#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h4i h ASP 2 N 0.00 0.46 -0.31 1.20 3.32 -1.99 -1.37 116.42 117.72 1h4i h ASP 2 Ca 0.00 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 56.87 1h4i h ASP 2 Cb 0.00 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1h4i h ASP 2 CO 0.00 0.68 0.04 0.11 -1.72 0.00 0.00 179.24 178.35 1h4i h LYS 3 N 0.42 0.52 -0.69 3.56 1.57 -1.99 -1.93 116.57 118.03 1h4i h LYS 3 Ca 0.07 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 1h4i h LYS 3 Cb 0.61 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.83 1h4i h LYS 3 CO 0.04 0.63 0.33 -0.07 -0.57 0.00 0.00 179.45 179.81 1h4i h LEU 4 N 0.34 0.90 -0.46 2.94 3.38 -1.91 0.62 115.31 121.13 1h4i h LEU 4 Ca 0.09 -0.14 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1h4i h LEU 4 Cb 0.37 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 1h4i h LEU 4 CO 0.01 0.79 0.19 0.58 0.09 0.00 0.00 178.44 180.09 1h4i h VAL 5 N 0.96 0.90 -0.15 1.22 2.07 -1.09 0.19 116.25 120.35 1h4i h VAL 5 Ca 0.24 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 1h4i h VAL 5 Cb 0.12 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1h4i h VAL 5 CO -0.03 0.07 0.03 -0.33 0.02 0.00 0.00 177.57 177.33 1h4i h GLU 6 N 0.38 0.24 -0.96 1.57 4.39 -0.86 -2.92 114.58 116.42 1h4i h GLU 6 Ca 0.21 -0.06 0.10 0.00 0.34 0.00 0.00 59.36 59.94 1h4i h GLU 6 Cb 0.18 -0.03 -0.08 0.00 -0.10 0.00 0.00 28.75 28.72 1h4i h GLU 6 CO -0.19 0.41 0.60 -0.07 -1.16 0.00 0.00 179.01 178.60 1h4i h LEU 7 N 0.03 0.91 -0.01 1.33 3.38 -0.41 -0.72 115.31 119.82 1h4i h LEU 7 Ca 0.05 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1h4i h LEU 7 Cb 0.28 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1h4i h LEU 7 CO 0.00 0.53 0.00 -1.54 0.09 0.00 0.00 178.44 177.52 1h4i n SER 8 N -4.61 0.00 -0.61 -0.43 3.41 0.64 -1.26 113.62 110.76 1h4i n SER 8 Ca 0.16 0.50 0.13 0.00 -0.26 0.00 0.00 58.87 59.41 1h4i n SER 8 Cb 0.28 -0.50 0.35 0.00 -0.26 0.00 0.00 64.21 64.08 1h4i n SER 8 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1h4i n LYS 9 N -1.50 1.78 -3.44 4.33 0.00 -0.28 -4.83 118.16 114.21 1h4i n LYS 9 Ca 0.02 -1.23 -0.37 0.00 0.00 0.00 0.00 58.31 56.72 1h4i n LYS 9 Cb 0.07 -1.47 -0.06 0.00 0.00 0.00 0.00 35.03 33.57 1h4i n LYS 9 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1h4i s SER 10 N -2.07 6.60 0.00 3.14 0.15 -0.39 -4.94 113.70 116.19 1h4i s SER 10 Ca 0.33 0.72 0.24 0.00 0.70 0.00 0.00 55.95 57.93 1h4i s SER 10 Cb 0.20 -2.24 1.22 0.00 -1.71 0.00 0.00 66.02 63.50 1h4i s SER 10 CO 0.35 0.11 1.80 0.47 1.20 0.00 0.00 173.24 177.17 1h4i n ASP 11 N 3.27 0.00 -0.00 5.45 10.43 -1.26 -2.61 116.55 131.83 1h4i n ASP 11 Ca -0.10 -0.07 0.13 0.00 2.57 0.00 0.00 54.79 57.31 1h4i n ASP 11 Cb 0.52 -0.28 0.47 0.00 1.84 0.00 0.00 41.12 43.67 1h4i n ASP 11 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 1h4i n ASP 12 N -1.28 0.22 -4.45 -2.24 9.92 -1.26 -1.23 116.55 116.22 1h4i n ASP 12 Ca 0.12 0.16 -0.23 0.00 -0.53 0.00 0.00 54.79 54.31 1h4i n ASP 12 Cb 0.19 -0.18 -0.10 0.00 -0.64 0.00 0.00 41.12 40.39 1h4i n ASP 12 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 1h4i s ASN 13 N -2.99 3.11 -0.39 -2.24 0.01 -1.07 -4.58 114.94 106.79 1h4i s ASN 13 Ca 0.13 -1.15 0.04 0.00 -0.71 0.00 0.00 52.86 51.17 1h4i s ASN 13 Cb 0.18 -0.23 0.16 0.00 0.41 0.00 0.00 41.25 41.77 1h4i s ASN 13 CO 0.60 -0.23 0.41 0.86 -1.51 0.00 0.00 177.10 177.23 1h4i s TRP 14 N -2.83 -0.20 -1.34 2.20 -0.11 0.00 -4.87 118.94 111.80 1h4i s TRP 14 Ca 0.29 -1.07 0.27 0.00 1.22 0.00 0.00 56.10 56.82 1h4i s TRP 14 Cb 0.02 -0.42 0.88 0.00 -1.50 0.00 0.00 33.47 32.45 1h4i s TRP 14 CO 0.13 -0.98 1.66 1.33 -4.62 0.00 0.00 176.95 174.46 1h4i n VAL 15 N 3.85 0.00 -3.62 5.86 0.24 -1.26 -1.58 118.33 121.82 1h4i n VAL 15 Ca 0.15 -0.04 -0.10 0.00 -2.04 0.00 0.00 64.34 62.31 1h4i n VAL 15 Cb 0.47 0.06 -0.02 0.00 -1.47 0.00 0.00 33.84 32.87 1h4i n VAL 15 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1h4i s MET 16 N -2.75 1.48 0.18 7.34 -1.94 -1.26 -4.00 119.30 118.35 1h4i s MET 16 Ca 0.19 -0.71 -0.33 0.00 -1.71 0.00 0.00 55.69 53.13 1h4i s MET 16 Cb 0.19 0.59 -0.13 0.00 2.01 0.00 0.00 34.83 37.49 1h4i s MET 16 CO 0.57 -0.66 1.67 -2.30 -0.01 0.00 0.00 175.02 174.30 1h4i n PRO 17 N -0.40 2.50 -0.48 2.03 -0.02 -1.26 -1.69 135.00 135.68 1h4i n PRO 17 Ca -0.11 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1h4i n PRO 17 Cb 0.62 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 1h4i n PRO 17 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h4i n GLY 18 N 3.76 0.92 3.05 -1.23 0.00 -1.26 -4.58 105.19 105.85 1h4i n GLY 18 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1h4i n GLY 18 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1h4i n LYS 19 N -2.00 0.00 -4.41 1.61 0.00 -0.68 -2.67 118.16 110.01 1h4i n LYS 19 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 58.31 58.08 1h4i n LYS 19 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 34.95 1h4i n LYS 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1h4i s ASN 20 N 0.00 2.35 0.42 3.14 2.20 -1.26 -4.17 114.94 117.62 1h4i s ASN 20 Ca 0.00 -1.75 0.20 0.00 -0.94 0.00 0.00 52.86 50.37 1h4i s ASN 20 Cb 0.00 0.58 0.95 0.00 -2.00 0.00 0.00 41.25 40.78 1h4i s ASN 20 CO 0.00 -1.03 1.87 1.88 -2.94 0.00 0.00 177.10 176.89 1h4i h TYR 21 N 1.91 0.00 0.00 1.54 0.99 -1.89 -1.93 116.97 117.60 1h4i h TYR 21 Ca -0.30 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.39 1h4i h TYR 21 Cb 1.26 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.98 1h4i h TYR 21 CO 1.72 0.28 -0.23 -0.44 -0.00 0.00 0.00 178.16 179.49 1h4i h ASP 22 N 0.00 0.00 -3.67 3.88 3.32 -1.92 -1.88 116.42 116.15 1h4i h ASP 22 Ca -0.00 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 1h4i h ASP 22 Cb 0.64 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.27 1h4i h ASP 22 CO 0.04 0.23 -0.37 -1.20 -1.72 0.00 0.00 179.24 176.21 1h4i n SER 23 N -3.83 -4.01 -0.12 6.45 7.64 -0.73 -1.25 113.62 117.78 1h4i n SER 23 Ca -0.02 -0.30 -0.12 0.00 1.01 0.00 0.00 58.87 59.45 1h4i n SER 23 Cb 0.32 -2.96 -0.02 0.00 -1.01 0.00 0.00 64.21 60.54 1h4i n SER 23 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1h4i h ASN 24 N -1.40 0.77 -5.36 6.43 2.35 -1.79 -3.44 115.58 113.15 1h4i h ASN 24 Ca -0.31 -0.40 -0.42 0.00 -0.55 0.00 0.00 56.30 54.63 1h4i h ASN 24 Cb 1.20 -0.21 0.04 0.00 0.05 0.00 0.00 38.32 39.40 1h4i h ASN 24 CO 0.30 1.00 -0.65 0.59 -1.65 0.00 0.00 177.43 177.01 1h4i n ASN 25 N -4.31 -5.60 -4.27 5.81 4.13 -1.09 -1.20 115.26 108.73 1h4i n ASN 25 Ca -0.02 -0.47 -0.32 0.00 1.68 0.00 0.00 54.58 55.45 1h4i n ASN 25 Cb 0.40 -4.49 -0.16 0.00 -1.54 0.00 0.00 39.78 33.98 1h4i n ASN 25 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1h4i s PHE 26 N -3.21 2.49 -0.02 3.10 5.36 -1.26 -1.18 117.98 123.27 1h4i s PHE 26 Ca 0.47 -0.77 0.06 0.00 -0.96 0.00 0.00 56.93 55.73 1h4i s PHE 26 Cb -0.22 -1.64 -0.02 0.00 -0.34 0.00 0.00 43.02 40.80 1h4i s PHE 26 CO 0.58 -0.25 -0.21 0.45 -1.46 0.00 0.00 175.22 174.33 1h4i s SER 27 N -0.05 3.50 0.05 6.13 0.15 -0.08 -4.99 113.70 118.40 1h4i s SER 27 Ca -0.07 -0.38 0.26 0.00 0.70 0.00 0.00 55.95 56.47 1h4i s SER 27 Cb -0.15 -0.55 0.76 0.00 -1.71 0.00 0.00 66.02 64.38 1h4i s SER 27 CO 0.05 0.32 1.62 0.47 1.20 0.00 0.00 173.24 176.89 1h4i n ASP 28 N 2.22 0.40 -4.75 5.45 8.00 -1.26 -0.32 116.55 126.29 1h4i n ASP 28 Ca -0.16 0.17 -0.42 0.00 0.71 0.00 0.00 54.79 55.09 1h4i n ASP 28 Cb 0.52 -0.14 -0.02 0.00 -0.02 0.00 0.00 41.12 41.46 1h4i n ASP 28 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1h4i n LEU 29 N -1.70 4.39 -0.88 0.64 4.77 -1.26 -4.45 117.00 118.51 1h4i n LEU 29 Ca 0.06 1.15 0.04 0.00 -0.03 0.00 0.00 56.01 57.22 1h4i n LEU 29 Cb 0.37 -1.60 0.05 0.00 -2.33 0.00 0.00 43.42 39.91 1h4i n LEU 29 CO 0.32 0.17 0.22 2.29 -1.33 0.00 0.00 177.39 179.06 1h4i n LYS 30 N 2.15 0.37 -0.08 3.23 2.85 -1.26 -3.56 118.16 121.86 1h4i n LYS 30 Ca 0.08 -1.92 -0.10 0.00 -1.05 0.00 0.00 58.31 55.33 1h4i n LYS 30 Cb 0.37 -0.56 -0.03 0.00 -0.65 0.00 0.00 35.03 34.16 1h4i n LYS 30 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 177.40 177.72 1h4i h GLN 31 N 0.56 0.37 -5.25 -1.58 4.15 -1.97 -3.36 115.11 108.03 1h4i h GLN 31 Ca -0.10 -0.05 -0.64 0.00 0.77 0.00 0.00 58.65 58.63 1h4i h GLN 31 Cb 1.51 -0.07 -0.15 0.00 0.21 0.00 0.00 27.48 28.98 1h4i h GLN 31 CO 0.04 0.36 -0.05 0.42 -1.93 0.00 0.00 178.83 177.68 1h4i s ILE 32 N -5.73 5.02 0.32 2.39 1.01 -1.26 -4.95 121.20 118.00 1h4i s ILE 32 Ca -0.13 0.39 0.04 0.00 0.00 0.00 0.00 60.65 60.95 1h4i s ILE 32 Cb 0.08 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 1h4i s ILE 32 CO 0.71 -0.19 0.19 0.54 0.00 0.00 0.00 174.94 176.20 1h4i s ASN 33 N 1.74 1.70 0.66 3.58 2.20 -1.26 -4.44 114.94 119.12 1h4i s ASN 33 Ca 0.19 -1.63 0.41 0.00 -0.94 0.00 0.00 52.86 50.88 1h4i s ASN 33 Cb -0.15 0.46 2.24 0.00 -2.00 0.00 0.00 41.25 41.80 1h4i s ASN 33 CO 0.13 -0.95 2.29 0.07 -2.94 0.00 0.00 177.10 175.70 1h4i h LYS 34 N 2.14 0.00 0.00 3.55 2.10 -1.39 -1.06 116.57 121.91 1h4i h LYS 34 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 1h4i h LYS 34 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 1h4i h LYS 34 CO 0.48 0.00 0.00 0.78 -2.00 0.00 0.00 179.45 178.71 1h4i h GLY 35 N 0.00 0.00 -0.04 0.07 0.00 -1.96 -3.36 103.07 97.78 1h4i h GLY 35 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h4i h GLY 35 CO -0.00 0.00 -0.02 1.16 0.00 0.00 0.00 176.54 177.68 1h4i n ASN 36 N -2.42 0.47 -0.08 0.19 0.23 -0.50 -4.84 115.26 108.32 1h4i n ASN 36 Ca 0.05 -1.28 0.10 0.00 -0.53 0.00 0.00 54.58 52.92 1h4i n ASN 36 Cb 0.43 -0.01 0.48 0.00 -2.08 0.00 0.00 39.78 38.59 1h4i n ASN 36 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1h4i h VAL 37 N 2.46 0.94 0.00 3.53 2.07 -1.47 -1.04 116.25 122.74 1h4i h VAL 37 Ca 0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 1h4i h VAL 37 Cb 0.91 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1h4i h VAL 37 CO 0.00 0.08 0.32 0.11 0.02 0.00 0.00 177.57 178.10 1h4i h LYS 38 N 0.46 0.00 -0.14 1.57 6.56 -1.87 0.95 116.57 124.10 1h4i h LYS 38 Ca 0.26 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.85 1h4i h LYS 38 Cb 0.42 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.08 1h4i h LYS 38 CO -0.07 0.00 0.00 1.04 -2.06 0.00 0.00 179.45 178.36 1h4i n GLN 39 N -2.88 1.78 -2.11 3.15 6.02 -0.39 -4.92 117.38 118.02 1h4i n GLN 39 Ca -0.02 -1.17 -0.42 0.00 -0.01 0.00 0.00 57.00 55.38 1h4i n GLN 39 Cb 0.36 -1.43 -0.03 0.00 1.02 0.00 0.00 30.24 30.17 1h4i n GLN 39 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1h4i s LEU 40 N -1.68 4.34 0.05 1.08 1.43 0.33 -0.44 118.68 123.78 1h4i s LEU 40 Ca 0.34 2.29 -0.06 0.00 -1.03 0.00 0.00 54.13 55.67 1h4i s LEU 40 Cb 0.19 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.83 1h4i s LEU 40 CO 0.29 -0.76 0.11 -0.13 0.23 0.00 0.00 176.35 176.08 1h4i s ARG 41 N 2.14 0.64 0.40 1.70 3.00 -0.55 -4.89 118.95 121.39 1h4i s ARG 41 Ca 0.67 -0.81 -0.27 0.00 0.00 0.00 0.00 55.73 55.32 1h4i s ARG 41 Cb -0.36 0.25 -0.10 0.00 0.00 0.00 0.00 34.95 34.75 1h4i s ARG 41 CO 0.29 -0.17 1.43 -2.14 0.00 0.00 0.00 175.30 174.72 1h4i s PRO 42 N -2.89 3.96 -0.16 3.54 0.02 -1.26 -1.57 135.00 136.64 1h4i s PRO 42 Ca -0.03 2.45 0.13 0.00 0.02 0.00 0.00 61.00 63.57 1h4i s PRO 42 Cb 0.01 -2.84 -0.19 0.00 0.02 0.00 0.00 34.50 31.49 1h4i s PRO 42 CO -0.06 -0.60 0.04 0.00 -0.33 0.00 0.00 177.00 176.05 1h4i n ALA 43 N 0.22 1.61 -3.58 -1.55 0.00 0.17 -4.43 120.51 112.95 1h4i n ALA 43 Ca 0.03 -1.01 -0.05 0.00 0.00 0.00 0.00 53.44 52.40 1h4i n ALA 43 Cb 0.41 -0.07 -0.02 0.00 0.00 0.00 0.00 19.45 19.77 1h4i n ALA 43 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 1h4i s TRP 44 N -2.38 -0.18 0.16 0.00 1.48 -1.19 -4.77 118.94 112.07 1h4i s TRP 44 Ca -0.09 0.09 -0.01 0.00 -1.06 0.00 0.00 56.10 55.03 1h4i s TRP 44 Cb 0.05 0.53 -0.04 0.00 -1.16 0.00 0.00 33.47 32.84 1h4i s TRP 44 CO 0.62 -0.32 0.08 0.95 -4.06 0.00 0.00 176.95 174.23 1h4i s THR 45 N -2.63 0.10 -0.23 0.66 -4.23 -1.26 -1.58 115.64 106.46 1h4i s THR 45 Ca 0.09 -1.95 -0.10 0.00 -1.18 0.00 0.00 61.69 58.54 1h4i s THR 45 Cb -0.01 -2.24 0.09 0.00 1.34 0.00 0.00 72.50 71.68 1h4i s THR 