#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3khu h MET 1 N 0.00 -0.34 -6.58 -1.46 1.85 -2.00 -3.43 114.93 102.98 3khu h MET 1 Ca 0.00 0.02 -0.53 0.00 -0.61 0.00 0.00 59.70 58.59 3khu h MET 1 Cb 0.00 0.08 0.01 0.00 0.43 0.00 0.00 31.60 32.12 3khu h MET 1 CO 0.00 -0.22 0.57 0.12 -0.40 0.00 0.00 176.91 176.98 3khu s PHE 2 N -6.14 3.42 -0.13 1.39 5.36 -1.26 -5.02 117.98 115.61 3khu s PHE 2 Ca -0.15 1.34 0.02 0.00 -0.96 0.00 0.00 56.93 57.18 3khu s PHE 2 Cb 0.05 -3.44 0.01 0.00 -0.34 0.00 0.00 43.02 39.31 3khu s PHE 2 CO 0.65 -1.32 -0.18 -2.00 -1.46 0.00 0.00 175.22 170.91 3khu s GLU 3 N 0.41 2.57 -0.16 10.12 2.12 -1.26 -4.60 118.70 127.89 3khu s GLU 3 Ca 0.56 -0.68 -0.28 0.00 0.36 0.00 0.00 54.97 54.92 3khu s GLU 3 Cb -0.32 -2.16 -0.01 0.00 0.26 0.00 0.00 34.13 31.91 3khu s GLU 3 CO 0.33 -0.08 0.98 0.42 -0.54 0.00 0.00 175.26 176.37 3khu s ILE 4 N 1.02 4.77 -0.01 -3.70 1.01 -1.26 -4.89 121.20 118.14 3khu s ILE 4 Ca -0.04 1.95 0.03 0.00 0.00 0.00 0.00 60.65 62.58 3khu s ILE 4 Cb -0.15 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.01 3khu s ILE 4 CO -0.04 -0.05 0.06 0.29 0.00 0.00 0.00 174.94 175.20 3khu n LYS 5 N 5.50 0.43 -4.02 2.79 5.02 -1.26 -4.89 118.16 121.74 3khu n LYS 5 Ca 0.09 -0.02 -0.19 0.00 -2.02 0.00 0.00 58.31 56.17 3khu n LYS 5 Cb 0.48 -1.03 -0.16 0.00 -0.02 0.00 0.00 35.03 34.29 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 -2.12 0.56 -0.07 1.97 1.02 -1.26 -1.13 119.74 118.71 3khu s LYS 6 Ca -0.01 0.00 0.05 0.00 0.02 0.00 0.00 55.97 56.03 3khu s LYS 6 Cb 0.02 -0.69 -0.00 0.00 -0.52 0.00 0.00 37.83 36.64 3khu s LYS 6 CO 0.10 -0.13 -0.23 0.42 -0.92 0.00 0.00 175.35 174.60 3khu s ILE 7 N 1.07 1.91 -0.11 2.17 1.01 0.41 -0.38 121.20 127.28 3khu s ILE 7 Ca -0.09 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 59.62 3khu s ILE 7 Cb -0.14 -1.64 -0.01 0.00 0.01 0.00 0.00 42.46 40.69 3khu s ILE 7 CO -0.01 0.53 -0.19 0.00 0.00 0.00 0.00 174.94 175.27 3khu s ILE 10 N 1.26 4.39 0.00 0.00 1.01 -0.01 -0.66 121.20 127.18 3khu s ILE 10 Ca -0.02 0.69 0.00 0.00 0.00 0.00 0.00 60.65 61.32 3khu s ILE 10 Cb -0.17 -4.50 0.00 0.00 0.01 0.00 0.00 42.46 37.80 3khu s ILE 10 CO -0.06 -0.96 0.00 0.61 0.00 0.00 0.00 174.94 174.53 3khu n GLY 11 N 4.98 2.43 2.76 6.18 0.00 0.11 -0.70 105.19 120.96 3khu n GLY 11 Ca 0.06 -0.94 -0.36 0.00 0.00 0.00 0.00 46.02 44.77 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 0.33 5.91 -2.19 4.61 0.00 -1.23 -4.21 120.51 123.73 3khu n ALA 12 Ca 0.00 -4.39 0.00 0.00 0.00 0.00 0.00 53.44 49.05 3khu n ALA 12 Cb 0.00 -1.66 0.00 0.00 0.00 0.00 0.00 19.45 17.79 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 -0.34 2.98 0.31 0.00 0.00 -1.26 -4.61 105.19 102.27 3khu n GLY 13 Ca 0.46 -2.02 0.01 0.00 0.00 0.00 0.00 46.02 44.48 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 0.67 0.00 1.61 3.20 -1.94 -2.49 116.97 118.02 3khu h TYR 14 Ca 0.00 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.72 3khu h TYR 14 Cb 0.00 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 3khu h TYR 14 CO 0.00 0.49 -0.74 0.28 -1.64 0.00 0.00 178.16 176.55 3khu h VAL 15 N 0.69 1.23 -0.44 1.81 2.07 -1.93 -3.39 116.25 116.29 3khu h VAL 15 Ca 0.17 -2.21 -0.06 0.00 0.82 0.00 0.00 66.70 65.43 3khu h VAL 15 Cb 0.06 2.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 3khu h VAL 15 CO -0.02 0.42 0.05 1.23 0.02 0.00 0.00 177.57 179.26 3khu h GLY 16 N -1.00 0.79 0.62 2.17 0.00 -1.73 -2.23 103.07 101.70 3khu h GLY 16 Ca -0.20 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.55 3khu h GLY 16 CO -0.12 0.50 -0.30 -1.33 0.00 0.00 0.00 176.54 175.29 3khu h GLY 17 N 0.59 -0.87 0.69 4.60 0.00 -1.61 -1.55 103.07 104.91 3khu h GLY 17 Ca 0.13 0.32 0.05 0.00 0.00 0.00 0.00 47.33 47.84 3khu h GLY 17 CO 0.01 -0.32 0.30 -2.55 0.00 0.00 0.00 176.54 173.99 3khu h PRO 18 N -0.99 0.55 -0.05 4.80 0.11 -1.75 0.12 132.00 134.80 3khu h PRO 18 Ca -0.09 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.99 3khu h PRO 18 Cb 0.64 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.62 3khu h PRO 18 CO 0.14 0.36 0.03 1.15 -0.21 0.00 0.00 178.00 179.47 3khu h THR 19 N 0.57 1.05 0.00 -1.15 2.02 -1.44 -1.21 112.91 112.75 3khu h THR 19 Ca 0.26 -0.13 -0.06 0.00 0.77 0.00 0.00 66.41 67.25 3khu h THR 19 Cb 0.17 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 3khu h THR 19 CO -0.18 0.04 -0.30 0.00 0.37 0.00 0.00 175.52 175.45 3khu h SER 21 N 0.00 0.57 -0.62 0.00 0.02 -0.40 -2.35 113.55 110.77 3khu h SER 21 Ca -0.00 -0.34 -0.06 0.00 -0.84 0.00 0.00 61.79 60.55 3khu h SER 21 Cb 0.88 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.24 3khu h SER 21 CO 0.04 0.78 0.16 0.58 -1.14 0.00 0.00 176.83 177.25 3khu h VAL 22 N 0.36 1.25 -0.30 2.27 2.07 -0.95 -1.60 116.25 119.35 3khu h VAL 22 Ca 0.08 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 66.76 3khu h VAL 22 Cb 0.50 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.87 3khu h VAL 22 CO 0.02 0.34 -0.02 0.40 0.02 0.00 0.00 177.57 178.33 3khu h ILE 23 N 0.91 0.76 -0.73 4.57 2.04 -1.28 -0.96 117.51 122.81 3khu h ILE 23 Ca 0.20 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 66.04 3khu h ILE 23 Cb 0.34 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 3khu h ILE 23 CO -0.00 0.01 0.46 0.00 0.00 0.00 0.00 178.15 178.62 3khu h ALA 24 N 1.27 0.93 -0.49 1.87 0.00 -1.22 0.16 119.26 121.78 3khu h ALA 24 Ca 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3khu h ALA 24 Cb 0.20 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3khu h ALA 24 CO -0.26 0.37 0.25 1.25 0.00 0.00 0.00 179.25 180.86 3khu h HIS 25 N 0.99 0.66 0.00 0.00 -0.00 -0.84 -2.99 115.15 112.97 3khu h HIS 25 Ca 0.26 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.62 3khu h HIS 25 Cb -0.07 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 27.12 3khu h HIS 25 CO -0.02 0.48 -0.98 -1.33 -0.00 0.00 0.00 177.93 176.09 3khu n MET 26 N -4.40 0.25 -3.57 5.26 2.81 -0.41 -4.61 117.12 112.45 3khu n MET 26 Ca 0.04 -0.00 -0.27 0.00 -1.81 0.00 0.00 57.70 55.66 3khu n MET 26 Cb 0.11 -1.58 -0.10 0.00 -0.71 0.00 0.00 33.22 30.93 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 5.17 0.00 -0.01 0.00 0.11 -1.82 -1.80 132.00 133.65 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 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3khu h PRO 28 CO 0.57 0.02 -0.08 -0.85 -0.21 0.00 0.00 178.00 177.46 3khu n GLU 29 N -3.84 1.39 -3.90 1.05 0.00 -1.26 -4.80 120.64 109.28 3khu n GLU 29 Ca -0.03 -0.80 -0.35 0.00 0.00 0.00 0.00 57.16 55.98 3khu n GLU 29 Cb 0.11 -1.48 -0.10 0.00 0.00 0.00 0.00 31.44 29.97 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 -2.16 4.93 -0.15 3.84 1.01 -0.68 -4.93 121.20 123.07 3khu s ILE 30 Ca 0.34 0.02 -0.26 0.00 0.00 0.00 0.00 60.65 60.75 3khu s ILE 30 Cb 0.20 -3.24 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 3khu s ILE 30 CO 0.39 0.43 0.85 -0.60 0.00 0.00 0.00 174.94 176.02 3khu s ARG 31 N 0.54 4.34 -0.19 2.79 3.52 -0.28 -4.83 118.95 124.83 3khu s ARG 31 Ca 0.05 1.07 0.01 0.00 -0.13 0.00 0.00 55.73 56.73 3khu s ARG 31 Cb -0.12 -3.55 0.03 0.00 -1.56 0.00 0.00 34.95 29.74 3khu s ARG 31 CO 0.01 -0.28 -0.17 0.08 -0.81 0.00 0.00 175.30 174.12 3khu s VAL 32 N 1.97 1.97 -0.24 7.11 1.01 0.42 -0.45 120.40 132.19 3khu s VAL 32 Ca 0.40 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.41 3khu s VAL 32 Cb -0.17 -1.85 0.05 0.00 0.00 0.00 0.00 36.38 34.41 3khu s VAL 32 CO 0.14 0.42 -0.12 -0.89 0.00 0.00 0.00 175.10 174.65 3khu s THR 33 N 1.30 2.05 -0.19 3.92 2.01 0.08 -0.72 115.64 124.10 3khu s THR 33 Ca 0.03 -1.44 -0.15 0.00 0.31 0.00 0.00 61.69 60.44 3khu s THR 33 Cb -0.14 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.20 3khu s THR 33 CO -0.11 0.07 0.35 -0.69 -0.69 0.00 0.00 174.62 173.54 3khu s VAL 34 N 1.18 5.25 0.19 3.82 1.01 0.12 -1.21 120.40 130.76 3khu s VAL 34 Ca -0.06 0.63 0.07 0.00 0.00 0.00 0.00 61.98 62.62 3khu s VAL 34 Cb -0.19 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 3khu s VAL 34 CO -0.07 0.31 -0.15 0.68 0.00 0.00 0.00 175.10 175.88 3khu s VAL 35 N 0.96 1.67 -0.12 2.92 -7.23 0.16 -1.38 120.40 117.38 3khu s VAL 35 Ca 0.18 -2.11 -0.29 0.00 -1.81 0.00 0.00 61.98 57.95 3khu s VAL 35 Cb -0.14 -1.95 0.07 0.00 0.56 0.00 0.00 36.38 34.92 3khu s VAL 35 CO 0.06 -0.55 0.68 -0.62 -0.31 0.00 0.00 175.10 174.36 3khu s ASP 36 N -3.13 -0.68 0.37 4.85 -1.08 -1.17 0.08 116.67 115.92 3khu s ASP 36 Ca 0.20 0.93 0.18 0.00 -0.52 0.00 0.00 52.55 53.33 3khu s ASP 36 Cb -0.02 0.82 0.69 0.00 -1.46 0.00 0.00 42.92 42.95 3khu s ASP 36 CO 0.06 -0.49 1.75 -0.37 0.52 0.00 0.00 175.17 176.63 3khu h VAL 37 N 3.33 0.96 -2.84 1.11 -1.51 -1.91 -3.41 116.25 111.98 3khu h VAL 37 Ca -0.28 -1.51 -0.55 0.00 -1.23 0.00 0.00 66.70 63.14 3khu h VAL 37 Cb 1.15 1.90 -0.07 0.00 -2.13 0.00 0.00 31.29 32.13 3khu h VAL 37 CO 0.29 0.38 1.04 0.21 -1.23 0.00 0.00 177.57 178.26 3khu s ASN 38 N -6.51 6.26 0.15 4.19 3.84 -1.26 -4.89 114.94 116.72 3khu s ASN 38 Ca -0.01 -0.01 -0.14 0.00 0.21 0.00 0.00 52.86 52.91 3khu s ASN 38 Cb 0.12 -2.55 0.04 0.00 -0.55 0.00 0.00 41.25 38.30 3khu s ASN 38 CO 0.69 -1.66 1.74 -0.08 -2.79 0.00 0.00 177.10 175.01 3khu h GLU 39 N 10.16 0.69 -0.79 0.43 4.81 -2.00 -2.60 114.58 125.29 3khu h GLU 39 Ca -0.26 -0.10 0.09 0.00 -0.13 0.00 0.00 59.36 58.96 3khu h GLU 39 Cb 1.07 -0.13 -0.07 0.00 0.63 0.00 0.00 28.75 30.25 3khu h GLU 39 CO 1.21 0.57 0.43 1.03 -0.73 0.00 0.00 179.01 181.53 3khu h SER 40 N 0.64 0.61 -0.37 1.04 0.87 -1.98 -1.09 113.55 113.27 3khu h SER 40 Ca 0.17 0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.67 3khu h SER 40 Cb 0.10 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.99 3khu h SER 40 CO -0.02 0.35 -0.20 -0.09 -0.53 0.00 0.00 176.83 176.33 3khu h ARG 41 N 0.73 0.78 -0.51 2.24 2.43 -1.93 -1.53 114.38 116.59 3khu h ARG 41 Ca 0.38 -0.35 0.03 0.00 -0.81 0.00 0.00 59.98 59.22 3khu h ARG 41 Cb 0.36 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.86 3khu h ARG 41 CO -0.25 0.98 0.30 0.82 -1.51 0.00 0.00 179.97 180.31 3khu h ILE 42 N 0.57 1.04 -0.57 1.20 1.08 -1.17 -1.36 117.51 118.30 3khu h ILE 42 Ca 0.08 -0.21 0.07 0.00 -0.39 0.00 0.00 64.86 64.41 3khu h ILE 42 Cb 0.76 0.39 -0.06 0.00 -3.07 0.00 0.00 36.82 34.84 3khu h ILE 42 CO 0.06 0.11 0.27 0.78 -0.69 0.00 0.00 178.15 178.68 3khu h ASN 43 N 0.60 0.35 -0.85 1.72 2.35 -1.05 -1.60 115.58 117.09 3khu h ASN 43 Ca 0.21 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.99 3khu h ASN 43 Cb 0.04 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.35 3khu h ASN 43 CO -0.10 0.23 0.49 0.00 -1.65 0.00 0.00 177.43 176.40 3khu h ALA 44 N 1.34 1.24 0.00 -0.83 0.00 -0.82 -0.14 119.26 120.05 3khu h ALA 44 Ca 0.27 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3khu h ALA 44 Cb 0.24 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3khu h ALA 44 CO -0.22 0.63 -0.21 -1.49 0.00 0.00 0.00 179.25 177.96 3khu h TRP 45 N 1.19 0.00 -0.32 0.00 4.06 -0.78 -1.90 115.95 118.21 3khu h TRP 45 Ca 0.31 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.26 3khu h TRP 45 Cb -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 3khu h TRP 45 CO 0.01 0.21 0.00 0.09 -3.56 0.00 0.00 178.44 175.19 3khu n ASN 46 N -4.10 1.71 -4.87 -3.49 3.02 -0.16 -4.95 115.26 102.41 3khu n ASN 46 Ca -0.02 -1.99 -0.26 0.00 -0.03 0.00 0.00 54.58 52.28 3khu n ASN 46 Cb 0.28 -0.21 -0.02 0.00 -0.61 0.00 0.00 39.78 39.22 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 -1.02 4.59 0.16 6.41 1.04 -0.61 -5.03 113.70 119.22 3khu s SER 47 Ca 0.22 -1.25 0.27 0.00 0.48 0.00 0.00 55.95 55.67 3khu s SER 47 Cb 0.11 0.30 0.92 0.00 0.10 0.00 0.00 66.02 67.46 3khu s SER 47 CO 0.15 -1.01 1.82 -2.65 0.98 0.00 0.00 173.24 172.52 3khu n PRO 48 N -1.66 0.19 -3.71 4.02 -0.02 -1.26 -4.52 135.00 128.03 3khu n PRO 48 Ca -0.03 0.16 -0.37 0.00 -2.02 0.00 0.00 63.50 61.24 3khu n PRO 48 Cb 0.64 -1.73 -0.10 0.00 -0.02 0.00 0.00 33.50 32.30 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 -3.08 3.64 0.44 3.45 2.01 -1.26 -5.09 115.64 115.75 3khu s THR 49 Ca 0.11 -2.46 -0.25 0.00 0.31 0.00 0.00 61.69 59.41 3khu s THR 49 Cb 0.14 -3.42 -0.08 0.00 0.01 0.00 0.00 72.50 69.15 3khu s THR 49 CO 0.58 -0.80 1.31 -0.76 -0.69 0.00 0.00 174.62 174.26 3khu s LEU 50 N 0.58 4.11 0.12 4.42 1.43 -1.26 -4.72 118.68 123.37 3khu s LEU 50 Ca 0.12 2.65 0.22 0.00 -1.03 0.00 0.00 54.13 56.10 3khu s LEU 50 Cb -0.22 -4.02 0.88 0.00 0.03 0.00 0.00 46.19 42.87 3khu s LEU 50 CO -0.04 -1.02 1.68 -0.81 0.23 0.00 0.00 176.35 176.40 3khu n PRO 51 N -0.19 0.11 -4.69 1.29 -0.04 -1.26 -4.48 135.00 125.74 3khu n PRO 51 Ca 0.05 0.26 -0.33 0.00 -0.04 0.00 0.00 63.50 63.44 3khu n PRO 51 Cb 0.44 -1.68 -0.16 0.00 -0.04 0.00 0.00 33.50 32.07 3khu n PRO 51 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3khu s ILE 52 N -3.12 2.54 -0.29 0.52 -1.09 -1.26 -5.10 121.20 113.39 3khu s ILE 52 Ca 0.08 -0.82 -0.20 0.00 -2.23 0.00 0.00 60.65 57.48 3khu s ILE 52 Cb 0.12 -2.05 -0.01 0.00 -1.58 0.00 0.00 42.46 38.93 3khu s ILE 52 CO 0.41 0.53 0.61 -0.47 -1.23 0.00 0.00 174.94 174.79 3khu s TYR 53 N 0.68 3.23 -0.03 3.97 5.04 -1.26 -4.97 117.35 124.01 3khu s TYR 53 Ca -0.08 0.61 -0.02 0.00 -2.44 0.00 0.00 57.07 55.14 3khu s TYR 53 Cb -0.16 -2.93 0.02 0.00 0.35 0.00 0.00 41.96 39.24 3khu s TYR 53 CO 0.02 -0.43 0.06 -1.21 -1.34 0.00 0.00 175.55 172.65 3khu s GLU 54 N 2.54 0.04 0.21 4.97 0.41 -1.26 -4.84 118.70 120.77 3khu s GLU 54 Ca 0.25 0.16 -0.32 0.00 -0.41 0.00 0.00 54.97 54.64 3khu s GLU 54 Cb -0.15 -0.08 -0.14 0.00 -1.78 0.00 0.00 34.13 31.97 3khu s GLU 54 CO 0.11 -0.08 1.33 -2.30 -0.49 0.00 0.00 175.26 173.83 3khu n PRO 55 N 3.56 1.71 0.00 0.39 -0.02 -1.26 -2.26 135.00 137.12 3khu n PRO 55 Ca -0.19 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 3khu n PRO 55 Cb 0.56 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 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 2.16 2.62 0.20 -1.23 0.00 -1.26 -4.44 105.19 103.23 3khu n GLY 56 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 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 0.78 -0.46 0.99 5.85 -1.86 -2.40 115.31 118.21 3khu h LEU 57 Ca 0.00 -0.59 0.09 0.00 0.84 0.00 0.00 57.88 58.22 3khu h LEU 57 Cb 0.00 -0.23 -0.09 0.00 0.37 0.00 0.00 40.66 40.72 3khu h LEU 57 CO 0.00 1.24 -0.10 0.50 -0.34 0.00 0.00 178.44 179.74 3khu h LYS 58 N 0.36 0.01 -0.06 1.25 3.64 -1.90 -1.07 116.57 118.81 3khu h LYS 58 Ca -0.02 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.24 3khu h LYS 58 Cb 1.16 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 3khu h LYS 58 CO 0.12 0.01 -0.49 1.05 -2.27 0.00 0.00 179.45 177.86 3khu h GLU 59 N 0.01 0.15 -0.14 1.90 9.09 -1.93 -0.60 114.58 123.05 3khu h GLU 59 Ca 0.22 -0.08 -0.04 0.00 0.05 0.00 0.00 59.36 59.51 3khu h GLU 59 Cb 0.34 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.44 3khu h GLU 59 CO -0.46 0.61 -0.07 0.28 0.05 0.00 0.00 179.01 179.42 3khu h VAL 60 N 0.12 1.31 -0.27 -1.06 2.07 -1.03 -2.57 116.25 114.83 3khu h VAL 60 Ca 0.00 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 3khu h VAL 60 Cb 0.92 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 3khu h VAL 60 CO 0.07 0.32 0.11 0.58 0.02 0.00 0.00 177.57 178.68 3khu h VAL 61 N -0.03 1.17 0.00 2.57 2.07 -1.01 -2.97 116.25 118.04 3khu h VAL 61 Ca 0.03 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 3khu h VAL 61 Cb 0.53 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.29 3khu h VAL 61 CO 0.02 0.17 -0.14 -0.33 0.02 0.00 0.00 