ALA 137 CO -0.33 0.55 0.25 1.49 0.00 0.00 0.00 179.25 181.21 3khu h GLU 138 N 1.14 0.65 -0.16 0.00 4.81 -1.81 0.00 114.58 119.20 3khu h GLU 138 Ca 0.31 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.41 3khu h GLU 138 Cb -0.11 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.13 3khu h GLU 138 CO -0.07 0.48 -0.16 0.77 -0.73 0.00 0.00 179.01 179.31 3khu h SER 139 N 0.66 0.42 -0.15 1.04 0.02 -0.77 -1.56 113.55 113.20 3khu h SER 139 Ca 0.17 -0.48 0.03 0.00 -0.84 0.00 0.00 61.79 60.68 3khu h SER 139 Cb 0.03 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.42 3khu h SER 139 CO -0.03 0.81 -0.06 0.40 -1.14 0.00 0.00 176.83 176.81 3khu h ILE 140 N 0.04 0.79 -0.96 3.27 2.04 -0.88 -1.96 117.51 119.86 3khu h ILE 140 Ca 0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.99 3khu h ILE 140 Cb 0.69 0.79 -0.07 0.00 -0.74 0.00 0.00 36.82 37.49 3khu h ILE 140 CO 0.04 0.00 0.61 -0.09 0.00 0.00 0.00 178.15 178.71 3khu h ARG 141 N -0.04 0.94 -0.40 2.37 9.65 -0.96 -1.58 114.38 124.36 3khu h ARG 141 Ca 0.08 -0.06 -0.06 0.00 -1.10 0.00 0.00 59.98 58.85 3khu h ARG 141 Cb 0.16 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 28.51 3khu h ARG 141 CO -0.18 0.62 0.02 0.00 2.80 0.00 0.00 179.97 183.23 3khu h ARG 142 N 0.97 0.70 -0.37 0.20 3.08 -0.56 0.78 114.38 119.17 3khu h ARG 142 Ca 0.45 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 60.31 3khu h ARG 142 Cb 0.42 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 3khu h ARG 142 CO -0.21 0.77 0.20 0.82 -1.07 0.00 0.00 179.97 180.48 3khu h ILE 143 N 0.54 1.00 0.11 2.04 2.04 -0.78 -0.78 117.51 121.68 3khu h ILE 143 Ca 0.12 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 3khu h ILE 143 Cb 0.44 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3khu h ILE 143 CO 0.02 0.07 -0.07 -0.26 0.00 0.00 0.00 178.15 177.91 3khu h PHE 144 N 0.40 -0.17 -0.40 1.37 0.04 -1.04 -2.09 116.94 115.04 3khu h PHE 144 Ca 0.16 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 3khu h PHE 144 Cb 0.05 0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 3khu h PHE 144 CO -0.09 -0.11 0.26 -0.44 -0.60 0.00 0.00 178.31 177.33 3khu h ASP 145 N -0.17 0.47 1.24 2.17 3.32 -0.65 -2.16 116.42 120.64 3khu h ASP 145 Ca -0.01 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3khu h ASP 145 Cb 0.15 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3khu h ASP 145 CO 0.01 0.35 -0.18 0.00 -1.72 0.00 0.00 179.24 177.70 3khu n ALA 146 N -2.48 2.50 -2.49 3.45 0.00 -0.31 -3.97 120.51 117.21 3khu n ALA 146 Ca 0.03 -0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.15 3khu n ALA 146 Cb 0.07 -1.38 0.01 0.00 0.00 0.00 0.00 19.45 18.15 3khu n ALA 146 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3khu n ASN 147 N -2.13 3.98 -4.83 0.00 3.02 -0.81 -5.08 115.26 109.42 3khu n ASN 147 Ca 0.05 -3.47 -0.32 0.00 -0.03 0.00 0.00 54.58 50.80 3khu n ASN 147 Cb 0.42 -0.47 -0.01 0.00 -0.61 0.00 0.00 39.78 39.12 3khu n ASN 147 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3khu s THR 148 N -4.93 4.23 0.10 3.41 -1.32 -1.17 -4.93 115.64 111.03 3khu s THR 148 Ca 0.43 1.02 0.03 0.00 -1.21 0.00 0.00 61.69 61.97 3khu s THR 148 Cb 0.41 -3.58 -0.04 0.00 -1.51 0.00 0.00 72.50 67.78 3khu s THR 148 CO -0.12 -0.66 -0.09 -0.54 -2.21 0.00 0.00 174.62 171.00 3khu s LYS 149 N -4.21 0.83 0.25 7.08 1.02 -1.26 -5.09 119.74 118.36 3khu s LYS 149 Ca 0.60 -1.17 -0.31 0.00 0.02 0.00 0.00 55.97 55.11 3khu s LYS 149 Cb -0.13 -0.46 -0.13 0.00 -0.52 0.00 0.00 37.83 36.60 3khu s LYS 149 CO 0.37 0.06 1.47 -2.30 -0.92 0.00 0.00 175.35 174.02 3khu n PRO 150 N 0.48 2.24 -0.96 -1.68 -0.02 -1.26 -2.01 135.00 131.78 3khu n PRO 150 Ca -0.16 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 3khu n PRO 150 Cb 0.58 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 3khu n PRO 150 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3khu n ASN 151 N 2.18 -4.54 -4.65 2.55 3.02 -1.26 -4.78 115.26 107.78 3khu n ASN 151 Ca 0.11 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.24 3khu n ASN 151 Cb 0.33 -2.53 -0.05 0.00 -0.61 0.00 0.00 39.78 36.92 3khu n ASN 151 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3khu s LEU 152 N 0.00 4.11 -0.37 3.41 2.96 -0.85 -2.69 118.68 125.25 3khu s LEU 152 Ca 0.00 1.00 0.00 0.00 -0.22 0.00 0.00 54.13 54.91 3khu s LEU 152 Cb 0.00 -3.11 0.12 0.00 0.50 0.00 0.00 46.19 43.70 3khu s LEU 152 CO 0.00 -0.43 0.18 0.21 -1.32 0.00 0.00 176.35 174.99 3khu s ASN 153 N 1.29 3.63 -0.18 3.68 2.47 -0.33 -4.78 114.94 120.71 3khu s ASN 153 Ca 0.34 -2.10 -0.08 0.00 0.42 0.00 0.00 52.86 51.43 3khu s ASN 153 Cb -0.16 -0.79 -0.04 0.00 -1.45 0.00 0.00 41.25 38.81 3khu s ASN 153 CO 0.09 -0.34 0.10 -0.76 -3.72 0.00 0.00 177.10 172.47 3khu s LEU 154 N 1.06 4.03 -0.09 3.21 1.43 -1.26 -2.23 118.68 124.82 3khu s LEU 154 Ca 0.14 0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.43 3khu s LEU 154 Cb -0.21 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.96 3khu s LEU 154 CO -0.11 0.20 -0.09 -1.10 0.23 0.00 0.00 176.35 175.49 3khu s GLN 155 N 0.22 2.99 -0.19 1.70 -1.52 -0.27 -4.98 119.66 117.61 3khu s GLN 155 Ca 0.06 -0.59 -0.03 0.00 -1.95 0.00 0.00 55.36 52.85 3khu s GLN 155 Cb -0.12 -2.62 -0.01 0.00 -0.22 0.00 0.00 33.01 30.04 3khu s GLN 155 CO -0.00 0.50 -0.06 0.08 -0.25 0.00 0.00 175.29 175.56 3khu s VAL 156 N -0.37 3.45 0.25 1.09 1.01 -1.26 0.84 120.40 125.42 3khu s VAL 156 Ca 0.05 -0.49 0.08 0.00 0.00 0.00 0.00 61.98 61.63 3khu s VAL 156 Cb -0.12 -2.53 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 3khu s VAL 156 CO 0.02 0.46 -0.13 -0.76 0.00 0.00 0.00 175.10 174.70 3khu s LEU 157 N 0.98 2.55 -0.09 3.92 1.43 -0.08 -4.59 118.68 122.80 3khu s LEU 157 Ca -0.00 -1.09 0.02 0.00 -1.03 0.00 0.00 54.13 52.03 3khu s LEU 157 Cb -0.15 -0.78 -0.02 0.00 0.03 0.00 0.00 46.19 45.28 3khu s LEU 157 CO 0.00 -0.18 -0.16 -0.55 0.23 0.00 0.00 176.35 175.69 3khu s SER 158 N -3.42 3.79 -0.42 2.29 0.15 0.27 -1.24 113.70 115.13 3khu s SER 158 Ca 0.27 -0.34 0.07 0.00 0.70 0.00 0.00 55.95 56.65 3khu s SER 158 Cb 0.00 -1.26 0.23 0.00 -1.71 0.00 0.00 66.02 63.28 3khu s SER 158 CO 0.11 0.23 0.55 -3.20 1.20 0.00 0.00 173.24 172.12 3khu n ASN 159 N 3.09 -0.61 -4.72 5.45 4.05 0.59 0.02 115.26 123.13 3khu n ASN 159 Ca -0.18 -2.72 -0.33 0.00 0.45 0.00 0.00 54.58 51.80 3khu n ASN 159 Cb 0.52 -0.14 0.10 0.00 1.23 0.00 0.00 39.78 41.50 3khu n ASN 159 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 177.26 171.37 3khu s PRO 160 N -0.54 1.98 0.23 1.20 0.02 -1.25 -4.36 135.00 132.27 3khu s PRO 160 Ca 0.34 1.56 0.09 0.00 0.02 0.00 0.00 61.00 63.02 3khu s PRO 160 Cb 0.14 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.79 3khu s PRO 160 CO -0.15 -1.92 -0.06 -0.65 -0.33 0.00 0.00 177.00 173.90 3khu s GLN 161 N -4.27 2.15 -0.47 5.54 -1.52 -1.22 -4.61 119.66 115.27 3khu s GLN 161 Ca 0.69 -1.37 0.09 0.00 -1.95 0.00 0.00 55.36 52.82 3khu s GLN 161 Cb -0.24 -2.14 0.34 0.00 -0.22 0.00 0.00 33.01 30.75 3khu s GLN 161 CO 0.49 0.39 0.83 1.19 -0.25 0.00 0.00 175.29 177.95 3khu n PHE 162 N -0.45 2.02 -3.63 0.91 3.72 -1.26 -4.98 117.46 113.79 3khu n PHE 162 Ca -0.08 -3.91 -0.37 0.00 -0.05 0.00 0.00 57.45 53.05 3khu n PHE 162 Cb 0.57 -0.45 -0.07 0.00 -0.94 0.00 0.00 39.48 38.59 3khu n PHE 162 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3khu s LEU 163 N -2.92 4.32 -0.06 4.37 1.43 -1.26 -4.90 118.68 119.67 3khu s LEU 163 Ca 0.44 0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 54.09 3khu s LEU 163 Cb 0.32 -2.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 3khu s LEU 163 CO -0.11 0.23 0.03 0.00 0.23 0.00 0.00 176.35 176.73 3khu s ALA 164 N -0.21 3.41 0.16 4.21 0.00 -1.26 -5.01 121.76 123.06 3khu s ALA 164 Ca 0.17 -0.83 -0.34 0.00 0.00 0.00 0.00 51.96 50.96 3khu s ALA 164 Cb -0.13 -1.53 -0.14 0.00 0.00 0.00 0.00 23.12 21.32 3khu s ALA 164 CO 0.05 0.62 1.53 -1.91 0.00 0.00 0.00 175.76 176.06 3khu n GLU 165 N 1.79 2.01 0.00 0.00 0.00 -1.26 -1.54 120.64 121.64 3khu n GLU 165 Ca -0.17 0.72 0.00 0.00 0.00 0.00 0.00 57.16 57.72 3khu n GLU 165 Cb 0.53 -2.47 0.00 0.00 0.00 0.00 0.00 31.44 29.51 3khu n GLU 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3khu n GLY 166 N 3.18 1.80 0.38 8.31 0.00 -1.26 -4.81 105.19 112.79 3khu n GLY 166 Ca 0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 3khu n GLY 166 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3khu n THR 167 N -2.00 0.99 -0.16 2.61 -2.24 -0.59 -4.64 114.28 108.25 3khu n THR 167 Ca 0.00 -1.29 -0.02 0.00 -2.27 0.00 0.00 64.05 60.47 3khu n THR 167 Cb 0.00 0.16 0.06 0.00 -2.10 0.00 0.00 70.33 68.45 3khu n THR 167 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3khu h ALA 168 N 0.14 0.49 -0.32 6.98 0.00 -1.85 0.02 119.26 124.71 3khu h ALA 168 Ca -0.02 0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3khu h ALA 168 Cb 1.23 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 3khu h ALA 168 CO 0.01 -0.38 -0.05 0.82 0.00 0.00 0.00 179.25 179.65 3khu h ILE 169 N 0.13 1.27 -0.57 0.00 1.08 -1.91 -0.49 117.51 117.02 3khu h ILE 169 Ca 0.25 -1.07 -0.03 0.00 -0.39 0.00 0.00 64.86 63.62 3khu h ILE 169 Cb 0.38 1.32 -0.03 0.00 -3.07 0.00 0.00 36.82 35.42 3khu h ILE 169 CO -0.41 0.35 0.21 0.11 -0.69 0.00 0.00 178.15 177.72 3khu h LYS 170 N 0.39 0.83 -0.31 2.37 1.57 -1.81 0.27 116.57 119.88 3khu h LYS 170 Ca 0.08 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3khu h LYS 170 Cb 0.53 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 3khu h LYS 170 CO 0.03 0.69 0.03 -0.44 -0.57 0.00 0.00 179.45 179.19 3khu h ASP 171 N 0.82 0.43 0.20 0.86 3.32 -0.46 -1.15 116.42 120.44 3khu h ASP 171 Ca 0.19 -0.07 -0.34 0.00 0.02 0.00 0.00 57.03 56.83 3khu h ASP 171 Cb 0.18 -0.11 0.02 0.00 0.22 0.00 0.00 39.33 39.64 3khu h ASP 171 CO -0.02 0.47 -1.65 -0.07 -1.72 0.00 0.00 179.24 176.25 3khu h LEU 172 N 0.45 0.67 -0.27 1.55 3.38 -0.68 -3.09 115.31 117.32 3khu h LEU 172 Ca 0.10 -0.93 -0.19 0.00 0.09 0.00 0.00 57.88 56.95 3khu h LEU 172 Cb 0.25 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3khu h LEU 172 CO 0.00 1.76 -0.87 0.11 0.09 0.00 0.00 178.44 179.53 3khu h LYS 173 N 0.09 0.06 -2.04 1.13 1.57 -0.93 -3.37 116.57 113.08 3khu h LYS 173 Ca -0.32 -0.07 -0.53 0.00 -1.87 0.00 0.00 60.65 57.85 3khu h LYS 173 Cb 2.10 0.02 -0.40 0.00 0.08 0.00 0.00 32.23 34.03 3khu h LYS 173 CO 0.20 0.89 -1.06 -1.71 -0.57 0.00 0.00 179.45 177.20 3khu n ASN 174 N -3.56 1.14 -4.79 0.86 5.15 -0.44 -4.91 115.26 108.72 3khu n ASN 174 Ca -0.02 -2.98 -0.35 0.00 -0.60 0.00 0.00 54.58 50.64 3khu n ASN 174 Cb 0.82 -0.63 -0.03 0.00 -0.53 0.00 0.00 39.78 39.41 3khu n ASN 174 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3khu s PRO 175 N -2.01 3.89 0.20 1.20 0.04 -1.17 -4.73 135.00 132.42 3khu s PRO 175 Ca 0.39 1.48 -0.10 0.00 0.04 0.00 0.00 61.00 62.81 3khu s PRO 175 Cb 0.25 -2.28 0.14 0.00 0.04 0.00 0.00 34.50 32.65 3khu s PRO 175 CO -0.09 -0.38 1.82 -0.44 0.04 0.00 0.00 177.00 177.96 3khu h ASP 176 N 1.91 0.91 -5.04 6.66 3.32 -1.94 -3.45 116.42 118.79 3khu h ASP 176 Ca -0.49 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 56.42 3khu h ASP 176 Cb 1.22 -0.23 -0.14 0.00 0.22 0.00 0.00 39.33 40.40 3khu h ASP 176 CO 0.60 0.74 0.00 0.00 -1.72 0.00 0.00 179.24 178.86 3khu s ARG 177 N -5.87 1.08 -0.12 3.56 3.03 -1.26 -4.87 118.95 114.50 3khu s ARG 177 Ca -0.13 -0.50 -0.03 0.00 2.03 0.00 0.00 55.73 57.11 3khu s ARG 177 Cb 0.15 0.48 -0.03 0.00 -1.03 0.00 0.00 34.95 34.52 