45 CO -0.05 -0.27 0.53 0.12 -0.54 0.00 0.00 174.62 174.40 1h4i s PHE 46 N -4.06 -0.93 -0.01 3.99 5.36 -0.61 -4.99 117.98 116.72 1h4i s PHE 46 Ca 0.30 1.79 -0.15 0.00 -0.96 0.00 0.00 56.93 57.91 1h4i s PHE 46 Cb 0.07 0.48 -0.06 0.00 -0.34 0.00 0.00 43.02 43.18 1h4i s PHE 46 CO 0.06 -0.50 0.42 0.45 -1.46 0.00 0.00 175.22 174.19 1h4i s SER 47 N 2.16 6.80 0.37 6.13 0.15 -1.26 -0.47 113.70 127.57 1h4i s SER 47 Ca -0.06 0.95 0.24 0.00 0.70 0.00 0.00 55.95 57.77 1h4i s SER 47 Cb -0.10 -2.26 0.43 0.00 -1.71 0.00 0.00 66.02 62.39 1h4i s SER 47 CO -0.16 0.29 1.61 0.71 1.20 0.00 0.00 173.24 176.90 1h4i h THR 48 N 3.80 0.00 0.00 6.45 1.35 -1.71 -3.48 112.91 119.32 1h4i h THR 48 Ca -0.50 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 64.49 1h4i h THR 48 Cb 1.21 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.46 1h4i h THR 48 CO 0.63 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.51 1h4i n GLY 49 N 1.16 0.57 3.22 5.82 0.00 -1.26 -5.03 105.19 109.66 1h4i n GLY 49 Ca 0.04 -0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 1h4i n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h4i s LEU 50 N 0.00 2.46 0.00 0.99 1.43 -1.26 -5.13 118.68 117.17 1h4i s LEU 50 Ca 0.00 -0.90 0.00 0.00 -1.03 0.00 0.00 54.13 52.20 1h4i s LEU 50 Cb 0.00 -0.34 0.00 0.00 0.03 0.00 0.00 46.19 45.88 1h4i s LEU 50 CO 0.00 -0.28 0.00 0.18 0.23 0.00 0.00 176.35 176.48 1h4i n LEU 51 N 0.21 0.00 -0.78 1.79 4.77 -1.26 -3.82 117.00 117.91 1h4i n LEU 51 Ca -0.13 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 55.94 1h4i n LEU 51 Cb 0.59 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.63 1h4i n LEU 51 CO 0.29 0.00 -0.31 0.59 -1.33 0.00 0.00 177.39 176.64 1h4i n ASN 52 N 0.00 -4.39 -4.72 -1.43 3.02 -1.26 -4.72 115.26 101.76 1h4i n ASN 52 Ca 0.00 0.69 -0.43 0.00 -0.03 0.00 0.00 54.58 54.82 1h4i n ASN 52 Cb 0.00 -2.61 -0.02 0.00 -0.61 0.00 0.00 39.78 36.54 1h4i n ASN 52 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h4i n GLY 53 N -3.35 1.30 3.14 7.41 0.00 -1.19 -4.60 105.19 107.91 1h4i n GLY 53 Ca -0.04 0.53 -0.38 0.00 0.00 0.00 0.00 46.02 46.12 1h4i n GLY 53 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1h4i s HIS 54 N 0.38 3.53 0.65 1.61 3.76 -0.54 -4.30 115.29 120.39 1h4i s HIS 54 Ca 0.69 -2.63 -0.02 0.00 -0.15 0.00 0.00 55.06 52.95 1h4i s HIS 54 Cb -0.53 -3.32 0.07 0.00 1.11 0.00 0.00 32.58 29.91 1h4i s HIS 54 CO 0.43 -0.85 0.92 -1.21 -0.85 0.00 0.00 174.74 173.18 1h4i s GLU 55 N -0.22 2.12 2.93 1.40 2.02 -1.25 -3.82 118.70 121.88 1h4i s GLU 55 Ca 0.19 -0.75 0.00 0.00 0.02 0.00 0.00 54.97 54.43 1h4i s GLU 55 Cb -0.17 -2.34 0.00 0.00 0.10 0.00 0.00 34.13 31.72 1h4i s GLU 55 CO -0.05 -1.13 0.00 0.41 0.02 0.00 0.00 175.26 174.51 1h4i n GLY 56 N -2.68 -0.40 3.45 -1.39 0.00 -1.25 -4.60 105.19 98.31 1h4i n GLY 56 Ca 0.10 -1.08 -0.11 0.00 0.00 0.00 0.00 46.02 44.93 1h4i n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4i s ALA 57 N -1.16 -1.43 0.68 4.61 0.00 -1.26 -2.40 121.76 120.81 1h4i s ALA 57 Ca 0.00 0.30 -0.11 0.00 0.00 0.00 0.00 51.96 52.15 1h4i s ALA 57 Cb 0.00 0.86 -0.00 0.00 0.00 0.00 0.00 23.12 23.97 1h4i s ALA 57 CO 0.00 -0.78 1.06 -1.25 0.00 0.00 0.00 175.76 174.80 1h4i s PRO 58 N -3.78 3.07 -0.00 0.00 0.04 -1.26 -4.67 135.00 128.39 1h4i s PRO 58 Ca 0.03 0.73 0.00 0.00 0.04 0.00 0.00 61.00 61.80 1h4i s PRO 58 Cb -0.01 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1h4i s PRO 58 CO -0.11 -0.95 0.04 -0.51 0.04 0.00 0.00 177.00 175.52 1h4i s LEU 59 N -5.39 3.70 -0.16 -3.56 1.43 -0.95 -4.95 118.68 108.80 1h4i s LEU 59 Ca 0.57 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.74 1h4i s LEU 59 Cb -0.12 -2.13 0.03 0.00 0.03 0.00 0.00 46.19 43.99 1h4i s LEU 59 CO 0.54 0.28 -0.13 -0.69 0.23 0.00 0.00 176.35 176.58 1h4i s VAL 60 N -1.13 1.55 -0.13 -1.59 1.01 -0.61 -0.26 120.40 119.24 1h4i s VAL 60 Ca 0.21 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.43 1h4i s VAL 60 Cb -0.12 -1.50 0.06 0.00 0.00 0.00 0.00 36.38 34.81 1h4i s VAL 60 CO 0.12 0.39 0.29 -0.69 0.00 0.00 0.00 175.10 175.20 1h4i s VAL 61 N 1.48 -0.16 -1.20 2.92 1.01 -0.36 -0.82 120.40 123.28 1h4i s VAL 61 Ca 0.04 0.17 -0.06 0.00 0.00 0.00 0.00 61.98 62.13 1h4i s VAL 61 Cb -0.14 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 35.80 1h4i s VAL 61 CO -0.10 0.07 1.03 -0.67 0.00 0.00 0.00 175.10 175.43 1h4i n ASP 62 N 4.56 -4.73 -0.50 3.32 4.64 -1.26 -2.64 116.55 119.93 1h4i n ASP 62 Ca -0.20 -0.52 -0.07 0.00 -1.38 0.00 0.00 54.79 52.63 1h4i n ASP 62 Cb 0.52 -4.68 -0.03 0.00 -1.04 0.00 0.00 41.12 35.90 1h4i n ASP 62 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1h4i n GLY 63 N -1.64 0.86 3.19 0.27 0.00 -1.26 -5.02 105.19 101.60 1h4i n GLY 63 Ca -0.08 -0.46 -0.21 0.00 0.00 0.00 0.00 46.02 45.27 1h4i n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h4i s LYS 64 N -2.25 0.98 -0.09 1.61 1.02 -1.08 -1.20 119.74 118.72 1h4i s LYS 64 Ca 0.00 -0.93 0.00 0.00 0.02 0.00 0.00 55.97 55.06 1h4i s LYS 64 Cb 0.00 -1.05 -0.02 0.00 -0.52 0.00 0.00 37.83 36.23 1h4i s LYS 64 CO 0.00 0.25 -0.10 1.41 -0.92 0.00 0.00 175.35 175.99 1h4i s MET 65 N -1.52 3.01 -0.17 1.68 -2.45 0.28 -1.22 119.30 118.91 1h4i s MET 65 Ca 0.02 -0.61 -0.03 0.00 -1.25 0.00 0.00 55.69 53.82 1h4i s MET 65 Cb -0.09 -2.60 -0.02 0.00 1.25 0.00 0.00 34.83 33.37 1h4i s MET 65 CO 0.02 0.47 -0.06 0.71 1.05 0.00 0.00 175.02 177.21 1h4i s TYR 66 N -0.30 2.94 -0.04 4.11 1.51 0.64 -0.73 117.35 125.49 1h4i s TYR 66 Ca 0.03 -0.61 0.05 0.00 -1.01 0.00 0.00 57.07 55.53 1h4i s TYR 66 Cb -0.13 -1.98 -0.02 0.00 -0.11 0.00 0.00 41.96 39.72 1h4i s TYR 66 CO 0.03 -0.27 -0.18 0.42 -1.11 0.00 0.00 175.55 174.44 1h4i s ILE 67 N 0.77 2.78 0.21 2.71 1.09 0.11 -2.25 121.20 126.62 1h4i s ILE 67 Ca -0.02 -0.85 0.10 0.00 -1.10 0.00 0.00 60.65 58.77 1h4i s ILE 67 Cb -0.15 -2.06 -0.05 0.00 -1.06 0.00 0.00 42.46 39.14 1h4i s ILE 67 CO 0.02 0.57 -0.18 -1.38 -0.10 0.00 0.00 174.94 173.87 1h4i s HIS 68 N -0.71 1.98 0.22 3.97 -3.43 -1.26 -1.56 115.29 114.49 1h4i s HIS 68 Ca 0.11 -0.45 0.01 0.00 -0.80 0.00 0.00 55.06 53.94 1h4i s HIS 68 Cb -0.10 -0.92 -0.01 0.00 -1.43 0.00 0.00 32.58 30.12 1h4i s HIS 68 CO 0.00 0.47 0.05 0.25 -2.00 0.00 0.00 174.74 173.52 1h4i n THR 69 N -0.19 0.00 -1.95 -5.38 -2.24 -1.11 -4.97 114.28 98.43 1h4i n THR 69 Ca -0.09 -1.18 -0.30 0.00 -2.27 0.00 0.00 64.05 60.21 1h4i n THR 69 Cb 0.59 0.36 0.21 0.00 -2.10 0.00 0.00 70.33 69.39 1h4i n THR 69 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1h4i s SER 70 N -2.29 2.83 0.30 3.42 1.04 -1.26 -4.43 113.70 113.31 1h4i s SER 70 Ca 0.07 0.14 -0.28 0.00 0.48 0.00 0.00 55.95 56.37 1h4i s SER 70 Cb 0.00 -0.09 -0.14 0.00 0.10 0.00 0.00 66.02 65.90 1h4i s SER 70 CO 0.05 -2.90 1.02 0.33 0.98 0.00 0.00 173.24 172.71 1h4i n PHE 71 N -3.85 1.29 0.89 5.02 -0.00 0.32 -0.30 117.46 120.83 1h4i n PHE 71 Ca 0.17 0.68 0.00 0.00 -0.00 0.00 0.00 57.45 58.30 1h4i n PHE 71 Cb 0.59 -2.25 0.00 0.00 -0.00 0.00 0.00 39.48 37.82 1h4i n PHE 71 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1h4i n PRO 72 N 0.67 0.89 -3.25 -7.13 -0.04 -1.26 -4.95 135.00 119.93 1h4i n PRO 72 Ca 0.09 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.45 1h4i n PRO 72 Cb 0.33 -1.24 0.03 0.00 -0.04 0.00 0.00 33.50 32.58 1h4i n PRO 72 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1h4i n ASN 73 N 0.32 -6.92 -4.89 3.54 3.02 0.58 -4.27 115.26 106.64 1h4i n ASN 73 Ca 0.00 -0.47 -0.29 0.00 -0.03 0.00 0.00 54.58 53.79 1h4i n ASN 73 Cb 0.34 -4.83 -0.00 0.00 -0.61 0.00 0.00 39.78 34.68 1h4i n ASN 73 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1h4i s ASN 74 N -3.19 6.31 -0.03 6.41 0.01 -1.26 -4.54 114.94 118.64 1h4i s ASN 74 Ca 0.22 1.06 0.03 0.00 -0.71 0.00 0.00 52.86 53.46 1h4i s ASN 74 Cb -0.04 -2.30 0.00 0.00 0.41 0.00 0.00 41.25 39.32 1h4i s ASN 74 CO 0.77 -0.60 -0.11 -0.89 -1.51 0.00 0.00 177.10 174.76 1h4i s THR 75 N -2.76 0.93 0.05 1.60 2.01 -0.09 -2.77 115.64 114.62 1h4i s THR 75 Ca 0.50 -0.45 0.06 0.00 0.31 0.00 0.00 61.69 62.11 1h4i s THR 75 Cb -0.10 -0.82 -0.02 0.00 0.01 0.00 0.00 72.50 71.57 1h4i s THR 75 CO 0.44 0.28 -0.17 -0.36 -0.69 0.00 0.00 174.62 174.13 1h4i s PHE 76 N 0.13 1.44 -0.11 4.92 0.40 -0.60 -0.20 117.98 123.96 1h4i s PHE 76 Ca -0.03 -0.38 0.03 0.00 -0.60 0.00 0.00 56.93 55.96 1h4i s PHE 76 Cb -0.09 -0.84 0.01 0.00 0.51 0.00 0.00 43.02 42.60 1h4i s PHE 76 CO 0.01 0.07 -0.21 0.00 0.70 0.00 0.00 175.22 175.79 1h4i s ALA 77 N -0.91 2.06 -0.04 5.36 0.00 -0.68 -0.71 121.76 126.84 1h4i s ALA 77 Ca 0.03 -0.94 0.06 0.00 0.00 0.00 0.00 51.96 51.11 1h4i s ALA 77 Cb -0.09 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.16 1h4i s ALA 77 CO 0.02 0.11 -0.23 -0.51 0.00 0.00 0.00 175.76 175.15 1h4i s LEU 78 N 0.63 2.03 -0.11 0.00 1.43 0.09 -0.56 118.68 122.19 1h4i s LEU 78 Ca -0.13 -0.44 -0.28 0.00 -1.03 0.00 0.00 54.13 52.26 1h4i s LEU 78 Cb -0.16 -1.22 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 1h4i s LEU 78 CO 0.03 0.24 0.91 -0.83 0.23 0.00 0.00 176.35 176.94 1h4i s GLY 79 N -0.27 2.37 0.65 -3.19 0.00 -1.26 -0.55 107.32 105.07 1h4i s GLY 79 Ca 0.01 0.26 0.41 0.00 0.00 0.00 0.00 44.72 45.41 1h4i s GLY 79 CO 0.02 1.73 2.26 1.41 0.00 0.00 0.00 173.10 178.52 1h4i h LEU 80 N 7.83 0.00 0.00 0.66 4.07 -1.51 -1.67 115.31 124.69 1h4i h LEU 80 Ca -0.33 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.63 1h4i h LEU 80 Cb 1.16 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.90 1h4i h LEU 80 CO 0.83 0.00 -0.39 0.44 -1.08 0.00 0.00 178.44 178.23 1h4i h ASP 81 N 0.00 0.00 -0.85 -0.43 3.45 -1.93 -3.41 116.42 113.26 1h4i h ASP 81 Ca 0.00 -0.04 -0.28 0.00 0.43 0.00 0.00 57.03 57.13 1h4i h ASP 81 Cb 0.12 0.00 -0.21 0.00 -0.56 0.00 0.00 39.33 38.69 1h4i h ASP 81 CO 0.00 0.02 -0.63 -0.67 -1.57 0.00 0.00 179.24 176.39 1h4i n ASP 82 N -2.63 -2.41 0.33 6.45 2.03 -0.68 -4.84 116.55 114.80 1h4i n ASP 82 Ca 0.03 -3.00 0.20 0.00 0.52 0.00 0.00 54.79 52.54 1h4i n ASP 82 Cb 0.50 1.22 1.07 0.00 -0.72 0.00 0.00 41.12 43.19 1h4i n ASP 82 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1h4i h PRO 83 N 4.49 0.00 0.00 -0.67 0.11 -1.64 -2.03 132.00 132.26 1h4i h PRO 83 Ca -0.01 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 1h4i h PRO 83 Cb 1.02 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1h4i h PRO 83 CO 0.25 0.00 -0.08 0.78 -0.21 0.00 0.00 178.00 178.74 1h4i h GLY 84 N 0.00 0.00 -6.54 -0.55 0.00 -1.95 -3.41 103.07 90.62 1h4i h GLY 84 Ca 0.01 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.73 1h4i h GLY 84 CO -0.00 0.00 -0.18 -1.59 0.00 0.00 0.00 176.54 174.77 1h4i s THR 85 N -4.48 5.18 -0.42 4.70 2.01 -0.76 -5.03 115.64 116.84 1h4i s THR 85 Ca -0.04 0.71 -0.27 0.00 0.31 0.00 0.00 61.69 62.40 1h4i s THR 85 Cb 0.15 -3.74 0.02 0.00 0.01 0.00 0.00 72.50 68.94 1h4i s THR 85 CO 0.60 0.22 1.02 -0.63 -0.69 0.00 0.00 174.62 175.14 1h4i s ILE 86 N 1.52 4.41 0.08 1.82 1.01 -1.26 -4.19 121.20 124.59 1h4i s ILE 86 Ca 0.19 1.20 -0.28 0.00 0.00 0.00 0.00 60.65 61.75 1h4i s ILE 86 Cb -0.15 -4.46 -0.17 0.00 0.01 0.00 0.00 42.46 37.68 1h4i s ILE 86 CO 0.08 -0.76 1.66 -0.07 0.00 0.00 0.00 174.94 175.86 1h4i h LEU 87 N 10.58 -0.40 -7.38 2.97 4.07 -1.21 -3.47 115.31 120.48 1h4i h LEU 87 Ca -0.23 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.70 1h4i h LEU 87 Cb 1.07 0.10 -0.12 0.00 1.08 0.00 0.00 40.66 42.79 1h4i h LEU 87 CO 1.05 -0.28 0.02 -1.66 -1.08 0.00 0.00 178.44 176.49 1h4i s TRP 88 N -6.05 -0.26 -0.07 1.13 1.48 -1.23 -5.00 118.94 108.94 1h4i s TRP 88 Ca -0.15 -0.04 -0.07 0.00 -1.06 0.00 0.00 56.10 54.78 1h4i s TRP 88 Cb 0.04 0.36 0.02 0.00 -1.16 0.00 0.00 33.47 32.73 1h4i s TRP 88 CO 0.64 -0.79 0.19 1.14 -4.06 0.00 0.00 176.95 174.06 1h4i s GLN 89 N -3.81 0.22 -0.16 3.25 -2.07 -1.26 -1.68 119.66 114.15 1h4i s GLN 89 Ca 0.04 0.26 0.00 0.00 -1.82 0.00 0.00 55.36 53.85 1h4i s GLN 89 Cb 0.00 0.10 -0.00 0.00 -1.09 0.00 0.00 33.01 32.03 1h4i s GLN 89 CO -0.10 -0.03 -0.15 0.34 -1.32 0.00 0.00 175.29 174.04 1h4i s ASP 90 N 0.11 3.69 -0.41 12.60 2.15 0.72 -4.95 116.67 130.58 1h4i s ASP 90 Ca -0.00 -0.46 0.02 0.00 0.43 0.00 0.00 52.55 52.54 1h4i s ASP 90 Cb -0.01 -1.57 0.12 0.00 -0.30 0.00 0.00 42.92 41.16 1h4i s ASP 90 CO 