177.57 177.31 3khu h GLU 62 N 0.29 0.00 0.00 1.57 5.08 -1.14 0.20 114.58 120.58 3khu h GLU 62 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3khu h GLU 62 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 3khu h GLU 62 CO -0.01 0.14 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 -1.28 -3.37 113.55 114.95 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 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 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 4.18 0.00 0.00 3.52 0.68 -1.44 118.95 125.88 3khu s ARG 65 Ca 0.00 2.47 0.00 0.00 -0.13 0.00 0.00 55.73 58.07 3khu s ARG 65 Cb 0.00 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.31 3khu s ARG 65 CO 0.00 -0.59 0.00 0.41 -0.81 0.00 0.00 175.30 174.31 3khu n GLY 66 N 2.70 2.72 0.02 8.12 0.00 -0.34 -4.85 105.19 113.56 3khu n GLY 66 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 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 0.13 0.00 1.61 5.02 -0.52 -4.86 118.16 117.54 3khu n LYS 67 Ca 0.00 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 3khu n LYS 67 Cb 0.00 -0.75 0.00 0.00 -0.02 0.00 0.00 35.03 34.26 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 -2.98 0.98 -4.24 4.39 6.94 -0.98 -5.04 115.26 114.33 3khu n ASN 68 Ca -0.03 -1.33 -0.33 0.00 -0.02 0.00 0.00 54.58 52.87 3khu n ASN 68 Cb 0.13 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.39 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 -0.33 2.32 0.00 -4.53 2.96 -0.89 -0.44 118.68 117.77 3khu s LEU 69 Ca 0.00 -0.51 0.02 0.00 -0.22 0.00 0.00 54.13 53.42 3khu s LEU 69 Cb 0.00 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 45.18 3khu s LEU 69 CO 0.00 0.10 -0.07 -0.36 -1.32 0.00 0.00 176.35 174.71 3khu s PHE 70 N 0.69 0.61 -0.13 5.38 0.08 0.10 -1.19 117.98 123.51 3khu s PHE 70 Ca -0.09 -0.15 0.02 0.00 0.12 0.00 0.00 56.93 56.83 3khu s PHE 70 Cb -0.16 -0.39 0.00 0.00 -0.57 0.00 0.00 43.02 41.91 3khu s PHE 70 CO 0.02 -0.01 -0.20 -0.06 -0.10 0.00 0.00 175.22 174.86 3khu s PHE 71 N -0.27 2.69 -0.01 0.36 0.08 -1.26 0.13 117.98 119.70 3khu s PHE 71 Ca 0.01 -1.14 -0.19 0.00 0.12 0.00 0.00 56.93 55.73 3khu s PHE 71 Cb -0.03 -1.82 0.04 0.00 -0.57 0.00 0.00 43.02 40.64 3khu s PHE 71 CO -0.00 -0.50 0.42 0.45 -0.10 0.00 0.00 175.22 175.48 3khu s SER 72 N 0.68 -0.31 0.00 1.36 0.15 -0.48 -4.94 113.70 110.15 3khu s SER 72 Ca -0.09 0.20 0.26 0.00 0.70 0.00 0.00 55.95 57.02 3khu s SER 72 Cb -0.16 0.39 0.70 0.00 -1.71 0.00 0.00 66.02 65.24 3khu s SER 72 CO 0.02 -0.54 1.53 0.35 1.20 0.00 0.00 173.24 175.80 3khu n THR 73 N 0.99 0.00 -2.37 6.45 -2.24 -1.26 -3.02 114.28 112.84 3khu n THR 73 Ca -0.20 -0.17 -0.43 0.00 -2.27 0.00 0.00 64.05 60.98 3khu n THR 73 Cb 0.57 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 3khu n THR 73 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3khu n ASN 74 N -0.43 4.68 -0.13 3.42 2.85 -1.26 -4.77 115.26 119.62 3khu n ASN 74 Ca 0.13 -2.91 -0.10 0.00 -0.11 0.00 0.00 54.58 51.59 3khu n ASN 74 Cb 0.37 -1.69 -0.01 0.00 1.24 0.00 0.00 39.78 39.68 3khu n ASN 74 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 3khu h ILE 75 N 4.96 1.21 -0.43 -1.44 2.04 -1.91 -2.94 117.51 119.00 3khu h ILE 75 Ca 0.47 -0.70 0.01 0.00 1.00 0.00 0.00 64.86 65.64 3khu h ILE 75 Cb 0.79 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 3khu h ILE 75 CO 1.57 0.24 0.28 0.44 0.00 0.00 0.00 178.15 180.68 3khu h ASP 76 N 0.46 0.48 0.38 1.72 3.32 -1.98 -1.73 116.42 119.07 3khu h ASP 76 Ca 0.12 -0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.00 3khu h ASP 76 Cb 0.26 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3khu h ASP 76 CO -0.00 0.35 -0.67 0.44 -1.72 0.00 0.00 179.24 177.63 3khu h ASP 77 N 0.57 0.30 -0.18 6.45 3.32 -1.96 -1.59 116.42 123.32 3khu h ASP 77 Ca 0.16 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 3khu h ASP 77 Cb -0.05 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 3khu h ASP 77 CO -0.04 0.88 0.11 0.00 -1.72 0.00 0.00 179.24 178.47 3khu h ALA 78 N 1.12 0.23 -0.36 3.45 0.00 -1.27 -2.04 119.26 120.39 3khu h ALA 78 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3khu h ALA 78 Cb 1.21 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 3khu h ALA 78 CO 0.11 -0.26 0.24 0.82 0.00 0.00 0.00 179.25 180.15 3khu h ILE 79 N 0.22 1.09 -0.59 0.00 2.04 -1.27 -2.74 117.51 116.26 3khu h ILE 79 Ca 0.07 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 65.81 3khu h ILE 79 Cb 0.02 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 36.62 3khu h ILE 79 CO -0.01 0.09 0.31 0.50 0.00 0.00 0.00 178.15 179.03 3khu h LYS 80 N 0.48 0.56 0.00 2.37 3.64 -0.95 -2.08 116.57 120.59 3khu h LYS 80 Ca 0.13 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3khu h LYS 80 Cb -0.05 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 3khu h LYS 80 CO -0.03 0.37 0.00 0.93 -2.27 0.00 0.00 179.45 178.45 3khu h GLU 81 N 0.58 0.00 -6.88 1.90 4.39 -1.29 -3.46 114.58 109.82 3khu h GLU 81 Ca 0.26 0.00 -0.48 0.00 0.34 0.00 0.00 59.36 59.49 3khu h GLU 81 Cb 0.17 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 3khu h GLU 81 CO -0.18 0.00 0.37 0.00 -1.16 0.00 0.00 179.01 178.05 3khu s ALA 82 N -3.13 3.22 -0.02 3.43 0.00 -0.78 -4.86 121.76 119.62 3khu s ALA 82 Ca 0.10 0.62 -0.05 0.00 0.00 0.00 0.00 51.96 52.62 3khu s ALA 82 Cb 0.11 -3.22 -0.28 0.00 0.00 0.00 0.00 23.12 19.72 3khu s ALA 82 CO 0.60 0.06 0.79 -0.44 0.00 0.00 0.00 175.76 176.77 3khu h ASP 83 N 3.23 0.45 -3.48 0.00 3.32 -1.04 -3.46 116.42 115.45 3khu h ASP 83 Ca -0.47 -0.65 -0.54 0.00 0.02 0.00 0.00 57.03 55.39 3khu h ASP 83 Cb 1.20 -0.15 -0.33 0.00 0.22 0.00 0.00 39.33 40.27 3khu h ASP 83 CO 0.65 1.55 -0.82 -0.22 -1.72 0.00 0.00 179.24 178.67 3khu s LEU 84 N -7.05 1.74 -0.26 1.55 2.96 -0.96 -1.44 118.68 115.22 3khu s LEU 84 Ca -0.11 -0.33 -0.02 0.00 -0.22 0.00 0.00 54.13 53.45 3khu s LEU 84 Cb 0.06 -0.91 0.03 0.00 0.50 0.00 0.00 46.19 45.88 3khu s LEU 84 CO 0.85 0.06 -0.05 -0.69 -1.32 0.00 0.00 176.35 175.21 3khu s VAL 85 N 0.54 2.91 0.08 1.68 1.01 0.84 -0.83 120.40 126.63 3khu s VAL 85 Ca -0.14 -1.07 -0.28 0.00 0.00 0.00 0.00 61.98 60.49 3khu s VAL 85 Cb -0.15 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 3khu s VAL 85 CO 0.04 0.15 0.90 -0.36 0.00 0.00 0.00 175.10 175.83 3khu s PHE 86 N 1.32 3.78 -0.31 5.22 0.08 0.98 -0.92 117.98 128.12 3khu s PHE 86 Ca -0.01 1.69 -0.12 0.00 0.12 0.00 0.00 56.93 58.61 3khu s PHE 86 Cb -0.17 -2.98 -0.03 0.00 -0.57 0.00 0.00 43.02 39.27 3khu s PHE 86 CO -0.04 0.21 0.21 0.42 -0.10 0.00 0.00 175.22 175.92 3khu s ILE 87 N 0.05 5.18 -0.35 0.64 1.01 0.21 -0.83 121.20 127.11 3khu s ILE 87 Ca 0.44 -0.10 0.14 0.00 0.00 0.00 0.00 60.65 61.14 3khu s ILE 87 Cb -0.22 -3.58 0.45 0.00 0.01 0.00 0.00 42.46 39.12 3khu s ILE 87 CO 0.27 0.11 1.01 -0.24 0.00 0.00 0.00 174.94 176.09 3khu n SER 88 N 5.07 2.46 -4.88 3.58 2.88 0.13 -0.84 113.62 122.01 3khu n SER 88 Ca -0.13 -2.98 -0.21 0.00 -1.33 0.00 0.00 58.87 54.21 3khu n SER 88 Cb 0.51 -0.50 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 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 -3.88 4.65 0.51 2.46 -7.23 -1.24 -4.39 120.40 111.27 3khu s VAL 89 Ca 0.34 -1.26 -0.22 0.00 -1.81 0.00 0.00 61.98 59.03 3khu s VAL 89 Cb 0.43 -3.54 -0.06 0.00 0.56 0.00 0.00 36.38 33.77 3khu s VAL 89 CO -0.03 -0.33 1.23 0.21 -0.31 0.00 0.00 175.10 175.87 3khu s ASN 90 N -3.91 5.76 -0.53 4.85 2.47 -1.26 -4.73 114.94 117.58 3khu s ASN 90 Ca 0.34 2.45 0.04 0.00 0.42 0.00 0.00 52.86 56.11 3khu s ASN 90 Cb -0.08 -2.61 0.14 0.00 -1.45 0.00 0.00 41.25 37.25 3khu s ASN 90 CO 0.27 -1.21 0.30 0.42 -3.72 0.00 0.00 177.10 173.15 3khu s THR 91 N -1.49 2.33 0.66 -5.21 -4.23 -1.26 -4.67 115.64 101.78 3khu s THR 91 Ca 0.68 -3.32 -0.13 0.00 -1.18 0.00 0.00 61.69 57.74 3khu s THR 91 Cb -0.32 -2.61 -0.00 0.00 1.34 0.00 0.00 72.50 70.91 3khu s THR 91 CO 0.38 -0.87 1.06 -2.16 -0.54 0.00 0.00 174.62 172.49 3khu s PRO 92 N -0.36 3.00 0.32 3.99 0.04 -1.26 -4.50 135.00 136.24 3khu s PRO 92 Ca 0.19 1.09 -0.29 0.00 0.04 0.00 0.00 61.00 62.03 3khu s PRO 92 Cb -0.21 -1.99 -0.11 0.00 0.04 0.00 0.00 34.50 32.23 3khu s PRO 92 CO -0.03 -1.05 1.52 0.99 0.04 0.00 0.00 177.00 178.46 3khu s THR 93 N -2.78 2.15 0.26 1.26 2.01 -1.26 -0.07 115.64 117.21 3khu s THR 93 Ca 0.61 0.14 -0.30 0.00 0.31 0.00 0.00 61.69 62.44 3khu s THR 93 Cb -0.15 -3.09 -0.11 0.00 0.01 0.00 0.00 72.50 69.16 3khu s THR 93 CO 0.48 0.03 1.57 -0.54 -0.69 0.00 0.00 174.62 175.47 3khu s LYS 94 N -1.21 4.16 0.00 4.92 1.02 -0.18 -4.76 119.74 123.70 3khu s LYS 94 Ca 0.58 2.51 0.20 0.00 0.02 0.00 0.00 55.97 59.28 3khu s LYS 94 Cb -0.46 -3.06 -0.20 0.00 -0.52 0.00 0.00 37.83 33.59 3khu s LYS 94 CO 0.54 -0.60 0.89 0.25 -0.92 0.00 0.00 175.35 175.51 3khu n THR 95 N 2.57 0.00 -4.02 2.17 -2.24 -1.26 -0.67 114.28 110.82 3khu n THR 95 Ca 0.09 -0.05 -0.10 0.00 -2.27 0.00 0.00 64.05 61.73 3khu n THR 95 Cb 0.38 1.03 -0.07 0.00 -2.10 0.00 0.00 70.33 69.56 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 -2.87 0.54 0.00 4.78 -0.85 -1.26 -4.82 117.35 112.87 3khu s TYR 96 Ca 0.09 -0.89 0.00 0.00 -0.52 0.00 0.00 57.07 55.75 3khu s TYR 96 Cb 0.16 -0.12 0.00 0.00 0.38 0.00 0.00 41.96 42.38 3khu s TYR 96 CO 0.80 -0.74 0.00 0.41 -1.52 0.00 0.00 175.55 174.50 3khu n GLY 97 N -0.24 -1.20 3.68 5.49 0.00 -1.26 -4.44 105.19 107.21 3khu n GLY 97 Ca -0.05 -1.32 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 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 4.27 0.00 1.61 -1.94 -1.26 -2.23 119.30 119.75 3khu s MET 98 Ca 0.00 1.96 0.00 0.00 -1.71 0.00 0.00 55.69 55.94 3khu s MET 98 Cb 0.00 -3.64 0.00 0.00 2.01 0.00 0.00 34.83 33.20 3khu s MET 98 CO 0.00 -0.62 0.00 0.41 -0.01 0.00 0.00 175.02 174.80 3khu n GLY 99 N 3.70 0.47 3.63 -0.03 0.00 -1.26 -4.85 105.19 106.86 3khu n GLY 99 Ca 0.14 -0.94 -0.52 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.82 1.39 -0.86 1.61 4.81 -0.95 -0.46 118.16 120.89 3khu n LYS 100 Ca 0.00 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 57.94 3khu n LYS 100 Cb 0.01 -2.19 0.00 0.00 0.02 0.00 0.00 35.03 32.87 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 3.10 0.87 1.71 3.14 0.00 0.15 -4.73 105.19 109.43 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 -2.14 0.00 -1.99 1.61 1.74 -0.51 -4.96 116.66 110.41 3khu n ARG 102 Ca 0.00 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.71 3khu n ARG 102 Cb 0.00 -0.06 0.02 0.00 -1.02 0.00 0.00 32.46 31.41 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 -1.85 2.80 0.25 7.54 0.00 0.39 -3.85 121.76 127.04 3khu s ALA 103 Ca 0.00 1.13 -0.21 0.00 0.00 0.00 0.00 51.96 52.87 3khu s ALA 103 Cb 0.00 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.55 3khu s ALA 103 CO 0.00 -1.09 0.79 0.00 0.00 0.00 0.00 175.76 175.46 3khu s ALA 104 N -1.45 3.35 -0.42 0.00 0.00 -1.26 -1.01 121.76 120.97 3khu s ALA 104 Ca 0.70 0.26 -0.19 0.00 0.00 0.00 0.00 51.96 52.74 3khu s ALA 104 Cb -0.34 -2.92 0.02 0.00 0.00 0.00 0.00 23.12 19.88 3khu s ALA 104 CO 0.40 0.28 0.51 0.34 0.00 0.00 0.00 175.76 177.30 3khu s ASP 105 N -1.66 6.25 0.00 0.00 -1.08 0.90 -4.73 116.67 116.35 3khu s ASP 105 Ca 0.45 -0.51 0.06 0.00 -0.52 0.00 0.00 52.55 52.03 3khu s ASP 105 Cb -0.17 -2.26 0.28 0.00 -1.46 0.00 0.00 42.92 39.31 3khu s ASP 105 CO 0.22 -0.64 1.19 0.18 0.52 0.00 0.00 175.17 176.63 3khu n LEU 106 N 5.84 0.30 -0.22 -1.34 4.77 -1.26 -4.10 117.00 120.99 3khu n LEU 106 Ca -0.05 -0.15 0.02 0.00 -0.03 0.00 0.00 56.01 55.81 3khu n LEU 106 Cb 0.48 -0.03 0.14 0.00 -2.33 0.00 0.00 43.42 41.67 3khu n LEU 106 CO 0.49 0.07 0.96 0.07 -1.33 0.00 0.00 177.39 177.65 3khu h LYS 107 N 0.35 0.33 -0.28 3.23 2.10 -1.93 -0.21 116.57 120.16 3khu h LYS 107 Ca 0.00 -0.02 -0.17 0.00 -2.00 0.00 0.00 60.65 58.46 3khu h LYS 107 Cb 0.08 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 3khu h LYS 107 CO 0.00 0.22 -0.50 1.88 -2.00 0.00 0.00 179.45 179.05 3khu h TYR 108 N 0.34 1.04 -0.64 0.07 0.05 -1.83 -0.44 116.97 115.55 3khu h TYR 108 Ca 0.35 -0.37 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 3khu h TYR 108 Cb 0.53 -0.20 -0.03 0.00 1.01 0.00 0.00 36.73 38.04 3khu h TYR 108 CO -0.21 1.18 0.40 0.82 -1.05 0.00 0.00 178.16 179.30 3khu h ILE 109 N 0.60 1.18 -0.36 -2.88 1.08 -1.66 -0.60 117.51 114.86 3khu h ILE 109 Ca 0.02 -0.38 -0.03 0.00 -0.39 0.00 0.00 64.86 64.08 3khu h ILE 109 Cb 1.11 0.28 -0.02 0.00 -3.07 0.00 0.00 36.82 35.12 3khu h ILE 109 CO 0.11 0.18 0.10 -0.08 -0.69 0.00 0.00 178.15 177.78 3khu h GLU 110 N 0.87 0.57 -0.60 2.37 4.81 -0.80 -0.42 114.58 121.37 3khu h GLU 110 Ca 0.23 -0.13 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 3khu h GLU 110 Cb -0.05 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 3khu h GLU 110 CO -0.05 0.60 0.36 0.00 -0.73 0.00 0.00 179.01 179.19 3khu h ALA 111 N 0.95 0.79 -0.32 2.92 0.00 -0.72 -0.90 119.26 121.98 3khu h ALA 111 Ca 0.12 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3khu h ALA 111 Cb 0.27 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3khu h ALA 111 CO -0.00 0.07 0.18 0.00 0.00 0.00 0.00 179.25 179.50 3khu h ALA 113 N 1.15 0.95 -0.33 0.00 0.00 -0.49 0.11 119.26 120.65 3khu h ALA 113 Ca 0.13 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3khu h ALA 113 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3khu h ALA 113 CO -0.07 0.18 -0.09 0.00 0.00 0.00 0.00 179.25 179.27 3khu h ARG 114 N 0.83 0.65 -0.86 0.00 3.08 -0.91 -2.34 114.38 114.82 3khu h ARG 114 Ca 0.30 -0.25 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 3khu h ARG 114 Cb 0.09 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 3khu h ARG 114 CO -0.14 0.82 0.42 -0.09 -1.07 0.00 0.00 179.97 179.91 3khu h ARG 115 N 0.43 1.23 -0.29 0.04 9.65 -0.75 -1.60 114.38 123.08 3khu h ARG 115 Ca 0.08 -0.18 -0.01 0.00 -1.10 0.00 0.00 59.98 58.77 3khu h ARG 115 Cb 0.59 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 28.93 3khu h ARG 115 CO 0.03 0.94 0.13 0.82 2.80 0.00 0.00 179.97 184.69 3khu h ILE 116 N 1.22 1.17 -0.31 1.20 2.04 -0.64 -1.84 117.51 120.34 3khu h ILE 116 Ca 0.30 -0.49 -0.10 0.00 1.00 0.00 0.00 64.86 65.56 3khu h ILE 116 Cb 0.11 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3khu h ILE 116 CO -0.04 0.17 -0.23 1.62 0.00 0.00 0.00 178.15 179.68 3khu h VAL 117 N 0.33 1.27 -0.94 1.67 3.04 -1.31 -2.35 116.25 117.95 3khu h VAL 117 Ca 0.10 -1.27 0.01 0.00 -1.01 0.00 0.00 66.70 64.53 3khu h VAL 117 Cb 0.15 1.28 -0.05 0.00 -2.01 0.00 0.00 31.29 30.66 3khu h VAL 117 CO -0.01 0.41 0.62 -0.61 -1.01 0.00 0.00 177.57 176.98 3khu h GLN 118 N 0.52 1.23 -0.61 4.17 4.15 -1.05 -3.11 115.11 120.42 3khu h GLN 118 Ca 0.08 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3khu h GLN 118 Cb 0.68 -0.28 0.00 0.00 0.21 0.00 0.00 27.48 28.09 3khu h GLN 118 CO 0.05 0.81 0.00 0.09 -1.93 0.00 0.00 178.83 177.85 3khu n ASN 119 N -4.39 4.54 -4.36 -0.69 3.02 -0.71 -4.98 115.26 107.68 3khu n ASN 119 Ca 0.11 -2.42 -0.30 0.00 -0.03 0.00 0.00 54.58 51.94 3khu n ASN 119 Cb 0.02 -0.55 -0.14 0.00 -0.61 0.00 0.00 39.78 38.50 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 -0.99 3.22 0.05 6.41 0.01 -0.91 -4.02 113.70 117.46 3khu s SER 120 Ca 0.48 -0.61 -0.00 0.00 1.31 0.00 0.00 55.95 57.13 3khu s SER 120 Cb 0.31 -0.29 -0.04 0.00 0.21 0.00 0.00 66.02 66.21 3khu s SER 120 CO 0.24 0.25 -0.04 0.20 0.41 0.00 0.00 173.24 174.30 3khu s ASN 121 N -1.39 0.53 0.43 2.44 0.01 -1.26 -4.97 114.94 110.74 3khu s ASN 121 Ca 0.12 -0.91 0.00 0.00 -0.71 0.00 0.00 52.86 51.36 