3khu s ARG 177 CO 0.80 -0.42 -0.02 0.08 -1.13 0.00 0.00 175.30 174.61 3khu s VAL 178 N -3.27 4.13 -0.13 4.99 1.01 0.02 -4.96 120.40 122.18 3khu s VAL 178 Ca -0.01 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.70 3khu s VAL 178 Cb 0.00 -2.77 0.01 0.00 0.00 0.00 0.00 36.38 33.62 3khu s VAL 178 CO -0.08 0.54 -0.20 -0.22 0.00 0.00 0.00 175.10 175.14 3khu s LEU 179 N -0.23 2.00 -0.07 3.92 2.96 -1.26 -0.15 118.68 125.85 3khu s LEU 179 Ca 0.05 -0.56 -0.00 0.00 -0.22 0.00 0.00 54.13 53.40 3khu s LEU 179 Cb -0.13 -1.35 0.02 0.00 0.50 0.00 0.00 46.19 45.24 3khu s LEU 179 CO 0.02 0.06 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.45 3khu s ILE 180 N 0.89 0.56 -0.05 6.68 1.01 -0.61 -3.83 121.20 125.85 3khu s ILE 180 Ca -0.06 -0.05 0.03 0.00 0.00 0.00 0.00 60.65 60.56 3khu s ILE 180 Cb -0.15 -0.64 -0.03 0.00 0.01 0.00 0.00 42.46 41.65 3khu s ILE 180 CO -0.03 0.27 -0.12 -0.83 0.00 0.00 0.00 174.94 174.24 3khu s GLY 181 N 1.48 1.59 0.28 6.18 0.00 0.10 -1.26 107.32 115.70 3khu s GLY 181 Ca -0.02 -0.95 -0.16 0.00 0.00 0.00 0.00 44.72 43.59 3khu s GLY 181 CO -0.03 -0.74 0.61 -0.32 0.00 0.00 0.00 173.10 172.62 3khu s GLY 182 N -0.79 0.32 0.68 0.20 0.00 -0.96 -0.57 107.32 106.20 3khu s GLY 182 Ca 0.12 -0.67 -0.16 0.00 0.00 0.00 0.00 44.72 44.01 3khu s GLY 182 CO 0.01 -0.39 1.21 0.99 0.00 0.00 0.00 173.10 174.92 3khu s ASP 183 N -3.00 4.54 0.00 1.64 -0.00 -1.26 -3.32 116.67 115.26 3khu s ASP 183 Ca 0.17 2.38 0.00 0.00 -0.00 0.00 0.00 52.55 55.10 3khu s ASP 183 Cb -0.03 -2.59 0.00 0.00 -0.00 0.00 0.00 42.92 40.29 3khu s ASP 183 CO 0.09 -2.04 0.82 -1.84 -0.00 0.00 0.00 175.17 172.20 3khu n GLU 184 N -2.33 0.90 -2.47 8.23 -0.00 -1.26 -3.70 120.64 120.00 3khu n GLU 184 Ca 0.14 0.00 -0.27 0.00 -0.00 0.00 0.00 57.16 57.02 3khu n GLU 184 Cb 0.50 -1.08 0.01 0.00 -0.00 0.00 0.00 31.44 30.87 3khu n GLU 184 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 3khu s THR 185 N -1.82 4.34 0.26 3.84 -4.23 -1.26 -4.88 115.64 111.89 3khu s THR 185 Ca 0.00 0.16 -0.03 0.00 -1.18 0.00 0.00 61.69 60.64 3khu s THR 185 Cb 0.00 -3.68 0.27 0.00 1.34 0.00 0.00 72.50 70.42 3khu s THR 185 CO 0.00 -0.70 1.91 -0.65 -0.54 0.00 0.00 174.62 174.63 3khu h PRO 186 N 0.01 1.20 -0.42 3.99 0.11 -1.99 0.48 132.00 135.37 3khu h PRO 186 Ca -0.46 -0.07 -0.11 0.00 0.11 0.00 0.00 66.00 65.47 3khu h PRO 186 Cb 1.23 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 3khu h PRO 186 CO 0.61 0.79 -0.15 0.93 -0.21 0.00 0.00 178.00 179.97 3khu h GLU 187 N 1.24 0.85 -0.46 1.05 4.39 -1.94 -1.99 114.58 117.72 3khu h GLU 187 Ca 0.40 -0.35 0.05 0.00 0.34 0.00 0.00 59.36 59.80 3khu h GLU 187 Cb 0.04 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 3khu h GLU 187 CO -0.13 0.99 0.20 0.78 -1.16 0.00 0.00 179.01 179.69 3khu h GLY 188 N 0.68 0.62 1.92 -3.84 0.00 -1.55 -1.86 103.07 99.03 3khu h GLY 188 Ca 0.10 -0.13 -0.10 0.00 0.00 0.00 0.00 47.33 47.20 3khu h GLY 188 CO 0.05 0.06 -0.45 1.46 0.00 0.00 0.00 176.54 177.67 3khu h GLN 189 N 0.40 0.09 -0.60 4.80 1.08 -0.83 -0.94 115.11 119.11 3khu h GLN 189 Ca 0.21 -0.04 -0.07 0.00 -1.45 0.00 0.00 58.65 57.30 3khu h GLN 189 Cb 0.16 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.57 3khu h GLN 189 CO -0.18 0.52 0.12 -0.09 -0.95 0.00 0.00 178.83 178.25 3khu h ARG 190 N 0.07 0.98 -0.24 1.46 2.43 -0.96 -0.90 114.38 117.23 3khu h ARG 190 Ca 0.00 -0.25 -0.08 0.00 -0.81 0.00 0.00 59.98 58.84 3khu h ARG 190 Cb 0.83 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 3khu h ARG 190 CO 0.06 0.92 -0.15 0.00 -1.51 0.00 0.00 179.97 179.29 3khu h ALA 191 N 1.03 0.35 -0.32 2.80 0.00 -0.90 -1.88 119.26 120.34 3khu h ALA 191 Ca 0.19 -0.33 0.05 0.00 0.00 0.00 0.00 54.91 54.82 3khu h ALA 191 Cb 0.40 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3khu h ALA 191 CO 0.01 0.24 0.04 0.28 0.00 0.00 0.00 179.25 179.82 3khu h VAL 192 N 0.25 0.82 -0.70 0.00 2.07 -1.04 -2.06 116.25 115.58 3khu h VAL 192 Ca 0.05 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3khu h VAL 192 Cb 0.67 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3khu h VAL 192 CO 0.04 0.03 0.46 -0.61 0.02 0.00 0.00 177.57 177.51 3khu h GLN 193 N 0.15 0.92 -0.96 1.57 4.15 -1.08 -0.62 115.11 119.23 3khu h GLN 193 Ca 0.15 -0.06 0.05 0.00 0.77 0.00 0.00 58.65 59.57 3khu h GLN 193 Cb 0.18 -0.21 -0.06 0.00 0.21 0.00 0.00 27.48 27.60 3khu h GLN 193 CO -0.22 0.61 0.62 0.00 -1.93 0.00 0.00 178.83 177.91 3khu h ALA 194 N 1.26 1.30 -0.07 3.38 0.00 -0.75 -0.16 119.26 124.22 3khu h ALA 194 Ca 0.26 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.93 3khu h ALA 194 Cb -0.10 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.38 3khu h ALA 194 CO -0.06 0.45 -0.83 1.25 0.00 0.00 0.00 179.25 180.07 3khu h LEU 195 N 1.17 0.64 -0.47 0.00 5.85 -0.73 -3.03 115.31 118.73 3khu h LEU 195 Ca 0.40 -0.45 0.09 0.00 0.84 0.00 0.00 57.88 58.75 3khu h LEU 195 Cb 0.08 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 40.85 3khu h LEU 195 CO -0.15 1.23 0.03 0.00 -0.34 0.00 0.00 178.44 179.21 3khu h ALA 197 N 1.41 2.03 0.61 0.00 0.00 -0.94 0.92 119.26 123.28 3khu h ALA 197 Ca 0.24 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 3khu h ALA 197 Cb 0.34 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.08 3khu h ALA 197 CO -0.37 -0.11 -0.29 0.28 0.00 0.00 0.00 179.25 178.76 3khu h VAL 198 N 0.28 0.37 0.00 0.00 2.07 -1.30 -3.08 116.25 114.59 3khu h VAL 198 Ca 0.18 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 3khu h VAL 198 Cb 0.37 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 3khu h VAL 198 CO -0.04 0.02 -0.01 1.88 0.02 0.00 0.00 177.57 179.44 3khu h TYR 199 N -0.91 0.00 0.00 1.57 -1.99 -0.99 -2.21 116.97 112.44 3khu h TYR 199 Ca -0.08 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.65 3khu h TYR 199 Cb 0.66 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.39 3khu h TYR 199 CO -0.02 0.01 0.00 0.39 -0.00 0.00 0.00 178.16 178.55 3khu n GLU 200 N -4.38 0.16 0.27 4.88 1.02 0.20 -0.69 120.64 122.10 3khu n GLU 200 Ca -0.03 0.47 0.16 0.00 -0.02 0.00 0.00 57.16 57.74 3khu n GLU 200 Cb 0.10 -1.86 0.89 0.00 -0.02 0.00 0.00 31.44 30.54 3khu n GLU 200 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3khu h HIS 201 N 0.00 0.00 0.00 -0.32 3.86 -1.45 -3.35 115.15 113.88 3khu h HIS 201 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3khu h HIS 201 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.72 3khu h HIS 201 CO 0.00 0.00 0.00 -2.67 0.86 0.00 0.00 177.93 176.12 3khu n TRP 202 N -3.83 0.00 -4.60 2.45 2.14 -0.64 -5.00 117.44 107.96 3khu n TRP 202 Ca -0.01 0.00 -0.33 0.00 2.07 0.00 0.00 57.50 59.22 3khu n TRP 202 Cb 0.17 0.00 -0.15 0.00 -0.81 0.00 0.00 31.31 30.53 3khu n TRP 202 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 3khu s VAL 203 N 0.00 2.98 0.37 -1.67 1.01 0.13 -4.99 120.40 118.23 3khu s VAL 203 Ca 0.00 -0.67 -0.27 0.00 0.00 0.00 0.00 61.98 61.04 3khu s VAL 203 Cb 0.00 -2.26 -0.11 0.00 0.00 0.00 0.00 36.38 34.00 3khu s VAL 203 CO 0.00 0.51 1.25 -2.65 0.00 0.00 0.00 175.10 174.21 3khu n PRO 204 N 3.82 1.97 -0.32 2.72 -0.02 -1.26 -4.24 135.00 137.67 3khu n PRO 204 Ca -0.18 0.69 0.17 0.00 -2.02 0.00 0.00 63.50 62.15 3khu n PRO 204 Cb 0.52 -2.30 0.41 0.00 -0.02 0.00 0.00 33.50 32.11 3khu n PRO 204 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3khu h ARG 205 N 2.29 0.58 0.00 -0.52 9.65 -1.95 -1.14 114.38 123.29 3khu h ARG 205 Ca -0.46 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.38 3khu h ARG 205 Cb 1.29 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.74 3khu h ARG 205 CO 0.61 0.38 0.00 -0.85 2.80 0.00 0.00 179.97 182.91 3khu n GLU 206 N -4.67 0.04 -0.02 0.20 0.00 -1.26 -1.67 120.64 113.26 3khu n GLU 206 Ca 0.23 0.24 0.12 0.00 0.00 0.00 0.00 57.16 57.75 3khu n GLU 206 Cb 0.67 -1.57 0.18 0.00 0.00 0.00 0.00 31.44 30.72 3khu n GLU 206 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3khu n LYS 207 N -1.64 2.23 -3.60 3.44 5.02 -0.43 -4.86 118.16 118.32 3khu n LYS 207 Ca 0.04 -1.79 -0.39 0.00 -2.02 0.00 0.00 58.31 54.15 3khu n LYS 207 Cb 0.21 -1.47 -0.11 0.00 -0.02 0.00 0.00 35.03 33.64 3khu n LYS 207 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3khu s ILE 208 N -1.96 5.00 -0.17 -0.18 1.01 -0.67 -0.80 121.20 123.43 3khu s ILE 208 Ca 0.31 -0.21 -0.05 0.00 0.00 0.00 0.00 60.65 60.70 3khu s ILE 208 Cb 0.20 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 3khu s ILE 208 CO 0.31 0.08 -0.01 -0.22 0.00 0.00 0.00 174.94 175.10 3khu s LEU 209 N 1.69 3.36 -0.09 2.97 2.96 0.78 -4.97 118.68 125.39 3khu s LEU 209 Ca 0.06 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 3khu s LEU 209 Cb -0.17 -1.83 -0.02 0.00 0.50 0.00 0.00 46.19 44.67 3khu s LEU 209 CO 0.09 0.14 -0.11 0.42 -1.32 0.00 0.00 176.35 175.57 3khu s THR 210 N 0.55 3.32 0.21 3.68 -4.23 -1.26 -1.58 115.64 116.34 3khu s THR 210 Ca -0.01 -0.60 0.04 0.00 -1.18 0.00 0.00 61.69 59.94 3khu s THR 210 Cb -0.14 -2.36 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 3khu s THR 210 CO 0.02 0.56 0.20 0.35 -0.54 0.00 0.00 174.62 175.22 3khu n THR 211 N 2.78 0.00 -1.96 3.99 -2.24 -0.39 -4.98 114.28 111.47 3khu n THR 211 Ca -0.18 -1.49 -0.30 0.00 -2.27 0.00 0.00 64.05 59.81 3khu n THR 211 Cb 0.53 0.77 0.04 0.00 -2.10 0.00 0.00 70.33 69.56 3khu n THR 211 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3khu s ASN 212 N -2.47 5.65 0.19 3.42 2.20 -1.26 -2.27 114.94 120.40 3khu s ASN 212 Ca 0.24 1.14 -0.12 0.00 -0.94 0.00 0.00 52.86 53.18 3khu s ASN 212 Cb 0.01 -2.03 0.12 0.00 -2.00 0.00 0.00 41.25 37.35 3khu s ASN 212 CO 0.17 -1.19 1.86 0.74 -2.94 0.00 0.00 177.10 175.74 3khu h THR 213 N -0.51 1.16 -0.36 0.54 2.02 -1.79 -1.90 112.91 112.06 3khu h THR 213 Ca -0.45 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.42 3khu h THR 213 Cb 1.24 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 3khu h THR 213 CO 0.63 0.16 0.17 -0.50 0.37 0.00 0.00 175.52 176.35 3khu h TRP 214 N 0.86 0.52 -0.96 3.16 6.55 -1.93 -1.82 115.95 122.33 3khu h TRP 214 Ca 0.24 -0.03 0.06 0.00 0.95 0.00 0.00 58.89 60.11 3khu h TRP 214 Cb -0.09 -0.16 -0.06 0.00 -0.86 0.00 0.00 29.16 27.99 3khu h TRP 214 CO -0.03 0.45 0.61 0.77 -1.05 0.00 0.00 178.44 179.19 3khu h SER 215 N 0.44 0.98 0.36 -3.49 0.02 -1.86 0.25 113.55 110.26 3khu h SER 215 Ca 0.12 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 3khu h SER 215 Cb 0.12 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.47 3khu h SER 215 CO -0.02 0.63 -0.17 -1.28 -1.14 0.00 0.00 176.83 174.85 3khu h SER 216 N 1.12 -0.40 -0.40 3.07 0.87 -0.95 0.13 113.55 116.98 3khu h SER 216 Ca 0.41 -0.10 0.02 0.00 -1.23 0.00 0.00 61.79 60.90 3khu h SER 216 Cb 0.16 0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.19 3khu h SER 216 CO -0.17 -0.14 0.22 -0.33 -0.53 0.00 0.00 176.83 175.89 3khu h GLU 217 N -0.67 0.44 -0.44 2.24 5.08 -0.99 -2.37 114.58 117.86 3khu h GLU 217 Ca -0.05 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 3khu h GLU 217 Cb 0.48 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 3khu h GLU 217 CO 0.08 0.29 0.05 1.25 -1.00 0.00 0.00 179.01 179.68 3khu h LEU 218 N 0.45 0.64 -1.22 1.33 5.85 -0.92 -2.96 115.31 118.48 3khu h LEU 218 Ca 0.17 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3khu h LEU 218 Cb 0.04 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 3khu h LEU 218 CO -0.09 0.67 0.30 0.28 -0.34 0.00 0.00 178.44 179.26 3khu h SER 219 N 0.65 0.75 0.11 1.25 0.02 -0.43 -0.40 