0.00 0.08 0.19 -0.54 -0.17 0.00 0.00 175.17 174.73 1h4i s LYS 91 N 0.85 1.30 0.36 4.34 1.02 -1.26 -0.91 119.74 125.43 1h4i s LYS 91 Ca -0.04 -1.90 -0.28 0.00 0.02 0.00 0.00 55.97 53.77 1h4i s LYS 91 Cb -0.15 -2.53 -0.12 0.00 -0.52 0.00 0.00 37.83 34.51 1h4i s LYS 91 CO -0.01 -1.09 1.37 -2.30 -0.92 0.00 0.00 175.35 172.41 1h4i n PRO 92 N 3.83 2.36 -3.47 -1.68 -0.02 -1.26 -5.01 135.00 129.75 1h4i n PRO 92 Ca 0.05 0.83 -0.42 0.00 -2.02 0.00 0.00 63.50 61.93 1h4i n PRO 92 Cb 0.37 -2.47 -0.10 0.00 -0.02 0.00 0.00 33.50 31.27 1h4i n PRO 92 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1h4i s LYS 93 N -1.96 3.08 0.17 -0.52 1.02 -1.26 -4.94 119.74 115.33 1h4i s LYS 93 Ca 0.55 -0.94 0.09 0.00 0.02 0.00 0.00 55.97 55.69 1h4i s LYS 93 Cb -0.53 -3.94 -0.04 0.00 -0.52 0.00 0.00 37.83 32.79 1h4i s LYS 93 CO 0.63 -0.69 -0.20 -0.65 -0.92 0.00 0.00 175.35 173.52 1h4i s GLN 94 N 1.69 1.35 -0.06 1.68 -0.21 -1.26 -5.10 119.66 117.74 1h4i s GLN 94 Ca 0.05 -1.43 -0.30 0.00 0.02 0.00 0.00 55.36 53.70 1h4i s GLN 94 Cb -0.19 -1.50 -0.05 0.00 1.00 0.00 0.00 33.01 32.28 1h4i s GLN 94 CO 0.10 0.31 1.48 1.21 -2.12 0.00 0.00 175.29 176.27 1h4i s ASN 95 N -2.63 6.79 0.62 5.90 3.84 -1.26 -4.88 114.94 123.31 1h4i s ASN 95 Ca 0.17 2.07 0.32 0.00 0.21 0.00 0.00 52.86 55.63 1h4i s ASN 95 Cb -0.07 -2.54 1.78 0.00 -0.55 0.00 0.00 41.25 39.87 1h4i s ASN 95 CO 0.08 -0.82 2.10 1.55 -2.79 0.00 0.00 177.10 177.22 1h4i h PRO 96 N 8.63 0.00 -0.14 0.43 0.13 -2.04 -1.16 132.00 137.85 1h4i h PRO 96 Ca -0.36 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.81 1h4i h PRO 96 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1h4i h PRO 96 CO 0.94 0.00 0.13 0.00 -0.23 0.00 0.00 178.00 178.84 1h4i h ALA 97 N 1.71 1.85 -0.85 -0.56 0.00 -2.03 -1.43 119.26 117.95 1h4i h ALA 97 Ca 0.06 -0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.18 1h4i h ALA 97 Cb 0.47 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 1h4i h ALA 97 CO -0.00 -0.20 0.58 0.00 0.00 0.00 0.00 179.25 179.63 1h4i h ALA 98 N 1.87 2.49 -0.63 0.00 0.00 -1.59 -1.23 119.26 120.17 1h4i h ALA 98 Ca 0.07 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1h4i h ALA 98 Cb 0.33 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1h4i h ALA 98 CO -0.00 -0.75 0.25 0.00 0.00 0.00 0.00 179.25 178.75 1h4i h ARG 99 N 0.19 0.93 0.00 0.00 3.08 -1.48 -2.90 114.38 114.20 1h4i h ARG 99 Ca 0.42 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.32 1h4i h ARG 99 Cb 1.35 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 31.24 1h4i h ARG 99 CO -0.09 0.76 -0.00 0.00 -1.07 0.00 0.00 179.97 179.58 1h4i h ALA 100 N 1.36 1.00 -0.51 0.04 0.00 -1.39 -3.04 119.26 116.72 1h4i h ALA 100 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1h4i h ALA 100 Cb 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1h4i h ALA 100 CO -0.02 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.56 1h4i n VAL 101 N -3.09 1.05 -3.10 0.00 0.24 -1.10 -4.90 118.33 107.42 1h4i n VAL 101 Ca -0.01 -1.02 -0.40 0.00 -2.04 0.00 0.00 64.34 60.87 1h4i n VAL 101 Cb 0.21 0.48 -0.06 0.00 -1.47 0.00 0.00 33.84 33.00 1h4i n VAL 101 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1h4i s ALA 102 N -1.05 3.60 0.26 2.33 0.00 -1.15 -4.87 121.76 120.87 1h4i s ALA 102 Ca 0.34 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.93 1h4i s ALA 102 Cb 0.18 -3.03 0.36 0.00 0.00 0.00 0.00 23.12 20.63 1h4i s ALA 102 CO 0.23 -0.75 1.70 0.00 0.00 0.00 0.00 175.76 176.95 1h4i s ASP 105 N 0.27 3.70 -0.74 0.00 2.15 -1.26 -4.94 116.67 115.86 1h4i s ASP 105 Ca 0.00 0.08 -0.05 0.00 0.43 0.00 0.00 52.55 53.01 1h4i s ASP 105 Cb 0.00 -0.29 0.06 0.00 -0.30 0.00 0.00 42.92 42.38 1h4i s ASP 105 CO 0.00 -2.33 2.71 0.18 -0.17 0.00 0.00 175.17 175.56 1h4i n LEU 106 N -3.38 6.97 -4.92 -1.34 4.77 -1.26 -4.94 117.00 112.90 1h4i n LEU 106 Ca 0.14 -4.29 -0.26 0.00 -0.03 0.00 0.00 56.01 51.57 1h4i n LEU 106 Cb 0.60 -1.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.40 1h4i n LEU 106 CO 0.45 1.85 0.41 0.54 -1.33 0.00 0.00 177.39 179.31 1h4i s VAL 107 N -1.57 4.63 -0.16 4.08 0.11 -1.26 -0.52 120.40 125.70 1h4i s VAL 107 Ca 0.58 0.00 -0.10 0.00 -2.93 0.00 0.00 61.98 59.54 1h4i s VAL 107 Cb 0.31 -3.75 0.05 0.00 -1.53 0.00 0.00 36.38 31.46 1h4i s VAL 107 CO -0.16 -0.69 0.40 0.21 -3.33 0.00 0.00 175.10 171.52 1h4i s ASN 108 N -4.14 -0.48 0.00 3.54 3.84 -1.26 -4.61 114.94 111.83 1h4i s ASN 108 Ca 0.48 0.85 0.28 0.00 0.21 0.00 0.00 52.86 54.68 1h4i s ASN 108 Cb -0.10 0.76 1.14 0.00 -0.55 0.00 0.00 41.25 42.50 1h4i s ASN 108 CO 0.43 -0.18 1.84 0.54 -2.79 0.00 0.00 177.10 176.94 1h4i n ARG 109 N 3.96 0.24 0.00 0.43 1.74 0.74 -3.90 116.66 119.87 1h4i n ARG 109 Ca -0.21 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 1h4i n ARG 109 Cb 0.55 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.50 1h4i n ARG 109 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h4i n GLY 110 N 1.41 2.01 3.91 -0.13 0.00 -1.26 -3.88 105.19 107.25 1h4i n GLY 110 Ca 0.10 -1.66 -0.20 0.00 0.00 0.00 0.00 46.02 44.26 1h4i n GLY 110 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h4i s LEU 111 N 0.00 3.77 0.13 0.99 1.43 -1.26 -4.07 118.68 119.66 1h4i s LEU 111 Ca 0.00 -0.36 0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1h4i s LEU 111 Cb 0.00 -2.44 -0.04 0.00 0.03 0.00 0.00 46.19 43.74 1h4i s LEU 111 CO 0.00 -0.36 -0.08 0.00 0.23 0.00 0.00 176.35 176.14 1h4i s ALA 112 N -2.24 1.25 -0.02 4.21 0.00 -0.82 -4.33 121.76 119.82 1h4i s ALA 112 Ca 0.42 -1.44 0.03 0.00 0.00 0.00 0.00 51.96 50.97 1h4i s ALA 112 Cb -0.07 0.13 -0.00 0.00 0.00 0.00 0.00 23.12 23.17 1h4i s ALA 112 CO 0.28 -0.17 -0.10 -0.47 0.00 0.00 0.00 175.76 175.30 1h4i s TYR 113 N -3.47 0.97 -0.15 0.00 6.14 -1.26 -0.57 117.35 119.01 1h4i s TYR 113 Ca 0.15 -0.21 0.01 0.00 0.64 0.00 0.00 57.07 57.66 1h4i s TYR 113 Cb 0.04 -0.65 0.02 0.00 0.42 0.00 0.00 41.96 41.78 1h4i s TYR 113 CO -0.01 -0.06 -0.19 -0.46 0.64 0.00 0.00 175.55 175.47 1h4i s TRP 114 N -0.05 2.52 0.12 4.97 -0.00 -0.51 -4.86 118.94 121.13 1h4i s TRP 114 Ca 0.01 -1.38 0.25 0.00 -0.00 0.00 0.00 56.10 54.98 1h4i s TRP 114 Cb -0.06 -1.76 1.37 0.00 -0.00 0.00 0.00 33.47 33.02 1h4i s TRP 114 CO 0.00 -0.68 1.75 -1.35 -0.00 0.00 0.00 176.95 176.66 1h4i h PRO 115 N 7.72 0.00 0.00 5.86 0.11 -1.92 0.14 132.00 143.91 1h4i h PRO 115 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1h4i h PRO 115 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1h4i h PRO 115 CO 0.57 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.77 1h4i n GLY 116 N -1.24 -1.37 0.00 -0.55 0.00 -1.26 -4.10 105.19 96.67 1h4i n GLY 116 Ca -0.02 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1h4i n GLY 116 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1h4i n ASP 117 N -1.59 0.00 -0.06 1.61 3.85 -1.03 -4.91 116.55 114.42 1h4i n ASP 117 Ca 0.00 0.00 -0.13 0.00 -0.71 0.00 0.00 54.79 53.95 1h4i n ASP 117 Cb 0.00 0.00 -0.04 0.00 -1.35 0.00 0.00 41.12 39.73 1h4i n ASP 117 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1h4i n GLY 118 N 5.00 -0.21 0.14 6.12 0.00 -1.26 -4.82 105.19 110.16 1h4i n GLY 118 Ca 0.00 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 1h4i n GLY 118 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1h4i h LYS 119 N -0.45 0.41 -5.96 1.61 2.10 -2.04 -3.45 116.57 108.78 1h4i h LYS 119 Ca -0.29 -0.69 -0.57 0.00 -2.00 0.00 0.00 60.65 57.09 1h4i h LYS 119 Cb 1.20 0.26 -0.06 0.00 -0.90 0.00 0.00 32.23 32.73 1h4i h LYS 119 CO -0.18 1.33 -0.05 0.99 -2.00 0.00 0.00 179.45 179.55 1h4i s THR 120 N -2.54 5.03 0.83 0.07 2.01 -1.26 -5.07 115.64 114.70 1h4i s THR 120 Ca -0.14 1.16 -0.12 0.00 0.31 0.00 0.00 61.69 62.90 1h4i s THR 120 Cb 0.04 -3.90 0.09 0.00 0.01 0.00 0.00 72.50 68.74 1h4i s THR 120 CO 0.87 0.37 1.11 -2.16 -0.69 0.00 0.00 174.62 174.12 1h4i s PRO 121 N 0.18 1.84 0.56 4.92 0.04 -1.26 -2.46 135.00 138.81 1h4i s PRO 121 Ca 0.30 0.50 -0.20 0.00 0.04 0.00 0.00 61.00 61.64 1h4i s PRO 121 Cb -0.17 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.41 1h4i s PRO 121 CO 0.15 -1.76 1.02 0.00 0.04 0.00 0.00 177.00 176.45 1h4i n ALA 122 N -3.50 0.34 -2.70 8.56 0.00 -1.26 -4.36 120.51 117.59 1h4i n ALA 122 Ca 0.07 0.07 -0.18 0.00 0.00 0.00 0.00 53.44 53.39 1h4i n ALA 122 Cb 0.57 -2.13 -0.12 0.00 0.00 0.00 0.00 19.45 17.77 1h4i n ALA 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1h4i s LEU 123 N -1.82 2.25 -0.19 0.00 1.43 0.48 -2.16 118.68 118.66 1h4i s LEU 123 Ca 0.72 -0.57 -0.06 0.00 -1.03 0.00 0.00 54.13 53.20 1h4i s LEU 123 Cb -0.45 -0.51 -0.03 0.00 0.03 0.00 0.00 46.19 45.24 1h4i s LEU 123 CO 0.50 -0.06 0.02 -0.63 0.23 0.00 0.00 176.35 176.41 1h4i s ILE 124 N -1.17 4.20 -0.08 -0.59 -1.09 0.72 -1.43 121.20 121.77 1h4i s ILE 124 Ca -0.02 -0.23 0.01 0.00 -2.23 0.00 0.00 60.65 58.18 1h4i s ILE 124 Cb -0.09 -2.90 -0.03 0.00 -1.58 0.00 0.00 42.46 37.86 1h4i s ILE 124 CO 0.02 0.43 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.33 1h4i s LEU 125 N 0.81 3.10 -0.03 2.97 1.43 0.27 -0.49 118.68 126.75 1h4i s LEU 125 Ca 0.01 -0.06 -0.09 0.00 -1.03 0.00 0.00 54.13 52.96 1h4i s LEU 125 Cb -0.14 -1.68 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1h4i s LEU 125 CO 0.02 0.34 0.20 -1.59 0.23 0.00 0.00 176.35 175.55 1h4i s LYS 126 N -0.65 0.47 0.17 1.70 -2.85 -0.59 -1.94 119.74 116.05 1h4i s LYS 126 Ca 0.10 -0.15 0.04 0.00 -1.00 0.00 0.00 55.97 54.95 1h4i s LYS 126 Cb -0.11 0.20 -0.04 0.00 -2.06 0.00 0.00 37.83 35.82 1h4i s LYS 126 CO 0.02 -0.11 0.25 0.95 0.10 0.00 0.00 175.35 176.55 1h4i s THR 127 N -0.96 5.04 0.10 3.79 -4.23 -1.26 -0.96 115.64 117.17 1h4i s THR 127 Ca -0.10 -0.86 0.08 0.00 -1.18 0.00 0.00 61.69 59.63 1h4i s THR 127 Cb -0.05 -3.61 -0.03 0.00 1.34 0.00 0.00 72.50 70.14 1h4i s THR 127 CO 0.02 -0.13 -0.21 -1.10 -0.54 0.00 0.00 174.62 172.65 1h4i s GLN 128 N -3.30 1.15 0.47 3.99 -0.21 -0.67 -4.98 119.66 116.11 1h4i s GLN 128 Ca 0.33 -1.16 0.14 0.00 0.02 0.00 0.00 55.36 54.68 1h4i s GLN 128 Cb -0.10 -1.43 1.11 0.00 1.00 0.00 0.00 33.01 33.58 1h4i s GLN 128 CO 0.27 0.33 2.08 1.25 -2.12 0.00 0.00 175.29 177.10 1h4i h LEU 129 N 4.10 0.22 0.00 2.90 7.12 -1.88 -0.38 115.31 127.39 1h4i h LEU 129 Ca -0.46 -0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.54 1h4i h LEU 129 Cb 1.18 -0.05 0.00 0.00 -0.53 0.00 0.00 40.66 41.26 1h4i h LEU 129 CO 0.40 0.15 0.00 -0.90 -0.13 0.00 0.00 178.44 177.96 1h4i n ASP 130 N -4.49 0.00 0.00 1.25 3.85 -1.26 -3.00 116.55 112.90 1h4i n ASP 130 Ca 0.02 -0.75 0.00 0.00 -0.71 0.00 0.00 54.79 53.36 1h4i n ASP 130 Cb 0.18 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.95 1h4i n ASP 130 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1h4i n GLY 131 N 0.20 0.64 3.89 6.12 0.00 -0.15 -4.51 105.19 111.39 1h4i n GLY 131 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1h4i n GLY 131 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h4i s ASN 132 N -2.89 6.47 -0.03 1.61 0.01 -1.25 -0.25 114.94 118.61 1h4i s ASN 132 Ca 0.00 0.90 0.07 0.00 -0.71 0.00 0.00 52.86 53.12 1h4i s ASN 132 Cb 0.00 -2.22 -0.01 0.00 0.41 0.00 0.00 41.25 39.42 1h4i s ASN 132 CO 0.00 -0.29 -0.24 -0.69 -1.51 0.00 0.00 177.10 174.37 1h4i s VAL 133 N -2.23 1.90 0.03 1.60 1.01 0.01 -1.67 120.40 121.05 1h4i s VAL 133 Ca 0.47 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.45 1h4i s VAL 133 Cb -0.10 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.66 1h4i s VAL 133 CO 0.31 0.54 -0.05 0.00 0.00 0.00 0.00 175.10 175.89 1h4i s ALA 134 N -0.40 0.35 -0.12 5.51 0.00 -0.13 -1.80 121.76 125.17 1h4i s ALA 134 Ca 0.04 -0.62 0.01 0.00 0.00 0.00 0.00 51.96 51.39 1h4i s ALA 134 Cb -0.11 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 1h4i s ALA 134 CO 0.01 -0.07 -0.16 0.00 0.00 0.00 0.00 175.76 175.53 1h4i s ALA 135 N -1.27 2.48 0.02 0.00 0.00 -0.63 -1.54 121.76 120.83 1h4i s ALA 135 Ca -0.11 -0.92 0.09 0.00 0.00 0.00 0.00 51.96 51.02 1h4i s ALA 135 Cb -0.09 -1.