3khu s ASN 121 Cb -0.10 0.17 0.00 0.00 0.41 0.00 0.00 41.25 41.73 3khu s ASN 121 CO 0.03 -0.53 0.00 0.61 -1.51 0.00 0.00 177.10 175.70 3khu n GLY 122 N 0.37 1.25 3.61 0.66 0.00 -1.16 -4.77 105.19 105.14 3khu n GLY 122 Ca -0.16 -0.73 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 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 3.20 0.05 1.61 5.04 -1.26 0.57 117.35 126.55 3khu s TYR 123 Ca 0.00 -0.00 -0.10 0.00 -2.44 0.00 0.00 57.07 54.53 3khu s TYR 123 Cb 0.00 -2.03 0.01 0.00 0.35 0.00 0.00 41.96 40.29 3khu s TYR 123 CO 0.00 0.14 0.22 0.15 -1.34 0.00 0.00 175.55 174.72 3khu s LYS 124 N 0.27 0.73 -0.20 4.97 1.02 -0.91 -4.85 119.74 120.77 3khu s LYS 124 Ca 0.02 -0.63 -0.05 0.00 0.02 0.00 0.00 55.97 55.32 3khu s LYS 124 Cb -0.13 0.31 -0.03 0.00 -0.52 0.00 0.00 37.83 37.46 3khu s LYS 124 CO 0.01 -0.22 0.01 0.42 -0.92 0.00 0.00 175.35 174.65 3khu s ILE 125 N -2.69 4.12 -0.18 2.17 1.01 -0.52 -1.16 121.20 123.94 3khu s ILE 125 Ca -0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 60.65 60.33 3khu s ILE 125 Cb -0.00 -2.86 -0.01 0.00 0.01 0.00 0.00 42.46 39.59 3khu s ILE 125 CO -0.04 0.43 -0.09 -0.69 0.00 0.00 0.00 174.94 174.55 3khu s VAL 126 N 0.90 3.19 -0.11 2.92 1.01 0.23 -0.12 120.40 128.42 3khu s VAL 126 Ca 0.02 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.42 3khu s VAL 126 Cb -0.14 -2.40 0.02 0.00 0.00 0.00 0.00 36.38 33.86 3khu s VAL 126 CO 0.02 0.47 -0.11 -0.89 0.00 0.00 0.00 175.10 174.60 3khu s THR 127 N 0.97 1.23 -0.01 3.92 2.01 -0.09 -0.69 115.64 122.97 3khu s THR 127 Ca -0.01 -0.44 -0.30 0.00 0.31 0.00 0.00 61.69 61.25 3khu s THR 127 Cb -0.15 -1.18 -0.05 0.00 0.01 0.00 0.00 72.50 71.13 3khu s THR 127 CO -0.00 0.40 1.31 -1.61 -0.69 0.00 0.00 174.62 174.02 3khu s GLU 128 N 1.41 4.32 -0.04 4.92 2.02 -0.55 -0.62 118.70 130.16 3khu s GLU 128 Ca 0.01 1.84 0.01 0.00 0.02 0.00 0.00 54.97 56.85 3khu s GLU 128 Cb -0.13 -3.53 -0.03 0.00 0.10 0.00 0.00 34.13 30.53 3khu s GLU 128 CO -0.06 -0.49 -0.02 1.17 0.02 0.00 0.00 175.26 175.87 3khu n LYS 129 N 5.12 0.89 -1.81 1.61 4.81 -0.02 -0.63 118.16 128.12 3khu n LYS 129 Ca 0.12 0.02 -0.30 0.00 -0.87 0.00 0.00 58.31 57.27 3khu n LYS 129 Cb 0.45 -1.08 0.05 0.00 0.02 0.00 0.00 35.03 34.47 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 -4.14 5.39 0.05 3.14 0.01 -1.21 -3.03 113.70 113.92 3khu s SER 130 Ca -0.04 1.22 -0.31 0.00 1.31 0.00 0.00 55.95 58.13 3khu s SER 130 Cb 0.01 -2.04 -0.06 0.00 0.21 0.00 0.00 66.02 64.14 3khu s SER 130 CO 0.10 -1.39 1.25 -0.89 0.41 0.00 0.00 173.24 172.72 3khu s THR 131 N -3.29 3.89 0.11 1.44 2.01 -1.26 -4.89 115.64 113.65 3khu s THR 131 Ca 0.58 1.34 0.05 0.00 0.31 0.00 0.00 61.69 63.97 3khu s THR 131 Cb -0.12 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.50 3khu s THR 131 CO 0.53 0.08 -0.12 0.68 -0.69 0.00 0.00 174.62 175.10 3khu s VAL 132 N 1.32 1.15 0.70 3.82 -7.23 -1.26 -4.49 120.40 114.41 3khu s VAL 132 Ca 0.60 -1.71 -0.13 0.00 -1.81 0.00 0.00 61.98 58.93 3khu s VAL 132 Cb -0.31 -1.48 0.02 0.00 0.56 0.00 0.00 36.38 35.18 3khu s VAL 132 CO 0.28 -0.50 1.10 -2.16 -0.31 0.00 0.00 175.10 173.51 3khu s PRO 133 N -2.79 2.66 0.36 4.82 0.04 -1.26 -4.94 135.00 133.88 3khu s PRO 133 Ca 0.08 1.27 -0.28 0.00 0.04 0.00 0.00 61.00 62.10 3khu s PRO 133 Cb -0.04 -1.94 -0.11 0.00 0.04 0.00 0.00 34.50 32.45 3khu s PRO 133 CO 0.02 -1.34 1.46 0.08 0.04 0.00 0.00 177.00 177.26 3khu s VAL 134 N -2.60 2.19 0.00 -0.36 1.01 -1.26 -1.86 120.40 117.53 3khu s VAL 134 Ca 0.64 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.81 3khu s VAL 134 Cb -0.18 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.07 3khu s VAL 134 CO 0.47 0.04 0.00 0.54 0.00 0.00 0.00 175.10 176.15 3khu n ARG 135 N 0.72 0.00 -0.13 2.72 3.00 -1.26 -4.96 116.66 116.75 3khu n ARG 135 Ca 0.02 0.00 -0.04 0.00 -0.01 0.00 0.00 57.85 57.81 3khu n ARG 135 Cb 0.40 -0.97 0.04 0.00 0.00 0.00 0.00 32.46 31.93 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 0.48 -0.49 7.54 0.00 -1.74 -2.36 119.26 122.69 3khu h ALA 136 Ca 0.00 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3khu h ALA 136 Cb 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3khu h ALA 136 CO 0.00 -0.31 0.30 0.00 0.00 0.00 0.00 179.25 179.24 3khu h ALA 137 N 1.32 1.60 -0.58 0.00 0.00 -1.93 -0.04 119.26 119.64 3khu h ALA 137 Ca 0.21 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3khu h ALA 137 Cb 0.26 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3khu h ALA 137 CO -0.27 0.35 0.23 1.49 0.00 0.00 0.00 179.25 181.05 3khu h GLU 138 N 0.67 0.84 -0.23 0.00 4.81 -1.86 -0.57 114.58 118.25 3khu h GLU 138 Ca 0.18 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 3khu h GLU 138 Cb -0.03 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 3khu h GLU 138 CO -0.03 0.69 -0.11 0.77 -0.73 0.00 0.00 179.01 179.59 3khu h SER 139 N 0.83 0.50 -0.14 1.04 0.02 -0.59 -1.23 113.55 113.97 3khu h SER 139 Ca 0.20 -0.41 0.01 0.00 -0.84 0.00 0.00 61.79 60.74 3khu h SER 139 Cb 0.17 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3khu h SER 139 CO -0.02 0.80 0.08 0.40 -1.14 0.00 0.00 176.83 176.95 3khu h ILE 140 N 0.19 1.01 -0.80 3.27 2.04 -1.14 -1.76 117.51 120.32 3khu h ILE 140 Ca 0.05 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 65.94 3khu h ILE 140 Cb 0.61 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 37.47 3khu h ILE 140 CO 0.03 0.03 0.52 -0.09 0.00 0.00 0.00 178.15 178.65 3khu h ARG 141 N 0.16 0.76 -0.38 2.37 9.65 -1.03 -1.46 114.38 124.45 3khu h ARG 141 Ca 0.05 -0.05 -0.12 0.00 -1.10 0.00 0.00 59.98 58.77 3khu h ARG 141 Cb -0.00 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.40 3khu h ARG 141 CO -0.03 0.50 -0.24 0.00 2.80 0.00 0.00 179.97 183.00 3khu h ARG 142 N 0.78 0.84 -0.52 0.20 3.08 -0.57 0.32 114.38 118.50 3khu h ARG 142 Ca 0.36 -0.39 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3khu h ARG 142 Cb 0.39 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 3khu h ARG 142 CO -0.14 1.03 0.28 0.82 -1.07 0.00 0.00 179.97 180.89 3khu h ILE 143 N 0.64 1.18 -0.19 2.04 2.04 -0.83 -1.40 117.51 121.00 3khu h ILE 143 Ca 0.08 -0.47 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 3khu h ILE 143 Cb 0.81 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 3khu h ILE 143 CO 0.07 0.19 0.06 -0.26 0.00 0.00 0.00 178.15 178.21 3khu h PHE 144 N 0.69 0.30 -0.33 1.37 0.04 -1.13 -2.18 116.94 115.70 3khu h PHE 144 Ca 0.18 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.92 3khu h PHE 144 Cb 0.06 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.11 3khu h PHE 144 CO -0.01 0.39 0.22 -0.44 -0.60 0.00 0.00 178.31 177.87 3khu h ASP 145 N 0.13 0.38 1.43 2.17 3.32 -0.81 -2.35 116.42 120.69 3khu h ASP 145 Ca 0.06 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3khu h ASP 145 Cb 0.23 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.68 3khu h ASP 145 CO -0.00 0.27 -0.25 0.00 -1.72 0.00 0.00 179.24 177.54 3khu h ALA 146 N 1.79 0.85 -1.33 3.45 0.00 -1.04 -3.35 119.26 119.64 3khu h ALA 146 Ca 0.12 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.48 3khu h ALA 146 Cb -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.32 3khu h ALA 146 CO -0.03 0.00 -0.80 0.09 0.00 0.00 0.00 179.25 178.51 3khu n ASN 147 N -2.50 4.32 -4.83 0.00 3.02 -0.84 -5.08 115.26 109.34 3khu n ASN 147 Ca 0.04 -3.58 -0.32 0.00 -0.03 0.00 0.00 54.58 50.69 3khu n ASN 147 Cb 0.47 -0.45 -0.02 0.00 -0.61 0.00 0.00 39.78 39.17 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 -5.11 4.31 0.09 3.41 -1.32 -1.19 -4.94 115.64 110.89 3khu s THR 148 Ca 0.46 1.08 0.04 0.00 -1.21 0.00 0.00 61.69 62.06 3khu s THR 148 Cb 0.41 -3.62 -0.03 0.00 -1.51 0.00 0.00 72.50 67.74 3khu s THR 148 CO -0.13 -0.66 -0.11 -0.54 -2.21 0.00 0.00 174.62 170.97 3khu s LYS 149 N -4.14 0.82 0.18 7.08 1.02 -1.26 -5.09 119.74 118.34 3khu s LYS 149 Ca 0.60 -1.08 -0.33 0.00 0.02 0.00 0.00 55.97 55.18 3khu s LYS 149 Cb -0.12 -0.59 -0.14 0.00 -0.52 0.00 0.00 37.83 36.46 3khu s LYS 149 CO 0.35 0.10 1.48 -2.30 -0.92 0.00 0.00 175.35 174.05 3khu n PRO 150 N 0.80 1.95 -0.82 -1.68 -0.02 -1.26 -2.06 135.00 131.92 3khu n PRO 150 Ca -0.18 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 3khu n PRO 150 Cb 0.57 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 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 2.83 -1.51 -4.66 2.55 3.02 -1.26 -4.80 115.26 111.43 3khu n ASN 151 Ca 0.15 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.28 3khu n ASN 151 Cb 0.28 -1.62 -0.03 0.00 -0.61 0.00 0.00 39.78 37.80 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 4.12 -0.36 3.41 2.96 -0.87 -2.99 118.68 124.95 3khu s LEU 152 Ca 0.00 1.25 0.00 0.00 -0.22 0.00 0.00 54.13 55.16 3khu s LEU 152 Cb 0.00 -3.38 0.12 0.00 0.50 0.00 0.00 46.19 43.43 3khu s LEU 152 CO 0.00 -0.55 0.16 0.21 -1.32 0.00 0.00 176.35 174.84 3khu s ASN 153 N 1.23 3.77 -0.19 3.68 2.47 0.19 -4.78 114.94 121.31 3khu s ASN 153 Ca 0.40 -2.02 -0.09 0.00 0.42 0.00 0.00 52.86 51.57 3khu s ASN 153 Cb -0.16 -0.85 -0.05 0.00 -1.45 0.00 0.00 41.25 38.75 3khu s ASN 153 CO 0.09 -0.35 0.11 -0.76 -3.72 0.00 0.00 177.10 172.46 3khu s LEU 154 N 1.15 4.12 -0.11 3.21 1.43 -1.26 -2.15 118.68 125.07 3khu s LEU 154 Ca 0.13 0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 53.43 3khu s LEU 154 Cb -0.20 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 3khu s LEU 154 CO -0.14 0.19 -0.07 -1.10 0.23 0.00 0.00 176.35 175.47 3khu s GLN 155 N 0.27 3.21 -0.19 1.70 -1.52 -0.31 -4.99 119.66 117.83 3khu s GLN 155 Ca 0.07 -0.56 -0.04 0.00 -1.95 0.00 0.00 55.36 52.88 3khu s GLN 155 Cb -0.11 -2.72 -0.02 0.00 -0.22 0.00 0.00 33.01 29.94 3khu s GLN 155 CO -0.01 0.43 -0.02 0.08 -0.25 0.00 0.00 175.29 175.52 3khu s VAL 156 N -0.17 3.83 0.22 1.09 1.01 -1.26 0.77 120.40 125.89 3khu s VAL 156 Ca 0.02 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.71 3khu s VAL 156 Cb -0.13 -2.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.48 3khu s VAL 156 CO 0.03 0.45 -0.11 -0.76 0.00 0.00 0.00 175.10 174.70 3khu s LEU 157 N 0.89 2.52 -0.09 3.92 1.43 0.13 -4.58 118.68 122.89 3khu s LEU 157 Ca 0.00 -1.07 0.02 0.00 -1.03 0.00 0.00 54.13 52.05 3khu s LEU 157 Cb -0.14 -0.62 -0.02 0.00 0.03 0.00 0.00 46.19 45.44 3khu s LEU 157 CO 0.02 -0.24 -0.15 -0.55 0.23 0.00 0.00 176.35 175.66 3khu s SER 158 N -3.33 3.91 -0.43 2.29 0.15 0.41 -1.49 113.70 115.21 3khu s SER 158 Ca 0.24 -0.30 0.05 0.00 0.70 0.00 0.00 55.95 56.64 3khu s SER 158 Cb 0.01 -1.27 0.19 0.00 -1.71 0.00 0.00 66.02 63.24 3khu s SER 158 CO 0.08 0.24 0.45 -3.20 1.20 0.00 0.00 173.24 172.00 3khu n ASN 159 N 3.04 -1.04 -4.76 5.45 4.05 0.19 -0.11 115.26 122.08 3khu n ASN 159 Ca -0.18 -2.54 -0.35 0.00 0.45 0.00 0.00 54.58 51.96 3khu n ASN 159 Cb 0.52 -0.06 0.04 0.00 1.23 0.00 0.00 39.78 41.51 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 0.08 2.94 0.22 1.20 0.02 -1.25 -4.27 135.00 133.94 3khu s PRO 160 Ca 0.33 1.69 0.02 0.00 0.02 0.00 0.00 61.00 63.06 3khu s PRO 160 Cb 0.06 -1.94 -0.03 0.00 0.02 0.00 0.00 34.50 32.60 3khu s PRO 160 CO -0.16 -1.20 0.37 -0.65 -0.33 0.00 0.00 177.00 175.03 3khu s GLN 161 N -3.52 3.47 -0.45 5.54 1.11 -1.17 -4.62 119.66 120.01 3khu s GLN 161 Ca 0.74 -0.55 0.09 0.00 0.01 0.00 0.00 55.36 55.65 3khu s GLN 161 Cb -0.27 -2.87 0.34 0.00 -1.01 0.00 0.00 33.01 29.21 3khu s GLN 161 CO 0.34 0.41 0.80 1.19 0.01 0.00 0.00 175.29 178.05 3khu n PHE 162 N -1.03 1.62 -3.81 0.91 3.72 -1.26 -4.99 117.46 112.62 3khu n PHE 162 Ca -0.07 -3.88 -0.35 0.00 -0.05 0.00 0.00 57.45 53.10 3khu n PHE 162 Cb 0.55 -0.45 -0.08 0.00 -0.94 0.00 0.00 39.48 38.57 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 -2.78 4.15 -0.06 4.37 1.43 -1.26 -4.91 118.68 119.63 3khu s LEU 163 Ca 0.43 0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 53.75 3khu s LEU 163 Cb 0.32 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 3khu s LEU 163 CO -0.10 0.21 0.04 0.00 0.23 0.00 0.00 176.35 176.73 3khu s ALA 164 N 0.17 3.45 0.15 4.21 0.00 -1.26 -5.01 121.76 123.47 3khu s ALA 164 Ca 0.08 -0.82 -0.34 0.00 0.00 0.00 0.00 51.96 50.88 3khu s ALA 164 Cb -0.11 -1.56 -0.14 0.00 0.00 0.00 0.00 23.12 21.31 3khu s ALA 164 CO -0.01 0.63 1.61 -1.91 0.00 0.00 0.00 175.76 176.08 3khu n GLU 165 N 1.74 2.20 0.00 0.00 0.00 -1.26 -1.88 120.64 121.45 3khu n GLU 165 Ca -0.17 0.79 0.00 0.00 0.00 0.00 0.00 57.16 57.79 3khu n GLU 165 Cb 0.53 -2.58 0.00 0.00 0.00 0.00 0.00 31.44 29.40 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 3.53 1.93 0.29 8.31 0.00 -1.26 -4.84 105.19 113.15 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 0.98 -0.22 2.61 -2.24 -0.79 -4.63 114.28 108.00 3khu n THR 167 Ca 0.00 -1.20 0.00 0.00 -2.27 0.00 0.00 64.05 60.58 3khu n THR 167 Cb 0.00 0.12 0.12 0.00 -2.10 0.00 0.00 70.33 68.47 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 0.02 0.85 -0.21 6.98 0.00 -1.87 0.18 119.26 125.21 3khu h ALA 168 Ca -0.00 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3khu h ALA 168 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3khu h ALA 168 CO 0.00 -0.12 0.04 0.82 0.00 0.00 0.00 179.25 179.99 3khu h ILE 169 N 0.50 1.22 -0.86 0.00 1.08 -1.91 -0.59 117.51 116.94 3khu h ILE 169 Ca 0.32 -0.73 -0.02 0.00 -0.39 0.00 0.00 64.86 64.03 3khu h ILE 169 Cb 0.35 1.30 -0.04 0.00 -3.07 0.00 0.00 36.82 35.37 3khu h ILE 169 CO -0.28 0.23 0.45 0.11 -0.69 0.00 0.00 178.15 177.97 3khu h LYS 170 N 0.15 1.22 0.00 2.37 1.57 -1.77 0.74 116.57 120.85 3khu h LYS 170 Ca 0.06 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 3khu h LYS 170 Cb 0.31 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 3khu h LYS 170 CO 0.00 0.91 -0.13 -0.44 -0.57 0.00 0.00 179.45 179.22 3khu h ASP 171 N 1.21 0.00 0.19 0.86 3.32 -0.27 0.35 116.42 122.09 3khu h ASP 171 Ca 0.30 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.00 3khu h ASP 171 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3khu h ASP 171 CO -0.04 0.13 -1.80 -0.07 -1.72 0.00 0.00 179.24 175.74 3khu h LEU 172 N 0.00 0.56 -0.19 1.55 3.38 -0.41 -3.14 115.31 117.07 3khu h LEU 172 Ca -0.00 -0.91 -0.22 0.00 0.09 0.00 0.00 57.88 56.84 3khu h LEU 172 Cb 0.26 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3khu h LEU 172 CO 0.02 1.78 -0.95 0.11 0.09 0.00 0.00 178.44 179.49 3khu h LYS 173 N 0.10 0.27 -2.11 1.13 1.57 -0.74 -3.38 116.57 113.41 3khu h LYS 173 Ca -0.36 -0.31 -0.54 0.00 -1.87 0.00 0.00 60.65 57.57 3khu h LYS 173 Cb 2.08 0.09 -0.41 0.00 0.08 0.00 0.00 32.23 34.08 3khu h LYS 173 CO 0.16 1.04 -0.95 -1.71 -0.57 0.00 0.00 179.45 177.42 3khu n ASN 174 N -3.66 2.21 -4.77 0.86 5.15 0.10 -4.89 115.26 110.25 3khu n ASN 174 Ca -0.05 -3.23 -0.38 0.00 -0.60 0.00 0.00 54.58 50.33 3khu n ASN 174 Cb 0.85 -0.61 -0.05 0.00 -0.53 0.00 0.00 39.78 39.44 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 -2.59 4.38 0.24 1.20 0.04 -1.19 -4.69 135.00 132.39 3khu s PRO 175 Ca 0.42 1.55 -0.06 0.00 0.04 0.00 0.00 61.00 62.95 3khu s PRO 175 Cb 0.28 -2.77 0.31 0.00 0.04 0.00 0.00 34.50 32.35 3khu s PRO 175 CO -0.10 0.05 1.85 -0.44 0.04 0.00 0.00 177.00 178.40 3khu h ASP 176 N 3.00 0.82 -5.04 6.66 3.32 -1.95 -3.44 116.42 119.80 3khu h ASP 176 Ca -0.47 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.57 3khu h ASP 176 Cb 1.21 -0.16 -0.11 0.00 0.22 0.00 0.00 39.33 40.49 3khu h ASP 176 CO 0.64 0.54 0.10 0.00 -1.72 0.00 0.00 179.24 178.80 3khu s ARG 177 N -6.07 1.28 -0.08 3.56 3.03 -1.26 -4.88 118.95 114.53 3khu s ARG 177 Ca -0.13 -0.64 0.01 0.00 2.03 0.00 0.00 