113.55 115.51 3khu h SER 219 Ca 0.14 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 3khu h SER 219 Cb 0.33 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.68 3khu h SER 219 CO 0.01 0.63 -0.05 0.50 -1.14 0.00 0.00 176.83 176.78 3khu h LYS 220 N 0.84 -0.14 -0.46 3.45 1.63 -1.39 0.60 116.57 121.10 3khu h LYS 220 Ca 0.21 0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.97 3khu h LYS 220 Cb 0.07 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.71 3khu h LYS 220 CO -0.03 0.03 0.09 -0.07 -3.45 0.00 0.00 179.45 176.03 3khu h LEU 221 N -0.30 0.72 -0.65 5.20 3.38 -1.56 -2.74 115.31 119.36 3khu h LEU 221 Ca -0.02 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.63 3khu h LEU 221 Cb 0.24 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 3khu h LEU 221 CO 0.02 0.78 0.11 0.00 0.09 0.00 0.00 178.44 179.44 3khu h ALA 222 N 0.97 0.87 -0.33 1.53 0.00 -1.01 -0.26 119.26 121.02 3khu h ALA 222 Ca 0.14 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.81 3khu h ALA 222 Cb 0.35 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3khu h ALA 222 CO 0.01 0.63 0.16 0.00 0.00 0.00 0.00 179.25 180.04 3khu h ALA 223 N 1.04 0.40 -0.53 0.00 0.00 -0.72 0.13 119.26 119.59 3khu h ALA 223 Ca 0.20 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 3khu h ALA 223 Cb 0.44 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3khu h ALA 223 CO 0.01 -0.22 0.07 -0.91 0.00 0.00 0.00 179.25 178.20 3khu h ASN 224 N 0.33 0.79 -0.61 0.00 2.35 -1.24 -0.79 115.58 116.41 3khu h ASN 224 Ca 0.14 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 3khu h ASN 224 Cb 0.06 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.20 3khu h ASN 224 CO -0.11 0.82 0.29 0.00 -1.65 0.00 0.00 177.43 176.78 3khu h ALA 225 N 1.28 0.79 -0.62 -0.83 0.00 -0.14 0.23 119.26 119.97 3khu h ALA 225 Ca 0.17 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3khu h ALA 225 Cb 0.38 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3khu h ALA 225 CO 0.01 0.35 0.07 0.74 0.00 0.00 0.00 179.25 180.42 3khu h PHE 226 N 0.83 1.12 -0.32 0.00 -1.00 -0.29 0.91 116.94 118.19 3khu h PHE 226 Ca 0.21 -0.16 -0.04 0.00 2.81 0.00 0.00 57.97 60.79 3khu h PHE 226 Cb 0.12 -0.30 -0.01 0.00 3.61 0.00 0.00 35.95 39.36 3khu h PHE 226 CO -0.00 0.95 0.05 -0.07 -1.61 0.00 0.00 178.31 177.63 3khu h LEU 227 N 0.97 0.52 -1.06 1.54 3.38 -0.83 -1.88 115.31 117.94 3khu h LEU 227 Ca 0.19 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 3khu h LEU 227 Cb 0.46 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 3khu h LEU 227 CO 0.02 0.65 -0.03 0.00 0.09 0.00 0.00 178.44 179.17 3khu h ALA 228 N 0.88 1.23 -0.51 1.53 0.00 -0.74 -2.41 119.26 119.24 3khu h ALA 228 Ca 0.10 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 3khu h ALA 228 Cb 0.36 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3khu h ALA 228 CO 0.01 0.51 0.04 0.37 0.00 0.00 0.00 179.25 180.18 3khu h GLN 229 N 0.59 0.82 -0.81 0.00 4.15 -0.52 -0.82 115.11 118.52 3khu h GLN 229 Ca 0.12 -0.21 0.01 0.00 0.77 0.00 0.00 58.65 59.34 3khu h GLN 229 Cb 0.42 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.97 3khu h GLN 229 CO 0.02 0.80 0.53 0.00 -1.93 0.00 0.00 178.83 178.25 3khu h ARG 230 N 0.78 1.07 -0.18 1.69 3.08 -0.84 0.33 114.38 120.31 3khu h ARG 230 Ca 0.16 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 3khu h ARG 230 Cb 0.41 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 3khu h ARG 230 CO 0.01 0.71 -0.12 0.82 -1.07 0.00 0.00 179.97 180.33 3khu h ILE 231 N 1.10 1.32 -0.24 2.04 2.04 -1.28 -1.12 117.51 121.37 3khu h ILE 231 Ca 0.30 -1.22 -0.05 0.00 1.00 0.00 0.00 64.86 64.89 3khu h ILE 231 Cb -0.12 1.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 3khu h ILE 231 CO -0.06 0.36 -0.09 0.28 0.00 0.00 0.00 178.15 178.64 3khu h SER 232 N 0.06 0.36 -0.02 1.72 0.02 -0.89 0.68 113.55 115.47 3khu h SER 232 Ca 0.04 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 3khu h SER 232 Cb 0.62 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 3khu h SER 232 CO 0.03 0.49 0.00 0.28 -1.14 0.00 0.00 176.83 176.50 3khu h SER 233 N 0.36 0.03 0.30 3.07 0.02 -0.12 0.20 113.55 117.41 3khu h SER 233 Ca 0.07 -0.29 -0.12 0.00 -0.84 0.00 0.00 61.79 60.62 3khu h SER 233 Cb 0.39 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 3khu h SER 233 CO 0.02 0.31 -0.48 -0.29 -1.14 0.00 0.00 176.83 175.25 3khu h ILE 234 N -0.25 1.34 -0.43 3.27 6.09 -1.01 -1.82 117.51 124.70 3khu h ILE 234 Ca 0.01 -1.69 -0.02 0.00 -1.37 0.00 0.00 64.86 61.79 3khu h ILE 234 Cb 0.30 1.81 -0.02 0.00 0.47 0.00 0.00 36.82 39.37 3khu h ILE 234 CO 0.00 0.50 0.16 0.78 -3.07 0.00 0.00 178.15 176.52 3khu h ASN 235 N 0.18 0.56 -0.46 2.19 2.35 -0.75 -0.80 115.58 118.83 3khu h ASN 235 Ca 0.01 -0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.63 3khu h ASN 235 Cb 0.91 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 39.12 3khu h ASN 235 CO 0.07 0.51 0.03 0.77 -1.65 0.00 0.00 177.43 177.17 3khu h SER 236 N 0.61 0.78 -0.21 5.81 4.64 -0.31 -2.11 113.55 122.76 3khu h SER 236 Ca 0.15 -0.29 0.01 0.00 -0.47 0.00 0.00 61.79 61.19 3khu h SER 236 Cb 0.14 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 3khu h SER 236 CO -0.01 0.87 0.14 0.40 -0.87 0.00 0.00 176.83 177.36 3khu h ILE 237 N 0.65 1.05 -0.42 0.95 1.08 -0.93 -2.53 117.51 117.37 3khu h ILE 237 Ca 0.14 -0.09 -0.03 0.00 -0.39 0.00 0.00 64.86 64.48 3khu h ILE 237 Cb 0.45 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 34.93 3khu h ILE 237 CO 0.02 0.05 0.11 0.77 -0.69 0.00 0.00 178.15 178.41 3khu h SER 238 N 0.27 0.56 -0.50 1.72 4.64 -0.45 0.58 113.55 120.37 3khu h SER 238 Ca 0.08 -0.08 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 3khu h SER 238 Cb -0.01 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 3khu h SER 238 CO -0.02 0.55 -0.12 0.00 -0.87 0.00 0.00 176.83 176.38 3khu h ALA 239 N 1.53 0.80 -0.40 5.18 0.00 -1.29 -2.38 119.26 122.70 3khu h ALA 239 Ca 0.14 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.56 3khu h ALA 239 Cb 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3khu h ALA 239 CO -0.01 0.66 -0.29 1.25 0.00 0.00 0.00 179.25 180.86 3khu h LEU 240 N 0.88 0.90 -0.39 0.00 5.85 -1.25 -2.79 115.31 118.52 3khu h LEU 240 Ca 0.14 -0.37 0.01 0.00 0.84 0.00 0.00 57.88 58.50 3khu h LEU 240 Cb 0.67 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 3khu h LEU 240 CO 0.05 1.13 0.24 0.00 -0.34 0.00 0.00 178.44 179.51 3khu h GLU 242 N 0.48 0.04 0.00 0.00 5.08 -1.29 -0.81 114.58 118.08 3khu h GLU 242 Ca 0.15 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.46 3khu h GLU 242 Cb -0.01 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3khu h GLU 242 CO -0.06 0.03 -0.58 0.00 -1.00 0.00 0.00 179.01 177.40 3khu h ALA 243 N 1.91 0.74 0.00 3.43 0.00 -1.11 -3.39 119.26 120.84 3khu h ALA 243 Ca 0.08 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 3khu h ALA 243 Cb 0.28 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3khu h ALA 243 CO -0.01 0.31 -1.34 0.25 0.00 0.00 0.00 179.25 178.46 3khu n THR 244 N -3.00 0.33 0.00 0.00 -2.24 -0.69 -5.02 114.28 103.66 3khu n THR 244 Ca 0.01 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 3khu n THR 244 Cb 0.64 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 3khu n THR 244 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3khu n GLY 245 N 2.67 0.31 3.57 3.38 0.00 -0.35 -5.09 105.19 109.69 3khu n GLY 245 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 3khu n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3khu s ALA 246 N -2.00 0.37 -0.10 4.61 0.00 -1.22 -4.85 121.76 118.57 3khu s ALA 246 Ca 0.00 0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.16 3khu s ALA 246 Cb 0.00 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 19.80 3khu s ALA 246 CO 0.00 -3.37 -0.15 0.34 0.00 0.00 0.00 175.76 172.58 3khu s ASP 247 N -2.60 2.33 0.43 0.00 2.15 -1.26 -4.47 116.67 113.25 3khu s ASP 247 Ca 0.68 -0.40 0.19 0.00 0.43 0.00 0.00 52.55 53.44 3khu s ASP 247 Cb -0.24 -1.04 0.97 0.00 -0.30 0.00 0.00 42.92 42.31 3khu s ASP 247 CO 0.62 0.02 1.90 1.62 -0.17 0.00 0.00 175.17 179.15 3khu h VAL 248 N 5.96 0.94 -0.20 1.11 3.04 -1.63 -0.82 116.25 124.66 3khu h VAL 248 Ca -0.30 -1.03 -0.17 0.00 -1.01 0.00 0.00 66.70 64.18 3khu h VAL 248 Cb 1.18 1.60 -0.00 0.00 -2.01 0.00 0.00 31.29 32.06 3khu h VAL 248 CO 0.48 0.27 -0.57 -0.33 -1.01 0.00 0.00 177.57 176.41 3khu h GLU 249 N 0.00 0.61 -0.16 4.17 4.39 -1.93 0.63 114.58 122.28 3khu h GLU 249 Ca -0.00 -0.40 -0.01 0.00 0.34 0.00 0.00 59.36 59.30 3khu h GLU 249 Cb 0.58 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 3khu h GLU 249 CO 0.04 1.01 0.08 0.93 -1.16 0.00 0.00 179.01 179.91 3khu h GLU 250 N 0.46 0.23 -0.47 2.33 5.08 -1.61 -1.85 114.58 118.77 3khu h GLU 250 Ca 0.01 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 3khu h GLU 250 Cb 1.13 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 3khu h GLU 250 CO 0.11 0.27 0.12 0.28 -1.00 0.00 0.00 179.01 178.79 3khu h VAL 251 N 0.14 1.23 -0.84 3.13 2.07 -1.18 -1.00 116.25 119.79 3khu h VAL 251 Ca 0.06 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.77 3khu h VAL 251 Cb 0.11 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 3khu h VAL 251 CO -0.01 0.29 0.54 0.00 0.02 0.00 0.00 177.57 178.41 3khu h ALA 252 N 0.98 1.07 -0.40 1.67 0.00 -0.81 0.57 119.26 122.34 3khu h ALA 252 Ca 0.15 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3khu h ALA 252 Cb 0.31 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3khu h ALA 252 CO 0.00 0.50 0.06 1.15 0.00 0.00 0.00 179.25 180.95 3khu h THR 253 N 1.14 1.24 -0.31 0.00 2.02 -0.97 -0.69 112.91 115.35 3khu h THR 253 Ca 0.31 -0.89 -0.01 0.00 0.77 0.00 0.00 66.41 66.59 3khu h THR 253 Cb -0.10 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 3khu h THR 253 CO -0.06 0.30 0.16 0.00 0.37 0.00 0.00 175.52 176.29 3khu h ALA 254 N 0.92 0.39 -0.08 6.16 0.00 -0.59 -2.24 119.26 123.82 3khu h ALA 254 Ca 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3khu h ALA 254 Cb 0.38 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3khu h ALA 254 CO 0.01 -0.06 0.04 0.82 0.00 0.00 0.00 179.25 180.06 3khu h ILE 255 N 0.37 1.10 0.00 0.00 2.04 -0.88 -3.15 117.51 116.99 3khu h ILE 255 Ca 0.11 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.68 3khu h ILE 255 Cb 0.09 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 3khu h ILE 255 CO -0.02 0.09 0.00 1.23 0.00 0.00 0.00 178.15 179.45 3khu h GLY 256 N 0.02 0.00 2.00 5.37 0.00 -0.92 -2.20 103.07 107.33 3khu h GLY 256 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3khu h GLY 256 CO -0.00 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.57 3khu n MET 257 N -2.39 0.23 -2.12 4.80 2.81 -0.86 -3.04 117.12 116.54 3khu n MET 257 Ca 0.01 0.22 -0.43 0.00 -1.81 0.00 0.00 57.70 55.70 3khu n MET 257 Cb 0.21 -1.79 -0.02 0.00 -0.71 0.00 0.00 33.22 30.91 3khu n MET 257 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3khu s ASP 258 N -4.35 6.17 0.00 7.83 -1.08 -0.83 -4.89 116.67 119.52 3khu s ASP 258 Ca 0.10 1.32 0.10 0.00 -0.52 0.00 0.00 52.55 53.55 3khu s ASP 258 Cb 0.12 -2.53 0.45 0.00 -1.46 0.00 0.00 42.92 39.51 3khu s ASP 258 CO 0.56 -1.48 1.32 0.00 0.52 0.00 0.00 175.17 176.09 3khu n GLN 259 N 8.07 0.02 0.15 4.34 6.02 -1.26 -0.58 117.38 134.13 3khu n GLN 259 Ca 0.20 0.30 0.04 0.00 -0.01 0.00 0.00 57.00 57.53 3khu n GLN 259 Cb 0.46 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.32 