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1h4i s ALA 135 CO -0.00 0.25 -0.26 -0.51 0.00 0.00 0.00 175.76 175.24 1h4i s LEU 136 N 0.36 2.12 0.07 0.00 1.43 0.36 -0.67 118.68 122.36 1h4i s LEU 136 Ca -0.13 -0.54 -0.30 0.00 -1.03 0.00 0.00 54.13 52.12 1h4i s LEU 136 Cb -0.17 -1.29 -0.09 0.00 0.03 0.00 0.00 46.19 44.67 1h4i s LEU 136 CO 0.07 0.28 1.86 0.21 0.23 0.00 0.00 176.35 178.99 1h4i s ASN 137 N -1.01 6.47 0.58 2.29 3.84 0.18 -0.20 114.94 127.10 1h4i s ASN 137 Ca 0.11 2.65 0.32 0.00 0.21 0.00 0.00 52.86 56.15 1h4i s ASN 137 Cb -0.10 -2.55 1.80 0.00 -0.55 0.00 0.00 41.25 39.86 1h4i s ASN 137 CO 0.01 -1.01 2.22 0.00 -2.79 0.00 0.00 177.10 175.53 1h4i h ALA 138 N 9.50 1.35 0.00 1.71 0.00 -1.75 0.59 119.26 130.65 1h4i h ALA 138 Ca -0.47 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.20 1h4i h ALA 138 Cb 1.22 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 1h4i h ALA 138 CO 0.94 0.04 -1.87 0.39 0.00 0.00 0.00 179.25 178.76 1h4i n GLU 139 N -3.64 0.65 -0.00 0.00 -0.58 -1.26 -4.62 120.64 111.19 1h4i n GLU 139 Ca -0.03 0.07 0.01 0.00 -0.42 0.00 0.00 57.16 56.80 1h4i n GLU 139 Cb 0.13 -1.65 -0.02 0.00 -0.57 0.00 0.00 31.44 29.33 1h4i n GLU 139 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1h4i n THR 140 N -2.73 0.00 -0.99 2.62 -2.24 -1.12 -4.95 114.28 104.87 1h4i n THR 140 Ca -0.17 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1h4i n THR 140 Cb 0.91 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 1h4i n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h4i n GLY 141 N 2.11 0.78 3.77 3.38 0.00 0.20 -4.88 105.19 110.55 1h4i n GLY 141 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1h4i n GLY 141 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h4i s GLU 142 N -0.03 3.90 -0.15 1.61 2.02 -1.26 -4.60 118.70 120.20 1h4i s GLU 142 Ca 0.00 1.82 -0.29 0.00 0.02 0.00 0.00 54.97 56.51 1h4i s GLU 142 Cb 0.00 -2.54 -0.01 0.00 0.10 0.00 0.00 34.13 31.68 1h4i s GLU 142 CO 0.00 -0.45 1.10 0.99 0.02 0.00 0.00 175.26 176.93 1h4i s THR 143 N -1.48 4.55 -0.19 3.63 2.01 -1.26 -0.65 115.64 122.26 1h4i s THR 143 Ca 0.60 1.85 -0.23 0.00 0.31 0.00 0.00 61.69 64.23 1h4i s THR 143 Cb -0.30 -4.19 -0.20 0.00 0.01 0.00 0.00 72.50 67.81 1h4i s THR 143 CO 0.37 -0.08 0.36 0.58 -0.69 0.00 0.00 174.62 175.15 1h4i h VAL 144 N 5.27 1.13 -3.59 3.82 2.07 -1.25 -3.48 116.25 120.23 1h4i h VAL 144 Ca -0.27 -2.18 -0.08 0.00 0.82 0.00 0.00 66.70 64.99 1h4i h VAL 144 Cb 1.11 2.47 -0.15 0.00 -1.52 0.00 0.00 31.29 33.20 1h4i h VAL 144 CO 0.92 0.38 -0.29 -1.66 0.02 0.00 0.00 177.57 176.95 1h4i s TRP 145 N -2.31 0.01 -0.18 1.57 1.48 -1.22 -5.01 118.94 113.27 1h4i s TRP 145 Ca -0.25 -0.33 -0.08 0.00 -1.06 0.00 0.00 56.10 54.37 1h4i s TRP 145 Cb 0.03 0.04 0.07 0.00 -1.16 0.00 0.00 33.47 32.46 1h4i s TRP 145 CO 0.60 -0.55 0.42 0.21 -4.06 0.00 0.00 176.95 173.56 1h4i s LYS 146 N -3.42 0.36 0.12 3.25 2.20 -1.26 -1.60 119.74 119.39 1h4i s LYS 146 Ca 0.01 0.92 0.04 0.00 -0.36 0.00 0.00 55.97 56.58 1h4i s LYS 146 Cb 0.02 0.15 -0.04 0.00 -1.51 0.00 0.00 37.83 36.46 1h4i s LYS 146 CO -0.09 -0.21 -0.11 0.14 -0.36 0.00 0.00 175.35 174.72 1h4i s VAL 147 N 2.02 1.10 -0.08 4.02 -7.23 -0.74 -4.96 120.40 114.52 1h4i s VAL 147 Ca -0.05 -1.76 -0.23 0.00 -1.81 0.00 0.00 61.98 58.13 1h4i s VAL 147 Cb -0.10 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.28 1h4i s VAL 147 CO -0.13 -0.57 0.69 -1.61 -0.31 0.00 0.00 175.10 173.18 1h4i s GLU 148 N -2.98 4.41 -0.13 4.82 2.02 -1.26 -0.81 118.70 124.77 1h4i s GLU 148 Ca 0.09 0.85 -0.00 0.00 0.02 0.00 0.00 54.97 55.93 1h4i s GLU 148 Cb -0.02 -3.46 -0.08 0.00 0.10 0.00 0.00 34.13 30.67 1h4i s GLU 148 CO 0.01 0.04 -0.12 -1.71 0.02 0.00 0.00 175.26 173.49 1h4i n ASN 149 N 3.90 2.70 -4.27 -0.19 5.15 0.65 -4.96 115.26 118.25 1h4i n ASN 149 Ca -0.01 -0.03 -0.18 0.00 -0.60 0.00 0.00 54.58 53.75 1h4i n ASN 149 Cb 0.51 -0.23 -0.11 0.00 -0.53 0.00 0.00 39.78 39.42 1h4i n ASN 149 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1h4i s SER 150 N -5.40 2.15 -0.25 1.20 0.01 -0.87 -5.07 113.70 105.48 1h4i s SER 150 Ca -0.18 -0.86 0.01 0.00 1.31 0.00 0.00 55.95 56.24 1h4i s SER 150 Cb 0.05 -0.08 0.05 0.00 0.21 0.00 0.00 66.02 66.24 1h4i s SER 150 CO 0.29 -0.15 -0.10 -0.62 0.41 0.00 0.00 173.24 173.07 1h4i s ASP 151 N -2.64 4.29 0.53 2.44 2.15 -1.22 -4.40 116.67 117.81 1h4i s ASP 151 Ca 0.12 -1.18 0.28 0.00 0.43 0.00 0.00 52.55 52.20 1h4i s ASP 151 Cb -0.04 -1.58 1.48 0.00 -0.30 0.00 0.00 42.92 42.48 1h4i s ASP 151 CO 0.04 -0.16 2.08 0.16 -0.17 0.00 0.00 175.17 177.12 1h4i h ILE 152 N 6.50 0.53 0.00 4.11 3.07 -1.70 -1.23 117.51 128.79 1h4i h ILE 152 Ca -0.26 -0.50 -0.00 0.00 1.55 0.00 0.00 64.86 65.65 1h4i h ILE 152 Cb 1.07 1.33 -0.00 0.00 -0.27 0.00 0.00 36.82 38.95 1h4i h ILE 152 CO 0.52 0.11 -0.01 0.11 -1.05 0.00 0.00 178.15 177.82 1h4i h LYS 153 N 0.00 0.00 -0.25 0.16 1.79 -1.94 0.51 116.57 116.85 1h4i h LYS 153 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1h4i h LYS 153 Cb 0.32 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 1h4i h LYS 153 CO 0.01 0.01 0.00 1.55 -1.08 0.00 0.00 179.45 179.95 1h4i n VAL 154 N -3.38 0.73 -0.57 0.50 3.14 -0.83 -3.84 118.33 114.09 1h4i n VAL 154 Ca -0.03 -0.87 0.00 0.00 -2.96 0.00 0.00 64.34 60.49 1h4i n VAL 154 Cb 0.11 0.69 0.00 0.00 -1.06 0.00 0.00 33.84 33.58 1h4i n VAL 154 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1h4i n GLY 155 N 0.50 0.66 3.55 7.55 0.00 0.17 -3.69 105.19 113.92 1h4i n GLY 155 Ca 0.10 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.26 1h4i n GLY 155 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1h4i s SER 156 N -2.45 5.63 0.38 1.61 0.15 -0.53 -4.44 113.70 114.05 1h4i s SER 156 Ca 0.00 -0.06 0.04 0.00 0.70 0.00 0.00 55.95 56.63 1h4i s SER 156 Cb 0.00 -2.02 -0.03 0.00 -1.71 0.00 0.00 66.02 62.26 1h4i s SER 156 CO 0.00 0.00 0.14 0.42 1.20 0.00 0.00 173.24 175.00 1h4i s THR 157 N 1.42 0.54 -0.09 6.45 -4.23 -1.14 -2.34 115.64 116.26 1h4i s THR 157 Ca 0.06 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.59 1h4i s THR 157 Cb -0.15 -2.41 0.02 0.00 1.34 0.00 0.00 72.50 71.30 1h4i s THR 157 CO 0.06 0.00 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.26 1h4i s LEU 158 N -3.55 1.56 0.00 4.79 1.43 -1.16 -2.50 118.68 119.25 1h4i s LEU 158 Ca 0.28 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1h4i s LEU 158 Cb 0.03 -0.89 0.00 0.00 0.03 0.00 0.00 46.19 45.36 1h4i s LEU 158 CO 0.16 -0.00 0.00 0.35 0.23 0.00 0.00 176.35 177.09 1h4i n THR 159 N 4.15 0.00 -2.33 5.49 -2.24 -1.26 -3.43 114.28 114.66 1h4i n THR 159 Ca -0.20 -0.12 -0.35 0.00 -2.27 0.00 0.00 64.05 61.12 1h4i n THR 159 Cb 0.51 0.56 -0.01 0.00 -2.10 0.00 0.00 70.33 69.30 1h4i n THR 159 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1h4i s ILE 160 N -1.17 3.37 0.23 2.28 2.07 -1.26 -0.18 121.20 126.54 1h4i s ILE 160 Ca 0.00 0.84 -0.24 0.00 -1.41 0.00 0.00 60.65 59.85 1h4i s ILE 160 Cb 0.00 -3.34 -0.09 0.00 0.13 0.00 0.00 42.46 39.17 1h4i s ILE 160 CO 0.00 -0.19 0.81 0.00 -1.91 0.00 0.00 174.94 173.65 1h4i s ALA 161 N -1.86 3.37 0.83 1.50 0.00 -1.26 -4.62 121.76 119.72 1h4i s ALA 161 Ca 0.71 0.35 -0.11 0.00 0.00 0.00 0.00 51.96 52.91 1h4i s ALA 161 Cb -0.21 -2.98 0.09 0.00 0.00 0.00 0.00 23.12 20.01 1h4i s ALA 161 CO 0.25 0.27 1.09 -2.14 0.00 0.00 0.00 175.76 175.24 1h4i s PRO 162 N -1.67 1.80 -0.04 0.00 0.02 -1.26 -4.79 135.00 129.06 1h4i s PRO 162 Ca 0.42 1.08 0.01 0.00 0.02 0.00 0.00 61.00 62.53 1h4i s PRO 162 Cb -0.20 -1.85 0.02 0.00 0.02 0.00 0.00 34.50 32.49 1h4i s PRO 162 CO 0.24 -1.94 -0.04 -0.47 -0.33 0.00 0.00 177.00 174.46 1h4i s TYR 163 N -2.89 0.71 -0.25 6.54 5.04 -0.95 -4.49 117.35 121.07 1h4i s TYR 163 Ca 0.62 -0.19 -0.07 0.00 -2.44 0.00 0.00 57.07 55.00 1h4i s TYR 163 Cb -0.18 -0.64 -0.02 0.00 0.35 0.00 0.00 41.96 41.47 1h4i s TYR 163 CO 0.57 -0.18 0.05 0.08 -1.34 0.00 0.00 175.55 174.73 1h4i s VAL 164 N 0.89 4.10 -0.10 3.14 1.01 -1.26 -0.16 120.40 128.02 1h4i s VAL 164 Ca -0.12 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1h4i s VAL 164 Cb -0.14 -2.94 0.02 0.00 0.00 0.00 0.00 36.38 33.32 1h4i s VAL 164 CO 0.00 0.32 -0.09 -0.69 0.00 0.00 0.00 175.10 174.64 1h4i s VAL 165 N 1.58 1.05 0.00 2.92 1.01 -0.52 -4.61 120.40 121.83 1h4i s VAL 165 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.69 1h4i s VAL 165 Cb -0.15 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.20 1h4i s VAL 165 CO 0.02 0.36 0.00 0.29 0.00 0.00 0.00 175.10 175.77 1h4i n LYS 166 N 4.56 0.00 -1.28 2.72 4.76 -1.26 -0.89 118.16 126.76 1h4i n LYS 166 Ca -0.16 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.09 1h4i n LYS 166 Cb 0.51 0.00 0.12 0.00 -1.84 0.00 0.00 35.03 33.82 1h4i n LYS 166 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1h4i n ASP 167 N 6.14 4.42 -4.28 4.39 10.43 -1.26 -4.53 116.55 131.86 1h4i n ASP 167 Ca 0.00 -3.77 -0.20 0.00 2.57 0.00 0.00 54.79 53.39 1h4i n ASP 167 Cb 0.00 -0.66 -0.11 0.00 1.84 0.00 0.00 41.12 42.18 1h4i n ASP 167 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1h4i s LYS 168 N -3.48 1.13 -0.17 -1.24 1.02 -0.07 -1.48 119.74 115.45 1h4i s LYS 168 Ca 0.52 -1.28 0.01 0.00 0.02 0.00 0.00 55.97 55.24 1h4i s LYS 168 Cb 0.44 -1.15 0.01 0.00 -0.52 0.00 0.00 37.83 36.61 1h4i s LYS 168 CO 0.02 0.24 -0.18 0.08 -0.92 0.00 0.00 175.35 174.58 1h4i s VAL 169 N -1.91 2.28 -0.18 3.17 1.01 -0.25 -1.44 120.40 123.09 1h4i s VAL 169 Ca 0.11 -0.88 -0.13 0.00 0.00 0.00 0.00 61.98 61.07 1h4i s VAL 169 Cb -0.06 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 1h4i s VAL 169 CO 0.05 0.53 0.26 -0.63 0.00 0.00 0.00 175.10 175.30 1h4i s ILE 170 N 1.06 5.32 -0.12 2.22 -1.09 0.78 -1.36 121.20 128.01 1h4i s ILE 170 Ca -0.01 0.45 0.03 0.00 -2.23 0.00 0.00 60.65 58.89 1h4i s ILE 170 Cb -0.14 -3.60 0.01 0.00 -1.58 0.00 0.00 42.46 37.15 1h4i s ILE 170 CO -0.06 0.38 -0.21 -0.63 -1.23 0.00 0.00 174.94 173.19 1h4i s ILE 171 N 0.59 1.90 0.00 2.92 -1.09 0.82 -2.25 121.20 124.09 1h4i s ILE 171 Ca 0.14 -0.89 0.00 0.00 -2.23 0.00 0.00 60.65 57.67 1h4i s ILE 171 Cb -0.13 -1.68 0.00 0.00 -1.58 0.00 0.00 42.46 39.07 1h4i s ILE 171 CO 0.03 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 174.87 1h4i n GLY 172 N 3.97 0.95 3.45 6.18 0.00 -1.26 -1.19 105.19 117.29 1h4i n GLY 172 Ca -0.20 -1.48 -0.11 0.00 0.00 0.00 0.00 46.02 44.22 1h4i n GLY 172 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h4i s SER 173 N -1.00 -0.52 0.01 1.61 1.04 -0.02 -4.77 113.70 110.05 1h4i s SER 173 Ca 0.00 0.05 -0.03 0.00 0.48 0.00 0.00 55.95 56.46 1h4i s SER 173 Cb 0.00 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.65 1h4i s SER 173 CO 0.00 -0.86 0.03 -0.44 0.98 0.00 0.00 173.24 172.95 1h4i s SER 174 N -2.56 0.17 0.00 7.02 0.01 -1.04 -2.85 113.70 114.45 1h4i s SER 174 Ca 0.01 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 56.86 1h4i s SER 174 Cb -0.01 0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.36 1h4i s SER 174 CO -0.10 -0.33 0.00 0.61 0.41 0.00 0.00 173.24 173.83 1h4i n GLY 175 N 1.53 -0.34 0.37 3.44 0.00 -1.26 -2.91 105.19 106.02 1h4i n GLY 175 Ca -0.23 0.00 0.19 0.00 0.00 0.00 0.00 46.02 45.98 1h4i n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4i h ALA 176 N 0.00 2.19 0.00 4.61 0.00 -1.89 0.25 119.26 124.42 1h4i h ALA 176 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1h4i h ALA 176 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1h4i h ALA 176 CO 0.00 -0.54 0.00 0.39 0.00 0.00 0.00 179.25 179.10 1h4i n GLU 177 N -4.03 0.00 -0.24 0.00 4.71 -1.26 -1.75 120.64 118.07 1h4i n GLU 177 Ca 0.07 0.19 0.09 0.00 -0.01 0.00 0.00 57.16 57.49 1h4i n GLU 177 Cb 0.52 -1.51 0.18 0.00 -1.01 0.00 0.00 31.44 29.62 1h4i n GLU 177 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1h4i n LEU 178 N -1.52 2.82 -2.59 -4.62 4.32 0.84 -0.24 117.00 116.02 1h4i n LEU 178 Ca 0.04 -3.19 -0.20 0.00 -0.02 0.00 0.00 56.01 52.65 1h4i n LEU 178 Cb 0.22 -0.48 0.03 0.00 -1.62 0.00 0.00 43.42 41.57 1h4i n LEU 178 CO 0.17 0.79 -0.04 0.61 -1.22 0.00 0.00 177.39 177.71 1h4i n GLY 179 N -1.18 -0.38 3.71 -0.72 0.00 -0.71 -4.71 105.19 101.18 1h4i n GLY 179 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1h4i n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h4i s VAL 180 N -3.08 4.97 -0.06 1.61 1.01 -0.98 -4.42 120.40 119.45 1h4i s VAL 180 Ca 0.22 1.65 -0.30 0.00 0.00 0.00 0.00 61.98 63.55 1h4i s VAL 180 Cb -0.10 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1h4i