55.73 57.00 3khu s ARG 177 Cb 0.18 0.55 -0.03 0.00 -1.03 0.00 0.00 34.95 34.62 3khu s ARG 177 CO 0.79 -0.55 -0.11 0.08 -1.13 0.00 0.00 175.30 174.39 3khu s VAL 178 N -3.80 3.36 -0.13 4.99 1.01 -0.18 -4.97 120.40 120.68 3khu s VAL 178 Ca 0.04 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.44 3khu s VAL 178 Cb -0.01 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 34.02 3khu s VAL 178 CO -0.09 0.57 -0.18 -0.22 0.00 0.00 0.00 175.10 175.17 3khu s LEU 179 N -0.43 1.92 -0.07 3.92 2.96 -1.26 -0.07 118.68 125.65 3khu s LEU 179 Ca 0.06 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.44 3khu s LEU 179 Cb -0.12 -1.29 0.02 0.00 0.50 0.00 0.00 46.19 45.30 3khu s LEU 179 CO 0.02 0.04 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.41 3khu s ILE 180 N 0.99 0.65 0.01 6.68 1.01 -0.51 -3.74 121.20 126.29 3khu s ILE 180 Ca -0.05 -0.13 0.06 0.00 0.00 0.00 0.00 60.65 60.53 3khu s ILE 180 Cb -0.15 -0.69 -0.03 0.00 0.01 0.00 0.00 42.46 41.60 3khu s ILE 180 CO -0.04 0.27 -0.16 -0.83 0.00 0.00 0.00 174.94 174.19 3khu s GLY 181 N 1.29 1.57 0.30 6.18 0.00 0.84 -0.99 107.32 116.51 3khu s GLY 181 Ca -0.05 -1.11 -0.20 0.00 0.00 0.00 0.00 44.72 43.36 3khu s GLY 181 CO -0.02 -0.97 0.74 -0.32 0.00 0.00 0.00 173.10 172.53 3khu s GLY 182 N -1.21 0.01 0.75 0.20 0.00 -0.89 -0.45 107.32 105.73 3khu s GLY 182 Ca 0.14 -0.40 -0.14 0.00 0.00 0.00 0.00 44.72 44.32 3khu s GLY 182 CO 0.04 -0.13 1.19 0.99 0.00 0.00 0.00 173.10 175.19 3khu s ASP 183 N -2.95 4.08 0.00 1.64 -0.00 -1.26 -3.38 116.67 114.79 3khu s ASP 183 Ca 0.12 2.30 0.04 0.00 -0.00 0.00 0.00 52.55 55.01 3khu s ASP 183 Cb -0.06 -2.58 0.24 0.00 -0.00 0.00 0.00 42.92 40.52 3khu s ASP 183 CO 0.08 -2.34 1.11 -1.84 -0.00 0.00 0.00 175.17 172.18 3khu n GLU 184 N -2.94 0.95 -2.25 8.23 -0.00 -1.26 -3.72 120.64 119.65 3khu n GLU 184 Ca 0.13 0.00 -0.28 0.00 -0.00 0.00 0.00 57.16 57.01 3khu n GLU 184 Cb 0.51 -1.07 0.03 0.00 -0.00 0.00 0.00 31.44 30.91 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 -2.00 3.68 0.21 3.84 -4.23 -1.26 -4.87 115.64 111.00 3khu s THR 185 Ca 0.06 0.17 -0.10 0.00 -1.18 0.00 0.00 61.69 60.64 3khu s THR 185 Cb 0.03 -3.48 0.16 0.00 1.34 0.00 0.00 72.50 70.54 3khu s THR 185 CO 0.05 -0.54 1.87 -0.65 -0.54 0.00 0.00 174.62 174.80 3khu h PRO 186 N -0.30 0.94 -0.53 3.99 0.11 -1.99 -0.20 132.00 134.02 3khu h PRO 186 Ca -0.45 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 3khu h PRO 186 Cb 1.25 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 3khu h PRO 186 CO 0.62 0.62 0.13 0.93 -0.21 0.00 0.00 178.00 180.09 3khu h GLU 187 N 0.97 0.85 -0.52 1.05 4.39 -1.94 -1.95 114.58 117.43 3khu h GLU 187 Ca 0.28 -0.20 0.05 0.00 0.34 0.00 0.00 59.36 59.83 3khu h GLU 187 Cb -0.06 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.43 3khu h GLU 187 CO -0.08 0.80 0.26 0.78 -1.16 0.00 0.00 179.01 179.61 3khu h GLY 188 N 0.74 0.73 1.87 -3.84 0.00 -1.67 -1.83 103.07 99.08 3khu h GLY 188 Ca 0.17 -0.17 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 3khu h GLY 188 CO 0.00 0.10 -0.48 1.46 0.00 0.00 0.00 176.54 177.62 3khu h GLN 189 N 0.50 0.14 -0.07 4.80 1.08 -0.90 -0.80 115.11 119.85 3khu h GLN 189 Ca 0.23 -0.07 -0.14 0.00 -1.45 0.00 0.00 58.65 57.22 3khu h GLN 189 Cb 0.15 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 3khu h GLN 189 CO -0.17 0.59 -0.58 0.00 -0.95 0.00 0.00 178.83 177.72 3khu h ARG 190 N 0.11 0.24 -0.20 1.46 3.08 -0.98 -1.67 114.38 116.41 3khu h ARG 190 Ca 0.00 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 59.84 3khu h ARG 190 Cb 0.90 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.96 3khu h ARG 190 CO 0.07 0.75 -0.08 0.00 -1.07 0.00 0.00 179.97 179.64 3khu h ALA 191 N 1.21 0.28 -0.41 0.04 0.00 -0.94 -2.28 119.26 117.17 3khu h ALA 191 Ca -0.00 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.67 3khu h ALA 191 Cb 1.08 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 3khu h ALA 191 CO 0.09 0.10 0.16 0.28 0.00 0.00 0.00 179.25 179.88 3khu h VAL 192 N 0.12 0.90 -0.50 0.00 2.07 -1.06 -1.84 116.25 115.95 3khu h VAL 192 Ca 0.05 -0.11 -0.08 0.00 0.82 0.00 0.00 66.70 67.37 3khu h VAL 192 Cb 0.56 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 3khu h VAL 192 CO 0.03 0.06 -0.02 -0.61 0.02 0.00 0.00 177.57 177.05 3khu h GLN 193 N 0.33 0.84 -0.95 1.57 4.15 -1.32 -0.62 115.11 119.12 3khu h GLN 193 Ca 0.18 -0.24 0.05 0.00 0.77 0.00 0.00 58.65 59.41 3khu h GLN 193 Cb 0.15 -0.09 -0.06 0.00 0.21 0.00 0.00 27.48 27.69 3khu h GLN 193 CO -0.17 0.85 0.61 0.00 -1.93 0.00 0.00 178.83 178.19 3khu h ALA 194 N 1.20 1.29 -0.06 3.38 0.00 -0.84 -0.49 119.26 123.73 3khu h ALA 194 Ca 0.15 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.81 3khu h ALA 194 Cb 0.49 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3khu h ALA 194 CO 0.02 0.43 -0.86 1.25 0.00 0.00 0.00 179.25 180.09 3khu h LEU 195 N 1.14 0.66 -0.62 0.00 5.85 -0.84 -3.02 115.31 118.49 3khu h LEU 195 Ca 0.40 -0.48 0.07 0.00 0.84 0.00 0.00 57.88 58.71 3khu h LEU 195 Cb 0.10 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.87 3khu h LEU 195 CO -0.15 1.26 0.30 0.00 -0.34 0.00 0.00 178.44 179.51 3khu h ALA 197 N 1.36 1.86 0.26 0.00 0.00 -0.97 0.17 119.26 121.93 3khu h ALA 197 Ca 0.29 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 3khu h ALA 197 Cb 0.26 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3khu h ALA 197 CO -0.22 0.07 -0.12 0.28 0.00 0.00 0.00 179.25 179.26 3khu h VAL 198 N 0.45 0.80 -0.00 0.00 2.07 -1.30 -3.02 116.25 115.24 3khu h VAL 198 Ca 0.19 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 3khu h VAL 198 Cb 0.19 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 3khu h VAL 198 CO -0.05 0.09 -0.10 1.88 0.02 0.00 0.00 177.57 179.41 3khu h TYR 199 N -0.55 0.00 0.00 1.57 -1.99 -1.04 -2.49 116.97 112.47 3khu h TYR 199 Ca -0.04 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.69 3khu h TYR 199 Cb 0.41 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.14 3khu h TYR 199 CO -0.00 0.10 0.00 0.39 -0.00 0.00 0.00 178.16 178.65 3khu n GLU 200 N -4.42 0.09 0.29 4.88 1.02 0.50 -0.73 120.64 122.28 3khu n GLU 200 Ca -0.03 0.46 0.14 0.00 -0.02 0.00 0.00 57.16 57.71 3khu n GLU 200 Cb 0.18 -1.72 0.87 0.00 -0.02 0.00 0.00 31.44 30.75 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 -1.49 -3.37 115.15 113.83 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 0.16 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.63 3khu h HIS 201 CO 0.00 0.01 0.00 -2.67 0.86 0.00 0.00 177.93 176.13 3khu n TRP 202 N -3.93 0.00 -4.78 2.45 2.14 -0.53 -5.00 117.44 107.78 3khu n TRP 202 Ca -0.03 0.00 -0.33 0.00 2.07 0.00 0.00 57.50 59.21 3khu n TRP 202 Cb 0.09 0.01 -0.14 0.00 -0.81 0.00 0.00 31.31 30.46 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 3.07 0.41 -1.67 1.01 0.10 -4.99 120.40 118.33 3khu s VAL 203 Ca 0.00 -0.66 -0.26 0.00 0.00 0.00 0.00 61.98 61.06 3khu s VAL 203 Cb 0.00 -2.28 -0.10 0.00 0.00 0.00 0.00 36.38 34.00 3khu s VAL 203 CO 0.00 0.53 1.36 -2.65 0.00 0.00 0.00 175.10 174.34 3khu n PRO 204 N 3.44 2.19 -0.31 2.72 -0.02 -1.26 -4.26 135.00 137.49 3khu n PRO 204 Ca -0.18 0.78 0.17 0.00 -2.02 0.00 0.00 63.50 62.25 3khu n PRO 204 Cb 0.53 -2.50 0.42 0.00 -0.02 0.00 0.00 33.50 31.92 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 2.37 0.56 0.00 -0.52 9.65 -1.94 0.11 114.38 124.60 3khu h ARG 205 Ca -0.49 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.36 3khu h ARG 205 Cb 1.28 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.73 3khu h ARG 205 CO 0.61 0.37 0.00 1.05 2.80 0.00 0.00 179.97 184.80 3khu h GLU 206 N 0.57 0.00 -0.51 0.20 9.09 -2.03 -1.98 114.58 119.93 3khu h GLU 206 Ca 0.55 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.96 3khu h GLU 206 Cb 1.12 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.22 3khu h GLU 206 CO -0.30 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.39 3khu n LYS 207 N -2.67 2.58 -3.70 1.06 5.02 0.02 -4.83 118.16 115.64 3khu n LYS 207 Ca 0.00 -2.42 -0.37 0.00 -2.02 0.00 0.00 58.31 53.50 3khu n LYS 207 Cb 0.19 -1.53 -0.12 0.00 -0.02 0.00 0.00 35.03 33.55 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 -1.30 4.52 -0.15 -0.18 1.01 -0.74 -1.01 121.20 123.34 3khu s ILE 208 Ca 0.42 -0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.84 3khu s ILE 208 Cb 0.24 -3.18 -0.02 0.00 0.01 0.00 0.00 42.46 39.50 3khu s ILE 208 CO 0.32 0.25 -0.07 -0.22 0.00 0.00 0.00 174.94 175.22 3khu s LEU 209 N 1.63 3.08 -0.07 2.97 2.96 0.90 -4.97 118.68 125.18 3khu s LEU 209 Ca 0.06 -0.20 0.03 0.00 -0.22 0.00 0.00 54.13 53.80 3khu s LEU 209 Cb -0.16 -1.73 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 3khu s LEU 209 CO 0.05 0.16 -0.16 0.42 -1.32 0.00 0.00 176.35 175.51 3khu s THR 210 N 0.39 2.91 0.27 3.68 -4.23 -1.26 -1.43 115.64 115.97 3khu s THR 210 Ca -0.06 -0.76 0.03 0.00 -1.18 0.00 0.00 61.69 59.71 3khu s THR 210 Cb -0.15 -2.14 -0.01 0.00 1.34 0.00 0.00 72.50 71.54 3khu s THR 210 CO 0.04 0.57 0.29 0.35 -0.54 0.00 0.00 174.62 175.34 3khu n THR 211 N 2.64 0.00 -1.76 3.99 -2.24 -0.16 -4.98 114.28 111.77 3khu n THR 211 Ca -0.17 -1.72 -0.30 0.00 -2.27 0.00 0.00 64.05 59.59 3khu n THR 211 Cb 0.52 0.93 0.07 0.00 -2.10 0.00 0.00 70.33 69.75 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 -2.80 5.03 0.19 3.42 2.20 -1.26 -2.10 114.94 119.62 3khu s ASN 212 Ca 0.28 1.17 -0.12 0.00 -0.94 0.00 0.00 52.86 53.25 3khu s ASN 212 Cb 0.01 -1.93 0.11 0.00 -2.00 0.00 0.00 41.25 37.44 3khu s ASN 212 CO 0.20 -1.61 1.85 0.74 -2.94 0.00 0.00 177.10 175.34 3khu h THR 213 N -0.84 1.17 -0.42 0.54 2.02 -1.80 -2.13 112.91 111.45 3khu h THR 213 Ca -0.46 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.37 3khu h THR 213 Cb 1.26 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 3khu h THR 213 CO 0.62 0.17 0.14 -0.50 0.37 0.00 0.00 175.52 176.32 3khu h TRP 214 N 0.87 0.66 -0.86 3.16 6.55 -1.93 -1.60 115.95 122.79 3khu h TRP 214 Ca 0.23 -0.06 0.07 0.00 0.95 0.00 0.00 58.89 60.08 3khu h TRP 214 Cb -0.08 -0.19 -0.06 0.00 -0.86 0.00 0.00 29.16 27.97 3khu h TRP 214 CO -0.03 0.59 0.56 0.77 -1.05 0.00 0.00 178.44 179.29 3khu h SER 215 N 0.53 0.85 0.09 -3.49 0.02 -1.89 0.20 113.55 109.85 3khu h SER 215 Ca 0.14 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3khu h SER 215 Cb 0.23 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.60 3khu h SER 215 CO -0.01 0.54 -0.04 -1.28 -1.14 0.00 0.00 176.83 174.90 3khu h SER 216 N 0.96 -0.10 -0.30 3.07 0.87 -0.98 -0.00 113.55 117.07 3khu h SER 216 Ca 0.37 -0.36 0.03 0.00 -1.23 0.00 0.00 61.79 60.60 3khu h SER 216 Cb 0.22 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 3khu h SER 216 CO -0.14 0.33 0.13 -0.33 -0.53 0.00 0.00 176.83 176.29 3khu h GLU 217 N -0.55 0.26 -0.51 2.24 5.08 -1.00 -2.69 114.58 117.42 3khu h GLU 217 Ca -0.01 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 3khu h GLU 217 Cb 0.46 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 3khu h GLU 217 CO 0.02 0.18 0.10 1.25 -1.00 0.00 0.00 179.01 179.55 3khu h LEU 218 N 0.27 0.74 -1.31 1.33 5.85 -0.97 -3.00 115.31 118.22 3khu h LEU 218 Ca 0.13 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.72 3khu h LEU 218 Cb 0.07 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 3khu h LEU 218 CO -0.11 0.75 0.47 0.28 -0.34 0.00 0.00 178.44 179.48 3khu h SER 219 N 0.75 0.80 -0.12 1.25 0.02 -0.65 0.83 113.55 116.44 3khu h SER 219 Ca 0.16 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 3khu h SER 219 Cb 0.32 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 3khu h SER 219 CO 0.00 0.57 -0.00 0.50 -1.14 0.00 0.00 176.83 176.76 3khu h LYS 220 N 0.94 0.21 -0.32 3.45 1.63 -1.43 0.13 116.57 121.18 3khu h LYS 220 Ca 0.26 -0.07 -0.02 0.00 -0.85 0.00 0.00 60.65 59.98 3khu h LYS 220 Cb -0.08 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.52 3khu h LYS 220 CO -0.06 0.46 0.14 -0.07 -3.45 0.00 0.00 179.45 176.47 3khu h LEU 221 N -0.07 0.44 -0.64 5.20 3.38 -1.53 -2.90 115.31 119.19 3khu h LEU 221 Ca 0.03 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 3khu h LEU 221 Cb 0.37 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3khu h LEU 221 CO 0.01 0.46 0.17 0.00 0.09 0.00 0.00 178.44 179.16 3khu h ALA 222 N 0.99 0.85 -0.60 1.53 0.00 -0.71 -0.92 119.26 120.40 3khu h ALA 222 Ca 0.11 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.81 3khu h ALA 222 Cb 0.15 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3khu h ALA 222 CO -0.01 0.55 0.37 0.00 0.00 0.00 0.00 179.25 180.16 3khu h ALA 223 N 1.06 0.78 -0.20 0.00 0.00 -0.67 0.84 119.26 121.07 3khu h ALA 223 Ca 0.20 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 3khu h ALA 223 Cb 0.34 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3khu h ALA 223 CO 0.00 0.11 -0.28 -0.91 0.00 0.00 0.00 179.25 178.17 3khu h ASN 224 N 0.73 0.39 -0.49 0.00 2.35 -1.26 -1.58 115.58 115.73 3khu h ASN 224 Ca 0.24 -0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.82 3khu h ASN 224 Cb 0.01 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 3khu h ASN 224 CO -0.10 0.67 0.16 0.00 -1.65 0.00 0.00 177.43 176.52 3khu h ALA 225 N 1.36 0.64 -0.64 -0.83 0.00 -0.05 0.59 119.26 120.33 3khu h ALA 225 Ca 0.05 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 3khu h ALA 225 Cb 0.68 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 3khu h ALA 225 CO 0.05 0.28 0.15 0.74 0.00 0.00 0.00 179.25 180.47 3khu h PHE 226 N 0.66 1.05 -0.29 0.00 -1.00 -0.45 0.11 116.94 117.02 3khu h PHE 226 Ca 0.16 -0.12 -0.11 0.00 2.81 0.00 0.00 57.97 60.72 3khu h PHE 226 Cb 0.25 -0.30 -0.01 0.00 3.61 0.00 0.00 35.95 39.51 3khu h PHE 226 CO 0.01 0.87 -0.23 -0.07 -1.61 0.00 0.00 178.31 177.28 3khu h LEU 227 N 0.96 0.70 -1.10 1.54 3.38 -1.03 -1.95 115.31 117.81 3khu h LEU 227 Ca 0.20 -0.45 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 3khu h LEU 227 Cb 0.35 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3khu h LEU 227 CO 0.00 1.01 -0.10 0.00 0.09 0.00 0.00 178.44 179.44 3khu h ALA 228 N 0.72 1.25 -0.67 1.53 0.00 -0.63 -2.65 119.26 118.82 3khu h ALA 228 Ca 0.05 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 3khu h ALA 228 Cb 0.78 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 3khu h ALA 228 CO 0.06 0.49 0.14 0.37 0.00 0.00 0.00 179.25 180.31 3khu h GLN 229 N 0.49 1.08 -0.70 0.00 4.15 -0.60 -0.56 115.11 118.97 3khu h GLN 229 Ca 0.09 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.25 3khu h GLN 229 Cb 0.47 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.98 3khu h GLN 229 CO 0.03 0.97 0.44 0.00 -1.93 0.00 0.00 178.83 178.34 3khu h ARG 230 N 1.02 0.93 -0.26 1.69 3.08 -1.00 0.20 114.38 120.05 3khu h ARG 230 Ca 0.21 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 3khu h ARG 230 Cb 0.39 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 3khu h ARG 230 CO 0.01 0.64 -0.02 0.82 -1.07 0.00 0.00 179.97 180.34 3khu h ILE 231 N 0.95 1.27 -0.36 2.04 2.04 -1.28 -1.24 117.51 120.93 3khu h ILE 231 Ca 0.25 -0.98 -0.05 0.00 1.00 0.00 0.00 64.86 65.09 3khu h ILE 231 Cb -0.07 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 3khu h ILE 231 CO -0.05 0.31 0.01 0.28 0.00 0.00 0.00 178.15 178.70 3khu h SER 232 N 0.24 0.52 -0.10 1.72 0.02 -0.89 0.65 113.55 115.71 3khu h SER 232 Ca 0.07 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 3khu h SER 232 Cb 0.46 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 3khu h SER 232 CO 0.02 0.58 -0.00 0.28 -1.14 0.00 0.00 176.83 176.57 