3khu n GLN 259 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3khu h ARG 260 N 0.00 0.00 0.06 -1.09 3.08 -1.94 -3.34 114.38 111.16 3khu h ARG 260 Ca 0.00 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.68 3khu h ARG 260 Cb 0.17 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 3khu h ARG 260 CO 0.00 0.45 -2.21 -0.89 -1.07 0.00 0.00 179.97 176.25 3khu n ILE 261 N -3.26 1.64 -0.05 2.04 5.41 0.25 -5.11 119.36 120.28 3khu n ILE 261 Ca 0.02 -0.63 0.01 0.00 1.00 0.00 0.00 62.75 63.14 3khu n ILE 261 Cb 0.68 -1.54 -0.00 0.00 -0.71 0.00 0.00 39.64 38.07 3khu n ILE 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3khu n GLY 262 N 2.09 -2.66 0.89 7.39 0.00 -0.22 -4.84 105.19 107.84 3khu n GLY 262 Ca -0.38 -1.43 0.08 0.00 0.00 0.00 0.00 46.02 44.30 3khu n GLY 262 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3khu n ASN 263 N -2.06 3.22 -4.93 1.61 0.23 -1.17 -4.37 115.26 107.79 3khu n ASN 263 Ca -0.00 -1.96 -0.27 0.00 -0.53 0.00 0.00 54.58 51.82 3khu n ASN 263 Cb 0.02 -0.29 -0.03 0.00 -2.08 0.00 0.00 39.78 37.40 3khu n ASN 263 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 3khu s LYS 264 N -1.04 3.52 -1.35 -3.83 -0.14 -1.26 -4.50 119.74 111.13 3khu s LYS 264 Ca 0.32 -0.33 -0.08 0.00 -1.36 0.00 0.00 55.97 54.52 3khu s LYS 264 Cb 0.17 -2.82 0.02 0.00 -1.68 0.00 0.00 37.83 33.52 3khu s LYS 264 CO 0.22 0.38 1.10 1.19 -0.76 0.00 0.00 175.35 177.49 3khu n PHE 265 N -0.74 -2.64 -1.83 3.18 0.99 -1.26 -4.91 117.46 110.25 3khu n PHE 265 Ca -0.05 0.98 0.06 0.00 -0.00 0.00 0.00 57.45 58.44 3khu n PHE 265 Cb 0.54 -4.88 0.15 0.00 -1.00 0.00 0.00 39.48 34.29 3khu n PHE 265 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 3khu n LEU 266 N -4.77 2.12 -4.49 4.37 4.77 -1.26 -3.90 117.00 113.83 3khu n LEU 266 Ca -0.06 -3.23 -0.43 0.00 -0.03 0.00 0.00 56.01 52.26 3khu n LEU 266 Cb 0.58 -0.36 -0.08 0.00 -2.33 0.00 0.00 43.42 41.24 3khu n LEU 266 CO 0.66 1.07 0.25 -0.54 -1.33 0.00 0.00 177.39 177.50 3khu s LYS 267 N -2.21 3.17 0.70 3.23 3.01 -1.26 -4.85 119.74 121.53 3khu s LYS 267 Ca 0.35 -0.62 -0.16 0.00 -1.01 0.00 0.00 55.97 54.53 3khu s LYS 267 Cb 0.36 -3.98 0.01 0.00 -1.01 0.00 0.00 37.83 33.21 3khu s LYS 267 CO -0.09 -0.97 1.10 0.00 0.51 0.00 0.00 175.35 175.90 3khu n ALA 268 N 5.94 0.23 -3.83 5.17 0.00 -1.26 -4.97 120.51 121.80 3khu n ALA 268 Ca -0.05 -0.14 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 3khu n ALA 268 Cb 0.47 -2.20 -0.02 0.00 0.00 0.00 0.00 19.45 17.71 3khu n ALA 268 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3khu s SER 269 N -1.60 -0.26 0.56 0.00 1.04 -1.26 -4.76 113.70 107.41 3khu s SER 269 Ca 0.76 -0.55 0.32 0.00 0.48 0.00 0.00 55.95 56.96 3khu s SER 269 Cb -0.35 0.69 1.67 0.00 0.10 0.00 0.00 66.02 68.12 3khu s SER 269 CO 0.47 -1.27 2.14 1.62 0.98 0.00 0.00 173.24 177.18 3khu h VAL 270 N 2.00 0.38 0.00 5.02 3.04 -1.55 -3.46 116.25 121.68 3khu h VAL 270 Ca -0.20 -0.37 0.00 0.00 -1.01 0.00 0.00 66.70 65.12 3khu h VAL 270 Cb 1.25 1.26 0.00 0.00 -2.01 0.00 0.00 31.29 31.79 3khu h VAL 270 CO 0.24 0.07 0.00 0.61 -1.01 0.00 0.00 177.57 177.48 3khu n GLY 271 N -0.73 4.00 3.78 3.17 0.00 -1.26 -3.06 105.19 111.08 3khu n GLY 271 Ca -0.02 -0.69 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 3khu n GLY 271 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3khu s PHE 272 N -1.78 2.90 0.00 1.61 -0.12 -1.26 -4.51 117.98 114.83 3khu s PHE 272 Ca 0.00 1.57 0.00 0.00 -0.05 0.00 0.00 56.93 58.45 3khu s PHE 272 Cb 0.00 -3.24 0.00 0.00 -0.63 0.00 0.00 43.02 39.15 3khu s PHE 272 CO 0.00 -1.23 0.00 0.41 -0.05 0.00 0.00 175.22 174.35 3khu n GLY 273 N 0.19 5.80 0.00 1.99 0.00 -1.26 -4.71 105.19 107.20 3khu n GLY 273 Ca 0.09 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3khu n GLY 273 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3khu n GLY 274 N 1.22 1.11 0.36 -0.02 0.00 0.84 -4.61 105.19 104.09 3khu n GLY 274 Ca 0.00 -1.91 0.13 0.00 0.00 0.00 0.00 46.02 44.24 3khu n GLY 274 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3khu n SER 275 N -0.31 1.09 -0.09 1.61 3.41 -1.26 -4.29 113.62 113.80 3khu n SER 275 Ca 0.00 -1.45 -0.14 0.00 -0.26 0.00 0.00 58.87 57.01 3khu n SER 275 Cb 0.00 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 63.87 3khu n SER 275 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3khu h PHE 277 N -0.83 -0.75 -0.08 0.00 0.04 -1.82 0.59 116.94 114.09 3khu h PHE 277 Ca -0.23 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.52 3khu h PHE 277 Cb 1.10 0.25 -0.00 0.00 2.20 0.00 0.00 35.95 39.50 3khu h PHE 277 CO -0.25 -0.43 0.05 0.37 -0.60 0.00 0.00 178.31 177.45 3khu h GLN 278 N -0.91 0.11 -0.46 1.51 4.15 -1.89 -0.30 115.11 117.32 3khu h GLN 278 Ca -0.08 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.37 3khu h GLN 278 Cb 0.66 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.28 3khu h GLN 278 CO 0.14 0.14 0.22 -0.22 -1.93 0.00 0.00 178.83 177.18 3khu h LYS 279 N 0.05 0.42 -0.28 1.69 3.64 -1.81 -0.62 116.57 119.65 3khu h LYS 279 Ca 0.03 -0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 59.21 3khu h LYS 279 Cb 0.06 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3khu h LYS 279 CO -0.00 0.28 -0.53 -0.44 -2.27 0.00 0.00 179.45 176.48 3khu h ASP 280 N 0.43 0.91 -0.36 4.20 3.32 -0.67 -1.52 116.42 122.73 3khu h ASP 280 Ca 0.21 -0.48 -0.05 0.00 0.02 0.00 0.00 57.03 56.73 3khu h ASP 280 Cb 0.14 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3khu h ASP 280 CO -0.16 1.26 0.03 0.58 -1.72 0.00 0.00 179.24 179.23 3khu h VAL 281 N 0.64 1.25 -0.33 -1.35 2.07 -0.84 -0.78 116.25 116.90 3khu h VAL 281 Ca 0.02 -0.91 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 3khu h VAL 281 Cb 1.12 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 3khu h VAL 281 CO 0.12 0.30 0.12 -0.07 0.02 0.00 0.00 177.57 178.06 3khu h LEU 282 N 0.44 0.42 -0.49 2.57 3.38 -1.09 -0.01 115.31 120.54 3khu h LEU 282 Ca 0.11 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 3khu h LEU 282 Cb 0.40 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3khu h LEU 282 CO 0.01 0.40 -0.27 -1.13 0.09 0.00 0.00 178.44 177.55 3khu h ASN 283 N 0.47 0.99 -0.19 -0.43 -0.73 -0.84 -1.14 115.58 113.71 3khu h ASN 283 Ca 0.12 -0.40 0.01 0.00 1.87 0.00 0.00 56.30 57.90 3khu h ASN 283 Cb 0.13 -0.28 -0.01 0.00 0.27 0.00 0.00 38.32 38.43 3khu h ASN 283 CO -0.01 1.19 0.10 0.25 -0.37 0.00 0.00 177.43 178.59 3khu h LEU 284 N 0.81 0.16 -0.35 0.34 5.85 -0.32 -0.94 115.31 120.87 3khu h LEU 284 Ca 0.09 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3khu h LEU 284 Cb 0.85 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 3khu h LEU 284 CO 0.07 0.12 0.16 0.58 -0.34 0.00 0.00 178.44 179.04 3khu h VAL 285 N 0.22 0.97 -0.69 1.05 2.07 -0.83 -1.40 116.25 117.64 3khu h VAL 285 Ca 0.07 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3khu h VAL 285 Cb 0.00 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 3khu h VAL 285 CO -0.04 0.06 0.42 0.22 0.02 0.00 0.00 177.57 178.25 3khu h TYR 286 N 0.34 0.78 -0.53 1.57 3.20 -1.10 -1.42 116.97 119.81 3khu h TYR 286 Ca 0.15 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.09 3khu h TYR 286 Cb 0.07 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.04 3khu h TYR 286 CO -0.11 0.43 0.26 1.25 -1.64 0.00 0.00 178.16 178.35 3khu h LEU 287 N 0.81 0.36 -0.42 2.82 5.85 -0.57 -0.62 115.31 123.54 3khu h LEU 287 Ca 0.28 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 3khu h LEU 287 Cb 0.06 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3khu h LEU 287 CO -0.12 0.24 0.21 0.00 -0.34 0.00 0.00 178.44 178.43 3khu h GLU 289 N 0.54 0.49 0.00 0.00 5.08 -0.90 0.16 114.58 119.95 3khu h GLU 289 Ca 0.15 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 3khu h GLU 289 Cb 0.10 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 3khu h GLU 289 CO -0.02 0.33 -0.08 0.00 -1.00 0.00 0.00 179.01 178.24 3khu h ALA 290 N 1.20 1.83 -0.52 3.43 0.00 -0.77 -1.62 119.26 122.81 3khu h ALA 290 Ca 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3khu h ALA 290 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3khu h ALA 290 CO -0.08 0.10 0.00 1.28 0.00 0.00 0.00 179.25 180.54 3khu n LEU 291 N -4.38 3.17 -3.50 0.00 4.77 -0.43 -4.95 117.00 111.68 3khu n LEU 291 Ca -0.03 -1.59 -0.20 0.00 -0.03 0.00 0.00 56.01 54.16 3khu n LEU 291 Cb 0.16 -0.41 0.09 0.00 -2.33 0.00 0.00 43.42 40.92 3khu n LEU 291 CO 0.34 0.69 0.16 0.59 -1.33 0.00 0.00 177.39 177.84 3khu n ASN 292 N 0.97 -3.71 -3.30 -1.43 3.02 -0.61 -4.96 115.26 105.24 3khu n ASN 292 Ca 0.18 -0.59 -0.26 0.00 -0.03 0.00 0.00 54.58 53.88 3khu n ASN 292 Cb 0.54 -5.08 -0.07 0.00 -0.61 0.00 0.00 39.78 34.57 3khu n ASN 292 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3khu n LEU 293 N -4.47 3.49 0.19 3.41 4.77 -0.01 -4.92 117.00 119.46 3khu n LEU 293 Ca -0.17 -5.41 0.04 0.00 -0.03 0.00 0.00 56.01 50.43 3khu n LEU 293 Cb 0.63 -0.49 0.43 0.00 -2.33 0.00 0.00 43.42 41.66 3khu n LEU 293 CO 0.63 2.13 0.84 1.55 -1.33 0.00 0.00 177.39 181.21 3khu h PRO 294 N 3.89 0.06 -0.52 3.23 0.13 -1.90 -1.50 132.00 135.39 3khu h PRO 294 Ca 0.17 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 65.17 3khu h PRO 294 Cb 0.66 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.76 3khu h PRO 294 CO 0.79 0.29 -0.12 0.93 -0.23 0.00 0.00 178.00 179.66 3khu h GLU 295 N 0.05 0.99 -0.22 0.86 3.07 -1.95 -0.31 114.58 117.06 3khu h GLU 295 Ca 0.01 -0.37 -0.18 0.00 -0.50 0.00 0.00 59.36 58.32 3khu h GLU 295 Cb 0.44 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.28 3khu h GLU 295 CO 0.03 1.04 -0.58 0.28 -1.40 0.00 0.00 179.01 178.38 3khu h VAL 296 N 0.88 1.30 0.01 3.13 2.07 -1.84 -2.10 116.25 119.70 3khu h VAL 296 Ca 0.14 -1.80 0.02 0.00 0.82 0.00 0.00 66.70 65.87 3khu h VAL 296 Cb 0.68 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.16 3khu h VAL 296 CO 0.05 0.57 -0.15 0.00 0.02 0.00 0.00 177.57 178.06 3khu h ALA 297 N 0.80 -0.19 -0.44 1.67 0.00 -1.10 -2.02 119.26 117.99 3khu h ALA 297 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3khu h ALA 297 Cb 1.16 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 3khu h ALA 297 CO 0.12 -0.65 0.13 0.00 0.00 0.00 0.00 179.25 178.85 3khu h ARG 298 N -0.26 0.64 0.17 0.00 3.08 -0.95 -0.83 114.38 116.24 3khu h ARG 298 Ca 0.05 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3khu h ARG 298 Cb 0.32 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3khu h ARG 298 CO -0.14 0.57 -0.08 -0.92 -1.07 0.00 0.00 179.97 178.32 3khu h TYR 299 N 0.63 -0.22 0.00 3.04 3.20 -1.00 -3.10 116.97 119.52 3khu h TYR 299 Ca 0.15 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.89 3khu h TYR 299 Cb 0.20 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 3khu h TYR 299 CO 0.01 -0.06 -0.60 -1.49 -1.64 0.00 0.00 178.16 174.37 3khu h TRP 300 N -0.32 0.00 -0.51 -3.82 4.06 -1.06 -2.99 115.95 111.30 3khu h TRP 300 Ca -0.02 0.00 0.12 0.00 2.06 0.00 0.00 58.89 61.04 3khu h TRP 300 Cb 0.25 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.38 3khu h TRP 300 CO -0.04 0.60 0.36 0.37 -3.56 0.00 0.00 178.44 176.17 3khu h GLN 301 N 0.00 0.17 -0.13 0.49 5.75 -1.09 -1.39 115.11 118.91 3khu h GLN 301 Ca -0.01 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.52 3khu h GLN 301 Cb 1.09 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.59 3khu h GLN 301 CO 0.08 0.11 0.10 1.96 -2.65 0.00 0.00 178.83 178.43 3khu h GLN 302 N 0.18 0.00 -0.83 1.69 