s VAL 180 CO 0.28 0.19 1.16 -0.60 0.00 0.00 0.00 175.10 176.13 1h4i s ARG 181 N 1.07 4.37 0.50 2.72 3.52 -1.26 -2.56 118.95 127.31 1h4i s ARG 181 Ca 0.42 1.62 -0.22 0.00 -0.13 0.00 0.00 55.73 57.42 1h4i s ARG 181 Cb -0.18 -3.55 -0.06 0.00 -1.56 0.00 0.00 34.95 29.60 1h4i s ARG 181 CO 0.20 -0.41 1.20 0.20 -0.81 0.00 0.00 175.30 175.68 1h4i s GLY 182 N 1.39 2.78 -0.06 8.12 0.00 0.10 -4.85 107.32 114.80 1h4i s GLY 182 Ca 0.54 1.01 -0.28 0.00 0.00 0.00 0.00 44.72 45.99 1h4i s GLY 182 CO 0.21 1.46 0.63 -2.52 0.00 0.00 0.00 173.10 172.89 1h4i s TYR 183 N -1.52 -0.60 0.13 1.90 -0.85 -1.26 -1.05 117.35 114.09 1h4i s TYR 183 Ca 0.67 1.07 0.09 0.00 -0.52 0.00 0.00 57.07 58.38 1h4i s TYR 183 Cb -0.31 0.36 -0.04 0.00 0.38 0.00 0.00 41.96 42.35 1h4i s TYR 183 CO 0.36 -0.56 -0.21 -0.48 -1.52 0.00 0.00 175.55 173.14 1h4i s LEU 184 N -1.08 2.34 0.03 -3.49 2.34 -0.52 -4.00 118.68 114.30 1h4i s LEU 184 Ca -0.10 -0.75 0.03 0.00 0.06 0.00 0.00 54.13 53.37 1h4i s LEU 184 Cb -0.01 -0.93 -0.02 0.00 -0.56 0.00 0.00 46.19 44.67 1h4i s LEU 184 CO 0.09 0.06 -0.09 -0.89 -1.06 0.00 0.00 176.35 174.45 1h4i s THR 185 N -1.39 0.64 -0.12 5.48 2.01 -0.33 -1.46 115.64 120.47 1h4i s THR 185 Ca 0.10 -0.84 0.02 0.00 0.31 0.00 0.00 61.69 61.29 1h4i s THR 185 Cb -0.09 -0.64 -0.00 0.00 0.01 0.00 0.00 72.50 71.78 1h4i s THR 185 CO 0.05 -0.16 -0.20 0.00 -0.69 0.00 0.00 174.62 173.62 1h4i s ALA 186 N -0.93 2.32 0.18 7.40 0.00 -0.22 -0.13 121.76 130.38 1h4i s ALA 186 Ca -0.04 -0.97 0.11 0.00 0.00 0.00 0.00 51.96 51.06 1h4i s ALA 186 Cb -0.07 -0.96 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 1h4i s ALA 186 CO 0.00 0.23 -0.23 0.71 0.00 0.00 0.00 175.76 176.47 1h4i s TYR 187 N 0.42 2.34 -0.10 0.00 1.51 -0.47 -0.46 117.35 120.60 1h4i s TYR 187 Ca -0.15 -0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 55.27 1h4i s TYR 187 Cb -0.17 -1.18 -0.03 0.00 -0.11 0.00 0.00 41.96 40.47 1h4i s TYR 187 CO 0.06 0.47 1.34 0.34 -1.11 0.00 0.00 175.55 176.65 1h4i s ASP 188 N -2.56 6.91 0.66 2.29 -1.08 0.14 -1.09 116.67 121.93 1h4i s ASP 188 Ca 0.20 1.87 0.40 0.00 -0.52 0.00 0.00 52.55 54.50 1h4i s ASP 188 Cb -0.08 -2.55 2.19 0.00 -1.46 0.00 0.00 42.92 41.02 1h4i s ASP 188 CO 0.10 -0.75 2.23 1.62 0.52 0.00 0.00 175.17 178.89 1h4i h VAL 189 N 5.31 0.00 0.00 1.11 3.04 -1.57 -0.07 116.25 124.07 1h4i h VAL 189 Ca -0.32 0.00 -0.20 0.00 -1.01 0.00 0.00 66.70 65.17 1h4i h VAL 189 Cb 1.14 0.89 -0.03 0.00 -2.01 0.00 0.00 31.29 31.28 1h4i h VAL 189 CO 0.94 0.00 -1.68 0.29 -1.01 0.00 0.00 177.57 176.11 1h4i n LYS 190 N -3.01 0.64 0.00 4.17 5.02 -1.26 -4.63 118.16 119.09 1h4i n LYS 190 Ca -0.03 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1h4i n LYS 190 Cb 0.16 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.44 1h4i n LYS 190 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1h4i n THR 191 N -2.81 0.00 -0.66 -0.18 -2.24 -1.05 -4.96 114.28 102.38 1h4i n THR 191 Ca -0.14 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1h4i n THR 191 Cb 0.89 0.62 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 1h4i n THR 191 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h4i n GLY 192 N 1.47 0.70 3.70 3.38 0.00 -0.07 -4.93 105.19 109.44 1h4i n GLY 192 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1h4i n GLY 192 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h4i s GLU 193 N -0.34 4.32 -0.04 1.61 2.12 -1.25 -4.69 118.70 120.42 1h4i s GLU 193 Ca 0.00 2.00 -0.30 0.00 0.36 0.00 0.00 54.97 57.03 1h4i s GLU 193 Cb 0.00 -3.40 -0.05 0.00 0.26 0.00 0.00 34.13 30.94 1h4i s GLU 193 CO 0.00 -0.48 1.46 -1.14 -0.54 0.00 0.00 175.26 174.56 1h4i s GLN 194 N 1.66 4.24 -0.23 4.30 0.74 -1.26 0.24 119.66 129.35 1h4i s GLN 194 Ca 0.64 1.99 -0.17 0.00 0.05 0.00 0.00 55.36 57.87 1h4i s GLN 194 Cb -0.34 -3.72 -0.17 0.00 1.10 0.00 0.00 33.01 29.88 1h4i s GLN 194 CO 0.29 -0.68 -0.03 0.28 -0.55 0.00 0.00 175.29 174.60 1h4i n VAL 195 N 5.02 1.55 -3.65 1.34 0.31 0.40 -4.91 118.33 118.39 1h4i n VAL 195 Ca 0.14 -0.24 -0.14 0.00 -0.01 0.00 0.00 64.34 64.10 1h4i n VAL 195 Cb 0.43 -1.93 -0.07 0.00 -0.91 0.00 0.00 33.84 31.37 1h4i n VAL 195 CO 0.00 0.00 0.00 -1.66 -1.32 0.00 0.00 176.83 173.85 1h4i s TRP 196 N -2.44 -0.34 -0.06 3.52 1.48 -1.13 -5.00 118.94 114.97 1h4i s TRP 196 Ca -0.33 0.43 -0.02 0.00 -1.06 0.00 0.00 56.10 55.12 1h4i s TRP 196 Cb 0.10 0.24 0.04 0.00 -1.16 0.00 0.00 33.47 32.69 1h4i s TRP 196 CO 0.56 -0.55 0.11 0.50 -4.06 0.00 0.00 176.95 173.51 1h4i s ARG 197 N -2.00 -0.01 -0.04 3.25 3.52 -1.26 -1.06 118.95 121.36 1h4i s ARG 197 Ca -0.08 0.43 0.07 0.00 -0.13 0.00 0.00 55.73 56.02 1h4i s ARG 197 Cb -0.02 -0.34 -0.02 0.00 -1.56 0.00 0.00 34.95 33.02 1h4i s ARG 197 CO 0.01 -0.28 -0.25 0.00 -0.81 0.00 0.00 175.30 173.97 1h4i s ALA 198 N 1.95 2.17 0.38 6.12 0.00 -0.54 -4.92 121.76 126.92 1h4i s ALA 198 Ca 0.01 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 50.92 1h4i s ALA 198 Cb -0.12 -0.61 -0.01 0.00 0.00 0.00 0.00 23.12 22.38 1h4i s ALA 198 CO -0.04 0.48 0.55 0.71 0.00 0.00 0.00 175.76 177.45 1h4i s TYR 199 N -0.41 3.15 -0.12 0.00 1.51 -0.33 -1.44 117.35 119.71 1h4i s TYR 199 Ca 0.04 -0.05 0.22 0.00 -1.01 0.00 0.00 57.07 56.27 1h4i s TYR 199 Cb -0.12 -2.12 -0.19 0.00 -0.11 0.00 0.00 41.96 39.43 1h4i s TYR 199 CO 0.01 -0.14 0.73 0.00 -1.11 0.00 0.00 175.55 175.03 1h4i n ALA 200 N -1.81 2.68 -2.30 3.71 0.00 -0.21 -4.42 120.51 118.16 1h4i n ALA 200 Ca 0.00 -0.40 -0.16 0.00 0.00 0.00 0.00 53.44 52.88 1h4i n ALA 200 Cb 0.58 -0.91 -0.10 0.00 0.00 0.00 0.00 19.45 19.03 1h4i n ALA 200 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1h4i s THR 201 N -3.45 0.35 0.00 0.00 -4.23 -1.26 -4.08 115.64 102.97 1h4i s THR 201 Ca -0.05 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 1h4i s THR 201 Cb 0.12 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.40 1h4i s THR 201 CO 0.86 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.55 1h4i n GLY 202 N -0.47 -1.81 3.71 3.99 0.00 -0.52 -4.67 105.19 105.42 1h4i n GLY 202 Ca 0.01 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.78 1h4i n GLY 202 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1h4i n PRO 203 N 0.00 2.05 -0.09 1.61 -0.02 -1.26 -3.39 135.00 133.90 1h4i n PRO 203 Ca 0.00 0.73 0.23 0.00 -2.02 0.00 0.00 63.50 62.44 1h4i n PRO 203 Cb 0.00 -2.40 0.69 0.00 -0.02 0.00 0.00 33.50 31.77 1h4i n PRO 203 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1h4i h ASP 204 N 2.28 0.04 -0.58 2.55 3.32 -1.95 0.16 116.42 122.24 1h4i h ASP 204 Ca -0.48 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.53 1h4i h ASP 204 Cb 1.29 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.80 1h4i h ASP 204 CO 0.61 0.02 0.20 0.07 -1.72 0.00 0.00 179.24 178.41 1h4i h LYS 205 N 0.04 0.93 -0.05 3.56 -0.00 -1.98 -1.37 116.57 117.70 1h4i h LYS 205 Ca 0.33 -0.18 -0.20 0.00 -0.00 0.00 0.00 60.65 60.61 1h4i h LYS 205 Cb 1.28 -0.15 -0.00 0.00 -0.00 0.00 0.00 32.23 33.36 1h4i h LYS 205 CO -0.02 0.80 -0.82 -0.44 -0.00 0.00 0.00 179.45 178.97 1h4i h ASP 206 N 0.90 0.50 0.73 7.07 3.32 -1.09 -3.09 116.42 124.75 1h4i h ASP 206 Ca 0.20 -0.36 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 1h4i h ASP 206 Cb 0.25 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1h4i h ASP 206 CO -0.01 1.12 -0.09 -0.07 -1.72 0.00 0.00 179.24 178.47 1h4i h LEU 207 N 0.26 0.00 -2.69 1.55 3.38 -0.69 -0.86 115.31 116.26 1h4i h LEU 207 Ca -0.05 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.64 1h4i h LEU 207 Cb 1.42 0.00 0.14 0.00 0.09 0.00 0.00 40.66 42.31 1h4i h LEU 207 CO 0.14 0.09 -0.81 -0.11 0.09 0.00 0.00 178.44 177.85 1h4i n LEU 208 N -3.31 -4.88 -4.83 1.67 0.00 -0.57 -4.55 117.00 100.54 1h4i n LEU 208 Ca -0.01 -0.74 -0.36 0.00 0.00 0.00 0.00 56.01 54.90 1h4i n LEU 208 Cb 0.30 -2.96 -0.06 0.00 0.00 0.00 0.00 43.42 40.70 1h4i n LEU 208 CO 0.29 0.10 0.26 -0.76 0.00 0.00 0.00 177.39 177.28 1h4i s LEU 209 N -5.56 4.40 0.56 -1.96 1.43 -1.25 -1.22 118.68 115.08 1h4i s LEU 209 Ca 0.41 1.17 -0.17 0.00 -1.03 0.00 0.00 54.13 54.51 1h4i s LEU 209 Cb -0.09 -3.18 -0.05 0.00 0.03 0.00 0.00 46.19 42.91 1h4i s LEU 209 CO 0.78 0.15 1.06 0.00 0.23 0.00 0.00 176.35 178.57 1h4i s ALA 210 N -1.36 2.77 0.41 4.21 0.00 -0.52 -4.72 121.76 122.56 1h4i s ALA 210 Ca 0.35 0.48 0.13 0.00 0.00 0.00 0.00 51.96 52.92 1h4i s ALA 210 Cb -0.17 -3.24 0.97 0.00 0.00 0.00 0.00 23.12 20.68 1h4i s ALA 210 CO 0.19 -0.67 1.93 0.66 0.00 0.00 0.00 175.76 177.88 1h4i h SER 211 N 0.79 0.46 -0.76 0.00 4.64 -1.98 -1.06 113.55 115.65 1h4i h SER 211 Ca -0.48 0.02 -0.31 0.00 -0.47 0.00 0.00 61.79 60.55 1h4i h SER 211 Cb 1.22 -0.08 -0.19 0.00 -0.31 0.00 0.00 62.40 63.05 1h4i h SER 211 CO 0.58 0.26 0.40 -0.90 -0.87 0.00 0.00 176.83 176.29 1h4i n ASP 212 N -4.49 4.15 -4.68 4.97 5.75 -1.26 -5.00 116.55 116.00 1h4i n ASP 212 Ca 0.13 -3.23 -0.47 0.00 -0.01 0.00 0.00 54.79 51.22 1h4i n ASP 212 Cb 0.44 -0.76 -0.04 0.00 -1.03 0.00 0.00 41.12 39.73 1h4i n ASP 212 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1h4i n PHE 213 N -0.47 2.34 -2.37 2.11 7.35 -0.41 -2.02 117.46 123.99 1h4i n PHE 213 Ca 0.44 0.07 -0.20 0.00 -0.76 0.00 0.00 57.45 57.01 1h4i n PHE 213 Cb 1.40 -2.63 -0.01 0.00 0.35 0.00 0.00 39.48 38.59 1h4i n PHE 213 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 1h4i n ASN 214 N 5.33 -5.64 -0.32 -2.13 3.02 -0.62 -4.90 115.26 110.00 1h4i n ASN 214 Ca 0.20 0.03 0.06 0.00 -0.03 0.00 0.00 54.58 54.85 1h4i n ASN 214 Cb 0.30 -4.71 0.26 0.00 -0.61 0.00 0.00 39.78 35.02 1h4i n ASN 214 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1h4i h ILE 215 N 0.00 0.97 0.00 2.41 2.04 -1.65 -0.99 117.51 120.30 1h4i h ILE 215 Ca -0.47 -0.33 -0.14 0.00 1.00 0.00 0.00 64.86 64.92 1h4i h ILE 215 Cb 1.34 -0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1h4i h ILE 215 CO 0.56 0.18 -0.90 0.11 0.00 0.00 0.00 178.15 178.09 1h4i h LYS 216 N 0.97 0.00 -2.10 2.37 1.79 -1.86 -3.38 116.57 114.36 1h4i h LYS 216 Ca 0.44 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 58.36 1h4i h LYS 216 Cb 0.39 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.64 1h4i h LYS 216 CO -0.20 0.48 -0.93 0.09 -1.08 0.00 0.00 179.45 177.80 1h4i n ASN 217 N -3.11 2.03 0.33 0.86 3.02 -0.84 -4.93 115.26 112.61 1h4i n ASN 217 Ca -0.03 -3.16 0.20 0.00 -0.03 0.00 0.00 54.58 51.57 1h4i n ASN 217 Cb 0.80 -0.62 1.10 0.00 -0.61 0.00 0.00 39.78 40.45 1h4i n ASN 217 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1h4i h PRO 218 N 3.49 0.00 0.00 3.52 0.13 -1.40 -0.18 132.00 137.57 1h4i h PRO 218 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1h4i h PRO 218 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 1h4i h PRO 218 CO 0.63 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.01 1h4i n HIS 219 N -3.18 0.10 0.23 1.56 1.44 -1.26 -1.62 115.22 112.50 1h4i n HIS 219 Ca -0.03 0.04 0.12 0.00 -2.01 0.00 0.00 57.72 55.84 1h4i n HIS 219 Cb 0.14 -0.56 0.49 0.00 0.12 0.00 0.00 29.99 30.18 1h4i n HIS 219 CO 0.00 0.00 0.00 1.88 -2.81 0.00 0.00 176.34 175.41 1h4i h TYR 220 N 0.00 0.00 0.00 -1.40 0.99 -1.34 -3.49 116.97 111.73 1h4i h TYR 220 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1h4i h TYR 220 Cb 0.34 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.07 1h4i h TYR 220 CO 0.00 0.17 0.00 0.41 -0.00 0.00 0.00 178.16 178.74 1h4i n GLY 221 N 0.17 2.92 0.00 3.88 0.00 -0.64 -4.80 105.19 106.73 1h4i n GLY 221 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1h4i n GLY 221 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1h4i n GLN 222 N 0.20 0.00 -3.05 1.61 6.02 -1.26 -4.85 117.38 116.05 1h4i n GLN 222 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.69 1h4i n GLN 222 Cb 0.00 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.22 1h4i n GLN 222 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1h4i s LYS 223 N 1.08 3.78 0.00 -1.09 1.02 -1.26 -4.32 119.74 118.95 1h4i s LYS 223 Ca 0.00 0.38 0.00 0.00 0.02 0.00 0.00 55.97 56.37 1h4i s LYS 223 Cb 0.00 -2.48 0.00 0.00 -0.52 0.00 0.00 37.83 34.83 1h4i s LYS 223 CO 0.00 0.08 0.00 0.41 -0.92 0.00 0.00 175.35 174.92 1h4i n GLY 224 N -0.98 0.42 0.18 -3.33 0.00 -1.26 -4.91 105.19 95.31 1h4i n GLY 224 