3khu h SER 233 N 0.53 0.18 0.04 3.07 0.02 -0.41 0.12 113.55 117.09 3khu h SER 233 Ca 0.11 -0.32 -0.10 0.00 -0.84 0.00 0.00 61.79 60.65 3khu h SER 233 Cb 0.33 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 3khu h SER 233 CO 0.01 0.45 -0.32 -0.29 -1.14 0.00 0.00 176.83 175.54 3khu h ILE 234 N -0.10 1.28 -0.60 3.27 6.09 -1.09 -1.74 117.51 124.62 3khu h ILE 234 Ca 0.03 -1.37 -0.05 0.00 -1.37 0.00 0.00 64.86 62.10 3khu h ILE 234 Cb 0.36 1.48 -0.03 0.00 0.47 0.00 0.00 36.82 39.10 3khu h ILE 234 CO 0.01 0.43 0.19 0.78 -3.07 0.00 0.00 178.15 176.48 3khu h ASN 235 N 0.36 0.84 -0.56 2.19 2.35 -0.67 -0.36 115.58 119.74 3khu h ASN 235 Ca 0.05 -0.14 -0.05 0.00 -0.55 0.00 0.00 56.30 55.61 3khu h ASN 235 Cb 0.74 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.86 3khu h ASN 235 CO 0.06 0.80 0.17 0.77 -1.65 0.00 0.00 177.43 177.57 3khu h SER 236 N 0.88 0.86 -0.01 5.81 4.64 -0.16 -1.04 113.55 124.53 3khu h SER 236 Ca 0.20 -0.15 -0.04 0.00 -0.47 0.00 0.00 61.79 61.32 3khu h SER 236 Cb 0.26 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3khu h SER 236 CO -0.01 0.82 -0.10 0.40 -0.87 0.00 0.00 176.83 177.07 3khu h ILE 237 N 0.89 1.16 -0.48 0.95 1.08 -0.50 -2.79 117.51 117.83 3khu h ILE 237 Ca 0.20 -0.71 -0.06 0.00 -0.39 0.00 0.00 64.86 63.90 3khu h ILE 237 Cb 0.28 1.16 -0.02 0.00 -3.07 0.00 0.00 36.82 35.16 3khu h ILE 237 CO -0.01 0.22 0.06 0.77 -0.69 0.00 0.00 178.15 178.51 3khu h SER 238 N 0.24 0.71 -0.63 1.72 4.64 0.26 0.74 113.55 121.22 3khu h SER 238 Ca 0.05 -0.14 -0.05 0.00 -0.47 0.00 0.00 61.79 61.18 3khu h SER 238 Cb 0.33 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.21 3khu h SER 238 CO 0.02 0.74 0.21 0.00 -0.87 0.00 0.00 176.83 176.93 3khu h ALA 239 N 1.34 0.83 -0.37 5.18 0.00 -1.22 -1.75 119.26 123.28 3khu h ALA 239 Ca 0.15 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 3khu h ALA 239 Cb 0.36 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3khu h ALA 239 CO 0.01 0.49 -0.24 1.25 0.00 0.00 0.00 179.25 180.75 3khu h LEU 240 N 0.91 0.76 -0.32 0.00 5.85 -1.21 -2.50 115.31 118.79 3khu h LEU 240 Ca 0.21 -0.28 0.02 0.00 0.84 0.00 0.00 57.88 58.66 3khu h LEU 240 Cb 0.27 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 3khu h LEU 240 CO -0.01 0.97 0.18 0.00 -0.34 0.00 0.00 178.44 179.24 3khu h GLU 242 N 0.37 0.00 0.00 0.00 5.08 -0.98 -0.22 114.58 118.83 3khu h GLU 242 Ca 0.13 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 3khu h GLU 242 Cb 0.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 3khu h GLU 242 CO -0.07 0.00 -0.88 0.00 -1.00 0.00 0.00 179.01 177.06 3khu h ALA 243 N 1.95 0.62 0.00 3.43 0.00 -0.95 -3.39 119.26 120.92 3khu h ALA 243 Ca 0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 3khu h ALA 243 Cb 0.11 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3khu h ALA 243 CO -0.00 0.19 -1.22 0.25 0.00 0.00 0.00 179.25 178.48 3khu n THR 244 N -2.81 0.13 -0.01 0.00 -2.24 -0.64 -5.03 114.28 103.67 3khu n THR 244 Ca -0.01 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3khu n THR 244 Cb 0.61 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 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 2.53 0.25 3.64 3.38 0.00 -0.17 -5.08 105.19 109.74 3khu n GLY 245 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.06 1.10 -0.11 4.61 0.00 -1.24 -4.88 121.76 119.19 3khu s ALA 246 Ca 0.00 0.47 0.03 0.00 0.00 0.00 0.00 51.96 52.46 3khu s ALA 246 Cb 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.71 3khu s ALA 246 CO 0.00 -2.98 -0.22 0.34 0.00 0.00 0.00 175.76 172.90 3khu s ASP 247 N -2.63 2.97 0.34 0.00 2.15 -1.26 -4.48 116.67 113.75 3khu s ASP 247 Ca 0.67 -0.54 0.05 0.00 0.43 0.00 0.00 52.55 53.16 3khu s ASP 247 Cb -0.23 -1.36 0.61 0.00 -0.30 0.00 0.00 42.92 41.64 3khu s ASP 247 CO 0.59 0.13 1.87 1.62 -0.17 0.00 0.00 175.17 179.21 3khu h VAL 248 N 5.76 1.20 -0.28 1.11 3.04 -1.57 -1.49 116.25 124.01 3khu h VAL 248 Ca -0.23 -0.82 -0.15 0.00 -1.01 0.00 0.00 66.70 64.49 3khu h VAL 248 Cb 1.22 1.00 -0.01 0.00 -2.01 0.00 0.00 31.29 31.50 3khu h VAL 248 CO 0.49 0.27 -0.43 -0.33 -1.01 0.00 0.00 177.57 176.57 3khu h GLU 249 N 0.46 0.70 -0.27 4.17 4.39 -1.94 0.19 114.58 122.29 3khu h GLU 249 Ca 0.10 -0.38 0.00 0.00 0.34 0.00 0.00 59.36 59.42 3khu h GLU 249 Cb 0.36 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 3khu h GLU 249 CO 0.01 0.99 0.18 0.93 -1.16 0.00 0.00 179.01 179.97 3khu h GLU 250 N 0.57 0.35 -0.37 2.33 5.08 -1.79 -1.29 114.58 119.47 3khu h GLU 250 Ca 0.04 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 3khu h GLU 250 Cb 0.97 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 3khu h GLU 250 CO 0.09 0.24 -0.00 0.28 -1.00 0.00 0.00 179.01 178.61 3khu h VAL 251 N 0.36 1.26 -0.83 3.13 2.07 -1.00 -1.48 116.25 119.77 3khu h VAL 251 Ca 0.10 -1.00 0.02 0.00 0.82 0.00 0.00 66.70 66.64 3khu h VAL 251 Cb -0.04 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 3khu h VAL 251 CO -0.02 0.33 0.54 0.00 0.02 0.00 0.00 177.57 178.44 3khu h ALA 252 N 0.87 1.07 -0.38 1.67 0.00 -0.57 0.84 119.26 122.76 3khu h ALA 252 Ca 0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3khu h ALA 252 Cb 0.47 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3khu h ALA 252 CO 0.02 0.41 0.15 1.15 0.00 0.00 0.00 179.25 180.98 3khu h THR 253 N 1.08 1.19 -0.54 0.00 2.02 -0.93 -0.50 112.91 115.23 3khu h THR 253 Ca 0.32 -0.60 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 3khu h THR 253 Cb -0.07 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 3khu h THR 253 CO -0.09 0.21 0.24 0.00 0.37 0.00 0.00 175.52 176.26 3khu h ALA 254 N 0.99 0.70 0.04 6.16 0.00 -0.59 -2.31 119.26 124.26 3khu h ALA 254 Ca 0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3khu h ALA 254 Cb 0.19 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3khu h ALA 254 CO -0.01 0.28 -0.02 0.82 0.00 0.00 0.00 179.25 180.32 3khu h ILE 255 N 0.73 1.15 0.00 0.00 2.04 -0.77 -3.19 117.51 117.47 3khu h ILE 255 Ca 0.18 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.41 3khu h ILE 255 Cb 0.15 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 3khu h ILE 255 CO -0.02 0.16 0.00 0.61 0.00 0.00 0.00 178.15 178.90 3khu n GLY 256 N -0.36 -1.05 0.05 5.37 0.00 -0.20 -1.85 105.19 107.15 3khu n GLY 256 Ca -0.08 0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.16 3khu n GLY 256 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3khu n MET 257 N -2.07 0.16 -2.09 1.61 2.81 -0.89 -3.05 117.12 113.60 3khu n MET 257 Ca 0.01 0.10 -0.43 0.00 -1.81 0.00 0.00 57.70 55.58 3khu n MET 257 Cb 0.15 -1.66 -0.03 0.00 -0.71 0.00 0.00 33.22 30.97 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 -3.84 6.31 0.21 7.83 -1.08 -0.77 -4.90 116.67 120.42 3khu s ASP 258 Ca 0.11 1.57 0.21 0.00 -0.52 0.00 0.00 52.55 53.91 3khu s ASP 258 Cb 0.15 -2.53 0.90 0.00 -1.46 0.00 0.00 42.92 39.98 3khu s ASP 258 CO 0.61 -1.33 1.63 0.00 0.52 0.00 0.00 175.17 176.60 3khu n GLN 259 N 7.78 0.14 0.16 4.34 6.02 -1.26 -0.90 117.38 133.66 3khu n GLN 259 Ca 0.19 0.42 0.03 0.00 -0.01 0.00 0.00 57.00 57.64 3khu n GLN 259 Cb 0.45 -1.80 0.17 0.00 1.02 0.00 0.00 30.24 30.09 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 0.07 -1.09 3.08 -1.94 -3.33 114.38 111.17 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 0.28 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.29 3khu h ARG 260 CO 0.00 0.49 -2.15 -0.89 -1.07 0.00 0.00 179.97 176.34 3khu n ILE 261 N -3.40 1.65 0.00 2.04 5.41 -0.31 -5.11 119.36 119.64 3khu n ILE 261 Ca 0.01 -0.57 0.00 0.00 1.00 0.00 0.00 62.75 63.19 3khu n ILE 261 Cb 0.64 -1.65 0.00 0.00 -0.71 0.00 0.00 39.64 37.92 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 2.02 -2.33 0.73 7.39 0.00 -0.07 -4.85 105.19 108.08 3khu n GLY 262 Ca -0.38 -1.48 0.07 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.91 2.89 -4.91 1.61 0.23 -1.17 -4.31 115.26 107.69 3khu n ASN 263 Ca 0.00 -1.89 -0.28 0.00 -0.53 0.00 0.00 54.58 51.88 3khu n ASN 263 Cb 0.00 -0.21 -0.03 0.00 -2.08 0.00 0.00 39.78 37.45 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 3.61 -1.37 -3.83 -0.14 -1.26 -4.48 119.74 111.24 3khu s LYS 264 Ca 0.26 -0.06 -0.06 0.00 -1.36 0.00 0.00 55.97 54.75 3khu s LYS 264 Cb 0.14 -2.68 0.01 0.00 -1.68 0.00 0.00 37.83 33.61 3khu s LYS 264 CO 0.19 0.25 0.77 1.19 -0.76 0.00 0.00 175.35 176.99 3khu n PHE 265 N -0.86 -2.14 -1.57 3.18 0.99 -1.26 -4.91 117.46 110.89 3khu n PHE 265 Ca -0.02 0.66 0.07 0.00 -0.00 0.00 0.00 57.45 58.15 3khu n PHE 265 Cb 0.54 -4.43 0.18 0.00 -1.00 0.00 0.00 39.48 34.77 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 -4.09 2.48 -4.50 4.37 4.77 -1.26 -3.79 117.00 114.97 3khu n LEU 266 Ca -0.06 -3.58 -0.43 0.00 -0.03 0.00 0.00 56.01 51.91 3khu n LEU 266 Cb 0.59 -0.47 -0.06 0.00 -2.33 0.00 0.00 43.42 41.15 3khu n LEU 266 CO 0.50 1.20 0.43 -0.54 -1.33 0.00 0.00 177.39 177.64 3khu s LYS 267 N -2.90 3.26 0.62 3.23 3.01 -1.26 -4.86 119.74 120.85 3khu s LYS 267 Ca 0.36 -0.46 -0.19 0.00 -1.01 0.00 0.00 55.97 54.67 3khu s LYS 267 Cb 0.35 -4.00 -0.02 0.00 -1.01 0.00 0.00 37.83 33.15 3khu s LYS 267 CO -0.06 -1.12 1.32 0.00 0.51 0.00 0.00 175.35 176.00 3khu n ALA 268 N 6.42 1.29 -3.56 5.17 0.00 -1.26 -4.95 120.51 123.61 3khu n ALA 268 Ca -0.02 0.04 -0.09 0.00 0.00 0.00 0.00 53.44 53.37 3khu n ALA 268 Cb 0.47 -2.34 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 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 -1.25 -0.28 0.58 0.00 1.04 -1.26 -4.77 113.70 107.75 3khu s SER 269 Ca 0.80 -0.53 0.27 0.00 0.48 0.00 0.00 55.95 56.96 3khu s SER 269 Cb -0.39 0.65 1.70 0.00 0.10 0.00 0.00 66.02 68.08 3khu s SER 269 CO 0.43 -1.19 2.23 1.62 0.98 0.00 0.00 173.24 177.31 3khu h VAL 270 N 2.08 0.63 0.00 5.02 3.04 -1.40 -3.46 116.25 122.17 3khu h VAL 270 Ca -0.25 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.44 3khu h VAL 270 Cb 1.26 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 31.54 3khu h VAL 270 CO 0.30 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.47 3khu n GLY 271 N -1.37 4.01 3.77 3.17 0.00 -1.26 -3.05 105.19 110.45 3khu n GLY 271 Ca -0.03 -0.56 -0.35 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.54 2.74 0.00 1.61 -0.12 -1.26 -4.47 117.98 114.95 3khu s PHE 272 Ca 0.00 1.54 0.00 0.00 -0.05 0.00 0.00 56.93 58.42 3khu s PHE 272 Cb 0.00 -3.30 0.00 0.00 -0.63 0.00 0.00 43.02 39.09 3khu s PHE 272 CO 0.00 -1.52 0.00 0.41 -0.05 0.00 0.00 175.22 174.06 3khu n GLY 273 N 0.21 5.64 0.00 1.99 0.00 -1.26 -4.73 105.19 107.04 3khu n GLY 273 Ca 0.10 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.64 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 0.98 1.63 0.20 -0.02 0.00 0.54 -4.63 105.19 103.89 3khu n GLY 274 Ca 0.00 -1.94 0.12 0.00 0.00 0.00 0.00 46.02 44.21 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 -0.08 0.60 -0.09 1.61 3.41 -1.26 -4.29 113.62 113.54 3khu n SER 275 Ca 0.00 -1.37 -0.13 0.00 -0.26 0.00 0.00 58.87 57.12 3khu n SER 275 Cb 0.00 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 63.89 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 -0.88 -0.83 -0.44 0.00 0.04 -1.82 0.82 116.94 113.82 3khu h PHE 277 Ca -0.17 -0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.61 3khu h PHE 277 Cb 1.06 0.28 -0.03 0.00 2.20 0.00 0.00 35.95 39.45 3khu h PHE 277 CO -0.30 -0.48 0.25 0.37 -0.60 0.00 0.00 178.31 177.55 3khu h GLN 278 N -1.12 0.48 -0.09 1.51 4.15 -1.89 -0.44 115.11 117.71 3khu h GLN 278 Ca -0.09 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.31 3khu h GLN 278 Cb 0.72 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.29 3khu h GLN 278 CO 0.15 0.32 0.02 -0.22 -1.93 0.00 0.00 178.83 177.17 3khu h LYS 279 N 0.50 0.06 -0.45 1.69 3.64 -1.81 -0.91 116.57 119.29 3khu h LYS 279 Ca 0.18 -0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.42 3khu h LYS 279 Cb 0.05 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3khu h LYS 279 CO -0.10 0.04 -0.25 -0.44 -2.27 0.00 0.00 179.45 176.43 3khu h ASP 280 N 0.07 0.97 -0.39 4.20 3.32 -0.53 -0.75 116.42 123.31 3khu h ASP 280 Ca 0.04 -0.38 -0.10 0.00 0.02 0.00 0.00 57.03 56.61 3khu h ASP 280 Cb 0.03 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 3khu h ASP 280 CO -0.05 1.16 -0.13 0.58 -1.72 0.00 0.00 179.24 179.08 3khu h VAL 281 N 0.81 1.28 -0.28 -1.35 2.07 -0.97 -0.29 116.25 117.52 3khu h VAL 281 Ca 0.10 -1.24 -0.05 0.00 0.82 0.00 0.00 66.70 66.33 3khu h VAL 281 Cb 0.82 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 3khu h VAL 281 CO 0.07 0.41 -0.04 -0.07 0.02 0.00 0.00 177.57 177.97 3khu h LEU 282 N 0.58 0.40 -0.60 2.57 3.38 -1.10 -0.03 115.31 120.52 3khu h LEU 282 Ca 0.09 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 3khu h LEU 282 Cb 0.67 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 3khu h LEU 282 CO 0.05 0.50 -0.22 -1.13 0.09 0.00 0.00 178.44 177.73 3khu h ASN 283 N 0.41 0.90 -0.33 -0.43 -0.73 -0.62 -1.57 115.58 113.21 3khu h ASN 283 Ca 0.09 -0.33 -0.00 0.00 1.87 0.00 0.00 56.30 57.93 3khu h ASN 283 Cb 0.33 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.66 3khu h ASN 283 CO 0.01 1.08 0.20 0.25 -0.37 0.00 0.00 177.43 178.60 3khu h LEU 284 N 0.76 0.39 -0.33 0.34 5.85 -0.42 0.32 115.31 122.22 3khu h LEU 284 Ca 0.10 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.79 3khu h LEU 284 Cb 0.76 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 3khu h LEU 284 CO 0.06 0.32 0.19 0.58 -0.34 0.00 0.00 178.44 179.25 3khu h VAL 285 N 0.43 1.03 -0.38 1.05 2.07 -0.89 -1.02 116.25 118.53 3khu h VAL 285 Ca 0.12 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.52 3khu h VAL 285 Cb 0.00 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 3khu h VAL 285 CO -0.02 0.07 0.23 0.22 0.02 0.00 0.00 177.57 178.09 3khu h TYR 286 N 0.39 0.44 -0.84 1.57 3.20 -1.07 -1.04 116.97 119.62 3khu h TYR 286 Ca 0.13 0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.14 3khu h TYR 286 Cb 0.00 -0.14 -0.09 0.00 1.54 0.00 0.00 36.73 38.05 3khu h TYR 286 CO -0.08 0.26 0.45 1.25 -1.64 0.00 0.00 178.16 178.40 3khu h LEU 287 N 0.48 0.58 -0.37 2.82 5.85 -0.52 -0.58 115.31 123.56 3khu h LEU 287 Ca 0.15 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.90 3khu h LEU 287 Cb -0.01 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3khu h LEU 287 CO -0.06 0.28 0.06 0.00 -0.34 0.00 0.00 178.44 178.37 3khu h GLU 289 N 0.45 0.69 0.00 0.00 5.08 -0.46 -0.15 114.58 120.18 3khu h GLU 289 Ca 0.11 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3khu h GLU 289 Cb 0.37 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 3khu h GLU 289 CO 0.01 0.50 -0.08 0.00 -1.00 0.00 0.00 179.01 178.44 3khu h ALA 290 N 1.15 1.58 -0.57 3.43 0.00 -0.86 -1.85 119.26 122.13 3khu h ALA 290 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3khu h ALA 290 Cb -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3khu h ALA 290 CO -0.03 0.10 0.00 1.28 0.00 0.00 0.00 179.25 180.59 3khu n LEU 291 N -4.02 3.59 -3.53 0.00 4.77 -0.64 -4.94 117.00 112.23 3khu n LEU 291 Ca -0.03 -1.81 -0.21 0.00 -0.03 0.00 0.00 56.01 53.94 3khu n LEU 291 Cb 0.17 -0.46 0.08 0.00 -2.33 0.00 0.00 43.42 40.88 3khu n LEU 291 CO 0.31 0.75 0.15 0.59 -1.33 0.00 0.00 177.39 177.87 3khu n ASN 292 N 1.10 -3.76 -3.14 -1.43 3.02 -0.70 -4.95 115.26 105.40 3khu n ASN 292 Ca 0.21 -0.61 -0.27 0.00 -0.03 0.00 0.00 54.58 53.88 3khu n ASN 292 Cb 0.62 -4.97 -0.06 0.00 -0.61 0.00 0.00 39.78 34.77 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 -4.50 4.07 0.20 3.41 4.77 -0.13 -4.92 117.00 119.91 3khu n LEU 293 Ca -0.16 -5.56 0.05 0.00 -0.03 0.00 0.00 56.01 50.30 3khu n LEU 293 Cb 0.62 -0.56 0.49 0.00 -2.33 0.00 0.00 43.42 41.64 3khu n LEU 293 CO 0.64 2.23 0.93 1.55 -1.33 0.00 0.00 177.39 181.41 3khu h PRO 294 N 3.48 0.07 -0.68 3.23 0.13 -1.89 -1.41 132.00 134.93 3khu h PRO 294 Ca 0.16 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.21 3khu h PRO 294 Cb 0.58 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.67 3khu h PRO 294 CO 0.82 0.21 0.18 0.93 -0.23 0.00 0.00 178.00 179.90 3khu h GLU 295 N 0.07 1.09 -0.17 0.86 3.07 -1.95 0.04 114.58 117.59 3khu h GLU 295 Ca 0.01 -0.26 -0.14 0.00 -0.50 0.00 0.00 59.36 58.47 3khu h GLU 295 Cb 0.28 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 3khu h GLU 295 CO 0.02 0.96 -0.46 0.28 -1.40 0.00 0.00 179.01 178.41 3khu h VAL 296 N 1.02 1.33 -0.23 3.13 2.07 -1.82 -1.91 116.25 119.84 3khu h VAL 296 Ca 0.22 -1.72 0.06 0.00 0.82 0.00 0.00 66.70 66.08 3khu h VAL 296 Cb 0.35 1.97 -0.07 0.00 -1.52 0.00 0.00 31.29 32.03 3khu h VAL 296 CO 0.00 0.53 -0.21 0.00 0.02 0.00 0.00 177.57 177.91 3khu h ALA 297 N 0.56 -0.08 -0.67 1.67 0.00 -1.11 -1.35 119.26 118.28 3khu h ALA 297 Ca -0.01 0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3khu h ALA 297 Cb 1.08 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 3khu h ALA 297 CO 0.10 -0.63 0.44 0.00 0.00 0.00 0.00 179.25 179.16 3khu h ARG 298 N -0.22 0.86 0.06 0.00 3.08 -0.87 -1.34 114.38 115.96 3khu h ARG 298 Ca 0.13 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 3khu h ARG 298 Cb 0.42 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.28 3khu h ARG 298 CO -0.36 0.57 -0.03 -0.92 -1.07 0.00 0.00 179.97 178.16 3khu h TYR 299 N 0.89 -0.07 -0.01 3.04 3.20 -0.48 -3.02 116.97 120.51 3khu h TYR 299 Ca 0.25 -0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.98 3khu h TYR 299 Cb -0.08 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 3khu h TYR 299 CO -0.00 0.14 -0.65 -1.49 -1.64 0.00 0.00 178.16 174.52 3khu h TRP 300 N -0.28 0.03 -0.37 -3.82 4.06 -1.09 -3.11 115.95 111.37 3khu h TRP 300 Ca -0.01 -0.01 0.11 0.00 2.06 0.00 0.00 58.89 61.04 3khu h TRP 300 Cb 0.25 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.39 3khu h TRP 300 CO -0.01 0.66 0.27 0.37 -3.56 0.00 0.00 178.44 176.18 3khu h GLN 301 N 0.02 0.00 0.00 0.49 5.75 -1.13 -0.87 115.11 119.37 3khu h GLN 301 Ca -0.01 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 3khu h GLN 301 Cb 1.15 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.70 3khu h GLN 301 CO 0.09 0.00 -0.06 1.96 -2.65 0.00 0.00 178.83 178.17 3khu h GLN 302 N 0.00 0.00 -0.97 1.69 1.08 -1.46 -0.70 115.11 114.76 3khu h GLN 302 Ca 0.18 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 3khu h GLN 302 Cb 0.72 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.10 3khu h GLN 302 CO -0.00 0.06 0.62 0.28 -0.95 0.00 0.00 178.83 178.84 3khu h VAL 303 N 0.00 1.25 0.05 -0.54 2.07 -1.34 -0.95 116.25 116.80 3khu h VAL 303 Ca -0.00 -0.49 -0.14 0.00 0.82 0.00 0.00 66.70 66.89 3khu h VAL 303 Cb 0.10 -0.16 0.01 0.00 -1.52 0.00 0.00 31.29 29.73 3khu h VAL 303 CO 0.01 0.25 -0.57 0.40 0.02 0.00 0.00 177.57 177.68 3khu h ILE 304 N 1.32 1.50 -0.65 4.57 1.08 -1.40 -2.78 117.51 121.16 3khu h ILE 304 Ca 0.35 -2.23 0.03 0.00 -0.39 0.00 0.00 64.86 62.62 3khu h ILE 304 Cb -0.12 2.89 -0.04 0.00 -3.07 0.00 0.00 36.82 36.48 3khu h ILE 304 CO -0.07 0.63 0.43 0.44 -0.69 0.00 0.00 178.15 178.89 3khu h ASP 305 N -0.33 0.68 -0.23 1.72 3.32 -1.07 0.12 116.42 120.63 3khu h ASP 305 Ca -0.09 -0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.79 3khu h ASP 305 Cb 1.35 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 3khu h ASP 305 CO 0.11 0.47 -0.49 -0.03 -1.72 0.00 0.00 179.24 177.59 3khu h MET 306 N 0.79 0.81 -0.41 3.56 4.05 -1.22 -0.57 114.93 121.94 3khu h MET 306 Ca 0.26 -0.47 -0.01 0.00 -0.28 0.00 0.00 59.70 59.20 3khu h MET 306 Cb 0.04 0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.87 3khu h MET 306 CO -0.07 1.11 0.22 -0.97 0.23 0.00 0.00 176.91 177.43 3khu h ASN 307 N 0.63 0.51 -0.90 1.39 -1.24 -1.08 0.19 115.58 115.08 3khu h ASN 307 Ca 0.03 -0.09 -0.02 0.00 0.71 0.00 0.00 56.30 56.94 3khu h ASN 307 Cb 1.07 -0.13 -0.04 0.00 0.73 0.00 0.00 38.32 39.95 3khu h ASN 307 CO 0.11 0.45 0.49 0.44 -1.29 0.00 0.00 177.43 177.62 3khu h ASP 308 N 0.53 1.12 -0.41 1.15 3.32 -0.65 -2.54 116.42 118.94 3khu h ASP 308 Ca 0.14 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 3khu h ASP 308 Cb 0.05 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 3khu h ASP 308 CO -0.02 0.90 -0.11 0.22 -1.72 0.00 0.00 179.24 178.51 3khu h TYR 309 N 1.26 0.90 -0.50 4.55 3.20 -0.91 -1.47 116.97 124.01 3khu h TYR 309 Ca 0.32 -0.20 0.03 0.00 3.14 0.00 0.00 58.73 62.02 3khu h TYR 309 Cb 0.03 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.04 3khu h TYR 309 CO 0.01 0.93 0.27 0.37 -1.64 0.00 0.00 178.16 178.10 3khu h GLN 310 N 0.62 0.52 -0.11 1.82 5.75 -0.65 0.98 115.11 124.03 3khu h GLN 310 Ca 0.10 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.57 3khu h GLN 310 Cb 0.64 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 29.07 3khu h GLN 310 CO 0.04 0.34 0.05 0.00 -2.65 0.00 0.00 178.83 176.61 3khu h ARG 311 N 0.53 0.16 -0.56 1.69 3.08 -1.37 -2.17 114.38 115.74 3khu h ARG 311 Ca 0.21 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.18 3khu h ARG 311 Cb 0.08 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 3khu h ARG 311 CO -0.13 0.25 0.15 -0.09 -1.07 0.00 0.00 179.97 179.08 3khu h ARG 312 N 0.03 0.90 -0.09 0.04 2.43 -0.68 -0.66 114.38 116.35 3khu h ARG 312 Ca 0.04 -0.21 -0.11 0.00 -0.81 0.00 0.00 59.98 58.89 3khu h ARG 312 Cb 0.15 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 3khu h ARG 312 CO -0.00 0.83 -0.42 0.07 -1.51 0.00 0.00 179.97 178.94 3khu h ARG 313 N 0.80 0.21 -0.02 0.20 0.11 -0.84 -0.37 114.38 114.47 3khu h ARG 313 Ca 0.18 -0.10 -0.00 0.00 0.10 0.00 0.00 59.98 60.16 3khu h ARG 313 Cb 0.33 -0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.41 3khu h ARG 313 CO 0.00 0.60 0.01 0.35 0.10 0.00 0.00 179.97 181.03 3khu h PHE 314 N 0.17 0.03 -0.85 4.08 3.57 -0.90 -0.51 116.94 122.53 3khu h PHE 314 Ca 0.01 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.58 3khu h PHE 314 Cb 0.82 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.48 3khu h PHE 314 CO 0.01 0.13 0.52 0.00 -2.23 0.00 0.00 178.31 176.74 3khu h ALA 315 N 0.90 1.18 -0.38 2.41 0.00 -0.90 -2.01 119.26 120.46 3khu h ALA 315 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3khu h ALA 315 Cb 0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3khu h ALA 315 CO -0.00 0.24 -0.03 0.77 0.00 0.00 0.00 179.25 180.22 3khu h SER 316 N 0.93 0.60 -0.40 0.00 0.02 -0.76 -1.47 113.55 112.47 3khu h SER 316 Ca 0.38 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.19 3khu h SER 316 Cb 0.21 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 3khu h SER 316 CO -0.19 0.69 0.23 0.03 -1.14 0.00 0.00 176.83 176.46 3khu h ARG 317 N 0.59 0.55 -0.05 3.45 3.08 -0.37 0.36 114.38 121.99 3khu h ARG 317 Ca 0.12 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.12 3khu h ARG 317 Cb 0.42 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 3khu h ARG 317 CO 0.02 0.42 -0.00 0.82 -1.07 0.00 0.00 179.97 180.15 3khu h ILE 318 N 0.52 0.96 -0.32 2.04 2.04 -1.04 0.34 117.51 122.04 3khu h ILE 318 Ca 0.14 -0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.93 3khu h ILE 318 Cb 0.02 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 3khu h ILE 318 CO -0.03 0.00 -0.06 0.40 0.00 0.00 0.00 178.15 178.47 3khu h ILE 319 N 0.01 1.28 -0.91 -0.67 2.04 -1.00 -1.85 117.51 116.40 3khu h ILE 319 Ca 0.02 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.78 3khu h ILE 319 Cb 0.03 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 3khu h ILE 319 CO -0.04 0.35 0.51 -0.78 0.00 0.00 0.00 178.15 178.19 3khu h ASP 320 N 0.40 1.13 -0.02 1.72 3.58 -0.84 1.00 116.42 123.39 3khu h ASP 320 Ca 0.08 -0.10 -0.03 0.00 0.42 0.00 0.00 57.03 57.41 3khu h ASP 320 Cb 0.54 -0.29 -0.01 0.00 1.72 0.00 0.00 39.33 41.30 3khu h ASP 320 CO 0.03 0.90 -0.05 0.28 -2.88 0.00 0.00 179.24 177.52 3khu h SER 321 N 1.27 0.16 -0.61 2.28 0.02 -0.36 -1.52 113.55 114.80 3khu h SER 321 Ca 0.32 -0.02 -0.32 0.00 -0.84 0.00 0.00 61.79 60.93 3khu h SER 321 Cb 0.01 -0.04 -0.19 0.00 0.14 0.00 0.00 62.40 62.32 3khu h SER 321 CO -0.05 0.24 0.40 0.18 -1.14 0.00 0.00 176.83 176.46 3khu n LEU 322 N -4.38 5.28 -1.34 5.07 4.77 -0.75 -4.88 117.00 120.77 3khu n LEU 322 Ca -0.01 -2.78 -0.13 0.00 -0.03 0.00 0.00 56.01 53.06 3khu n LEU 322 Cb 0.19 -0.71 -0.02 0.00 -2.33 0.00 0.00 43.42 40.56 3khu n LEU 322 CO 0.36 0.83 -0.15 0.49 -1.33 0.00 0.00 177.39 177.59 3khu n PHE 323 N -0.50 -0.48 -1.61 -1.77 0.99 -0.57 -2.82 117.46 110.70 3khu n PHE 323 Ca 0.37 0.00 -0.21 0.00 -0.00 0.00 0.00 57.45 57.61 3khu n PHE 323 Cb 1.22 -2.70 -0.09 0.00 -1.00 0.00 0.00 39.48 36.92 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 -0.33 -5.50 -3.76 4.37 5.15 0.32 -4.97 115.26 110.53 3khu n ASN 324 Ca -0.14 0.51 -0.18 0.00 -0.60 0.00 0.00 54.58 54.16 3khu n ASN 324 Cb 0.57 -4.83 -0.17 0.00 -0.53 0.00 0.00 39.78 34.83 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 -2.77 0.09 0.00 -0.44 -1.32 -1.13 -5.00 115.64 105.07 3khu s THR 325 Ca 0.00 0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.69 3khu s THR 325 Cb 0.00 -0.24 0.00 0.00 -1.51 0.00 0.00 72.50 70.75 3khu s THR 325 CO 0.00 0.16 0.47 0.52 -2.21 0.00 0.00 174.62 173.57 3khu n VAL 326 N 4.61 0.20 -1.66 5.08 0.31 -1.26 -4.85 118.33 120.76 3khu n VAL 326 Ca -0.18 -0.42 -0.49 0.00 -0.01 0.00 0.00 64.34 63.24 3khu n VAL 326 Cb 0.50 1.15 -0.05 0.00 -0.91 0.00 0.00 33.84 34.53 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 -0.10 0.17 -1.06 2.52 -1.04 -0.98 -1.24 114.28 112.55 3khu n THR 327 Ca 0.00 -0.03 -0.02 0.00 -2.04 0.00 0.00 64.05 61.96 3khu n THR 327 Cb 0.17 -1.42 -0.01 0.00 -1.82 0.00 0.00 70.33 67.25 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 4.20 -5.74 -4.75 8.00 8.00 0.04 -4.92 116.55 121.38 3khu n ASP 328 Ca 0.20 0.05 -0.40 0.00 0.71 0.00 0.00 54.79 55.35 3khu n ASP 328 Cb 0.25 -3.41 -0.05 0.00 -0.02 0.00 0.00 41.12 37.88 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 -2.04 4.47 -0.09 -1.24 1.02 -0.38 -4.72 119.74 116.76 3khu s LYS 329 Ca 0.00 1.01 -0.26 0.00 0.02 0.00 0.00 55.97 56.74 3khu s LYS 329 Cb 0.00 -3.35 -0.02 0.00 -0.52 0.00 0.00 37.83 33.94 3khu s LYS 329 CO 0.00 0.33 0.85 0.21 -0.92 0.00 0.00 175.35 175.82 3khu s LYS 330 N -0.20 4.42 -0.04 1.68 2.20 -1.26 -0.07 119.74 126.47 3khu s LYS 330 Ca 0.37 1.12 0.01 0.00 -0.36 0.00 0.00 55.97 57.11 3khu s LYS 330 Cb -0.20 -3.50 0.02 0.00 -1.51 0.00 0.00 37.83 32.63 3khu s LYS 330 CO 0.22 -0.14 -0.05 0.42 -0.36 0.00 0.00 175.35 175.45 3khu s ILE 331 N 1.44 0.53 -0.20 5.43 1.01 -0.11 -0.75 121.20 128.56 3khu s ILE 331 Ca 0.43 -0.13 -0.20 0.00 0.00 0.00 0.00 60.65 60.75 3khu s ILE 331 Cb -0.18 -0.55 -0.03 0.00 0.01 0.00 0.00 42.46 41.70 3khu s ILE 331 CO 0.19 0.22 0.57 0.00 0.00 0.00 0.00 174.94 175.92 3khu s ALA 332 N 0.86 3.54 -0.32 9.38 0.00 -0.64 -0.65 121.76 133.94 3khu s ALA 332 Ca -0.12 -0.33 -0.10 0.00 0.00 0.00 0.00 51.96 51.41 3khu s ALA 332 Cb -0.14 -2.89 -0.01 0.00 0.00 0.00 0.00 23.12 20.09 3khu s ALA 332 CO 0.00 -0.49 0.17 0.42 0.00 0.00 0.00 175.76 175.87 3khu s ILE 333 N 1.74 4.70 -0.43 0.00 -1.09 -0.07 -0.34 121.20 125.72 3khu s ILE 333 Ca 0.26 -0.43 -0.11 0.00 -2.23 0.00 0.00 60.65 58.15 3khu s ILE 333 Cb -0.16 -3.42 0.07 0.00 -1.58 0.00 0.00 42.46 37.37 3khu s ILE 333 CO 0.10 0.03 0.29 -0.76 -1.23 0.00 0.00 174.94 173.37 3khu s LEU 334 N 1.62 5.22 0.00 2.97 1.43 -0.01 -0.96 118.68 128.96 3khu s LEU 334 Ca 0.05 -1.40 0.00 0.00 -1.03 0.00 0.00 54.13 51.74 3khu s LEU 334 Cb -0.17 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.01 3khu s LEU 334 CO 0.07 -0.55 0.00 0.61 0.23 0.00 0.00 176.35 176.71 3khu n GLY 335 N 5.00 2.27 0.00 -3.19 0.00 0.06 -1.48 105.19 107.83 3khu n GLY 335 Ca -0.11 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.72 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 1.78 0.00 -1.34 1.61 7.35 -1.26 -4.27 117.46 121.33 3khu n PHE 336 Ca 0.00 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.37 3khu n PHE 336 Cb 0.00 0.00 0.09 0.00 0.35 0.00 0.00 39.48 39.92 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 -1.74 2.15 -0.38 3.13 0.00 -1.26 -4.60 121.76 119.06 3khu s ALA 337 Ca 0.00 0.54 0.26 0.00 0.00 0.00 0.00 51.96 52.76 3khu s ALA 337 Cb 0.00 -3.36 1.02 0.00 0.00 0.00 0.00 23.12 20.78 3khu s ALA 337 CO 0.00 -1.83 1.78 0.27 0.00 0.00 0.00 175.76 175.98 3khu h PHE 338 N -0.75 0.00 -3.01 0.00 -5.15 -1.70 -3.44 116.94 102.89 3khu h PHE 338 Ca -0.45 0.00 0.02 0.00 -0.20 0.00 0.00 57.97 57.34 3khu h PHE 338 Cb 1.26 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.40 3khu h PHE 338 CO 0.53 0.00 0.25 -1.59 -2.00 0.00 0.00 178.31 175.50 3khu s LYS 339 N -3.36 2.02 0.76 6.09 -2.85 -1.26 -4.47 119.74 116.66 3khu s LYS 339 Ca 0.05 -1.23 -0.11 0.00 -1.00 0.00 0.00 55.97 53.68 3khu s LYS 339 Cb 0.09 0.62 0.05 0.00 -2.06 0.00 0.00 37.83 36.53 3khu s LYS 339 CO 0.47 -0.94 1.09 -1.59 0.10 0.00 0.00 175.35 174.48 3khu s LYS 340 N -3.09 2.38 -1.07 1.78 -2.85 -1.26 -4.26 119.74 111.37 3khu s LYS 340 Ca 0.13 0.69 -0.05 0.00 -1.00 0.00 0.00 55.97 55.75 3khu s LYS 340 Cb -0.05 -1.95 0.01 0.00 -2.06 0.00 0.00 37.83 33.77 3khu s LYS 340 CO 0.09 -1.42 0.61 -0.25 0.10 0.00 0.00 175.35 174.48 3khu n ASP 341 N -3.31 -5.00 -3.45 0.03 8.00 -1.26 -5.00 116.55 106.55 3khu n ASP 341 Ca 0.07 -0.28 -0.13 0.00 0.71 0.00 0.00 54.79 55.16 3khu n ASP 341 Cb 0.56 -3.76 -0.03 0.00 -0.02 0.00 0.00 41.12 37.87 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 -3.09 0.00 -1.74 -3.53 -1.32 -1.26 -4.88 115.64 99.81 3khu s THR 342 Ca 0.30 -0.02 0.23 0.00 -1.21 0.00 0.00 61.69 60.99 3khu s THR 342 Cb -0.13 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.85 3khu s THR 342 CO 0.37 -0.01 1.15 0.61 -2.21 0.00 0.00 174.62 174.53 3khu n GLY 343 N -0.10 -0.33 3.74 6.08 0.00 -1.26 -4.60 105.19 108.72 3khu n GLY 343 Ca -0.17 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.61 6.80 0.00 1.61 -1.08 -1.26 -4.50 116.67 115.63 3khu s ASP 344 Ca 0.17 2.48 0.06 0.00 -0.52 0.00 0.00 52.55 54.73 3khu s ASP 344 Cb 0.18 -2.61 0.05 0.00 -1.46 0.00 0.00 42.92 39.08 3khu s ASP 344 CO 0.63 -0.61 0.71 0.35 0.52 0.00 0.00 175.17 176.77 3khu n THR 345 N 2.80 0.09 -1.68 1.71 -2.24 -1.26 -2.17 114.28 111.52 3khu n THR 345 Ca 0.07 -0.54 -0.45 0.00 -2.27 0.00 0.00 64.05 60.86 3khu n THR 345 Cb 0.42 1.06 -0.04 0.00 -2.10 0.00 0.00 70.33 69.67 3khu n THR 345 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3khu n ARG 346 N 0.28 2.44 -2.16 -0.78 1.74 -1.26 -0.80 116.66 116.13 3khu n ARG 346 Ca 0.03 0.89 -0.12 0.00 -0.77 0.00 0.00 57.85 57.88 3khu n ARG 346 Cb 0.16 -2.72 -0.02 0.00 -1.02 0.00 0.00 32.46 28.86 3khu n ARG 346 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3khu n GLU 347 N 4.74 -2.00 -2.06 5.56 -0.58 -1.26 -0.34 120.64 124.69 3khu n GLU 347 Ca 0.18 0.60 -0.41 0.00 -0.42 0.00 0.00 57.16 57.11 3khu n GLU 347 Cb 0.32 -5.10 -0.02 0.00 -0.57 0.00 0.00 31.44 26.07 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 -2.02 6.71 0.55 1.62 0.15 0.02 -3.92 113.70 116.82 3khu s SER 348 Ca 0.00 2.63 0.24 0.00 0.70 0.00 0.00 55.95 59.53 3khu s SER 348 Cb 0.00 -2.63 1.46 