1.08 -1.45 -0.37 115.11 115.40 3khu h GLN 302 Ca 0.24 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.44 3khu h GLN 302 Cb 0.72 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.11 3khu h GLN 302 CO -0.04 0.00 0.50 0.28 -0.95 0.00 0.00 178.83 178.62 3khu h VAL 303 N 0.00 1.23 0.01 -0.54 2.07 -1.43 -1.07 116.25 116.53 3khu h VAL 303 Ca 0.06 -0.52 -0.18 0.00 0.82 0.00 0.00 66.70 66.89 3khu h VAL 303 Cb 0.27 0.07 0.01 0.00 -1.52 0.00 0.00 31.29 30.13 3khu h VAL 303 CO -0.00 0.25 -0.70 0.40 0.02 0.00 0.00 177.57 177.53 3khu h ILE 304 N 1.14 1.41 -0.79 4.57 1.08 -1.43 -2.78 117.51 120.72 3khu h ILE 304 Ca 0.30 -2.15 0.04 0.00 -0.39 0.00 0.00 64.86 62.66 3khu h ILE 304 Cb -0.04 2.61 -0.05 0.00 -3.07 0.00 0.00 36.82 36.28 3khu h ILE 304 CO -0.06 0.63 0.52 0.44 -0.69 0.00 0.00 178.15 178.99 3khu h ASP 305 N -0.04 0.81 -0.21 1.72 3.32 -1.04 0.79 116.42 121.77 3khu h ASP 305 Ca -0.09 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 56.81 3khu h ASP 305 Cb 1.41 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3khu h ASP 305 CO 0.14 0.55 -0.44 -0.03 -1.72 0.00 0.00 179.24 177.74 3khu h MET 306 N 0.93 0.67 -0.65 3.56 4.05 -1.25 0.28 114.93 122.52 3khu h MET 306 Ca 0.32 -0.44 0.00 0.00 -0.28 0.00 0.00 59.70 59.31 3khu h MET 306 Cb 0.10 0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 30.93 3khu h MET 306 CO -0.10 1.06 0.43 -0.97 0.23 0.00 0.00 176.91 177.55 3khu h ASN 307 N 0.37 0.76 -0.89 1.39 -1.24 -1.12 0.46 115.58 115.30 3khu h ASN 307 Ca 0.01 -0.03 -0.01 0.00 0.71 0.00 0.00 56.30 56.98 3khu h ASN 307 Cb 1.04 -0.19 -0.04 0.00 0.73 0.00 0.00 38.32 39.86 3khu h ASN 307 CO 0.10 0.56 0.51 0.44 -1.29 0.00 0.00 177.43 177.75 3khu h ASP 308 N 0.88 1.09 -0.21 1.15 3.32 -0.62 -2.44 116.42 119.59 3khu h ASP 308 Ca 0.24 -0.08 -0.14 0.00 0.02 0.00 0.00 57.03 57.07 3khu h ASP 308 Cb -0.09 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.17 3khu h ASP 308 CO -0.05 0.86 -0.36 0.22 -1.72 0.00 0.00 179.24 178.19 3khu h TYR 309 N 1.24 0.87 -0.58 4.55 3.20 -0.49 -1.26 116.97 124.51 3khu h TYR 309 Ca 0.32 -0.24 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 3khu h TYR 309 Cb -0.01 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.04 3khu h TYR 309 CO 0.01 0.99 0.14 0.37 -1.64 0.00 0.00 178.16 178.03 3khu h GLN 310 N 0.62 0.92 -0.37 1.82 5.75 -0.73 0.09 115.11 123.22 3khu h GLN 310 Ca 0.06 -0.22 -0.05 0.00 -0.15 0.00 0.00 58.65 58.29 3khu h GLN 310 Cb 0.89 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.30 3khu h GLN 310 CO 0.08 0.85 0.05 0.00 -2.65 0.00 0.00 178.83 177.17 3khu h ARG 311 N 0.83 0.62 -0.43 1.69 3.08 -1.29 -2.60 114.38 116.28 3khu h ARG 311 Ca 0.18 -0.17 -0.12 0.00 0.07 0.00 0.00 59.98 59.94 3khu h ARG 311 Cb 0.34 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 3khu h ARG 311 CO 0.00 0.69 -0.19 -0.09 -1.07 0.00 0.00 179.97 179.30 3khu h ARG 312 N 0.45 0.89 -0.20 0.04 2.43 -0.87 -1.23 114.38 115.89 3khu h ARG 312 Ca 0.11 -0.38 -0.11 0.00 -0.81 0.00 0.00 59.98 58.79 3khu h ARG 312 Cb 0.37 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 3khu h ARG 312 CO 0.01 1.03 -0.34 0.07 -1.51 0.00 0.00 179.97 179.23 3khu h ARG 313 N 0.72 0.41 -0.26 0.20 0.11 -1.02 0.46 114.38 115.00 3khu h ARG 313 Ca 0.10 -0.18 -0.02 0.00 0.10 0.00 0.00 59.98 59.98 3khu h ARG 313 Cb 0.76 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.82 3khu h ARG 313 CO 0.06 0.70 0.10 0.35 0.10 0.00 0.00 179.97 181.29 3khu h PHE 314 N 0.35 0.40 -0.85 4.08 3.57 -1.15 0.18 116.94 123.52 3khu h PHE 314 Ca 0.04 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.52 3khu h PHE 314 Cb 0.77 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.35 3khu h PHE 314 CO 0.02 0.41 0.56 0.00 -2.23 0.00 0.00 178.31 177.07 3khu h ALA 315 N 0.94 1.08 -0.68 2.41 0.00 -1.00 -2.53 119.26 119.49 3khu h ALA 315 Ca 0.09 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3khu h ALA 315 Cb 0.18 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3khu h ALA 315 CO -0.01 0.46 0.24 0.77 0.00 0.00 0.00 179.25 180.71 3khu h SER 316 N 1.13 0.94 -0.28 0.00 0.02 -0.45 -1.86 113.55 113.05 3khu h SER 316 Ca 0.32 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 61.14 3khu h SER 316 Cb -0.10 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.17 3khu h SER 316 CO -0.08 0.86 0.12 0.03 -1.14 0.00 0.00 176.83 176.62 3khu h ARG 317 N 0.99 0.26 -0.43 3.45 3.08 -0.56 0.80 114.38 121.97 3khu h ARG 317 Ca 0.22 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.27 3khu h ARG 317 Cb 0.24 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 3khu h ARG 317 CO -0.01 0.17 0.27 0.82 -1.07 0.00 0.00 179.97 180.14 3khu h ILE 318 N 0.27 1.07 -0.27 2.04 2.04 -1.14 0.29 117.51 121.81 3khu h ILE 318 Ca 0.12 -0.19 -0.13 0.00 1.00 0.00 0.00 64.86 65.66 3khu h ILE 318 Cb 0.05 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 3khu h ILE 318 CO -0.09 0.10 -0.35 0.40 0.00 0.00 0.00 178.15 178.20 3khu h ILE 319 N 0.54 1.30 -0.67 -0.67 2.04 -0.93 -2.37 117.51 116.75 3khu h ILE 319 Ca 0.16 -1.54 -0.08 0.00 1.00 0.00 0.00 64.86 64.41 3khu h ILE 319 Cb -0.02 1.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3khu h ILE 319 CO -0.06 0.49 0.11 -0.78 0.00 0.00 0.00 178.15 177.91 3khu h ASP 320 N 0.46 1.05 0.15 1.72 3.58 -0.71 0.35 116.42 123.02 3khu h ASP 320 Ca 0.03 -0.25 -0.03 0.00 0.42 0.00 0.00 57.03 57.21 3khu h ASP 320 Cb 0.94 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.70 3khu h ASP 320 CO 0.08 1.04 -0.13 0.28 -2.88 0.00 0.00 179.24 177.63 3khu h SER 321 N 1.03 0.00 -0.74 2.28 0.02 -0.73 -0.65 113.55 114.76 3khu h SER 321 Ca 0.20 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.72 3khu h SER 321 Cb 0.43 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 62.75 3khu h SER 321 CO 0.01 0.13 0.55 0.18 -1.14 0.00 0.00 176.83 176.56 3khu n LEU 322 N -4.29 6.30 -1.12 5.07 4.77 -0.91 -4.88 117.00 121.94 3khu n LEU 322 Ca -0.03 -3.35 -0.12 0.00 -0.03 0.00 0.00 56.01 52.48 3khu n LEU 322 Cb 0.20 -0.86 -0.04 0.00 -2.33 0.00 0.00 43.42 40.40 3khu n LEU 322 CO 0.35 1.08 -0.13 0.49 -1.33 0.00 0.00 177.39 177.85 3khu n PHE 323 N -0.56 -0.21 -1.44 -1.77 0.99 -0.25 -2.49 117.46 111.72 3khu n PHE 323 Ca 0.45 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.75 3khu n PHE 323 Cb 1.08 -2.45 -0.07 0.00 -1.00 0.00 0.00 39.48 37.05 3khu n PHE 323 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 3khu n ASN 324 N -0.14 -5.07 -3.80 4.37 5.15 0.09 -4.98 115.26 110.89 3khu n ASN 324 Ca -0.13 0.38 -0.20 0.00 -0.60 0.00 0.00 54.58 54.02 3khu n ASN 324 Cb 0.48 -3.90 -0.17 0.00 -0.53 0.00 0.00 39.78 35.66 3khu n ASN 324 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 3khu s THR 325 N -2.48 0.27 0.00 -0.44 -1.32 -1.04 -4.99 115.64 105.64 3khu s THR 325 Ca 0.00 0.10 0.00 0.00 -1.21 0.00 0.00 61.69 60.58 3khu s THR 325 Cb 0.00 -0.40 0.00 0.00 -1.51 0.00 0.00 72.50 70.59 3khu s THR 325 CO 0.00 0.20 0.67 0.52 -2.21 0.00 0.00 174.62 173.80 3khu n VAL 326 N 4.59 0.45 -1.68 5.08 0.31 -1.26 -4.85 118.33 120.96 3khu n VAL 326 Ca -0.17 -0.53 -0.46 0.00 -0.01 0.00 0.00 64.34 63.16 3khu n VAL 326 Cb 0.50 0.88 -0.04 0.00 -0.91 0.00 0.00 33.84 34.28 3khu n VAL 326 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3khu n THR 327 N -0.22 0.37 -0.95 2.52 -1.04 -0.99 -1.60 114.28 112.37 3khu n THR 327 Ca 0.00 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 3khu n THR 327 Cb 0.27 -1.84 0.00 0.00 -1.82 0.00 0.00 70.33 66.95 3khu n THR 327 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3khu n ASP 328 N 5.48 -4.72 -4.74 8.00 8.00 -0.23 -4.93 116.55 123.41 3khu n ASP 328 Ca 0.20 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.30 3khu n ASP 328 Cb 0.31 -2.78 -0.05 0.00 -0.02 0.00 0.00 41.12 38.59 3khu n ASP 328 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3khu s LYS 329 N -1.49 4.54 -0.02 -1.24 1.02 -0.63 -4.70 119.74 117.22 3khu s LYS 329 Ca 0.00 1.16 -0.30 0.00 0.02 0.00 0.00 55.97 56.85 3khu s LYS 329 Cb 0.00 -3.38 -0.03 0.00 -0.52 0.00 0.00 37.83 33.90 3khu s LYS 329 CO 0.00 0.22 1.01 0.21 -0.92 0.00 0.00 175.35 175.87 3khu s LYS 330 N 0.13 4.52 -0.03 1.68 2.20 -1.26 -0.75 119.74 126.22 3khu s LYS 330 Ca 0.41 1.45 0.01 0.00 -0.36 0.00 0.00 55.97 57.48 3khu s LYS 330 Cb -0.21 -3.47 0.02 0.00 -1.51 0.00 0.00 37.83 32.66 3khu s LYS 330 CO 0.24 -0.13 -0.03 0.42 -0.36 0.00 0.00 175.35 175.49 3khu s ILE 331 N 1.25 0.43 -0.12 5.43 1.01 -0.24 -1.20 121.20 127.76 3khu s ILE 331 Ca 0.52 -0.08 -0.22 0.00 0.00 0.00 0.00 60.65 60.87 3khu s ILE 331 Cb -0.21 -0.46 -0.03 0.00 0.01 0.00 0.00 42.46 41.77 3khu s ILE 331 CO 0.26 0.19 0.65 0.00 0.00 0.00 0.00 174.94 176.04 3khu s ALA 332 N 0.79 3.43 -0.35 9.38 0.00 -0.54 -1.03 121.76 133.45 3khu s ALA 332 Ca -0.10 -0.05 -0.09 0.00 0.00 0.00 0.00 51.96 51.73 3khu s ALA 332 Cb -0.13 -2.93 0.03 0.00 0.00 0.00 0.00 23.12 20.09 3khu s ALA 332 CO -0.00 -0.26 0.15 0.42 0.00 0.00 0.00 175.76 176.07 3khu s ILE 333 N 1.20 4.21 -0.45 0.00 -1.09 0.06 -0.51 121.20 124.62 3khu s ILE 333 Ca 0.33 -0.91 -0.13 0.00 -2.23 0.00 0.00 60.65 57.70 3khu s ILE 333 Cb -0.17 -3.33 0.07 0.00 -1.58 0.00 0.00 42.46 37.46 3khu s ILE 333 CO 0.14 -0.16 0.35 -0.76 -1.23 0.00 0.00 174.94 173.28 3khu s LEU 334 N 1.49 5.44 0.00 2.97 1.43 0.15 -1.07 118.68 129.10 3khu s LEU 334 Ca 0.01 -1.36 0.00 0.00 -1.03 0.00 0.00 54.13 51.75 3khu s LEU 334 Cb -0.19 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 43.91 3khu s LEU 334 CO 0.05 -0.60 0.00 0.61 0.23 0.00 0.00 176.35 176.64 3khu n GLY 335 N 5.11 2.14 0.00 -3.19 0.00 0.27 -1.57 105.19 107.95 3khu n GLY 335 Ca -0.12 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.67 3khu n GLY 335 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3khu n PHE 336 N 2.05 0.00 -0.92 1.61 7.35 -1.26 -4.27 117.46 122.02 3khu n PHE 336 Ca 0.00 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.38 3khu n PHE 336 Cb 0.00 0.00 0.14 0.00 0.35 0.00 0.00 39.48 39.97 3khu n PHE 336 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3khu s ALA 337 N -1.65 1.75 -0.40 3.13 0.00 -1.26 -4.59 121.76 118.74 3khu s ALA 337 Ca 0.00 0.52 0.27 0.00 0.00 0.00 0.00 51.96 52.75 3khu s ALA 337 Cb 0.00 -3.40 0.90 0.00 0.00 0.00 0.00 23.12 20.62 3khu s ALA 337 CO 0.00 -2.40 1.78 0.27 0.00 0.00 0.00 175.76 175.40 3khu h PHE 338 N -1.53 0.00 -2.90 0.00 -5.15 -1.70 -3.44 116.94 102.22 3khu h PHE 338 Ca -0.44 0.00 0.06 0.00 -0.20 0.00 0.00 57.97 57.40 3khu h PHE 338 Cb 1.26 0.00 -0.04 0.00 0.22 0.00 0.00 35.95 37.39 3khu h PHE 338 CO 0.52 0.00 0.28 -1.59 -2.00 0.00 0.00 178.31 175.53 3khu s LYS 339 N -3.32 1.81 0.86 6.09 -2.85 -1.26 -4.52 119.74 116.55 3khu s LYS 339 Ca 0.06 -1.06 -0.11 0.00 -1.00 0.00 0.00 55.97 53.86 3khu s LYS 339 Cb 0.09 0.58 0.11 0.00 -2.06 0.00 0.00 37.83 36.55 3khu s LYS 339 CO 0.54 -0.84 1.09 -1.59 0.10 0.00 0.00 175.35 174.65 3khu s LYS 340 N -3.38 1.57 -1.21 1.78 -2.85 -1.26 -4.20 119.74 110.19 3khu s LYS 340 Ca 0.13 0.84 -0.05 0.00 -1.00 0.00 0.00 55.97 55.89 3khu s LYS 340 Cb -0.05 -1.84 0.01 0.00 -2.06 0.00 0.00 37.83 33.88 3khu s LYS 340 CO 0.07 -2.03 0.60 -0.25 0.10 0.00 0.00 175.35 173.85 3khu n ASP 341 N -3.74 -5.30 -3.53 0.03 8.00 -1.26 -4.98 116.55 105.77 3khu n ASP 341 Ca 0.07 -0.28 -0.11 0.00 0.71 0.00 0.00 54.79 55.18 3khu n ASP 341 Cb 0.55 -4.08 -0.03 0.00 -0.02 0.00 0.00 41.12 37.53 3khu n ASP 341 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3khu s THR 342 