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 1h4i n GLY 224 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1h4i h LEU 225 N 0.00 0.00 -2.20 0.99 3.38 -1.90 -0.44 115.31 115.14 1h4i h LEU 225 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1h4i h LEU 225 Cb 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1h4i h LEU 225 CO 0.00 0.25 -0.06 1.23 0.09 0.00 0.00 178.44 179.95 1h4i h GLY 226 N 3.74 0.00 0.00 0.83 0.00 -1.79 -2.19 103.07 103.65 1h4i h GLY 226 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1h4i h GLY 226 CO 0.03 0.00 -1.38 -1.30 0.00 0.00 0.00 176.54 173.89 1h4i n THR 227 N -3.65 0.38 0.18 4.70 -2.24 -1.22 -1.44 114.28 111.00 1h4i n THR 227 Ca -0.02 -0.20 0.06 0.00 -2.27 0.00 0.00 64.05 61.61 1h4i n THR 227 Cb 0.17 -0.81 0.52 0.00 -2.10 0.00 0.00 70.33 68.11 1h4i n THR 227 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1h4i h GLY 228 N 0.85 0.14 -3.46 3.38 0.00 -1.00 -2.19 103.07 100.80 1h4i h GLY 228 Ca -0.15 -0.06 -0.30 0.00 0.00 0.00 0.00 47.33 46.81 1h4i h GLY 228 CO -0.01 0.06 0.38 -1.30 0.00 0.00 0.00 176.54 175.68 1h4i n THR 229 N -4.42 2.62 -4.06 4.70 -2.24 -0.83 -4.88 114.28 105.17 1h4i n THR 229 Ca -0.01 -1.43 -0.10 0.00 -2.27 0.00 0.00 64.05 60.24 1h4i n THR 229 Cb 0.16 -0.50 -0.11 0.00 -2.10 0.00 0.00 70.33 67.78 1h4i n THR 229 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1h4i s TRP 230 N -2.59 0.54 -0.28 4.78 0.52 -0.82 -1.18 118.94 119.91 1h4i s TRP 230 Ca 0.45 -0.74 -0.11 0.00 0.02 0.00 0.00 56.10 55.72 1h4i s TRP 230 Cb 0.37 -0.35 -0.05 0.00 -1.15 0.00 0.00 33.47 32.29 1h4i s TRP 230 CO 0.10 -0.21 0.21 -2.00 0.02 0.00 0.00 176.95 175.07 1h4i s GLU 231 N -2.58 3.97 3.96 4.98 2.12 -1.25 -4.97 118.70 124.93 1h4i s GLU 231 Ca -0.03 -0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.02 1h4i s GLU 231 Cb -0.02 -3.65 0.00 0.00 0.26 0.00 0.00 34.13 30.71 1h4i s GLU 231 CO -0.04 -0.17 0.00 0.41 -0.54 0.00 0.00 175.26 174.92 1h4i n GLY 232 N 4.96 0.85 0.16 -1.50 0.00 -1.26 -3.15 105.19 105.25 1h4i n GLY 232 Ca -0.13 -0.72 0.04 0.00 0.00 0.00 0.00 46.02 45.20 1h4i n GLY 232 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h4i n ASP 233 N -1.26 0.46 0.22 1.61 10.43 -1.26 -4.37 116.55 122.38 1h4i n ASP 233 Ca 0.00 -1.86 0.17 0.00 2.57 0.00 0.00 54.79 55.67 1h4i n ASP 233 Cb 0.00 -0.05 0.76 0.00 1.84 0.00 0.00 41.12 43.67 1h4i n ASP 233 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1h4i h ALA 234 N 3.31 1.72 0.00 2.24 0.00 -1.94 0.92 119.26 125.52 1h4i h ALA 234 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1h4i h ALA 234 Cb 0.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1h4i h ALA 234 CO 0.00 -0.51 0.00 0.11 0.00 0.00 0.00 179.25 178.85 1h4i h TRP 235 N 0.00 0.00 0.00 0.00 5.08 -1.85 -3.05 115.95 116.13 1h4i h TRP 235 Ca 0.09 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.03 1h4i h TRP 235 Cb 0.91 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.06 1h4i h TRP 235 CO 0.00 0.00 -0.17 0.87 -1.28 0.00 0.00 178.44 177.86 1h4i h LYS 236 N 0.00 0.00 -0.72 0.12 1.57 -1.17 -2.22 116.57 114.14 1h4i h LYS 236 Ca 0.00 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.32 1h4i h LYS 236 Cb 0.40 0.00 -0.42 0.00 0.08 0.00 0.00 32.23 32.29 1h4i h LYS 236 CO 0.00 0.17 -0.91 0.44 -0.57 0.00 0.00 179.45 178.57 1h4i n ILE 237 N -3.83 2.10 1.59 1.86 -5.35 -1.16 -4.30 119.36 110.28 1h4i n ILE 237 Ca -0.02 -3.85 0.12 0.00 -0.27 0.00 0.00 62.75 58.73 1h4i n ILE 237 Cb 0.26 -0.38 0.54 0.00 -1.74 0.00 0.00 39.64 38.33 1h4i n ILE 237 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1h4i n GLY 238 N -0.64 -0.28 7.00 3.28 0.00 -0.84 -4.34 105.19 109.37 1h4i n GLY 238 Ca 0.32 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1h4i n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4i n GLY 239 N 1.04 -0.12 1.48 -0.02 0.00 -1.06 -2.19 105.19 104.32 1h4i n GLY 239 Ca 0.17 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1h4i n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4i n GLY 240 N 0.00 0.60 3.74 -0.02 0.00 0.09 0.02 105.19 109.62 1h4i n GLY 240 Ca 0.00 -0.27 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 1h4i n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1h4i s THR 241 N -2.00 2.23 -0.28 2.61 -4.23 -1.26 -3.25 115.64 109.46 1h4i s THR 241 Ca 0.00 0.14 0.02 0.00 -1.18 0.00 0.00 61.69 60.67 1h4i s THR 241 Cb 0.00 -3.01 0.06 0.00 1.34 0.00 0.00 72.50 70.89 1h4i s THR 241 CO 0.00 -0.04 -0.07 0.54 -0.54 0.00 0.00 174.62 174.52 1h4i s ASN 242 N -1.53 4.61 -0.03 3.99 4.22 -1.13 0.02 114.94 125.08 1h4i s ASN 242 Ca 0.80 -1.41 0.05 0.00 -2.14 0.00 0.00 52.86 50.17 1h4i s ASN 242 Cb -0.34 -1.61 0.08 0.00 1.28 0.00 0.00 41.25 40.66 1h4i s ASN 242 CO 0.39 -0.23 0.97 -2.67 -2.04 0.00 0.00 177.10 173.52 1h4i n TRP 243 N 4.48 0.00 0.00 1.54 4.27 -1.20 -0.84 117.44 125.69 1h4i n TRP 243 Ca -0.13 -0.53 0.00 0.00 -3.89 0.00 0.00 57.50 52.96 1h4i n TRP 243 Cb 0.42 -0.07 0.00 0.00 -1.36 0.00 0.00 31.31 30.30 1h4i n TRP 243 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1h4i n GLY 244 N -0.64 0.62 3.54 -1.67 0.00 -1.26 -4.47 105.19 101.32 1h4i n GLY 244 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 1h4i n GLY 244 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1h4i s TRP 245 N 2.56 2.34 0.30 1.61 0.52 -1.22 -4.66 118.94 120.39 1h4i s TRP 245 Ca 0.00 -0.63 0.05 0.00 0.02 0.00 0.00 56.10 55.54 1h4i s TRP 245 Cb 0.00 -1.47 -0.06 0.00 -1.15 0.00 0.00 33.47 30.79 1h4i s TRP 245 CO 0.00 0.45 0.01 0.71 0.02 0.00 0.00 176.95 178.13 1h4i s TYR 246 N -2.76 1.95 0.08 -1.98 1.51 -1.26 -4.52 117.35 110.36 1h4i s TYR 246 Ca 0.33 -0.84 -0.06 0.00 -1.01 0.00 0.00 57.07 55.49 1h4i s TYR 246 Cb 0.06 -1.21 -0.01 0.00 -0.11 0.00 0.00 41.96 40.68 1h4i s TYR 246 CO 0.16 0.13 0.12 0.00 -1.11 0.00 0.00 175.55 174.86 1h4i s ALA 247 N -3.17 0.04 -0.10 3.71 0.00 -0.86 -4.72 121.76 116.65 1h4i s ALA 247 Ca 0.33 -0.83 -0.09 0.00 0.00 0.00 0.00 51.96 51.37 1h4i s ALA 247 Cb 0.07 0.45 0.03 0.00 0.00 0.00 0.00 23.12 23.66 1h4i s ALA 247 CO 0.14 -0.47 0.26 -0.47 0.00 0.00 0.00 175.76 175.21 1h4i s TYR 248 N -3.89 -0.29 -0.28 0.00 5.04 -0.71 -0.95 117.35 116.27 1h4i s TYR 248 Ca 0.07 0.70 0.02 0.00 -2.44 0.00 0.00 57.07 55.41 1h4i s TYR 248 Cb 0.06 0.09 0.06 0.00 0.35 0.00 0.00 41.96 42.53 1h4i s TYR 248 CO -0.10 -0.14 -0.05 0.34 -1.34 0.00 0.00 175.55 174.25 1h4i s ASP 249 N 0.23 4.62 0.58 4.32 -1.08 -1.00 -4.33 116.67 120.02 1h4i s ASP 249 Ca -0.01 -1.48 0.28 0.00 -0.52 0.00 0.00 52.55 50.83 1h4i s ASP 249 Cb -0.02 -1.61 1.71 0.00 -1.46 0.00 0.00 42.92 41.53 1h4i s ASP 249 CO -0.00 -0.24 2.18 -0.65 0.52 0.00 0.00 175.17 176.98 1h4i h PRO 250 N 7.82 0.00 -0.04 4.34 0.11 -1.95 0.20 132.00 142.49 1h4i h PRO 250 Ca -0.18 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.83 1h4i h PRO 250 Cb 1.04 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1h4i h PRO 250 CO 0.49 0.00 -0.47 0.78 -0.21 0.00 0.00 178.00 178.59 1h4i h GLY 251 N 0.00 0.11 0.00 -0.55 0.00 -1.97 -3.18 103.07 97.48 1h4i h GLY 251 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1h4i h GLY 251 CO -0.00 0.10 -0.98 -1.30 0.00 0.00 0.00 176.54 174.36 1h4i n THR 252 N -3.97 0.00 -1.38 4.70 -2.24 -0.92 -4.98 114.28 105.49 1h4i n THR 252 Ca -0.02 -0.22 -0.13 0.00 -2.27 0.00 0.00 64.05 61.41 1h4i n THR 252 Cb 0.51 0.74 -0.06 0.00 -2.10 0.00 0.00 70.33 69.41 1h4i n THR 252 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1h4i n ASN 253 N -1.54 -5.16 -4.88 3.42 5.15 0.67 -4.97 115.26 107.95 1h4i n ASN 253 Ca 0.01 0.32 -0.36 0.00 -0.60 0.00 0.00 54.58 53.95 1h4i n ASN 253 Cb 0.27 -3.81 -0.06 0.00 -0.53 0.00 0.00 39.78 35.65 1h4i n ASN 253 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1h4i s LEU 254 N -2.98 4.40 -0.18 1.20 1.43 -1.20 -0.48 118.68 120.87 1h4i s LEU 254 Ca 0.00 0.55 -0.08 0.00 -1.03 0.00 0.00 54.13 53.57 1h4i s LEU 254 Cb 0.00 -2.30 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 1h4i s LEU 254 CO 0.00 0.36 0.09 0.27 0.23 0.00 0.00 176.35 177.30 1h4i s ILE 255 N -1.11 5.03 -0.11 -0.59 -4.36 0.47 -2.38 121.20 118.16 1h4i s ILE 255 Ca 0.19 0.05 -0.03 0.00 -0.26 0.00 0.00 60.65 60.60 1h4i s ILE 255 Cb -0.13 -3.26 -0.03 0.00 1.25 0.00 0.00 42.46 40.28 1h4i s ILE 255 CO 0.09 0.47 0.01 -0.31 0.24 0.00 0.00 174.94 175.44 1h4i s TYR 256 N 0.20 3.19 0.04 1.37 2.02 -0.13 -1.56 117.35 122.47 1h4i s TYR 256 Ca 0.06 0.15 -0.28 0.00 -0.37 0.00 0.00 57.07 56.63 1h4i s TYR 256 Cb -0.12 -1.85 0.10 0.00 -0.40 0.00 0.00 41.96 39.69 1h4i s TYR 256 CO -0.00 0.40 1.09 -0.59 -1.57 0.00 0.00 175.55 174.88 1h4i s PHE 257 N -0.63 -0.13 0.16 2.71 -0.12 -1.12 -2.03 117.98 116.83 1h4i s PHE 257 Ca 0.10 -0.06 0.10 0.00 -0.05 0.00 0.00 56.93 57.03 1h4i s PHE 257 Cb -0.12 0.58 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 1h4i s PHE 257 CO 0.02 -0.53 -0.21 0.20 -0.05 0.00 0.00 175.22 174.65 1h4i s GLY 258 N -2.82 1.68 0.08 1.99 0.00 -1.26 -0.97 107.32 106.03 1h4i s GLY 258 Ca 0.12 -1.51 -0.02 0.00 0.00 0.00 0.00 44.72 43.30 1h4i s GLY 258 CO -0.02 -1.52 0.27 -0.51 0.00 0.00 0.00 173.10 171.32 1h4i s THR 259 N -1.43 5.31 0.00 0.90 -4.23 -0.67 -4.37 115.64 111.16 1h4i s THR 259 Ca 0.19 -0.22 0.00 0.00 -1.18 0.00 0.00 61.69 60.49 1h4i s THR 259 Cb -0.09 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.13 1h4i s THR 259 CO 0.10 0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.91 1h4i n GLY 260 N 0.28 -2.05 3.80 3.99 0.00 0.10 -2.23 105.19 109.08 1h4i n GLY 260 Ca -0.05 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 1h4i n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h4i s ASN 261 N -1.35 5.84 0.58 1.61 4.22 -1.26 -1.38 114.94 123.19 1h4i s ASN 261 Ca 0.00 1.86 -0.14 0.00 -2.14 0.00 0.00 52.86 52.44 1h4i s ASN 261 Cb 0.00 -2.54 -0.05 0.00 1.28 0.00 0.00 41.25 39.94 1h4i s ASN 261 CO 0.00 -1.13 1.02 -2.16 -2.04 0.00 0.00 177.10 172.79 1h4i s PRO 262 N -3.89 3.66 -0.01 3.55 0.04 -1.26 -0.73 135.00 136.37 1h4i s PRO 262 Ca 0.65 0.92 0.05 0.00 0.04 0.00 0.00 61.00 62.66 1h4i s PRO 262 Cb -0.17 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 1h4i s PRO 262 CO 0.34 -0.51 -0.16 0.00 0.04 0.00 0.00 177.00 176.70 1h4i s ALA 263 N -2.83 2.61 0.93 8.56 0.00 -0.93 -4.45 121.76 125.65 1h4i s ALA 263 Ca 0.58 -1.08 -0.11 0.00 0.00 0.00 0.00 51.96 51.36 1h4i s ALA 263 Cb -0.11 -0.85 0.18 0.00 0.00 0.00 0.00 23.12 22.33 1h4i s ALA 263 CO 0.42 0.56 1.08 -0.35 0.00 0.00 0.00 175.76 177.47 1h4i n PRO 264 N 1.99 -0.86 0.18 0.00 -0.04 -1.26 -4.59 135.00 130.42 1h4i n PRO 264 Ca -0.17 -1.90 0.05 0.00 -0.04 0.00 0.00 63.50 61.44 1h4i n PRO 264 Cb 0.52 -1.04 0.33 0.00 -0.04 0.00 0.00 33.50 33.28 1h4i n PRO 264 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1h4i h TRP 265 N -1.41 0.00 -2.14 0.54 4.06 -0.92 -3.41 115.95 112.66 1h4i h TRP 265 Ca -0.35 0.00 -0.52 0.00 2.06 0.00 0.00 58.89 60.08 1h4i h TRP 265 Cb 1.03 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.16 1h4i h TRP 265 CO 0.00 0.40 1.38 1.21 -3.56 0.00 0.00 178.44 177.87 1h4i s ASN 266 N -6.53 5.34 0.45 -3.49 3.84 -1.15 -4.81 114.94 108.58 1h4i s ASN 266 Ca -0.01 0.85 0.15 0.00 0.21 0.00 0.00 52.86 54.06 1h4i s ASN 266 Cb 0.12 -2.52 1.04 0.00 -0.55 0.00 0.00 41.25 39.34 1h4i s ASN 266 CO 0.70 -2.23 2.00 1.05 -2.79 0.00 0.00 177.10 175.83 1h4i h GLU 267 N 15.07 0.00 0.00 0.43 -0.00 -1.84 -2.66 114.58 125.58 1h4i h GLU 267 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.07 1h4i h GLU 267 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.94 1h4i h GLU 267 CO 1.14 0.17 0.00 1.15 -0.00 0.00 0.00 179.01 181.47 1h4i h THR 268 N 0.00 0.00 -0.03 -1.06 2.02 -1.91 -2.51 112.91 109.41 1h4i h THR 268 Ca -0.00 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.91 1h4i h THR 268 Cb 0.31 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1h4i h THR 268 CO 0.02 0.00 0.00 0.23 0.37 0.00 0.00 175.52 176.14 1h4i n MET 269 N -2.71 1.72 -3.05 6.66 2.81 -1.00 -4.55 117.12 117.00 1h4i n MET 269 Ca 0.00 -1.05 -0.17 0.00 -1.81 0.00 0.00 57.70 54.66 1h4i n MET 269 Cb 0.20 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.21 1h4i n MET 269 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 1h4i n ARG 270 N 0.28 0.59 -1.79 0.03 1.85 -0.95 -4.95 116.66 111.72 1h4i n ARG 270 Ca 0.18 -2.64 -0.39 0.00 -1.00 0.00 0.00 57.85 54.00 1h4i n ARG 270 Cb 0.37 -1.42 0.03 0.00 -1.05 0.00 0.00 32.46 30.40 1h4i n ARG 270 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1h4i s PRO 271 N -0.11 3.37 0.00 2.89 0.04 -1.26 -4.87 135.00 135.05 1h4i s PRO 271 Ca 0.33 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.67 1h4i s PRO 271 Cb 0.13 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1h4i s PRO 271 CO -0.16 -1.03 0.00 0.41 0.04 0.00 0.00 177.00 176.26 1h4i n GLY 272 N 0.66 3.14 0.13 0.56 0.00 -1.26 -3.95 105.19 104.48 1h4i n GLY 272 Ca 0.08 -1.99 0.11 0.00 0.00 0.00 0.00 46.02 44.22 1h4i n GLY 272 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h4i n ASP 273 N 0.00 0.59 -3.74 1.61 9.92 -1.12 -4.04 116.55 119.78 1h4i n ASP 273 Ca 0.00 0.69 -0.24 0.00 -0.53 0.00 0.00 54.79 54.72 1h4i n ASP 273 Cb 0.00 -0.80 0.04 0.00 -0.64 0.00 0.00 41.12 39.72 1h4i n ASP 273 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1h4i n ASN 274 N -2.20 -2.41 -4.65 -2.24 5.03 -0.32 -1.59 115.26 106.88 1h4i n ASN 274 Ca 0.01 -0.79 -0.40 0.00 0.87 0.00 0.00 54.58 54.28 1h4i n ASN 274 Cb 0.15 -4.12 0.03 0.00 -1.02 0.00 0.00 39.78 34.82 1h4i n ASN 274 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1h4i n LYS 275 N -4.41 1.37 -0.69 3.52 5.02 -1.26 -3.17 118.16 118.54 1h4i n LYS 275 Ca -0.20 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.60 1h4i n LYS 275 Cb 0.63 -2.