0.00 -1.71 0.00 0.00 66.02 63.15 3khu s SER 348 CO 0.00 -0.64 2.07 0.28 1.20 0.00 0.00 173.24 176.15 3khu h SER 349 N 4.72 0.00 -0.20 5.45 0.02 -1.85 -0.67 113.55 121.03 3khu h SER 349 Ca -0.46 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.49 3khu h SER 349 Cb 1.22 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 3khu h SER 349 CO 0.75 0.00 0.12 0.28 -1.14 0.00 0.00 176.83 176.84 3khu h SER 350 N 0.00 0.24 -0.18 3.07 0.02 -1.85 -0.34 113.55 114.50 3khu h SER 350 Ca 0.13 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 3khu h SER 350 Cb 0.56 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 3khu h SER 350 CO -0.00 0.18 0.09 0.40 -1.14 0.00 0.00 176.83 176.36 3khu h ILE 351 N 0.28 1.13 -0.13 3.27 2.04 -1.39 -1.24 117.51 121.46 3khu h ILE 351 Ca 0.07 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.46 3khu h ILE 351 Cb -0.01 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 3khu h ILE 351 CO -0.01 0.13 -0.31 1.88 0.00 0.00 0.00 178.15 179.83 3khu h TYR 352 N 0.17 0.57 -0.92 1.37 -1.99 -1.40 -0.37 116.97 114.40 3khu h TYR 352 Ca 0.06 -0.21 0.02 0.00 2.00 0.00 0.00 58.73 60.60 3khu h TYR 352 Cb 0.12 -0.10 -0.05 0.00 2.00 0.00 0.00 36.73 38.70 3khu h TYR 352 CO -0.03 0.93 0.61 0.82 -0.00 0.00 0.00 178.16 180.49 3khu h ILE 353 N 0.05 1.21 -0.55 -2.88 1.08 -1.12 -0.64 117.51 114.65 3khu h ILE 353 Ca -0.00 -0.42 -0.07 0.00 -0.39 0.00 0.00 64.86 63.98 3khu h ILE 353 Cb 0.91 -0.12 -0.02 0.00 -3.07 0.00 0.00 36.82 34.52 3khu h ILE 353 CO 0.07 0.22 0.06 0.28 -0.69 0.00 0.00 178.15 178.09 3khu h SER 354 N 1.22 0.91 -0.70 1.72 0.02 -0.98 -2.58 113.55 113.16 3khu h SER 354 Ca 0.35 -0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 3khu h SER 354 Cb -0.09 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.18 3khu h SER 354 CO -0.09 0.96 0.34 0.11 -1.14 0.00 0.00 176.83 177.01 3khu h LYS 355 N 0.83 1.00 -1.00 3.45 1.57 -0.39 0.10 116.57 122.13 3khu h LYS 355 Ca 0.16 -0.14 0.03 0.00 -1.87 0.00 0.00 60.65 58.83 3khu h LYS 355 Cb 0.46 -0.18 -0.06 0.00 0.08 0.00 0.00 32.23 32.53 3khu h LYS 355 CO 0.02 0.78 0.65 1.88 -0.57 0.00 0.00 179.45 182.21 3khu h TYR 356 N 0.97 1.23 0.01 -1.35 0.99 -0.92 -0.94 116.97 116.95 3khu h TYR 356 Ca 0.24 0.03 -0.21 0.00 2.00 0.00 0.00 58.73 60.79 3khu h TYR 356 Cb 0.11 -0.41 -0.01 0.00 1.00 0.00 0.00 36.73 37.42 3khu h TYR 356 CO 0.00 0.72 -0.92 -0.07 -0.00 0.00 0.00 178.16 177.89 3khu h LEU 357 N 1.27 0.32 -1.21 3.88 3.38 -1.05 -2.95 115.31 118.96 3khu h LEU 357 Ca 0.39 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3khu h LEU 357 Cb -0.02 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3khu h LEU 357 CO -0.12 1.08 0.23 0.24 0.09 0.00 0.00 178.44 179.96 3khu h MET 358 N 0.13 0.78 0.00 1.13 2.86 -0.35 -1.50 114.93 117.97 3khu h MET 358 Ca -0.06 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 3khu h MET 358 Cb 1.56 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 33.07 3khu h MET 358 CO 0.14 0.63 0.00 -0.44 1.06 0.00 0.00 176.91 178.30 3khu h ASP 359 N 0.77 0.00 -0.10 1.22 3.32 -1.01 -0.38 116.42 120.24 3khu h ASP 359 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3khu h ASP 359 Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 3khu h ASP 359 CO -0.02 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 176.88 3khu n GLU 360 N -2.53 1.89 -1.26 3.56 -0.58 -0.81 -4.96 120.64 115.96 3khu n GLU 360 Ca 0.01 -1.31 -0.03 0.00 -0.42 0.00 0.00 57.16 55.41 3khu n GLU 360 Cb 0.22 -1.46 -0.01 0.00 -0.57 0.00 0.00 31.44 29.62 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 1.23 0.57 3.77 0.62 0.00 -0.15 -2.32 105.19 108.90 3khu n GLY 361 Ca 0.17 -0.90 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.13 2.84 -0.59 4.61 0.00 -0.63 -0.78 121.76 125.08 3khu s ALA 362 Ca 0.00 0.98 -0.19 0.00 0.00 0.00 0.00 51.96 52.75 3khu s ALA 362 Cb 0.00 -3.41 0.10 0.00 0.00 0.00 0.00 23.12 19.81 3khu s ALA 362 CO 0.00 -0.85 0.69 -1.01 0.00 0.00 0.00 175.76 174.59 3khu s HIS 363 N -1.56 3.01 0.04 0.00 3.76 0.91 -4.66 115.29 116.78 3khu s HIS 363 Ca 0.68 -0.96 -0.23 0.00 -0.15 0.00 0.00 55.06 54.40 3khu s HIS 363 Cb -0.30 -3.99 -0.06 0.00 1.11 0.00 0.00 32.58 29.35 3khu s HIS 363 CO 0.35 -1.28 0.68 -0.51 -0.85 0.00 0.00 174.74 173.13 3khu s LEU 364 N 2.64 4.46 -0.26 0.89 1.43 0.03 -0.93 118.68 126.94 3khu s LEU 364 Ca 0.11 1.34 0.03 0.00 -1.03 0.00 0.00 54.13 54.58 3khu s LEU 364 Cb -0.24 -3.09 0.06 0.00 0.03 0.00 0.00 46.19 42.95 3khu s LEU 364 CO 0.06 0.10 -0.11 -1.00 0.23 0.00 0.00 176.35 175.63 3khu s HIS 365 N -0.34 3.24 -0.20 0.29 3.76 0.18 -0.64 115.29 121.59 3khu s HIS 365 Ca 0.34 -2.28 -0.06 0.00 -0.15 0.00 0.00 55.06 52.91 3khu s HIS 365 Cb -0.20 -1.94 -0.03 0.00 1.11 0.00 0.00 32.58 31.52 3khu s HIS 365 CO 0.21 -0.87 0.04 0.42 -0.85 0.00 0.00 174.74 173.68 3khu s ILE 366 N 1.12 4.42 -0.09 0.60 1.01 -0.10 -0.89 121.20 127.27 3khu s ILE 366 Ca -0.08 -0.16 0.04 0.00 0.00 0.00 0.00 60.65 60.45 3khu s ILE 366 Cb -0.20 -3.00 0.00 0.00 0.01 0.00 0.00 42.46 39.27 3khu s ILE 366 CO -0.05 0.43 -0.21 -0.47 0.00 0.00 0.00 174.94 174.64 3khu s TYR 367 N 0.77 2.28 -0.02 3.97 5.04 -0.13 -1.02 117.35 128.24 3khu s TYR 367 Ca 0.02 -0.93 -0.01 0.00 -2.44 0.00 0.00 57.07 53.71 3khu s TYR 367 Cb -0.14 -1.55 0.02 0.00 0.35 0.00 0.00 41.96 40.64 3khu s TYR 367 CO 0.02 -0.39 0.05 0.34 -1.34 0.00 0.00 175.55 174.23 3khu s ASP 368 N 0.44 -0.02 0.05 4.32 -1.08 -1.26 -0.77 116.67 118.35 3khu s ASP 368 Ca -0.17 0.10 0.18 0.00 -0.52 0.00 0.00 52.55 52.13 3khu s ASP 368 Cb -0.17 0.05 0.74 0.00 -1.46 0.00 0.00 42.92 42.08 3khu s ASP 368 CO 0.07 -0.07 1.56 -0.81 0.52 0.00 0.00 175.17 176.44 3khu n PRO 369 N 3.57 0.04 0.00 4.34 -0.04 -1.26 -4.16 135.00 137.49 3khu n PRO 369 Ca -0.19 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 3khu n PRO 369 Cb 0.56 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.64 1.62 -2.08 0.54 3.00 -1.26 -5.05 118.16 113.31 3khu n LYS 370 Ca 0.04 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.93 3khu n LYS 370 Cb 0.20 -0.68 -0.03 0.00 0.00 0.00 0.00 35.03 34.53 3khu n LYS 370 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3khu s VAL 371 N -1.30 3.28 0.45 3.15 1.01 -1.26 -4.69 120.40 121.05 3khu s VAL 371 Ca 0.00 0.78 -0.25 0.00 0.00 0.00 0.00 61.98 62.51 3khu s VAL 371 Cb 0.00 -3.50 -0.08 0.00 0.00 0.00 0.00 36.38 32.80 3khu s VAL 371 CO 0.00 0.01 1.34 -2.84 0.00 0.00 0.00 175.10 173.61 3khu s PRO 372 N 2.14 3.73 0.35 2.72 0.02 -1.26 -4.84 135.00 137.86 3khu s PRO 372 Ca 0.68 2.21 0.02 0.00 0.02 0.00 0.00 61.00 63.94 3khu s PRO 372 Cb -0.37 -2.61 0.64 0.00 0.02 0.00 0.00 34.50 32.18 3khu s PRO 372 CO 0.30 -0.71 2.01 0.07 -0.33 0.00 0.00 177.00 178.33 3khu h ARG 373 N 2.31 0.84 -0.17 5.54 0.11 -1.97 -2.34 114.38 118.71 3khu h ARG 373 Ca -0.50 -0.05 -0.04 0.00 0.10 0.00 0.00 59.98 59.48 3khu h ARG 373 Cb 1.26 -0.19 -0.01 0.00 1.11 0.00 0.00 29.97 32.14 3khu h ARG 373 CO 0.61 0.55 -0.09 0.93 0.10 0.00 0.00 179.97 182.07 3khu h GLU 374 N 0.86 0.26 -0.10 0.08 4.39 -2.00 -1.77 114.58 116.31 3khu h GLU 374 Ca 0.24 -0.05 -0.19 0.00 0.34 0.00 0.00 59.36 59.70 3khu h GLU 374 Cb -0.08 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 3khu h GLU 374 CO -0.05 0.37 -0.73 0.37 -1.16 0.00 0.00 179.01 177.80 3khu h GLN 375 N 0.25 0.48 -0.70 2.33 5.75 -1.81 -1.71 115.11 119.70 3khu h GLN 375 Ca 0.05 -0.39 -0.04 0.00 -0.15 0.00 0.00 58.65 58.12 3khu h GLN 375 Cb 0.33 0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.93 3khu h GLN 375 CO 0.02 1.02 0.27 0.82 -2.65 0.00 0.00 178.83 178.30 3khu h ILE 376 N 0.33 1.25 -0.38 2.39 2.04 -1.23 -0.37 117.51 121.54 3khu h ILE 376 Ca -0.03 -0.80 -0.06 0.00 1.00 0.00 0.00 64.86 64.97 3khu h ILE 376 Cb 1.31 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 3khu h ILE 376 CO 0.13 0.32 0.01 0.58 0.00 0.00 0.00 178.15 179.18 3khu h VAL 377 N 1.00 1.26 -0.31 1.67 2.07 -1.25 -2.30 116.25 118.39 3khu h VAL 377 Ca 0.23 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 3khu h VAL 377 Cb 0.23 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 3khu h VAL 377 CO -0.02 0.33 0.15 0.58 0.02 0.00 0.00 177.57 178.64 3khu h VAL 378 N 0.50 1.15 -0.44 2.57 2.07 -1.17 -2.67 116.25 118.27 3khu h VAL 378 Ca 0.11 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 3khu h VAL 378 Cb 0.46 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 3khu h VAL 378 CO 0.02 0.16 0.25 0.44 0.02 0.00 0.00 177.57 178.46 3khu h ASP 379 N 0.37 0.52 -0.42 0.57 3.32 -0.93 -2.35 116.42 117.50 3khu h ASP 379 Ca 0.11 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3khu h ASP 379 Cb 0.11 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3khu h ASP 379 CO -0.01 0.41 0.00 0.18 -1.72 0.00 0.00 179.24 178.10 3khu n LEU 380 N -4.44 2.77 -4.94 1.55 4.77 -0.88 -4.95 117.00 110.89 3khu n LEU 380 Ca 0.03 -1.29 -0.27 0.00 -0.03 0.00 0.00 56.01 54.46 3khu n LEU 380 Cb 0.09 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 40.87 3khu n LEU 380 CO 0.36 0.64 -0.06 -0.44 -1.33 0.00 0.00 177.39 176.56 3khu s SER 381 N -1.26 6.36 0.13 -1.43 0.01 -0.89 -4.66 113.70 111.96 3khu s SER 381 Ca 0.36 0.26 -0.30 0.00 1.31 0.00 0.00 55.95 57.58 3khu s SER 381 Cb 0.20 -1.95 -0.07 0.00 0.21 0.00 0.00 66.02 64.40 3khu s SER 381 CO 0.27 0.03 1.22 -1.00 0.41 0.00 0.00 173.24 174.17 3khu s HIS 382 N -1.76 3.41 0.00 2.43 3.76 -1.26 -5.02 115.29 116.85 3khu s HIS 382 Ca 0.36 1.32 -0.10 0.00 -0.15 0.00 0.00 55.06 56.48 3khu s HIS 382 Cb -0.11 -3.46 -0.12 0.00 1.11 0.00 0.00 32.58 30.00 3khu s HIS 382 CO 0.29 -1.39 1.09 -0.35 -0.85 0.00 0.00 174.74 173.53 3khu n PRO 383 N 3.23 0.00 -1.55 8.40 -0.04 -1.26 -4.93 135.00 138.85 3khu n PRO 383 Ca 0.07 -0.60 -0.13 0.00 -0.04 0.00 0.00 63.50 62.79 3khu n PRO 383 Cb 0.45 -2.04 -0.10 0.00 -0.04 0.00 0.00 33.50 31.77 3khu n PRO 383 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3khu n GLU 387 N 5.72 0.25 -1.39 0.54 -0.58 -1.26 -5.25 120.64 118.67 3khu n GLU 387 Ca 0.15 -1.31 -0.42 0.00 -0.42 0.00 0.00 57.16 55.16 3khu n GLU 387 Cb 0.15 -3.69 -0.00 0.00 -0.57 0.00 0.00 31.44 27.33 3khu n GLU 387 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 3khu n ASP 388 N 18.73 -1.62 -0.05 1.62 -0.08 -1.26 -4.97 116.55 128.92 3khu n ASP 388 Ca 0.42 0.90 -0.17 0.00 -1.51 0.00 0.00 54.79 54.43 3khu n ASP 388 Cb 0.45 -1.01 -0.13 0.00 2.34 0.00 0.00 41.12 42.76 3khu n ASP 388 CO 0.00 0.00 0.00 -0.78 0.12 0.00 0.00 177.20 176.54 3khu h ASP 389 N 0.66 0.10 -0.19 1.67 3.58 -1.99 -3.15 116.42 117.11 3khu h ASP 389 Ca -0.38 -0.91 0.05 0.00 0.42 0.00 0.00 57.03 56.22 3khu h ASP 389 Cb 1.42 -0.03 -0.06 0.00 1.72 0.00 0.00 39.33 42.37 3khu h ASP 389 CO 0.50 1.18 -0.22 1.56 -2.88 0.00 0.00 179.24 179.38 3khu h GLN 390 N -0.85 -0.24 -0.62 0.28 4.20 -1.96 -0.54 115.11 115.38 3khu h GLN 390 Ca -0.10 0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.70 3khu h GLN 390 Cb 1.20 0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.98 3khu h GLN 390 CO -0.00 -0.16 0.32 0.28 -0.67 0.00 0.00 178.83 178.59 3khu h VAL 391 N -0.25 0.92 -0.16 -0.54 2.07 -1.83 0.11 116.25 116.56 3khu h VAL 391 Ca 0.12 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 3khu h VAL 391 Cb 0.43 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 3khu h VAL 391 CO -0.33 0.11 0.08 -1.28 0.02 0.00 0.00 177.57 176.17 3khu h SER 392 N 0.59 0.21 -0.69 0.57 0.87 -1.42 -0.12 113.55 113.56 3khu h SER 392 Ca 0.29 -0.10 -0.07 0.00 -1.23 0.00 0.00 61.79 60.68 3khu h SER 392 Cb 0.23 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 3khu h SER 392 CO -0.21 0.26 0.18 0.03 -0.53 0.00 0.00 176.83 176.56 3khu h ARG 393 N 0.15 1.10 0.00 2.24 3.08 -0.73 -3.39 114.38 116.83 3khu h ARG 393 Ca 0.06 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 59.84 3khu h ARG 393 Cb 0.10 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 3khu h ARG 393 CO -0.01 0.97 -1.41 1.28 -1.07 0.00 0.00 179.97 179.74 3khu n LEU 394 N -4.27 0.00 -4.35 3.04 4.77 0.35 -4.99 117.00 111.55 3khu n LEU 394 Ca 0.05 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.69 3khu n LEU 394 Cb 0.25 0.01 -0.14 0.00 -2.33 0.00 0.00 43.42 41.21 3khu n LEU 394 CO 0.42 0.01 -0.40 -0.69 -1.33 0.00 0.00 177.39 175.40 3khu s VAL 395 N -2.59 3.32 -0.08 4.08 1.01 -0.07 -0.79 120.40 125.28 3khu s VAL 395 Ca -0.03 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.45 3khu s VAL 395 Cb 0.05 -2.47 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 3khu s VAL 395 CO 0.36 0.47 -0.22 -0.89 0.00 0.00 0.00 175.10 174.82 3khu s THR 396 N 0.96 2.33 -0.32 3.92 2.01 0.19 -4.77 115.64 119.95 3khu s THR 396 Ca -0.01 -0.95 -0.14 0.00 0.31 0.00 0.00 61.69 60.90 3khu s THR 396 Cb -0.15 -1.89 -0.02 0.00 0.01 0.00 0.00 72.50 70.45 3khu s THR 396 CO 0.00 0.56 0.32 -0.63 -0.69 0.00 0.00 174.62 174.18 3khu s ILE 397 N 0.05 5.21 0.25 1.82 -1.09 -1.26 -0.92 121.20 125.26 3khu s ILE 397 Ca -0.09 0.10 -0.14 0.00 -2.23 0.00 0.00 60.65 58.30 3khu s ILE 397 Cb -0.15 -3.74 -0.08 0.00 -1.58 0.00 0.00 42.46 36.91 3khu s ILE 397 CO 0.06 0.01 0.64 -0.44 -1.23 0.00 0.00 174.94 173.98 3khu s SER 398 N 1.72 6.76 0.24 3.58 0.01 -0.19 -4.91 113.70 120.92 3khu s SER 398 Ca 0.11 1.14 0.23 0.00 1.31 0.00 0.00 55.95 58.74 3khu s SER 398 Cb -0.16 -2.31 0.11 0.00 0.21 0.00 0.00 66.02 63.86 3khu s SER 398 CO 0.11 -0.09 1.19 0.07 0.41 0.00 0.00 173.24 174.94 3khu h LYS 399 N 2.69 0.00 -3.46 12.44 -0.00 -1.98 -3.43 116.57 122.83 3khu h LYS 399 Ca -0.48 0.00 -0.06 0.00 -0.00 0.00 0.00 60.65 60.11 3khu h LYS 399 Cb 1.18 0.00 -0.13 0.00 -0.00 0.00 0.00 32.23 33.27 3khu h LYS 399 CO 0.67 0.00 -0.14 0.16 -0.00 0.00 0.00 179.45 180.14 3khu s ASP 400 N -5.38 -0.16 0.52 7.07 1.47 -1.26 -5.04 116.67 113.89 3khu s ASP 400 Ca 0.02 -0.37 0.31 0.00 1.18 0.00 0.00 52.55 53.68 3khu s ASP 400 Cb 0.09 0.44 1.25 0.00 -0.34 0.00 0.00 42.92 44.36 3khu s ASP 400 CO 0.76 -0.81 1.95 -0.65 0.68 0.00 0.00 175.17 177.09 3khu h PRO 401 N 2.50 0.00 -0.03 2.11 0.11 -1.96 -2.78 132.00 131.95 3khu h PRO 401 Ca -0.34 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.55 3khu h PRO 401 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3khu h PRO 401 CO 0.49 0.07 -0.88 1.88 -0.21 0.00 0.00 178.00 179.35 3khu h TYR 402 N 0.00 0.66 -0.38 0.65 0.05 -1.98 -2.01 116.97 113.96 3khu h TYR 402 Ca -0.00 -0.34 0.04 0.00 0.05 0.00 0.00 58.73 58.48 3khu h TYR 402 Cb 0.57 -0.08 -0.04 0.00 1.01 0.00 0.00 36.73 38.19 3khu h TYR 402 CO 0.00 1.14 0.15 0.93 -1.05 0.00 0.00 178.16 179.34 3khu h GLU 403 N 0.28 0.31 -0.73 4.88 5.08 -1.90 -1.79 114.58 120.71 3khu h GLU 403 Ca -0.07 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3khu h GLU 403 Cb 1.51 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.65 3khu h GLU 403 CO 0.16 0.21 0.48 0.00 -1.00 0.00 0.00 179.01 178.86 3khu h ALA 404 N 1.23 1.48 -0.00 3.43 0.00 -1.27 -2.54 119.26 121.58 3khu h ALA 404 Ca 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3khu h ALA 404 Cb 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3khu h ALA 404 CO -0.16 0.48 -0.41 0.00 0.00 0.00 0.00 179.25 179.17 3khu s ASP 406 N -2.82 6.26 -0.30 0.00 -1.08 -0.68 -2.14 116.67 115.90 3khu s ASP 406 Ca 0.16 1.41 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 0.63 -1.39 0.00 0.61 0.52 0.00 0.00 175.17 175.55 3khu n GLY 407 N 4.90 0.61 3.84 2.66 0.00 0.98 -5.00 105.19 113.17 3khu n GLY 407 Ca 0.19 -0.57 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.04 3.30 0.07 4.61 0.00 -0.91 -4.41 121.76 122.38 3khu s ALA 408 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 51.96 52.09 3khu s ALA 408 Cb 0.00 -2.82 -0.24 0.00 0.00 0.00 0.00 23.12 20.06 3khu s ALA 408 CO 0.00 0.31 1.10 0.45 0.00 0.00 0.00 175.76 177.62 3khu h HIS 409 N 2.33 0.19 -3.38 0.00 3.86 -1.22 -1.95 115.15 114.99 3khu h HIS 409 Ca -0.48 -0.14 -0.14 0.00 -1.16 0.00 0.00 60.37 58.46 3khu h HIS 409 Cb 1.18 -0.01 -0.20 0.00 1.06 0.00 0.00 27.41 29.43 3khu h HIS 409 CO 0.62 1.13 -0.43 0.00 0.86 0.00 0.00 177.93 180.11 3khu s ALA 410 N -2.67 -0.46 -0.18 2.45 0.00 -1.26 -2.32 121.76 117.33 3khu s ALA 410 Ca -0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 51.96 51.92 3khu s ALA 410 Cb 0.09 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.30 3khu s ALA 410 CO 0.84 -0.22 -0.10 0.08 0.00 0.00 0.00 175.76 176.35 3khu s VAL 411 N -1.37 3.03 -0.30 0.00 1.01 -0.19 -1.62 120.40 120.96 3khu s VAL 411 Ca -0.14 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 3khu s VAL 411 Cb -0.07 -2.32 0.06 0.00 0.00 0.00 0.00 36.38 34.05 3khu s VAL 411 CO 0.02 0.48 -0.00 -0.69 0.00 0.00 0.00 175.10 174.91 3khu s VAL 412 N 1.01 2.86 -0.25 2.92 1.01 0.54 -0.61 120.40 127.87 3khu s VAL 412 Ca -0.01 -1.51 -0.18 0.00 0.00 0.00 0.00 61.98 60.28 3khu s VAL 412 Cb -0.15 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 3khu s VAL 412 CO -0.01 -0.16 0.53 -0.63 0.00 0.00 0.00 175.10 174.83 3khu s ILE 413 N 1.21 5.06 -0.11 2.22 1.01 -0.21 -0.83 121.20 129.55 3khu s ILE 413 Ca -0.04 0.93 0.06 0.00 0.00 0.00 0.00 60.65 61.60 3khu s ILE 413 Cb -0.20 -3.85 -0.09 0.00 0.01 0.00 0.00 42.46 38.34 3khu s ILE 413 CO -0.02 0.09 0.18 0.00 0.00 0.00 0.00 174.94 175.19 3khu s THR 415 N -2.11 0.73 -0.09 0.00 2.01 -1.23 -4.75 115.64 110.21 3khu s THR 415 Ca -0.01 -0.35 -0.00 0.00 0.31 0.00 0.00 61.69 61.64 3khu s THR 415 Cb 0.04 -0.64 0.06 0.00 0.01 0.00 0.00 72.50 71.97 3khu s THR 415 CO 0.26 0.22 2.01 -1.84 -0.69 0.00 0.00 174.62 174.59 3khu n GLU 416 N 3.17 1.24 -1.68 4.92 0.00 -1.26 -4.69 120.64 122.33 3khu n GLU 416 Ca -0.17 -0.46 -0.45 0.00 0.00 0.00 0.00 57.16 56.09 3khu n GLU 416 Cb 0.55 -1.18 -0.04 0.00 0.00 0.00 0.00 31.44 30.77 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 1.17 2.40 -0.19 -1.84 7.02 -1.26 -4.80 117.44 119.94 3khu n TRP 417 Ca 0.09 0.24 0.16 0.00 -1.02 0.00 0.00 57.50 56.97 3khu n TRP 417 Cb 0.52 -2.56 0.50 0.00 -2.42 0.00 0.00 31.31 27.35 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 5.83 0.41 0.07 -0.99 3.32 -2.02 -2.31 116.42 120.74 3khu h ASP 418 Ca -0.45 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 3khu h ASP 418 Cb 1.24 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 3khu h ASP 418 CO 0.88 0.20 -0.05 0.00 -1.72 0.00 0.00 179.24 178.55 3khu h MET 419 N 0.42 0.00 0.00 3.56 -0.00 -1.99 -2.89 114.93 114.03 3khu h MET 419 Ca 0.40 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 60.06 3khu h MET 419 Cb 0.94 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.54 3khu h MET 419 CO -0.14 0.05 -0.19 0.74 -0.00 0.00 0.00 176.91 177.37 3khu h PHE 420 N 0.00 0.00 0.00 -0.10 0.04 -1.79 -1.71 116.94 113.38 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 0.10 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.25 3khu h PHE 420 CO 0.00 0.19 0.00 0.36 -0.60 0.00 0.00 178.31 178.26 3khu n LYS 421 N -4.20 0.21 -0.19 1.51 2.85 -1.09 -3.47 118.16 113.77 3khu n LYS 421 Ca -0.02 0.34 0.08 0.00 -1.05 0.00 0.00 58.31 57.66 3khu n LYS 421 Cb 0.26 -1.83 0.18 0.00 -0.65 0.00 0.00 35.03 32.99 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 -2.21 2.39 -1.52 -1.58 -0.58 -0.65 -4.99 120.64 111.50 3khu n GLU 422 Ca 0.03 -2.09 -0.34 0.00 -0.42 0.00 0.00 57.16 54.35 3khu n GLU 422 Cb 0.30 -1.38 0.08 0.00 -0.57 0.00 0.00 31.44 29.87 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 -1.11 3.33 -1.05 -4.62 1.43 -1.19 -4.92 118.68 110.56 3khu s LEU 423 Ca 0.30 2.24 -0.22 0.00 -1.03 0.00 0.00 54.13 55.43 3khu s LEU 423 Cb 0.17 -4.58 0.06 0.00 0.03 0.00 0.00 46.19 41.87 3khu s LEU 423 CO 0.23 -2.08 1.46 -0.62 0.23 0.00 0.00 176.35 175.57 3khu s ASP 424 N -2.21 6.57 0.43 2.29 -1.08 -1.26 -4.83 116.67 116.58 3khu s ASP 424 Ca 0.72 -1.66 0.24 0.00 -0.52 0.00 0.00 52.55 51.32 3khu s ASP 424 Cb -0.26 -2.55 0.81 0.00 -1.46 0.00 0.00 42.92 39.45 3khu s ASP 424 CO 0.44 -1.41 1.77 1.88 0.52 0.00 0.00 175.17 178.37 3khu h TYR 425 N 9.37 0.00 -0.26 -5.34 -1.99 -1.97 -2.05 116.97 114.72 3khu h TYR 425 Ca 0.23 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.94 3khu h TYR 425 Cb 0.99 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.71 3khu h TYR 425 CO 1.29 0.22 0.07 1.49 -0.00 0.00 0.00 178.16 181.24 3khu h GLU 426 N 0.00 0.41 -0.28 4.88 4.81 -2.00 -0.59 114.58 121.81 3khu h GLU 426 Ca -0.00 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.15 3khu h GLU 426 Cb 0.83 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 3khu h GLU 426 CO 0.03 0.49 0.15 -0.09 -0.73 0.00 0.00 179.01 178.86 3khu h ARG 427 N 0.25 0.31 -0.58 1.92 2.43 -1.89 -2.58 114.38 114.25 3khu h ARG 427 Ca 0.08 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.24 3khu h ARG 427 Cb 0.26 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 3khu h ARG 427 CO -0.00 0.20 0.38 0.82 -1.51 0.00 0.00 179.97 179.87 3khu h ILE 428 N 0.32 1.14 -0.32 1.20 2.04 -1.18 -2.80 117.51 117.91 3khu h ILE 428 Ca 0.11 -0.27 0.06 0.00 1.00 0.00 0.00 64.86 65.76 3khu h ILE 428 Cb 0.01 0.30 -0.05 0.00 -0.74 0.00 0.00 36.82 36.34 3khu h ILE 428 CO -0.06 0.14 -0.03 -0.74 0.00 0.00 0.00 178.15 177.46 3khu h HIS 429 N 0.78 -0.08 -1.00 1.37 2.76 -0.88 -2.60 115.15 115.50 3khu h HIS 429 Ca 0.21 0.03 0.21 0.00 -2.20 0.00 0.00 60.37 58.61 3khu h HIS 429 Cb -0.09 0.08 -0.11 0.00 1.55 0.00 0.00 27.41 28.85 3khu h HIS 429 CO -0.04 -0.09 0.61 0.87 -1.30 0.00 0.00 177.93 177.98 3khu h LYS 430 N 0.05 0.69 -0.48 5.26 1.57 -1.18 -2.05 116.57 120.43 3khu h LYS 430 Ca 0.15 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3khu h LYS 430 Cb 0.22 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3khu h LYS 430 CO -0.29 0.46 0.00 1.63 -0.57 0.00 0.00 179.45 180.68 3khu n LYS 431 N -4.79 2.53 -2.98 3.15 4.76 -1.08 -4.94 118.16 114.81 3khu n LYS 431 Ca 0.24 -2.31 -0.32 0.00 -2.87 0.00 0.00 58.31 53.05 3khu n LYS 431 Cb 0.62 -1.47 -0.06 0.00 -1.84 0.00 0.00 35.03 32.28 3khu n LYS 431 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 3khu s MET 432 N -1.19 4.00 0.61 1.97 -1.94 -0.77 -0.01 119.30 121.96 3khu s MET 432 Ca 0.38 0.73 -0.17 0.00 -1.71 0.00 0.00 55.69 54.92 3khu s MET 432 Cb 0.21 -2.36 -0.02 0.00 2.01 0.00 0.00 34.83 34.67 3khu s MET 432 CO 0.28 0.06 1.14 -0.51 -0.01 0.00 0.00 175.02 175.98 3khu s LEU 433 N -3.25 3.56 -0.05 -0.03 1.43 -0.73 -4.90 118.68 114.70 3khu s LEU 433 Ca 0.55 2.15 0.05 0.00 -1.03 0.00 0.00 54.13 55.86 3khu s LEU 433 Cb -0.10 -4.57 -0.02 0.00 0.03 0.00 0.00 46.19 41.53 3khu s LEU 433 CO 0.20 -1.53 -0.19 -0.54 0.23 0.00 0.00 176.35 174.53 3khu s LYS 434 N -3.66 2.48 0.42 1.70 -0.14 -1.26 -3.39 119.74 115.89 3khu s LYS 434 Ca 0.71 -0.78 -0.24 0.00 -1.36 0.00 0.00 55.97 54.30 3khu s LYS 434 Cb -0.24 -2.29 -0.08 0.00 -1.68 0.00 0.00 37.83 33.54 3khu s LYS 434 CO 0.35 0.54 1.11 -1.25 -0.76 0.00 0.00 175.35 175.35 3khu s PRO 435 N -0.54 3.98 -0.17 -1.68 0.04 -1.26 -5.16 135.00 130.21 3khu s PRO 435 Ca 0.07 1.66 -0.08 0.00 0.04 0.00 0.00 61.00 62.70 3khu s PRO 435 Cb -0.11 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.88 3khu s PRO 435 CO 0.01 -0.34 0.08 0.00 0.04 0.00 0.00 177.00 176.80 3khu s ALA 436 N -1.58 3.52 0.10 8.56 0.00 -1.22 -4.87 121.76 126.27 3khu s ALA 436 Ca 0.60 -0.72 0.09 0.00 0.00 0.00 0.00 51.96 51.93 3khu s ALA 436 Cb -0.26 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 20.87 3khu s ALA 436 CO 0.32 0.26 -0.20 -0.06 0.00 0.00 0.00 175.76 176.08 3khu s PHE 437 N 0.10 2.49 -0.09 0.00 0.40 -0.98 -1.48 117.98 118.41 3khu s PHE 437 Ca 0.06 -0.29 0.04 0.00 -0.60 0.00 0.00 56.93 56.14 3khu s PHE 437 Cb -0.12 -1.36 0.00 0.00 0.51 0.00 0.00 43.02 42.06 3khu s PHE 437 CO 0.00 0.33 -0.22 0.42 0.70 0.00 0.00 175.22 176.46 3khu s ILE 438 N -1.06 1.87 -0.27 0.64 1.01 -0.06 -1.02 121.20 122.31 3khu s ILE 438 Ca 0.16 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 3khu s ILE 438 Cb -0.10 -1.63 0.04 0.00 0.01 0.00 0.00 42.46 40.78 3khu s ILE 438 CO 0.08 0.52 -0.06 -0.36 0.00 0.00 0.00 174.94 175.12 3khu s PHE 439 N 0.39 3.17 -0.49 3.97 0.08 0.22 -1.14 117.98 124.17 3khu s PHE 439 Ca -0.18 -1.83 -0.16 0.00 0.12 0.00 0.00 56.93 54.88 3khu s PHE 439 Cb -0.17 -2.04 0.08 0.00 -0.57 0.00 0.00 43.02 40.32 3khu s PHE 439 CO 0.08 -0.79 0.43 0.34 -0.10 0.00 0.00 175.22 175.17 3khu s ASP 440 N 1.25 6.16 0.00 1.36 2.15 0.14 -1.04 116.67 126.69 3khu s ASP 440 Ca -0.03 -1.39 0.18 0.00 0.43 0.00 0.00 52.55 51.74 3khu s ASP 440 Cb -0.18 -2.19 0.77 0.00 -0.30 0.00 0.00 42.92 41.01 3khu s ASP 440 CO -0.04 -0.70 1.54 0.61 -0.17 0.00 0.00 175.17 176.41 3khu n GLY 441 N 5.21 -0.06 0.00 2.66 0.00 -0.15 -2.94 105.19 109.91 3khu n GLY 441 Ca -0.12 -0.32 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 0.03 -0.25 -2.30 1.61 5.12 -1.26 -0.96 116.66 118.65 3khu n ARG 442 Ca 0.14 -0.16 -0.19 0.00 -1.93 0.00 0.00 57.85 55.72 3khu n ARG 442 Cb 0.25 -0.65 -0.01 0.00 -1.16 0.00 0.00 32.46 30.88 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 -0.01 -1.48 0.20 5.56 5.12 -1.25 -4.91 116.66 119.88 3khu n ARG 443 Ca 0.00 0.92 0.08 0.00 -1.93 0.00 0.00 57.85 56.93 3khu n ARG 443 Cb 0.16 -5.45 0.26 0.00 -1.16 0.00 0.00 32.46 26.28 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 0.00 0.51 -0.54 1.55 -1.51 -1.95 -3.21 116.25 111.10 3khu h VAL 444 Ca -0.44 -1.44 0.00 0.00 -1.23 0.00 0.00 66.70 63.59 3khu h VAL 444 Cb 1.32 2.03 0.00 0.00 -2.13 0.00 0.00 31.29 32.51 3khu h VAL 444 CO 0.53 0.26 0.00 0.18 -1.23 0.00 0.00 177.57 177.30 3khu n LEU 445 N -3.25 3.80 -4.63 4.19 4.77 -1.26 -4.76 117.00 115.85 3khu n LEU 445 Ca 0.02 -1.91 -0.44 0.00 -0.03 0.00 0.00 56.01 53.64 3khu n LEU 445 Cb 0.55 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 41.13 3khu n LEU 445 CO 0.36 0.69 0.72 0.47 -1.33 0.00 0.00 177.39 178.30 3khu n ASP 446 N 0.94 1.88 0.00 -1.43 9.92 -1.22 -1.74 116.55 124.91 3khu n ASP 446 Ca 0.21 1.18 0.00 0.00 -0.53 0.00 0.00 54.79 55.65 3khu n ASP 446 Cb 0.70 -1.36 0.00 0.00 -0.64 0.00 0.00 41.12 39.82 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 1.20 3.22 1.11 0.44 0.00 -1.26 -4.85 105.19 105.05 3khu n GLY 447 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 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 3.31 -0.09 0.99 4.77 -0.71 -4.66 117.00 120.60 3khu n LEU 448 Ca 0.00 -1.45 -0.13 0.00 -0.03 0.00 0.00 56.01 54.40 3khu n LEU 448 Cb 0.00 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 40.79 3khu n LEU 448 CO 0.00 0.72 0.58 0.45 -1.33 0.00 0.00 177.39 177.81 3khu h HIS 449 N 4.20 0.83 -0.36 -1.77 3.86 -1.89 -1.31 115.15 118.71 3khu h HIS 449 Ca 0.00 -0.25 0.03 0.00 -1.16 0.00 0.00 60.37 58.99 3khu h HIS 449 Cb 0.93 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 29.19 3khu h HIS 449 CO 0.26 0.98 0.18 -0.91 0.86 0.00 0.00 177.93 179.30 3khu h ASN 450 N 0.43 0.27 -0.51 2.45 2.35 -1.96 -0.48 115.58 118.13 3khu h ASN 450 Ca 0.05 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 3khu h ASN 450 Cb 0.84 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 39.15 3khu h ASN 450 CO 0.07 0.20 0.32 -0.33 -1.65 0.00 0.00 177.43 176.04 3khu h GLU 451 N 0.37 0.68 -0.50 0.81 5.08 -1.84 -0.64 114.58 118.55 3khu h GLU 451 Ca 0.15 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 3khu h GLU 451 Cb 0.06 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3khu h GLU 451 CO -0.10 0.47 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.24 3khu h LEU 452 N 0.68 0.87 -0.58 1.33 3.38 -0.95 -1.03 115.31 119.01 3khu h LEU 452 Ca 0.18 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 3khu h LEU 452 Cb -0.05 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 3khu h LEU 452 CO -0.04 0.97 0.20 1.56 0.09 0.00 0.00 178.44 181.22 3khu h GLN 453 N 0.80 0.89 -0.56 1.13 4.20 -0.85 -1.47 115.11 119.24 3khu h GLN 453 Ca 0.14 -0.18 0.01 0.00 0.06 0.00 0.00 58.65 58.69 3khu h GLN 453 Cb 0.57 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 3khu h GLN 453 CO 0.03 0.78 0.36 1.15 -0.67 0.00 0.00 178.83 180.49 3khu h THR 454 N 0.81 1.11 -0.83 -0.54 2.02 -0.66 -1.10 112.91 113.73 3khu h THR 454 Ca 0.19 -0.25 0.06 0.00 0.77 0.00 0.00 66.41 67.19 3khu h THR 454 Cb 0.25 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 66.93 3khu h THR 454 CO -0.01 0.13 0.54 0.40 0.37 0.00 0.00 175.52 176.95 3khu h ILE 455 N 0.73 1.05 0.00 3.11 2.04 -1.02 -3.46 117.51 119.95 3khu h ILE 455 Ca 0.22 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.76 3khu h ILE 455 Cb -0.04 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.09 3khu h ILE 455 CO -0.07 0.17 0.00 0.61 0.00 0.00 0.00 178.15 178.86 3khu n GLY 456 N -1.42 0.18 3.80 5.37 0.00 -0.41 -5.06 105.19 107.65 3khu n GLY 456 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.01 3.04 -0.40 1.61 0.40 -0.63 -4.68 117.98 116.31 3khu s PHE 457 Ca 0.00 1.56 -0.20 0.00 -0.60 0.00 0.00 56.93 57.69 3khu s PHE 457 Cb 0.00 -3.03 0.01 0.00 0.51 0.00 0.00 43.02 40.52 3khu s PHE 457 CO 0.00 -0.80 0.60 -0.65 0.70 0.00 0.00 175.22 175.08 3khu s GLN 458 N -3.40 3.42 -0.17 0.44 -0.21 -0.55 -4.26 119.66 114.93 3khu s GLN 458 Ca 0.66 -0.27 -0.04 0.00 0.02 0.00 0.00 55.36 55.73 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 0.23 -0.87 -0.03 -1.50 -2.12 0.00 0.00 175.29 171.00 3khu s ILE 459 N 2.67 3.88 0.04 1.08 1.10 -1.26 -0.88 121.20 127.82 3khu s ILE 459 Ca 0.21 -0.36 0.04 0.00 -0.51 0.00 0.00 60.65 60.03 3khu s ILE 459 Cb -0.15 -2.71 -0.02 0.00 0.15 0.00 0.00 42.46 39.73 3khu s ILE 459 CO 0.17 0.48 -0.11 -1.61 -2.11 0.00 0.00 174.94 171.76 3khu s GLU 460 N 0.53 0.72 0.08 3.50 2.02 -0.30 -4.98 118.70 120.26 3khu s GLU 460 Ca -0.03 -0.71 -0.05 0.00 0.02 0.00 0.00 54.97 54.20 3khu s GLU 460 Cb -0.14 -0.65 -0.02 0.00 0.10 0.00 0.00 34.13 33.42 3khu s GLU 460 CO 0.03 0.15 0.10 -0.08 0.02 0.00 0.00 175.26 175.48 3khu s THR 461 N -0.98 0.17 0.51 3.63 -1.32 -1.26 -0.68 115.64 115.72 3khu s THR 461 Ca -0.03 -1.47 -0.22 0.00 -1.21 0.00 0.00 61.69 58.76 3khu s THR 461 Cb -0.08 -1.46 -0.06 0.00 -1.51 0.00 0.00 72.50 69.39 3khu s THR 461 CO 0.01 -0.77 1.30 0.27 -2.21 0.00 0.00 174.62 173.22 3khu s ILE 462 N -3.90 2.40 -0.32 5.08 -4.36 -1.15 -3.08 121.20 115.88 3khu s ILE 462 Ca 0.07 0.31 0.00 0.00 -0.26 0.00 0.00 60.65 60.77 3khu s ILE 462 Cb 0.06 -3.16 0.00 0.00 1.25 0.00 0.00 42.46 40.62 3khu s ILE 462 CO -0.10 -0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.69 3khu n GLY 463 N 0.63 0.62 2.78 6.27 0.00 -1.24 -4.84 105.19 109.40 3khu n GLY 463 Ca 0.09 -0.65 -0.21 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.82 0.45 0.35 1.61 2.20 -1.18 -1.43 119.74 119.93 3khu s LYS 464 Ca 0.00 0.12 -0.28 0.00 -0.36 0.00 0.00 55.97 55.44 3khu s LYS 464 Cb 0.00 -0.76 -0.11 0.00 -1.51 0.00 0.00 37.83 35.45 3khu s LYS 464 CO 0.00 -0.24 1.39 0.21 -0.36 0.00 0.00 175.35 176.35 3khu s LYS 465 N 1.64 4.23 0.00 4.03 2.20 -1.26 -4.66 119.74 125.92 3khu s LYS 465 Ca -0.01 2.37 0.27 0.00 -0.36 0.00 0.00 55.97 58.25 3khu s LYS 465 Cb -0.13 -3.01 1.64 0.00 -1.51 0.00 0.00 37.83 34.82 3khu s LYS 465 CO -0.03 -0.35 1.98 0.28 -0.36 0.00 0.00 175.35 176.87