N -3.10 0.03 -2.66 -3.53 -1.32 -1.26 -4.88 115.64 98.92 3khu s THR 342 Ca 0.30 -0.28 0.22 0.00 -1.21 0.00 0.00 61.69 60.71 3khu s THR 342 Cb -0.13 -1.08 0.21 0.00 -1.51 0.00 0.00 72.50 69.99 3khu s THR 342 CO 0.37 -0.16 1.22 0.61 -2.21 0.00 0.00 174.62 174.45 3khu n GLY 343 N -0.26 0.94 3.72 6.08 0.00 -1.26 -4.62 105.19 109.79 3khu n GLY 343 Ca -0.17 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.80 3khu n GLY 343 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3khu s ASP 344 N -1.76 7.08 0.00 1.61 -1.08 -1.26 -4.56 116.67 116.70 3khu s ASP 344 Ca 0.27 2.09 0.08 0.00 -0.52 0.00 0.00 52.55 54.47 3khu s ASP 344 Cb 0.19 -2.59 0.18 0.00 -1.46 0.00 0.00 42.92 39.24 3khu s ASP 344 CO 0.28 -0.44 1.07 0.35 0.52 0.00 0.00 175.17 176.94 3khu n THR 345 N 3.52 0.74 -1.86 1.71 -2.24 -1.26 -2.09 114.28 112.80 3khu n THR 345 Ca 0.08 -0.87 -0.42 0.00 -2.27 0.00 0.00 64.05 60.57 3khu n THR 345 Cb 0.46 0.67 -0.03 0.00 -2.10 0.00 0.00 70.33 69.33 3khu n THR 345 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3khu s ARG 346 N -0.91 4.18 -0.97 -0.78 0.52 -1.26 -1.59 118.95 118.14 3khu s ARG 346 Ca 0.15 2.41 -0.01 0.00 -0.52 0.00 0.00 55.73 57.76 3khu s ARG 346 Cb 0.08 -3.64 0.00 0.00 0.52 0.00 0.00 34.95 31.91 3khu s ARG 346 CO 0.11 -0.78 0.03 0.39 0.02 0.00 0.00 175.30 175.07 3khu n GLU 347 N 5.78 -2.38 -2.03 3.54 -0.58 -1.26 -0.11 120.64 123.60 3khu n GLU 347 Ca 0.17 0.53 -0.41 0.00 -0.42 0.00 0.00 57.16 57.03 3khu n GLU 347 Cb 0.40 -5.13 -0.02 0.00 -0.57 0.00 0.00 31.44 26.12 3khu n GLU 347 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3khu s SER 348 N -2.07 6.68 0.54 1.62 0.15 -0.62 -3.77 113.70 116.23 3khu s SER 348 Ca 0.02 2.66 0.26 0.00 0.70 0.00 0.00 55.95 59.60 3khu s SER 348 Cb -0.01 -2.63 1.44 0.00 -1.71 0.00 0.00 66.02 63.11 3khu s SER 348 CO 0.03 -0.67 2.00 0.28 1.20 0.00 0.00 173.24 176.08 3khu h SER 349 N 4.75 0.00 -0.30 5.45 0.02 -1.84 -1.62 113.55 120.01 3khu h SER 349 Ca -0.46 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.48 3khu h SER 349 Cb 1.22 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.74 3khu h SER 349 CO 0.75 0.00 0.19 0.28 -1.14 0.00 0.00 176.83 176.91 3khu h SER 350 N 0.00 0.37 -0.49 3.07 0.02 -1.85 0.37 113.55 115.03 3khu h SER 350 Ca 0.23 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 61.12 3khu h SER 350 Cb 0.97 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.40 3khu h SER 350 CO -0.00 0.28 0.12 0.40 -1.14 0.00 0.00 176.83 176.49 3khu h ILE 351 N 0.43 1.24 -0.06 3.27 2.04 -1.57 -1.12 117.51 121.74 3khu h ILE 351 Ca 0.11 -0.83 -0.21 0.00 1.00 0.00 0.00 64.86 64.94 3khu h ILE 351 Cb -0.02 0.84 0.01 0.00 -0.74 0.00 0.00 36.82 36.92 3khu h ILE 351 CO -0.02 0.30 -0.77 1.88 0.00 0.00 0.00 178.15 179.54 3khu h TYR 352 N 0.67 0.88 -0.53 1.37 -1.99 -1.33 -0.95 116.97 115.09 3khu h TYR 352 Ca 0.15 -0.44 0.00 0.00 2.00 0.00 0.00 58.73 60.45 3khu h TYR 352 Cb 0.32 -0.12 -0.03 0.00 2.00 0.00 0.00 36.73 38.91 3khu h TYR 352 CO 0.02 1.26 0.35 0.82 -0.00 0.00 0.00 178.16 180.61 3khu h ILE 353 N 0.26 1.14 -0.46 -2.88 1.08 -1.00 -1.34 117.51 114.30 3khu h ILE 353 Ca -0.08 -0.26 -0.01 0.00 -0.39 0.00 0.00 64.86 64.12 3khu h ILE 353 Cb 1.43 0.36 -0.02 0.00 -3.07 0.00 0.00 36.82 35.52 3khu h ILE 353 CO 0.15 0.14 0.26 0.28 -0.69 0.00 0.00 178.15 178.29 3khu h SER 354 N 0.72 0.57 -0.60 1.72 0.02 -1.11 -2.26 113.55 112.61 3khu h SER 354 Ca 0.19 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 3khu h SER 354 Cb -0.08 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 3khu h SER 354 CO -0.04 0.49 0.27 0.11 -1.14 0.00 0.00 176.83 176.51 3khu h LYS 355 N 0.60 0.91 -0.68 3.45 1.57 -0.79 0.63 116.57 122.26 3khu h LYS 355 Ca 0.16 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3khu h LYS 355 Cb 0.04 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 3khu h LYS 355 CO -0.03 0.73 0.43 1.88 -0.57 0.00 0.00 179.45 181.89 3khu h TYR 356 N 0.90 0.88 -0.13 -1.35 0.99 -0.80 -1.05 116.97 116.41 3khu h TYR 356 Ca 0.22 0.01 -0.18 0.00 2.00 0.00 0.00 58.73 60.77 3khu h TYR 356 Cb 0.15 -0.29 -0.00 0.00 1.00 0.00 0.00 36.73 37.58 3khu h TYR 356 CO 0.01 0.58 -0.67 -0.07 -0.00 0.00 0.00 178.16 178.01 3khu h LEU 357 N 0.93 0.61 -1.33 3.88 3.38 -0.82 -2.66 115.31 119.30 3khu h LEU 357 Ca 0.25 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3khu h LEU 357 Cb -0.07 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3khu h LEU 357 CO -0.05 1.11 0.20 0.24 0.09 0.00 0.00 178.44 180.04 3khu h MET 358 N 0.38 0.66 0.00 1.13 2.86 -0.65 -1.60 114.93 117.70 3khu h MET 358 Ca -0.02 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.53 3khu h MET 358 Cb 1.24 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.78 3khu h MET 358 CO 0.12 0.53 -0.01 -0.44 1.06 0.00 0.00 176.91 178.18 3khu h ASP 359 N 0.66 0.00 -0.14 1.22 3.32 -0.83 -1.22 116.42 119.43 3khu h ASP 359 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3khu h ASP 359 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3khu h ASP 359 CO -0.02 0.01 0.00 -0.62 -1.72 0.00 0.00 179.24 176.89 3khu n GLU 360 N -3.51 2.07 -1.11 3.56 -0.58 -0.68 -4.97 120.64 115.42 3khu n GLU 360 Ca -0.03 -1.58 -0.00 0.00 -0.42 0.00 0.00 57.16 55.13 3khu n GLU 360 Cb 0.09 -1.46 -0.00 0.00 -0.57 0.00 0.00 31.44 29.50 3khu n GLU 360 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3khu n GLY 361 N 1.29 0.39 3.77 0.62 0.00 -0.46 -2.35 105.19 108.46 3khu n GLY 361 Ca 0.17 -1.07 -0.37 0.00 0.00 0.00 0.00 46.02 44.76 3khu n GLY 361 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3khu s ALA 362 N -2.01 2.81 -0.65 4.61 0.00 -0.77 -1.07 121.76 124.69 3khu s ALA 362 Ca 0.00 0.98 -0.18 0.00 0.00 0.00 0.00 51.96 52.75 3khu s ALA 362 Cb 0.00 -3.41 0.12 0.00 0.00 0.00 0.00 23.12 19.83 3khu s ALA 362 CO 0.00 -0.87 0.74 -1.01 0.00 0.00 0.00 175.76 174.63 3khu s HIS 363 N -1.57 3.10 0.03 0.00 3.76 0.07 -4.72 115.29 115.95 3khu s HIS 363 Ca 0.69 -1.13 -0.25 0.00 -0.15 0.00 0.00 55.06 54.23 3khu s HIS 363 Cb -0.29 -4.01 -0.05 0.00 1.11 0.00 0.00 32.58 29.33 3khu s HIS 363 CO 0.34 -1.27 0.76 -0.51 -0.85 0.00 0.00 174.74 173.21 3khu s LEU 364 N 2.37 4.43 -0.26 0.89 1.43 0.41 -1.08 118.68 126.86 3khu s LEU 364 Ca 0.14 1.41 0.01 0.00 -1.03 0.00 0.00 54.13 54.66 3khu s LEU 364 Cb -0.21 -3.22 0.05 0.00 0.03 0.00 0.00 46.19 42.84 3khu s LEU 364 CO 0.03 -0.01 -0.09 -1.00 0.23 0.00 0.00 176.35 175.51 3khu s HIS 365 N 0.10 3.18 -0.17 0.29 3.76 -0.19 -0.24 115.29 122.02 3khu s HIS 365 Ca 0.39 -2.05 -0.04 0.00 -0.15 0.00 0.00 55.06 53.21 3khu s HIS 365 Cb -0.20 -1.98 -0.02 0.00 1.11 0.00 0.00 32.58 31.48 3khu s HIS 365 CO 0.22 -0.84 -0.04 0.42 -0.85 0.00 0.00 174.74 173.66 3khu s ILE 366 N 1.18 3.75 -0.09 0.60 1.01 -0.21 -0.76 121.20 126.69 3khu s ILE 366 Ca -0.05 -0.40 0.03 0.00 0.00 0.00 0.00 60.65 60.23 3khu s ILE 366 Cb -0.19 -2.66 0.01 0.00 0.01 0.00 0.00 42.46 39.63 3khu s ILE 366 CO -0.05 0.47 -0.18 -0.47 0.00 0.00 0.00 174.94 174.71 3khu s TYR 367 N 0.67 2.01 -0.05 3.97 5.04 -0.23 -1.07 117.35 127.69 3khu s TYR 367 Ca -0.02 -0.83 -0.03 0.00 -2.44 0.00 0.00 57.07 53.75 3khu s TYR 367 Cb -0.14 -1.40 0.03 0.00 0.35 0.00 0.00 41.96 40.79 3khu s TYR 367 CO 0.02 -0.38 0.12 0.34 -1.34 0.00 0.00 175.55 174.31 3khu s ASP 368 N 0.60 -0.09 0.11 4.32 -1.08 -1.26 -0.56 116.67 118.71 3khu s ASP 368 Ca -0.15 0.24 0.17 0.00 -0.52 0.00 0.00 52.55 52.29 3khu s ASP 368 Cb -0.16 0.16 0.73 0.00 -1.46 0.00 0.00 42.92 42.19 3khu s ASP 368 CO 0.05 -0.11 1.53 -0.81 0.52 0.00 0.00 175.17 176.35 3khu n PRO 369 N 3.81 0.08 0.00 4.34 -0.04 -1.26 -4.09 135.00 137.83 3khu n PRO 369 Ca -0.22 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 3khu n PRO 369 Cb 0.54 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 3khu n PRO 369 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3khu n LYS 370 N -1.80 1.86 -2.12 0.54 4.81 -1.26 -5.04 118.16 115.15 3khu n LYS 370 Ca 0.03 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.04 3khu n LYS 370 Cb 0.17 -0.66 -0.03 0.00 0.02 0.00 0.00 35.03 34.53 3khu n LYS 370 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3khu s VAL 371 N -1.19 3.31 0.39 3.15 1.01 -1.26 -4.68 120.40 121.13 3khu s VAL 371 Ca 0.00 0.86 -0.26 0.00 0.00 0.00 0.00 61.98 62.58 3khu s VAL 371 Cb 0.00 -3.55 -0.09 0.00 0.00 0.00 0.00 36.38 32.74 3khu s VAL 371 CO 0.00 0.04 1.26 -2.84 0.00 0.00 0.00 175.10 173.56 3khu s PRO 372 N 1.70 4.06 0.50 2.72 0.02 -1.26 -4.82 135.00 137.92 3khu s PRO 372 Ca 0.66 2.08 0.15 0.00 0.02 0.00 0.00 61.00 63.91 3khu s PRO 372 Cb -0.36 -2.80 1.21 0.00 0.02 0.00 0.00 34.50 32.57 3khu s PRO 372 CO 0.30 -0.39 2.13 0.07 -0.33 0.00 0.00 177.00 178.78 3khu h ARG 373 N 2.80 0.04 -0.28 5.54 0.11 -1.97 -1.74 114.38 118.89 3khu h ARG 373 Ca -0.49 -0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.48 3khu h ARG 373 Cb 1.24 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 32.30 3khu h ARG 373 CO 0.63 0.05 -0.27 0.93 0.10 0.00 0.00 179.97 181.40 3khu h GLU 374 N 0.04 0.56 -0.33 0.08 3.07 -1.99 -2.22 114.58 113.79 3khu h GLU 374 Ca 0.01 -0.23 -0.13 0.00 -0.50 0.00 0.00 59.36 58.51 3khu h GLU 374 Cb 0.03 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 3khu h GLU 374 CO 0.00 0.78 -0.33 0.37 -1.40 0.00 0.00 179.01 178.43 3khu h GLN 375 N 0.49 0.72 -0.48 2.33 5.75 -1.71 -1.87 115.11 120.35 3khu h GLN 375 Ca 0.07 -0.34 -0.01 0.00 -0.15 0.00 0.00 58.65 58.22 3khu h GLN 375 Cb 0.73 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.25 3khu h GLN 375 CO 0.06 0.95 0.25 0.82 -2.65 0.00 0.00 178.83 178.26 3khu h ILE 376 N 0.61 1.18 -0.66 2.39 2.04 -1.31 -0.79 117.51 120.96 3khu h ILE 376 Ca 0.07 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.40 3khu h ILE 376 Cb 0.85 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 3khu h ILE 376 CO 0.07 0.19 0.20 0.58 0.00 0.00 0.00 178.15 179.19 3khu h VAL 377 N 0.64 1.25 -0.41 1.67 2.07 -1.31 -1.81 116.25 118.36 3khu h VAL 377 Ca 0.17 -0.88 -0.06 0.00 0.82 0.00 0.00 66.70 66.75 3khu h VAL 377 Cb 0.08 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 3khu h VAL 377 CO -0.02 0.34 0.03 0.58 0.02 0.00 0.00 177.57 178.52 3khu h VAL 378 N 0.96 1.25 -0.53 2.57 2.07 -1.05 -2.74 116.25 118.79 3khu h VAL 378 Ca 0.21 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 3khu h VAL 378 Cb 0.31 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 3khu h VAL 378 CO -0.01 0.32 0.27 0.44 0.02 0.00 0.00 177.57 178.62 3khu h ASP 379 N 0.53 0.65 -0.22 0.57 3.32 -0.72 -2.62 116.42 117.94 3khu h ASP 379 Ca 0.12 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3khu h ASP 379 Cb 0.42 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3khu h ASP 379 CO 0.01 0.54 0.00 0.18 -1.72 0.00 0.00 179.24 178.25 3khu n LEU 380 N -4.39 2.38 -4.91 1.55 4.77 -0.72 -4.94 117.00 110.73 3khu n LEU 380 Ca 0.05 -0.97 -0.29 0.00 -0.03 0.00 0.00 56.01 54.76 3khu n LEU 380 Cb 0.11 -0.14 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 3khu n LEU 380 CO 0.37 0.49 0.05 -0.44 -1.33 0.00 0.00 177.39 176.53 3khu s SER 381 N -1.61 6.43 0.12 -1.43 0.01 -0.99 -4.69 113.70 111.54 3khu s SER 381 Ca 0.34 0.52 -0.30 0.00 1.31 0.00 0.00 55.95 57.82 3khu s SER 381 Cb 0.20 -2.06 -0.07 0.00 0.21 0.00 0.00 66.02 64.30 3khu s SER 381 CO 0.29 -0.03 1.17 -1.38 0.41 0.00 0.00 173.24 173.69 3khu s HIS 382 N -1.83 3.48 0.21 2.43 -3.43 -1.26 -4.95 115.29 109.95 3khu s HIS 382 Ca 0.40 1.42 -0.30 0.00 -0.80 0.00 0.00 