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 1h4i n LYS 275 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1h4i n TRP 276 N -0.92 0.00 -3.05 2.13 5.03 -1.26 -4.52 117.44 114.85 1h4i n TRP 276 Ca 0.10 0.00 -0.31 0.00 3.03 0.00 0.00 57.50 60.33 1h4i n TRP 276 Cb 0.43 0.00 -0.04 0.00 -1.03 0.00 0.00 31.31 30.67 1h4i n TRP 276 CO 0.00 0.00 0.00 0.95 -0.03 0.00 0.00 177.69 178.61 1h4i s THR 277 N -3.52 4.81 -1.52 -0.99 -4.23 -1.19 -3.94 115.64 105.07 1h4i s THR 277 Ca 0.00 0.60 -0.05 0.00 -1.18 0.00 0.00 61.69 61.06 1h4i s THR 277 Cb 0.00 -3.69 0.01 0.00 1.34 0.00 0.00 72.50 70.16 1h4i s THR 277 CO 0.00 -0.36 0.60 0.23 -0.54 0.00 0.00 174.62 174.55 1h4i n MET 278 N -0.90 -4.84 -4.57 3.99 2.81 -0.48 -4.82 117.12 108.31 1h4i n MET 278 Ca 0.02 0.89 -0.24 0.00 -1.81 0.00 0.00 57.70 56.56 1h4i n MET 278 Cb 0.54 -5.71 -0.14 0.00 -0.71 0.00 0.00 33.22 27.20 1h4i n MET 278 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1h4i s THR 279 N -3.17 1.43 -0.32 2.03 -4.23 -1.24 -1.01 115.64 109.13 1h4i s THR 279 Ca 0.30 -1.05 -0.26 0.00 -1.18 0.00 0.00 61.69 59.49 1h4i s THR 279 Cb -0.13 -1.25 0.01 0.00 1.34 0.00 0.00 72.50 72.47 1h4i s THR 279 CO 0.37 0.17 0.93 -0.63 -0.54 0.00 0.00 174.62 174.92 1h4i s ILE 280 N -0.75 4.65 0.19 2.99 1.01 0.06 -1.67 121.20 127.68 1h4i s ILE 280 Ca 0.05 1.42 0.07 0.00 0.00 0.00 0.00 60.65 62.19 1h4i s ILE 280 Cb -0.08 -4.29 -0.04 0.00 0.01 0.00 0.00 42.46 38.06 1h4i s ILE 280 CO 0.01 -0.39 0.07 -0.36 0.00 0.00 0.00 174.94 174.28 1h4i s PHE 281 N 3.32 2.97 -0.24 3.97 0.40 -0.14 -1.25 117.98 127.01 1h4i s PHE 281 Ca 0.39 -0.10 -0.02 0.00 -0.60 0.00 0.00 56.93 56.60 1h4i s PHE 281 Cb -0.13 -1.41 0.07 0.00 0.51 0.00 0.00 43.02 42.06 1h4i s PHE 281 CO 0.14 0.53 0.05 0.20 0.70 0.00 0.00 175.22 176.84 1h4i s GLY 282 N -3.18 0.87 0.02 4.36 0.00 -0.93 -2.78 107.32 105.69 1h4i s GLY 282 Ca 0.30 -1.07 0.07 0.00 0.00 0.00 0.00 44.72 44.01 1h4i s GLY 282 CO 0.21 1.45 -0.19 0.50 0.00 0.00 0.00 173.10 175.07 1h4i s ARG 283 N 1.74 2.11 0.17 2.90 0.52 -0.60 -0.75 118.95 125.05 1h4i s ARG 283 Ca 0.02 -0.95 -0.31 0.00 -0.52 0.00 0.00 55.73 53.97 1h4i s ARG 283 Cb -0.17 -2.18 -0.09 0.00 0.52 0.00 0.00 34.95 33.02 1h4i s ARG 283 CO -0.14 0.55 1.45 0.34 0.02 0.00 0.00 175.30 177.52 1h4i s ASP 284 N -1.26 6.72 0.35 0.23 2.15 0.11 -0.40 116.67 124.57 1h4i s ASP 284 Ca 0.14 2.50 0.02 0.00 0.43 0.00 0.00 52.55 55.64 1h4i s ASP 284 Cb -0.10 -2.60 0.64 0.00 -0.30 0.00 0.00 42.92 40.55 1h4i s ASP 284 CO 0.04 -0.70 2.00 0.00 -0.17 0.00 0.00 175.17 176.34 1h4i h ALA 285 N 6.21 1.54 0.06 3.66 0.00 -1.13 0.29 119.26 129.88 1h4i h ALA 285 Ca -0.43 -0.05 -0.30 0.00 0.00 0.00 0.00 54.91 54.12 1h4i h ALA 285 Cb 1.21 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1h4i h ALA 285 CO 0.85 0.42 -1.63 -0.44 0.00 0.00 0.00 179.25 178.45 1h4i h ASP 286 N 0.84 0.19 0.00 0.00 3.45 -1.91 -3.40 116.42 115.59 1h4i h ASP 286 Ca 0.22 -0.34 0.00 0.00 0.43 0.00 0.00 57.03 57.35 1h4i h ASP 286 Cb -0.07 -0.06 0.00 0.00 -0.56 0.00 0.00 39.33 38.63 1h4i h ASP 286 CO -0.05 1.29 -1.16 0.35 -1.57 0.00 0.00 179.24 178.11 1h4i n THR 287 N -3.28 0.00 -0.98 0.35 -2.24 -1.22 -4.91 114.28 101.99 1h4i n THR 287 Ca -0.17 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1h4i n THR 287 Cb 1.04 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.74 1h4i n THR 287 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h4i n GLY 288 N 1.77 0.61 3.72 3.38 0.00 0.10 -4.91 105.19 109.86 1h4i n GLY 288 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1h4i n GLY 288 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h4i s GLU 289 N -0.17 4.43 -0.18 1.61 2.02 -1.26 -4.47 118.70 120.69 1h4i s GLU 289 Ca 0.00 1.89 -0.29 0.00 0.02 0.00 0.00 54.97 56.59 1h4i s GLU 289 Cb 0.00 -3.27 -0.01 0.00 0.10 0.00 0.00 34.13 30.95 1h4i s GLU 289 CO 0.00 -0.23 1.19 0.00 0.02 0.00 0.00 175.26 176.24 1h4i s ALA 290 N 0.56 3.66 -0.03 5.21 0.00 -0.36 -0.72 121.76 130.09 1h4i s ALA 290 Ca 0.57 0.38 -0.00 0.00 0.00 0.00 0.00 51.96 52.91 1h4i s ALA 290 Cb -0.33 -3.59 -0.26 0.00 0.00 0.00 0.00 23.12 18.94 1h4i s ALA 290 CO 0.33 -1.11 0.73 0.87 0.00 0.00 0.00 175.76 176.58 1h4i h LYS 291 N 7.93 0.19 -3.32 0.00 1.57 -1.30 -1.39 116.57 120.26 1h4i h LYS 291 Ca -0.25 -0.33 -0.09 0.00 -1.87 0.00 0.00 60.65 58.11 1h4i h LYS 291 Cb 1.09 0.12 -0.16 0.00 0.08 0.00 0.00 32.23 33.36 1h4i h LYS 291 CO 0.97 1.00 -0.23 -0.59 -0.57 0.00 0.00 179.45 180.03 1h4i s PHE 292 N -2.60 -0.11 -0.25 -1.35 -0.12 -1.19 -1.59 117.98 110.76 1h4i s PHE 292 Ca -0.11 -0.05 -0.04 0.00 -0.05 0.00 0.00 56.93 56.68 1h4i s PHE 292 Cb 0.07 0.11 0.14 0.00 -0.63 0.00 0.00 43.02 42.71 1h4i s PHE 292 CO 0.83 -0.53 0.48 0.20 -0.05 0.00 0.00 175.22 176.15 1h4i s GLY 293 N -2.18 -0.59 -0.27 1.99 0.00 -1.26 -2.18 107.32 102.83 1h4i s GLY 293 Ca -0.04 1.46 -0.05 0.00 0.00 0.00 0.00 44.72 46.09 1h4i s GLY 293 CO -0.05 2.84 0.03 -0.47 0.00 0.00 0.00 173.10 175.45 1h4i s TYR 294 N 2.69 3.10 -0.38 1.90 5.04 -0.38 -4.87 117.35 124.45 1h4i s TYR 294 Ca 0.10 -1.09 -0.28 0.00 -2.44 0.00 0.00 57.07 53.35 1h4i s TYR 294 Cb -0.14 -2.18 0.02 0.00 0.35 0.00 0.00 41.96 40.01 1h4i s TYR 294 CO -0.17 -0.60 1.06 -1.14 -1.34 0.00 0.00 175.55 173.36 1h4i s GLN 295 N 1.46 3.91 0.04 4.97 0.74 -1.26 -0.76 119.66 128.75 1h4i s GLN 295 Ca 0.03 0.80 -0.18 0.00 0.05 0.00 0.00 55.36 56.05 1h4i s GLN 295 Cb -0.17 -3.81 -0.18 0.00 1.10 0.00 0.00 33.01 29.96 1h4i s GLN 295 CO -0.00 -1.07 1.22 0.87 -0.55 0.00 0.00 175.29 175.77 1h4i h LYS 296 N 8.53 0.49 -3.14 1.67 1.57 -1.39 -3.41 116.57 120.89 1h4i h LYS 296 Ca -0.22 -0.39 -0.62 0.00 -1.87 0.00 0.00 60.65 57.54 1h4i h LYS 296 Cb 1.06 0.08 -0.41 0.00 0.08 0.00 0.00 32.23 33.05 1h4i h LYS 296 CO 1.05 1.03 -0.68 0.99 -0.57 0.00 0.00 179.45 181.26 1h4i s THR 297 N -3.68 2.00 0.30 -0.16 2.01 -1.25 -4.72 115.64 110.15 1h4i s THR 297 Ca -0.13 -3.04 -0.29 0.00 0.31 0.00 0.00 61.69 58.54 1h4i s THR 297 Cb 0.05 -2.39 -0.10 0.00 0.01 0.00 0.00 72.50 70.08 1h4i s THR 297 CO 0.82 -0.88 1.27 -2.84 -0.69 0.00 0.00 174.62 172.30 1h4i s PRO 298 N -0.10 4.42 -0.82 4.92 0.02 -1.26 -3.71 135.00 138.47 1h4i s PRO 298 Ca 0.19 2.11 -0.02 0.00 0.02 0.00 0.00 61.00 63.30 1h4i s PRO 298 Cb -0.22 -3.12 -0.00 0.00 0.02 0.00 0.00 34.50 31.18 1h4i s PRO 298 CO -0.02 -0.12 0.66 1.58 -0.33 0.00 0.00 177.00 178.76 1h4i n HIS 299 N 1.22 -2.38 -1.68 6.54 -0.00 -0.62 -4.86 115.22 113.43 1h4i n HIS 299 Ca 0.01 0.91 -0.44 0.00 -0.00 0.00 0.00 57.72 58.20 1h4i n HIS 299 Cb 0.42 -3.33 -0.02 0.00 -0.00 0.00 0.00 29.99 27.06 1h4i n HIS 299 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 1h4i n ASP 300 N -2.30 2.85 0.00 0.26 4.64 -1.24 -4.90 116.55 115.86 1h4i n ASP 300 Ca -0.18 1.16 0.00 0.00 -1.38 0.00 0.00 54.79 54.39 1h4i n ASP 300 Cb 0.61 -1.46 0.00 0.00 -1.04 0.00 0.00 41.12 39.23 1h4i n ASP 300 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 1h4i n GLU 301 N 1.64 1.12 -0.06 -0.67 1.02 -1.26 -4.70 120.64 117.73 1h4i n GLU 301 Ca 0.09 -0.88 0.00 0.00 -0.02 0.00 0.00 57.16 56.36 1h4i n GLU 301 Cb 0.33 -0.81 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 1h4i n GLU 301 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 1h4i n TRP 302 N -0.22 0.00 -3.53 -0.32 8.01 -1.26 -4.49 117.44 115.64 1h4i n TRP 302 Ca 0.00 -0.01 -0.19 0.00 -1.31 0.00 0.00 57.50 56.00 1h4i n TRP 302 Cb 0.27 -0.01 0.07 0.00 -2.01 0.00 0.00 31.31 29.63 1h4i n TRP 302 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1h4i n ASP 303 N -0.01 -2.04 -2.53 -0.99 2.03 -1.26 -3.85 116.55 107.90 1h4i n ASP 303 Ca 0.00 -0.68 -0.28 0.00 0.52 0.00 0.00 54.79 54.35 1h4i n ASP 303 Cb 0.52 -4.78 -0.05 0.00 -0.72 0.00 0.00 41.12 36.10 1h4i n ASP 303 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1h4i n TYR 304 N -4.23 1.73 -0.89 -0.67 0.53 -1.26 -4.69 117.16 107.68 1h4i n TYR 304 Ca -0.27 -1.98 -0.42 0.00 -1.02 0.00 0.00 57.90 54.21 1h4i n TYR 304 Cb 0.66 -1.36 -0.08 0.00 -1.03 0.00 0.00 39.34 37.53 1h4i n TYR 304 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1h4i n ALA 305 N 0.73 0.06 -0.42 -0.72 0.00 -1.26 -4.54 120.51 114.36 1h4i n ALA 305 Ca 0.49 0.15 0.00 0.00 0.00 0.00 0.00 53.44 54.08 1h4i n ALA 305 Cb 0.52 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1h4i n ALA 305 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h4i n GLY 306 N 4.97 2.31 0.59 0.00 0.00 -1.14 -4.44 105.19 107.49 1h4i n GLY 306 Ca 0.37 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.51 1h4i n GLY 306 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1h4i n VAL 307 N 1.52 0.14 -0.59 1.61 0.24 -1.26 -3.58 118.33 116.41 1h4i n VAL 307 Ca 0.00 -0.35 -0.30 0.00 -2.04 0.00 0.00 64.34 61.65 1h4i n VAL 307 Cb 0.46 0.53 0.21 0.00 -1.47 0.00 0.00 33.84 33.57 1h4i n VAL 307 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1h4i n ASN 308 N 0.41 -1.77 -4.63 -1.34 3.02 -1.26 -3.43 115.26 106.26 1h4i n ASN 308 Ca 0.17 -0.05 -0.43 0.00 -0.03 0.00 0.00 54.58 54.24 1h4i n ASN 308 Cb 0.38 -1.18 -0.01 0.00 -0.61 0.00 0.00 39.78 38.36 1h4i n ASN 308 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1h4i n VAL 309 N -4.62 2.08 -4.07 2.41 3.14 -1.26 -4.48 118.33 111.53 1h4i n VAL 309 Ca 0.03 -0.50 -0.34 0.00 -2.96 0.00 0.00 64.34 60.57 1h4i n VAL 309 Cb 0.56 -1.22 -0.14 0.00 -1.06 0.00 0.00 33.84 31.98 1h4i n VAL 309 CO 0.00 0.00 0.00 -0.04 -6.46 0.00 0.00 176.83 170.33 1h4i s MET 310 N -1.76 3.36 -0.17 1.45 -1.94 -1.26 -4.30 119.30 114.68 1h4i s MET 310 Ca 0.58 -0.65 0.01 0.00 -1.71 0.00 0.00 55.69 53.92 1h4i s MET 310 Cb -0.63 -2.91 0.03 0.00 2.01 0.00 0.00 34.83 33.33 1h4i s MET 310 CO 0.60 -0.12 -0.15 -1.64 -0.01 0.00 0.00 175.02 173.70 1h4i s MET 311 N 1.25 2.43 0.14 2.03 -1.94 -0.44 -4.65 119.30 118.13 1h4i s MET 311 Ca 0.03 -0.72 -0.16 0.00 -1.71 0.00 0.00 55.69 53.13 1h4i s MET 311 Cb -0.14 -2.32 -0.07 0.00 2.01 0.00 0.00 34.83 34.30 1h4i s MET 311 CO -0.03 -0.28 0.56 -0.51 -0.01 0.00 0.00 175.02 174.76 1h4i s LEU 312 N 1.40 4.37 0.25 -0.03 1.43 -0.38 -0.32 118.68 125.40 1h4i s LEU 312 Ca 0.03 1.13 -0.15 0.00 -1.03 0.00 0.00 54.13 54.11 1h4i s LEU 312 Cb -0.14 -3.21 0.00 0.00 0.03 0.00 0.00 46.19 42.87 1h4i s LEU 312 CO -0.11 0.13 0.54 -0.94 0.23 0.00 0.00 176.35 176.20 1h4i s SER 313 N -1.60 -0.14 -0.19 2.29 1.04 -0.91 -4.86 113.70 109.33 1h4i s SER 313 Ca 0.36 -0.82 -0.02 0.00 0.48 0.00 0.00 55.95 55.96 1h4i s SER 313 Cb -0.16 0.62 0.05 0.00 0.10 0.00 0.00 66.02 66.63 1h4i s SER 313 CO 0.19 -1.18 -0.00 -1.61 0.98 0.00 0.00 173.24 171.62 1h4i s GLU 314 N -3.98 0.99 0.11 4.02 2.02 -1.26 -0.04 118.70 120.56 1h4i s GLU 314 Ca 0.19 -0.51 0.01 0.00 0.02 0.00 0.00 54.97 54.68 