55.06 55.78 3khu s HIS 382 Cb -0.11 -3.38 -0.16 0.00 -1.43 0.00 0.00 32.58 27.50 3khu s HIS 382 CO 0.28 -1.05 0.94 -2.30 -2.00 0.00 0.00 174.74 170.60 3khu n PRO 383 N 3.20 0.88 0.00 -0.38 -0.01 -1.26 -0.65 135.00 136.77 3khu n PRO 383 Ca 0.06 0.31 0.00 0.00 -0.01 0.00 0.00 63.50 63.86 3khu n PRO 383 Cb 0.46 -1.63 0.00 0.00 -0.01 0.00 0.00 33.50 32.32 3khu n PRO 383 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3khu n GLY 384 N 1.69 1.60 3.58 -1.23 0.00 -1.26 -4.94 105.19 104.63 3khu n GLY 384 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3khu n GLY 384 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3khu s VAL 385 N -0.15 3.49 0.02 1.61 0.11 0.18 -4.87 120.40 120.78 3khu s VAL 385 Ca 0.00 0.45 0.10 0.00 -2.93 0.00 0.00 61.98 59.60 3khu s VAL 385 Cb 0.00 -3.79 -0.13 0.00 -1.53 0.00 0.00 36.38 30.93 3khu s VAL 385 CO 0.00 -0.59 1.27 0.77 -3.33 0.00 0.00 175.10 173.22 3khu h SER 386 N 13.29 0.00 -2.15 3.54 4.64 -1.92 -3.35 113.55 127.60 3khu h SER 386 Ca -0.31 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.44 3khu h SER 386 Cb 1.16 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.84 3khu h SER 386 CO 1.09 0.85 -0.78 -1.84 -0.87 0.00 0.00 176.83 175.28 3khu n GLU 387 N -3.28 2.13 -1.67 4.77 0.00 -1.26 -5.12 120.64 116.20 3khu n GLU 387 Ca -0.01 -4.26 -0.44 0.00 0.00 0.00 0.00 57.16 52.45 3khu n GLU 387 Cb 0.89 -1.96 -0.02 0.00 0.00 0.00 0.00 31.44 30.34 3khu n GLU 387 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3khu n ASP 388 N 0.65 2.70 -0.02 -1.84 2.03 -1.26 -4.95 116.55 113.85 3khu n ASP 388 Ca 0.28 1.16 -0.16 0.00 0.52 0.00 0.00 54.79 56.59 3khu n ASP 388 Cb 0.46 -1.44 -0.12 0.00 -0.72 0.00 0.00 41.12 39.30 3khu n ASP 388 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 3khu h ASP 389 N 3.71 0.21 -0.27 1.67 3.58 -1.99 -3.02 116.42 120.30 3khu h ASP 389 Ca -0.45 -0.86 0.06 0.00 0.42 0.00 0.00 57.03 56.20 3khu h ASP 389 Cb 1.28 -0.07 -0.06 0.00 1.72 0.00 0.00 39.33 42.20 3khu h ASP 389 CO 0.72 1.05 -0.13 1.56 -2.88 0.00 0.00 179.24 179.56 3khu h GLN 390 N -0.60 -0.09 -0.83 0.28 4.20 -1.96 -0.42 115.11 115.70 3khu h GLN 390 Ca -0.04 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.73 3khu h GLN 390 Cb 1.11 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.85 3khu h GLN 390 CO 0.05 -0.06 0.52 0.28 -0.67 0.00 0.00 178.83 178.95 3khu h VAL 391 N -0.09 1.06 -0.29 -0.54 2.07 -1.84 0.12 116.25 116.75 3khu h VAL 391 Ca 0.14 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 3khu h VAL 391 Cb 0.31 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 3khu h VAL 391 CO -0.33 0.18 0.00 -1.28 0.02 0.00 0.00 177.57 176.15 3khu h SER 392 N 0.96 0.49 -0.61 0.57 0.87 -1.31 -1.11 113.55 113.41 3khu h SER 392 Ca 0.35 -0.31 -0.09 0.00 -1.23 0.00 0.00 61.79 60.51 3khu h SER 392 Cb 0.12 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 3khu h SER 392 CO -0.15 0.68 0.01 0.03 -0.53 0.00 0.00 176.83 176.87 3khu h ARG 393 N 0.29 1.07 0.00 2.24 3.08 -0.81 -3.40 114.38 116.86 3khu h ARG 393 Ca 0.08 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.80 3khu h ARG 393 Cb 0.42 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3khu h ARG 393 CO 0.01 1.03 -1.29 1.28 -1.07 0.00 0.00 179.97 179.94 3khu n LEU 394 N -4.20 0.04 -4.29 3.04 4.77 0.39 -4.99 117.00 111.76 3khu n LEU 394 Ca 0.03 -0.05 -0.34 0.00 -0.03 0.00 0.00 56.01 55.62 3khu n LEU 394 Cb 0.34 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.29 3khu n LEU 394 CO 0.44 0.01 -0.42 -0.69 -1.33 0.00 0.00 177.39 175.40 3khu s VAL 395 N -2.51 3.07 -0.09 4.08 1.01 -0.43 -0.45 120.40 125.09 3khu s VAL 395 Ca -0.02 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.37 3khu s VAL 395 Cb 0.06 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 34.05 3khu s VAL 395 CO 0.35 0.46 -0.14 -0.89 0.00 0.00 0.00 175.10 174.89 3khu s THR 396 N 1.22 3.02 -0.29 3.92 2.01 0.67 -4.76 115.64 121.43 3khu s THR 396 Ca 0.02 -0.71 -0.13 0.00 0.31 0.00 0.00 61.69 61.19 3khu s THR 396 Cb -0.14 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.11 3khu s THR 396 CO -0.03 0.56 0.26 -0.63 -0.69 0.00 0.00 174.62 174.09 3khu s ILE 397 N -0.20 5.26 0.25 1.82 -1.09 -1.26 -1.04 121.20 124.93 3khu s ILE 397 Ca 0.00 0.22 -0.09 0.00 -2.23 0.00 0.00 60.65 58.56 3khu s ILE 397 Cb -0.13 -3.63 -0.07 0.00 -1.58 0.00 0.00 42.46 37.05 3khu s ILE 397 CO 0.03 0.16 0.56 -0.44 -1.23 0.00 0.00 174.94 174.02 3khu s SER 398 N 1.72 6.58 0.12 3.58 0.01 -0.23 -4.89 113.70 120.59 3khu s SER 398 Ca 0.10 0.88 0.23 0.00 1.31 0.00 0.00 55.95 58.47 3khu s SER 398 Cb -0.16 -2.21 0.10 0.00 0.21 0.00 0.00 66.02 63.96 3khu s SER 398 CO 0.11 -0.11 1.09 2.29 0.41 0.00 0.00 173.24 177.03 3khu n LYS 399 N -0.34 0.42 -3.70 12.44 0.00 -1.26 -4.64 118.16 121.08 3khu n LYS 399 Ca 0.00 0.06 -0.10 0.00 -0.00 0.00 0.00 58.31 58.27 3khu n LYS 399 Cb 0.53 -1.70 -0.05 0.00 -0.00 0.00 0.00 35.03 33.81 3khu n LYS 399 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 3khu s ASP 400 N -4.57 -0.21 0.42 -5.58 1.47 -1.26 -5.05 116.67 101.89 3khu s ASP 400 Ca 0.02 -0.43 0.21 0.00 1.18 0.00 0.00 52.55 53.53 3khu s ASP 400 Cb 0.12 0.51 0.93 0.00 -0.34 0.00 0.00 42.92 44.14 3khu s ASP 400 CO 0.78 -0.93 1.86 -0.65 0.68 0.00 0.00 175.17 176.91 3khu h PRO 401 N 2.33 0.00 -0.17 2.11 0.11 -1.96 -2.90 132.00 131.52 3khu h PRO 401 Ca -0.32 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.61 3khu h PRO 401 Cb 1.26 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 3khu h PRO 401 CO 0.44 0.28 -0.64 1.88 -0.21 0.00 0.00 178.00 179.75 3khu h TYR 402 N 0.00 0.79 -0.73 0.65 0.05 -1.98 -1.78 116.97 113.97 3khu h TYR 402 Ca -0.00 -0.31 0.02 0.00 0.05 0.00 0.00 58.73 58.48 3khu h TYR 402 Cb 0.67 -0.14 -0.04 0.00 1.01 0.00 0.00 36.73 38.23 3khu h TYR 402 CO 0.00 1.08 0.48 0.93 -1.05 0.00 0.00 178.16 179.60 3khu h GLU 403 N 0.45 0.93 -0.45 4.88 5.08 -1.93 -1.79 114.58 121.74 3khu h GLU 403 Ca -0.01 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 3khu h GLU 403 Cb 1.21 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 3khu h GLU 403 CO 0.12 0.62 0.07 0.00 -1.00 0.00 0.00 179.01 178.82 3khu h ALA 404 N 1.29 1.28 -0.00 3.43 0.00 -1.28 -2.93 119.26 121.05 3khu h ALA 404 Ca 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3khu h ALA 404 Cb -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3khu h ALA 404 CO -0.08 0.50 -0.47 0.00 0.00 0.00 0.00 179.25 179.20 3khu s ASP 406 N -2.81 6.16 -0.38 0.00 -1.08 -0.69 -1.65 116.67 116.22 3khu s ASP 406 Ca 0.15 1.42 0.00 0.00 -0.52 0.00 0.00 52.55 53.60 3khu s ASP 406 Cb 0.18 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 39.11 3khu s ASP 406 CO 0.65 -1.47 0.00 0.61 0.52 0.00 0.00 175.17 175.48 3khu n GLY 407 N 5.05 0.66 3.85 2.66 0.00 0.79 -5.00 105.19 113.20 3khu n GLY 407 Ca 0.20 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 45.12 3khu n GLY 407 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3khu s ALA 408 N -2.11 3.33 0.07 4.61 0.00 -0.66 -4.43 121.76 122.57 3khu s ALA 408 Ca 0.00 0.01 0.06 0.00 0.00 0.00 0.00 51.96 52.02 3khu s ALA 408 Cb 0.00 -2.75 -0.23 0.00 0.00 0.00 0.00 23.12 20.14 3khu s ALA 408 CO 0.00 0.30 1.10 0.45 0.00 0.00 0.00 175.76 177.61 3khu h HIS 409 N 2.16 0.10 -3.14 0.00 3.86 -1.44 -2.16 115.15 114.53 3khu h HIS 409 Ca -0.48 -0.08 -0.13 0.00 -1.16 0.00 0.00 60.37 58.53 3khu h HIS 409 Cb 1.18 -0.00 -0.21 0.00 1.06 0.00 0.00 27.41 29.43 3khu h HIS 409 CO 0.62 1.07 -0.34 0.00 0.86 0.00 0.00 177.93 180.14 3khu s ALA 410 N -2.67 -0.67 -0.17 2.45 0.00 -1.26 -2.18 121.76 117.26 3khu s ALA 410 Ca -0.02 0.31 -0.01 0.00 0.00 0.00 0.00 51.96 52.24 3khu s ALA 410 Cb 0.09 -0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.19 3khu s ALA 410 CO 0.83 -0.23 -0.13 0.08 0.00 0.00 0.00 175.76 176.31 3khu s VAL 411 N -1.07 2.75 -0.30 0.00 1.01 0.05 -1.46 120.40 121.39 3khu s VAL 411 Ca -0.11 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.15 3khu s VAL 411 Cb -0.05 -2.19 0.06 0.00 0.00 0.00 0.00 36.38 34.21 3khu s VAL 411 CO 0.03 0.50 -0.03 -0.69 0.00 0.00 0.00 175.10 174.91 3khu s VAL 412 N 1.02 2.57 -0.35 2.92 1.01 0.33 -0.46 120.40 127.45 3khu s VAL 412 Ca -0.01 -1.66 -0.18 0.00 0.00 0.00 0.00 61.98 60.13 3khu s VAL 412 Cb -0.15 -2.56 -0.00 0.00 0.00 0.00 0.00 36.38 33.67 3khu s VAL 412 CO -0.03 -0.17 0.51 -0.63 0.00 0.00 0.00 175.10 174.77 3khu s ILE 413 N 1.14 5.02 -0.24 2.22 1.01 -0.06 -0.67 121.20 129.62 3khu s ILE 413 Ca -0.04 0.32 0.08 0.00 0.00 0.00 0.00 60.65 61.02 3khu s ILE 413 Cb -0.20 -3.96 -0.10 0.00 0.01 0.00 0.00 42.46 38.21 3khu s ILE 413 CO -0.04 -0.21 0.28 0.00 0.00 0.00 0.00 174.94 174.98 3khu s THR 415 N -2.08 0.51 -0.06 0.00 2.01 -1.22 -4.74 115.64 110.05 3khu s THR 415 Ca 0.01 -0.20 -0.00 0.00 0.31 0.00 0.00 61.69 61.81 3khu s THR 415 Cb 0.06 -0.48 0.04 0.00 0.01 0.00 0.00 72.50 72.13 3khu s THR 415 CO 0.34 0.18 1.91 -1.84 -0.69 0.00 0.00 174.62 174.52 3khu n GLU 416 N 3.44 1.14 -1.68 4.92 0.00 -1.26 -4.72 120.64 122.49 3khu n GLU 416 Ca -0.19 -0.29 -0.45 0.00 0.00 0.00 0.00 57.16 56.23 3khu n GLU 416 Cb 0.54 -1.11 -0.04 0.00 0.00 0.00 0.00 31.44 30.83 3khu n GLU 416 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 3khu n TRP 417 N 1.19 2.31 0.26 -1.84 7.02 -1.26 -4.80 117.44 120.32 3khu n TRP 417 Ca 0.06 0.28 0.12 0.00 -1.02 0.00 0.00 57.50 56.94 3khu n TRP 417 Cb 0.52 -2.54 0.77 0.00 -2.42 0.00 0.00 31.31 27.64 3khu n TRP 417 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3khu h ASP 418 N 5.61 0.00 0.44 -0.99 3.32 -2.01 -2.39 116.42 120.40 3khu h ASP 418 Ca -0.45 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.59 3khu h ASP 418 Cb 1.25 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.80 3khu h ASP 418 CO 0.86 0.00 -0.07 0.00 -1.72 0.00 0.00 179.24 178.31 3khu h MET 419 N 0.00 0.00 0.00 3.56 -0.00 -1.99 -3.05 114.93 113.45 3khu h MET 419 Ca 0.02 0.00 -0.08 0.00 -0.00 0.00 0.00 59.70 59.64 3khu h MET 419 Cb 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.68 3khu h MET 419 CO -0.00 0.07 -0.39 0.74 -0.00 0.00 0.00 176.91 177.34 3khu h PHE 420 N 0.00 0.00 0.00 -0.10 0.04 -1.80 -2.32 116.94 112.76 3khu h PHE 420 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3khu h PHE 420 Cb 0.32 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.47 3khu h PHE 420 CO 0.00 0.39 0.00 0.36 -0.60 0.00 0.00 178.31 178.46 3khu n LYS 421 N -4.01 0.13 0.00 1.51 2.85 -1.15 -3.36 118.16 114.13 3khu n LYS 421 Ca -0.02 0.23 0.12 0.00 -1.05 0.00 0.00 58.31 57.59 3khu n LYS 421 Cb 0.43 -1.69 0.12 0.00 -0.65 0.00 0.00 35.03 33.23 3khu n LYS 421 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3khu n GLU 422 N -1.92 1.95 -1.46 -1.58 -0.58 -0.88 -4.99 120.64 111.18 3khu n GLU 422 Ca 0.05 -1.58 -0.33 0.00 -0.42 0.00 0.00 57.16 54.87 3khu n GLU 422 Cb 0.30 -1.47 0.09 0.00 -0.57 0.00 0.00 31.44 29.79 3khu n GLU 422 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3khu s LEU 423 N -2.14 3.29 -0.93 -4.62 1.43 -1.19 -4.93 118.68 109.59 3khu s LEU 423 Ca 0.26 2.22 -0.22 0.00 -1.03 0.00 0.00 54.13 55.36 3khu s LEU 423 Cb 0.20 -4.57 0.08 0.00 0.03 0.00 0.00 46.19 41.92 3khu s LEU 423 CO 0.38 -2.14 1.28 -0.62 0.23 0.00 0.00 176.35 175.47 3khu s ASP 424 N -2.29 6.48 0.37 2.29 2.15 -1.26 -4.83 116.67 119.57 3khu s ASP 424 Ca 0.71 -1.50 0.19 0.00 0.43 0.00 0.00 52.55 52.39 3khu s ASP 424 Cb -0.26 -2.50 0.58 0.00 -0.30 0.00 0.00 42.92 40.45 3khu s ASP 424 CO 0.46 -1.39 1.68 1.88 -0.17 0.00 0.00 175.17 177.63 3khu h TYR 425 N 9.48 0.00 -0.20 -5.34 -1.99 -1.98 -2.30 116.97 114.64 3khu h TYR 425 Ca 0.09 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.81 3khu h TYR 425 Cb 1.02 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.75 3khu h TYR 425 CO 1.20 0.36 0.11 1.49 -0.00 0.00 0.00 178.16 181.31 3khu h GLU 426 N 0.00 0.29 -0.64 4.88 4.81 -1.99 0.14 114.58 122.07 3khu h GLU 426 Ca -0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 3khu h GLU 426 Cb 0.99 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.28 3khu h GLU 426 CO 0.05 0.29 0.28 -0.09 -0.73 0.00 0.00 179.01 178.81 3khu h ARG 427 N 0.21 0.94 -0.45 1.92 2.43 -1.91 -2.53 114.38 114.98 3khu h ARG 427 Ca 0.07 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 3khu h ARG 427 Cb 0.09 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 3khu h ARG 427 CO -0.01 0.77 0.26 0.82 -1.51 0.00 0.00 179.97 180.30 3khu h ILE 428 N 0.89 1.15 -0.36 1.20 2.04 -1.20 -3.03 117.51 118.20 3khu h ILE 428 Ca 0.22 -0.37 0.07 0.00 1.00 0.00 0.00 64.86 65.78 3khu h ILE 428 Cb 0.16 0.58 -0.07 0.00 -0.74 0.00 0.00 36.82 36.75 3khu h ILE 428 CO -0.02 0.16 -0.10 -0.74 0.00 0.00 0.00 178.15 177.45 3khu h HIS 429 N 0.60 -0.22 -0.98 1.37 2.76 -0.61 -2.60 115.15 115.48 3khu h HIS 429 Ca 0.16 0.03 0.18 0.00 -2.20 0.00 0.00 60.37 58.54 3khu h HIS 429 Cb 0.03 0.15 -0.09 0.00 1.55 0.00 0.00 27.41 29.05 3khu h HIS 429 CO -0.03 -0.17 0.61 0.87 -1.30 0.00 0.00 177.93 177.92 3khu h LYS 430 N -0.01 0.70 -0.44 5.26 1.57 -1.33 -2.13 116.57 120.19 3khu h LYS 430 Ca 0.18 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3khu h LYS 430 Cb 0.28 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.43 3khu h LYS 430 CO -0.38 0.47 0.00 1.63 -0.57 0.00 0.00 179.45 180.60 3khu n LYS 431 N -4.67 2.50 -2.87 3.15 5.02 -1.08 -4.94 118.16 115.27 3khu n LYS 431 Ca 0.21 -2.21 -0.32 0.00 -2.02 0.00 0.00 58.31 53.98 3khu n LYS 431 Cb 0.55 -1.41 -0.05 0.00 -0.02 0.00 0.00 35.03 34.10 3khu n LYS 431 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3khu s MET 432 N -1.11 3.97 0.63 1.97 -1.94 -0.80 -0.15 119.30 121.87 3khu s MET 432 Ca 0.34 0.74 -0.17 0.00 -1.71 0.00 0.00 55.69 54.90 3khu s MET 432 Cb 0.18 -2.32 -0.01 0.00 2.01 0.00 0.00 34.83 34.69 3khu s MET 432 CO 0.25 -0.00 1.14 -0.51 -0.01 0.00 0.00 175.02 175.89 3khu s LEU 433 N -3.45 3.50 -0.03 -0.03 1.43 -0.81 -4.89 118.68 114.41 3khu s LEU 433 Ca 0.56 2.16 0.06 0.00 -1.03 0.00 0.00 54.13 55.87 3khu s LEU 433 Cb -0.10 -4.57 -0.02 0.00 0.03 0.00 0.00 46.19 41.52 3khu s LEU 433 CO 0.23 -1.63 -0.19 -0.54 0.23 0.00 0.00 176.35 174.45 3khu s LYS 434 N -3.76 2.31 0.38 1.70 -0.14 -1.26 -3.33 119.74 115.64 3khu s LYS 434 Ca 0.71 -0.81 -0.25 0.00 -1.36 0.00 0.00 55.97 54.25 3khu s LYS 434 Cb -0.24 -2.24 -0.09 0.00 -1.68 0.00 0.00 37.83 33.58 3khu s LYS 434 CO 0.37 0.59 1.10 -1.25 -0.76 0.00 0.00 175.35 175.41 3khu s PRO 435 N -0.79 4.19 -0.20 -1.68 0.04 -1.26 -5.16 135.00 130.14 3khu s PRO 435 Ca 0.11 1.69 -0.08 0.00 0.04 0.00 0.00 61.00 62.76 3khu s PRO 435 Cb -0.10 -2.69 -0.04 0.00 0.04 0.00 0.00 34.50 31.70 3khu s PRO 435 CO 0.01 -0.16 0.09 0.00 0.04 0.00 0.00 177.00 176.97 3khu s ALA 436 N -1.48 3.44 0.02 8.56 0.00 -1.21 -4.87 121.76 126.22 3khu s ALA 436 Ca 0.55 -0.80 0.07 0.00 0.00 0.00 0.00 51.96 51.78 3khu s ALA 436 Cb -0.27 -2.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 3khu s ALA 436 CO 0.34 0.05 -0.19 -0.06 0.00 0.00 0.00 175.76 175.89 3khu s PHE 437 N 0.61 2.53 -0.13 0.00 0.40 -0.93 -1.36 117.98 119.10 3khu s PHE 437 Ca 0.05 -0.28 0.02 0.00 -0.60 0.00 0.00 56.93 56.12 3khu s PHE 437 Cb -0.13 -1.49 0.01 0.00 0.51 0.00 0.00 43.02 41.92 3khu s PHE 437 CO 0.01 0.19 -0.21 0.42 0.70 0.00 0.00 175.22 176.33 3khu s ILE 438 N -0.84 1.97 -0.33 0.64 1.01 0.15 -0.77 121.20 123.04 3khu s ILE 438 Ca 0.13 -0.93 -0.04 0.00 0.00 0.00 0.00 60.65 59.81 3khu s ILE 438 Cb -0.10 -1.75 0.05 0.00 0.01 0.00 0.00 42.46 40.68 3khu s ILE 438 CO 0.03 0.53 0.07 -0.36 0.00 0.00 0.00 174.94 175.22 3khu s PHE 439 N 0.81 3.30 -0.55 3.97 0.08 0.39 -0.90 117.98 125.08 3khu s PHE 439 Ca -0.08 -1.76 -0.18 0.00 0.12 0.00 0.00 56.93 55.03 3khu s PHE 439 Cb -0.16 -2.34 0.10 0.00 -0.57 0.00 0.00 43.02 40.05 3khu s PHE 439 CO -0.01 -0.80 0.61 0.34 -0.10 0.00 0.00 175.22 175.26 3khu s ASP 440 N 1.41 6.19 0.00 1.36 2.15 0.36 -0.88 116.67 127.26 3khu s ASP 440 Ca -0.02 -1.43 0.14 0.00 0.43 0.00 0.00 52.55 51.67 3khu s ASP 440 Cb -0.20 -2.26 0.49 0.00 -0.30 0.00 0.00 42.92 40.64 3khu s ASP 440 CO 0.00 -0.97 1.37 0.61 -0.17 0.00 0.00 175.17 176.01 3khu n GLY 441 N 5.25 0.27 0.00 2.66 0.00 0.24 -2.94 105.19 110.67 3khu n GLY 441 Ca -0.10 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.57 3khu n GLY 441 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3khu n ARG 442 N 0.28 0.09 -2.63 1.61 5.12 -1.26 -1.31 116.66 118.56 3khu n ARG 442 Ca 0.12 -0.35 -0.20 0.00 -1.93 0.00 0.00 57.85 55.49 3khu n ARG 442 Cb 0.27 -0.64 0.00 0.00 -1.16 0.00 0.00 32.46 30.93 3khu n ARG 442 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3khu n ARG 443 N -0.05 -2.79 0.16 5.56 5.12 -1.25 -4.90 116.66 118.50 3khu n ARG 443 Ca 0.00 0.91 0.04 0.00 -1.93 0.00 0.00 57.85 56.87 3khu n ARG 443 Cb 0.26 -5.63 0.10 0.00 -1.16 0.00 0.00 32.46 26.03 3khu n ARG 443 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 3khu h VAL 444 N -0.46 0.79 -0.46 1.55 -1.51 -1.95 -3.25 116.25 110.96 3khu h VAL 444 Ca -0.48 -2.00 0.00 0.00 -1.23 0.00 0.00 66.70 62.99 3khu h VAL 444 Cb 1.35 2.30 0.00 0.00 -2.13 0.00 0.00 31.29 32.81 3khu h VAL 444 CO 0.55 0.43 0.00 0.18 -1.23 0.00 0.00 177.57 177.50 3khu n LEU 445 N -3.26 3.13 -4.62 4.19 4.77 -1.26 -4.76 117.00 115.19 3khu n LEU 445 Ca 0.02 -1.57 -0.44 0.00 -0.03 0.00 0.00 56.01 53.99 3khu n LEU 445 Cb 0.68 -0.42 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 3khu n LEU 445 CO 0.39 0.61 0.66 0.47 -1.33 0.00 0.00 177.39 178.19 3khu n ASP 446 N 0.78 1.70 0.00 -1.43 9.92 -1.23 -1.72 116.55 124.57 3khu n ASP 446 Ca 0.17 1.18 0.00 0.00 -0.53 0.00 0.00 54.79 55.61 3khu n ASP 446 Cb 0.57 -1.35 0.00 0.00 -0.64 0.00 0.00 41.12 39.70 3khu n ASP 446 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3khu n GLY 447 N 1.09 2.44 0.90 0.44 0.00 -1.26 -4.84 105.19 103.97 3khu n GLY 447 Ca 0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.18 3khu n GLY 447 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3khu n LEU 448 N 0.00 3.27 -0.06 0.99 4.77 -0.70 -4.76 117.00 120.51 3khu n LEU 448 Ca 0.00 -1.93 -0.11 0.00 -0.03 0.00 0.00 56.01 53.94 3khu n LEU 448 Cb 0.00 -0.31 -0.05 0.00 -2.33 0.00 0.00 43.42 40.73 3khu n LEU 448 CO 0.00 0.81 0.78 0.45 -1.33 0.00 0.00 177.39 178.09 3khu h HIS 449 N 2.94 0.32 -0.45 -1.77 3.86 -1.89 -1.68 115.15 116.49 3khu h HIS 449 Ca 0.00 -0.05 0.04 0.00 -1.16 0.00 0.00 60.37 59.20 3khu h HIS 449 Cb 0.82 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 29.17 3khu h HIS 449 CO 0.31 0.47 0.21 -0.91 0.86 0.00 0.00 177.93 178.87 3khu h ASN 450 N 0.07 0.30 -0.69 2.45 2.35 -1.96 0.29 115.58 118.39 3khu h ASN 450 Ca 0.05 0.03 0.04 0.00 -0.55 0.00 0.00 56.30 55.87 3khu h ASN 450 Cb 0.33 -0.02 -0.05 0.00 0.05 0.00 0.00 38.32 38.63 3khu h ASN 450 CO 0.00 0.21 0.42 -0.08 -1.65 0.00 0.00 177.43 176.34 3khu h GLU 451 N 0.43 0.78 -0.27 0.81 4.81 -1.86 0.49 114.58 119.77 3khu h GLU 451 Ca 0.20 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 59.22 3khu h GLU 451 Cb 0.12 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 3khu h GLU 451 CO -0.15 0.52 -0.49 -0.07 -0.73 0.00 0.00 179.01 178.08 3khu h LEU 452 N 0.80 0.82 -0.07 1.64 3.38 -0.70 -1.87 115.31 119.32 3khu h LEU 452 Ca 0.29 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 3khu h LEU 452 Cb 0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3khu h LEU 452 CO -0.13 1.17 0.04 1.56 0.09 0.00 0.00 178.44 181.17 3khu h GLN 453 N 0.59 0.10 -0.76 1.13 4.20 -0.61 -1.68 115.11 118.08 3khu h GLN 453 Ca 0.03 -0.01 0.12 0.00 0.06 0.00 0.00 58.65 58.84 3khu h GLN 453 Cb 1.07 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 28.74 3khu h GLN 453 CO 0.10 0.18 0.37 1.15 -0.67 0.00 0.00 178.83 179.97 3khu h THR 454 N -0.00 0.78 -0.50 -0.54 2.02 -0.77 0.13 112.91 114.03 3khu h THR 454 Ca 0.02 -0.20 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 3khu h THR 454 Cb 0.11 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.65 3khu h THR 454 CO -0.00 0.11 0.30 0.40 0.37 0.00 0.00 175.52 176.69 3khu h ILE 455 N 0.58 1.14 0.00 3.11 2.04 -1.21 -3.46 117.51 119.71 3khu h ILE 455 Ca 0.39 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.94 3khu h ILE 455 Cb 0.50 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 3khu h ILE 455 CO -0.32 0.15 0.00 0.61 0.00 0.00 0.00 178.15 178.58 3khu n GLY 456 N -1.38 0.30 3.80 5.37 0.00 0.47 -5.05 105.19 108.70 3khu n GLY 456 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 3khu n GLY 456 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3khu s PHE 457 N -1.10 3.16 -0.41 1.61 0.40 -0.69 -4.65 117.98 116.30 3khu s PHE 457 Ca 0.00 1.61 -0.21 0.00 -0.60 0.00 0.00 56.93 57.72 3khu s PHE 457 Cb 0.00 -3.01 0.02 0.00 0.51 0.00 0.00 43.02 40.53 3khu s PHE 457 CO 0.00 -0.56 0.67 -0.65 0.70 0.00 0.00 175.22 175.39 3khu s GLN 458 N -3.05 3.47 -0.22 0.44 -0.21 -0.46 -4.23 119.66 115.41 3khu s GLN 458 Ca 0.64 -0.13 -0.06 0.00 0.02 0.00 0.00 55.36 55.82 3khu s GLN 458 Cb -0.15 -3.89 -0.03 0.00 1.00 0.00 0.00 33.01 29.94 3khu s GLN 458 CO 0.19 -0.92 0.02 -1.50 -2.12 0.00 0.00 175.29 170.96 3khu s ILE 459 N 2.88 4.05 0.05 1.08 1.10 -1.26 -0.67 121.20 128.43 3khu s ILE 459 Ca 0.25 -0.27 0.07 0.00 -0.51 0.00 0.00 60.65 60.18 3khu s ILE 459 Cb -0.14 -2.85 -0.03 0.00 0.15 0.00 0.00 42.46 39.59 3khu s ILE 459 CO 0.18 0.40 -0.18 -1.61 -2.11 0.00 0.00 174.94 171.62 3khu s GLU 460 N 1.19 1.17 0.07 3.50 2.02 -0.08 -4.98 118.70 121.59 3khu s GLU 460 Ca 0.03 -0.93 -0.06 0.00 0.02 0.00 0.00 54.97 54.04 3khu s GLU 460 Cb -0.14 -1.27 -0.02 0.00 0.10 0.00 0.00 34.13 32.80 3khu s GLU 460 CO 0.02 0.31 0.10 -0.08 0.02 0.00 0.00 175.26 175.64 3khu s THR 461 N -0.91 0.17 0.35 3.63 -1.32 -1.26 -0.49 115.64 115.82 3khu s THR 461 Ca 0.05 -1.44 -0.28 0.00 -1.21 0.00 0.00 61.69 58.81 3khu s THR 461 Cb -0.09 -1.42 -0.10 0.00 -1.51 0.00 0.00 72.50 69.38 3khu s THR 461 CO 0.02 -0.78 1.29 0.27 -2.21 0.00 0.00 174.62 173.20 3khu s ILE 462 N -3.89 2.76 -0.62 5.08 -4.36 -1.15 -2.85 121.20 116.16 3khu s ILE 462 Ca 0.06 0.73 0.00 0.00 -0.26 0.00 0.00 60.65 61.18 3khu s ILE 462 Cb 0.06 -3.45 0.00 0.00 1.25 0.00 0.00 42.46 40.32 3khu s ILE 462 CO -0.10 0.15 0.00 0.61 0.24 0.00 0.00 174.94 175.84 3khu n GLY 463 N 0.77 0.76 2.79 6.27 0.00 -1.23 -4.85 105.19 109.71 3khu n GLY 463 Ca 0.01 -0.77 -0.19 0.00 0.00 0.00 0.00 46.02 45.07 3khu n GLY 463 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3khu s LYS 464 N -2.70 0.37 0.37 1.61 2.20 -1.13 -1.61 119.74 118.85 3khu s LYS 464 Ca 0.00 0.11 -0.28 0.00 -0.36 0.00 0.00 55.97 55.44 3khu s LYS 464 Cb 0.00 -0.63 -0.10 0.00 -1.51 0.00 0.00 37.83 35.59 3khu s LYS 464 CO 0.00 -0.19 1.36 0.21 -0.36 0.00 0.00 175.35 176.36 3khu s LYS 465 N 1.38 4.15 0.00 4.03 2.20 -1.26 -4.65 119.74 125.59 3khu s LYS 465 Ca -0.05 2.30 0.26 0.00 -0.36 0.00 0.00 55.97 58.13 3khu s LYS 465 Cb -0.13 -2.94 1.57 0.00 -1.51 0.00 0.00 37.83 34.82 3khu s LYS 465 CO -0.02 -0.39 1.92 0.28 -0.36 0.00 0.00 175.35 176.77