1h4i s GLU 314 Cb -0.02 -2.09 -0.04 0.00 0.10 0.00 0.00 34.13 32.08 1h4i s GLU 314 CO 0.07 -0.56 -0.03 -0.65 0.02 0.00 0.00 175.26 174.11 1h4i s GLN 315 N 1.73 0.86 -0.03 1.61 -0.21 -1.05 -4.93 119.66 117.64 1h4i s GLN 315 Ca -0.01 -1.37 -0.23 0.00 0.02 0.00 0.00 55.36 53.77 1h4i s GLN 315 Cb -0.17 -0.09 -0.04 0.00 1.00 0.00 0.00 33.01 33.71 1h4i s GLN 315 CO -0.07 -0.09 0.70 0.15 -2.12 0.00 0.00 175.29 173.86 1h4i s LYS 316 N -3.89 4.43 0.00 2.91 1.02 -1.26 -0.14 119.74 122.81 1h4i s LYS 316 Ca 0.15 0.90 0.00 0.00 0.02 0.00 0.00 55.97 57.04 1h4i s LYS 316 Cb 0.06 -3.41 0.00 0.00 -0.52 0.00 0.00 37.83 33.96 1h4i s LYS 316 CO -0.03 0.16 0.00 -0.40 -0.92 0.00 0.00 175.35 174.16 1h4i n ASP 317 N 3.41 -0.37 0.27 2.83 5.68 0.13 -4.82 116.55 123.68 1h4i n ASP 317 Ca -0.02 -0.55 0.14 0.00 -0.50 0.00 0.00 54.79 53.86 1h4i n ASP 317 Cb 0.51 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 41.22 1h4i n ASP 317 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1h4i h LYS 318 N 0.00 0.00 -0.30 0.11 1.57 -1.91 -2.43 116.57 113.62 1h4i h LYS 318 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h4i h LYS 318 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1h4i h LYS 318 CO 0.00 0.10 0.00 -0.25 -0.57 0.00 0.00 179.45 178.73 1h4i n ASP 319 N -3.40 2.29 0.00 0.86 8.00 -1.26 -4.91 116.55 118.13 1h4i n ASP 319 Ca -0.01 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.63 1h4i n ASP 319 Cb 0.27 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 1h4i n ASP 319 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1h4i n GLY 320 N 1.24 0.77 3.72 0.44 0.00 -0.91 -5.02 105.19 105.42 1h4i n GLY 320 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1h4i n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h4i s LYS 321 N -0.22 4.60 -0.32 1.61 1.02 -1.26 -4.70 119.74 120.47 1h4i s LYS 321 Ca 0.00 1.38 -0.29 0.00 0.02 0.00 0.00 55.97 57.07 1h4i s LYS 321 Cb 0.00 -3.42 0.01 0.00 -0.52 0.00 0.00 37.83 33.90 1h4i s LYS 321 CO 0.00 0.08 1.13 0.00 -0.92 0.00 0.00 175.35 175.63 1h4i s ALA 322 N 0.56 3.46 0.19 5.17 0.00 -1.26 0.22 121.76 130.10 1h4i s ALA 322 Ca 0.48 -0.02 0.07 0.00 0.00 0.00 0.00 51.96 52.49 1h4i s ALA 322 Cb -0.22 -3.70 -0.04 0.00 0.00 0.00 0.00 23.12 19.16 1h4i s ALA 322 CO 0.28 -1.56 0.07 1.03 0.00 0.00 0.00 175.76 175.58 1h4i s ARG 323 N 3.78 2.63 -0.37 0.00 1.81 0.80 -4.95 118.95 122.64 1h4i s ARG 323 Ca 0.48 -1.05 -0.13 0.00 -1.72 0.00 0.00 55.73 53.31 1h4i s ARG 323 Cb -0.13 -2.46 0.01 0.00 -0.45 0.00 0.00 34.95 31.92 1h4i s ARG 323 CO 0.17 0.45 0.24 0.15 -0.68 0.00 0.00 175.30 175.63 1h4i s LYS 324 N -3.18 3.09 0.41 3.54 -0.14 -1.26 -2.53 119.74 119.67 1h4i s LYS 324 Ca 0.30 -0.92 0.07 0.00 -1.36 0.00 0.00 55.97 54.06 1h4i s LYS 324 Cb -0.09 -3.81 -0.06 0.00 -1.68 0.00 0.00 37.83 32.18 1h4i s LYS 324 CO 0.21 -0.63 0.10 -0.51 -0.76 0.00 0.00 175.35 173.77 1h4i s LEU 325 N 1.64 3.01 -0.02 3.17 1.43 0.94 -0.33 118.68 128.53 1h4i s LEU 325 Ca 0.04 -1.21 0.01 0.00 -1.03 0.00 0.00 54.13 51.95 1h4i s LEU 325 Cb -0.18 -1.20 0.01 0.00 0.03 0.00 0.00 46.19 44.85 1h4i s LEU 325 CO 0.09 -0.49 -0.03 -1.48 0.23 0.00 0.00 176.35 174.67 1h4i s LEU 326 N -3.81 1.63 -0.07 1.79 0.05 -0.69 -2.14 118.68 115.44 1h4i s LEU 326 Ca 0.38 -0.06 0.05 0.00 0.05 0.00 0.00 54.13 54.55 1h4i s LEU 326 Cb 0.06 -0.24 -0.01 0.00 -2.05 0.00 0.00 46.19 43.96 1h4i s LEU 326 CO 0.20 -0.02 -0.23 -0.89 -0.55 0.00 0.00 176.35 174.87 1h4i s THR 327 N 0.42 1.92 -0.27 5.48 2.01 0.56 -1.67 115.64 124.08 1h4i s THR 327 Ca -0.04 -0.97 -0.02 0.00 0.31 0.00 0.00 61.69 60.96 1h4i s THR 327 Cb -0.07 -1.64 0.12 0.00 0.01 0.00 0.00 72.50 70.92 1h4i s THR 327 CO -0.01 0.53 0.23 -2.28 -0.69 0.00 0.00 174.62 172.40 1h4i s HIS 328 N 0.02 -0.17 -0.46 4.92 5.04 0.97 -1.32 115.29 124.29 1h4i s HIS 328 Ca -0.08 -0.35 -0.29 0.00 -1.54 0.00 0.00 55.06 52.81 1h4i s HIS 328 Cb -0.14 -0.59 0.03 0.00 0.04 0.00 0.00 32.58 31.91 1h4i s HIS 328 CO 0.05 -0.84 1.17 -1.25 -2.34 0.00 0.00 174.74 171.53 1h4i s PRO 329 N 2.27 3.72 0.62 2.88 0.04 -1.26 -1.11 135.00 142.15 1h4i s PRO 329 Ca 0.09 0.65 -0.04 0.00 0.04 0.00 0.00 61.00 61.74 1h4i s PRO 329 Cb -0.15 -3.91 0.04 0.00 0.04 0.00 0.00 34.50 30.51 1h4i s PRO 329 CO -0.31 -1.38 0.90 0.34 0.04 0.00 0.00 177.00 176.59 1h4i s ASP 330 N 2.62 5.18 0.31 6.66 2.15 -0.43 -4.72 116.67 128.44 1h4i s ASP 330 Ca 0.50 0.36 0.02 0.00 0.43 0.00 0.00 52.55 53.85 1h4i s ASP 330 Cb -0.08 -1.19 0.49 0.00 -0.30 0.00 0.00 42.92 41.84 1h4i s ASP 330 CO 0.31 -1.29 1.84 0.03 -0.17 0.00 0.00 175.17 175.88 1h4i h ARG 331 N -0.24 0.65 0.00 4.34 2.47 -1.81 -2.99 114.38 116.79 1h4i h ARG 331 Ca -0.44 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.13 1h4i h ARG 331 Cb 1.29 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 1h4i h ARG 331 CO 0.58 0.65 0.00 0.27 0.56 0.00 0.00 179.97 182.03 1h4i n ASN 332 N -4.26 0.00 0.00 7.04 0.23 -1.26 -2.40 115.26 114.61 1h4i n ASN 332 Ca 0.02 -0.21 0.00 0.00 -0.53 0.00 0.00 54.58 53.87 1h4i n ASN 332 Cb 0.26 -0.03 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 1h4i n ASN 332 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1h4i n GLY 333 N -0.51 0.70 3.35 4.83 0.00 -1.13 -4.68 105.19 107.75 1h4i n GLY 333 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1h4i n GLY 333 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h4i s ILE 334 N -2.43 2.63 -0.22 -0.61 -1.09 -1.26 -0.08 121.20 118.14 1h4i s ILE 334 Ca 0.00 -0.85 -0.14 0.00 -2.23 0.00 0.00 60.65 57.43 1h4i s ILE 334 Cb 0.00 -2.03 -0.04 0.00 -1.58 0.00 0.00 42.46 38.81 1h4i s ILE 334 CO 0.00 0.56 0.32 -0.69 -1.23 0.00 0.00 174.94 173.90 1h4i s VAL 335 N -0.11 5.25 -0.10 2.92 1.01 0.11 -1.32 120.40 128.17 1h4i s VAL 335 Ca -0.03 0.52 -0.02 0.00 0.00 0.00 0.00 61.98 62.45 1h4i s VAL 335 Cb -0.14 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 1h4i s VAL 335 CO 0.04 0.28 0.01 -0.31 0.00 0.00 0.00 175.10 175.11 1h4i s TYR 336 N 1.25 3.17 -0.15 5.22 1.51 -0.27 -1.43 117.35 126.66 1h4i s TYR 336 Ca 0.15 0.17 0.00 0.00 -1.01 0.00 0.00 57.07 56.38 1h4i s TYR 336 Cb -0.14 -1.82 0.03 0.00 -0.11 0.00 0.00 41.96 39.92 1h4i s TYR 336 CO 0.07 0.43 -0.11 0.99 -1.11 0.00 0.00 175.55 175.82 1h4i s THR 337 N -0.76 1.41 0.24 -0.71 2.01 0.49 -0.02 115.64 118.30 1h4i s THR 337 Ca 0.12 -0.58 0.10 0.00 0.31 0.00 0.00 61.69 61.64 1h4i s THR 337 Cb -0.12 -1.38 -0.05 0.00 0.01 0.00 0.00 72.50 70.97 1h4i s THR 337 CO 0.02 0.38 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.40 1h4i s LEU 338 N 1.55 2.56 -0.17 4.42 1.43 -0.67 -0.14 118.68 127.66 1h4i s LEU 338 Ca 0.04 -1.01 -0.29 0.00 -1.03 0.00 0.00 54.13 51.84 1h4i s LEU 338 Cb -0.13 -0.90 -0.01 0.00 0.03 0.00 0.00 46.19 45.17 1h4i s LEU 338 CO -0.10 -0.05 1.20 -0.62 0.23 0.00 0.00 176.35 177.01 1h4i s ASP 339 N -3.36 7.00 0.00 2.29 -1.08 0.97 -1.71 116.67 120.78 1h4i s ASP 339 Ca 0.26 1.63 0.17 0.00 -0.52 0.00 0.00 52.55 54.10 1h4i s ASP 339 Cb -0.03 -2.54 0.85 0.00 -1.46 0.00 0.00 42.92 39.73 1h4i s ASP 339 CO 0.11 -0.72 1.53 -2.11 0.52 0.00 0.00 175.17 174.50 1h4i n ARG 340 N 6.36 0.19 0.03 4.34 1.85 0.55 -0.25 116.66 129.74 1h4i n ARG 340 Ca 0.13 0.14 -0.21 0.00 -1.00 0.00 0.00 57.85 56.91 1h4i n ARG 340 Cb 0.45 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.22 1h4i n ARG 340 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1h4i h THR 341 N 0.00 0.79 0.00 8.89 1.35 -1.91 -3.43 112.91 118.61 1h4i h THR 341 Ca 0.00 -2.46 0.00 0.00 -0.55 0.00 0.00 66.41 63.40 1h4i h THR 341 Cb 0.19 2.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 1h4i h THR 341 CO 0.00 0.85 0.00 -0.90 -0.25 0.00 0.00 175.52 175.22 1h4i n ASP 342 N -3.49 0.10 0.00 5.36 5.68 -1.20 -5.02 116.55 117.98 1h4i n ASP 342 Ca -0.27 -0.46 0.00 0.00 -0.50 0.00 0.00 54.79 53.56 1h4i n ASP 342 Cb 1.06 0.64 0.00 0.00 -1.14 0.00 0.00 41.12 41.68 1h4i n ASP 342 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h4i n GLY 343 N 0.64 0.68 3.74 6.12 0.00 0.66 -4.71 105.19 112.32 1h4i n GLY 343 Ca 0.00 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 1h4i n GLY 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4i s ALA 344 N -2.00 3.64 0.06 4.61 0.00 -1.25 -4.65 121.76 122.18 1h4i s ALA 344 Ca 0.00 1.30 -0.31 0.00 0.00 0.00 0.00 51.96 52.95 1h4i s ALA 344 Cb 0.00 -3.56 -0.07 0.00 0.00 0.00 0.00 23.12 19.49 1h4i s ALA 344 CO 0.00 -0.72 1.40 -0.51 0.00 0.00 0.00 175.76 175.93 1h4i s LEU 345 N -0.04 4.35 -0.21 0.00 1.43 -1.26 -0.02 118.68 122.92 1h4i s LEU 345 Ca 0.61 2.23 -0.12 0.00 -1.03 0.00 0.00 54.13 55.82 1h4i s LEU 345 Cb -0.41 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.14 1h4i s LEU 345 CO 0.40 -0.69 -0.29 0.52 0.23 0.00 0.00 176.35 176.52 1h4i n VAL 346 N 4.32 1.25 -3.75 -1.59 0.31 0.80 -4.89 118.33 114.77 1h4i n VAL 346 Ca 0.12 -0.25 -0.13 0.00 -0.01 0.00 0.00 64.34 64.07 1h4i n VAL 346 Cb 0.43 -1.85 -0.08 0.00 -0.91 0.00 0.00 33.84 31.43 1h4i n VAL 346 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1h4i s SER 347 N -6.88 -0.17 -0.41 4.52 1.04 -0.86 -4.99 113.70 105.94 1h4i s SER 347 Ca -0.30 -0.03 0.04 0.00 0.48 0.00 0.00 55.95 56.15 1h4i s SER 347 Cb 0.11 0.34 0.17 0.00 0.10 0.00 0.00 66.02 66.73 1h4i s SER 347 CO 0.39 -0.52 0.46 0.00 0.98 0.00 0.00 173.24 174.54 1h4i s ALA 348 N -1.86 -0.50 0.23 5.32 0.00 -1.25 -0.38 121.76 123.31 1h4i s ALA 348 Ca -0.10 -1.12 0.05 0.00 0.00 0.00 0.00 51.96 50.79 1h4i s ALA 348 Cb -0.03 -2.14 -0.03 0.00 0.00 0.00 0.00 23.12 20.92 1h4i s ALA 348 CO 0.01 -2.14 0.35 -0.80 0.00 0.00 0.00 175.76 173.19 1h4i s ASN 349 N 1.03 6.32 0.27 0.00 0.01 -0.51 -4.66 114.94 117.40 1h4i s ASN 349 Ca 0.23 0.09 -0.29 0.00 -0.71 0.00 0.00 52.86 52.18 1h4i s ASN 349 Cb -0.07 -1.87 -0.09 0.00 0.41 0.00 0.00 41.25 39.62 1h4i s ASN 349 CO -0.07 -0.05 1.00 -0.54 -1.51 0.00 0.00 177.10 175.93 1h4i s LYS 350 N -3.87 4.73 0.35 -0.60 1.02 -1.26 0.08 119.74 120.19 1h4i s LYS 350 Ca 0.34 1.60 0.15 0.00 0.02 0.00 0.00 55.97 58.08 1h4i s LYS 350 Cb -0.09 -3.18 0.64 0.00 -0.52 0.00 0.00 37.83 34.68 1h4i s LYS 350 CO 0.29 0.36 1.75 -0.07 -0.92 0.00 0.00 175.35 176.76 1h4i h LEU 351 N 3.89 0.00 -7.10 3.17 3.38 -0.84 -3.45 115.31 114.36 1h4i h LEU 351 Ca -0.46 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.44 1h4i h LEU 351 Cb 1.20 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.75 1h4i h LEU 351 CO 0.67 0.43 0.05 -0.62 0.09 0.00 0.00 178.44 179.07 1h4i s ASP 352 N -6.69 -0.62 0.19 -0.43 2.15 -1.26 -5.04 116.67 104.97 1h4i s ASP 352 Ca -0.01 1.00 0.13 0.00 0.43 0.00 0.00 52.55 54.10 1h4i s ASP 352 Cb 0.13 0.97 0.70 0.00 -0.30 0.00 0.00 42.92 44.42 1h4i s ASP 352 CO 0.71 -0.36 1.40 -0.90 -0.17 0.00 0.00 175.17 175.85 1h4i n ASP 353 N 2.03 0.34 -0.33 -0.34 5.68 -1.26 -2.29 116.55 120.38 1h4i n ASP 353 Ca -0.16 0.65 0.09 0.00 -0.50 0.00 0.00 54.79 54.88 1h4i n ASP 353 Cb 0.56 -0.70 0.42 0.00 -1.14 0.00 0.00 41.12 40.26 1h4i n ASP 353 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1h4i n THR 354 N -1.95 0.13 -0.08 2.12 -2.24 -1.26 -4.63 114.28 106.37 1h4i n THR 354 Ca -0.01 -0.21 -0.07 0.00 -2.27 0.00 0.00 64.05 61.50 1h4i n THR 354 Cb 0.03 0.10 -0.05 0.00 -2.10 0.00 0.00 70.33 68.31 1h4i n THR 354 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1h4i h VAL 355 N 1.28 0.00 0.00 2.28 2.07 -1.73 -3.44 116.25 116.71 1h4i h VAL 355 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1h4i h VAL 355 Cb 0.28 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 1h4i h VAL 355 CO 0.00 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 177.13 1h4i n ASN 356 N -4.04 0.00 0.11 0.57 0.23 -1.26 -3.68 115.26 107.19 1h4i n ASN 356 Ca -0.01 0.00 -0.04 0.00 -0.53 0.00 0.00 54.58 54.00 1h4i n ASN 356 Cb 0.17 -0.14 0.11 0.00 -2.08 0.00 0.00 39.78 37.83 1h4i n ASN 356 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 1h4i h VAL 357 N 0.00 1.45 -3.89 3.53 3.04 -1.87 -3.42 116.25 115.09 1h4i h VAL 357 Ca 0.00 -2.24 -0.56 0.00 -1.01 0.00 0.00 66.70 62.89 1h4i h VAL 357 Cb 0.00 2.19 -0.31 0.00 -2.01 0.00 0.00 31.29 31.16 1h4i h VAL 357 CO 0.00 0.65 -0.84 -0.36 -1.01 0.00 0.00 177.57 176.01 1h4i s PHE 358 N -3.54 1.69 0.21 3.17 2.99 -1.26 -1.96 117.98 119.29 1h4i s PHE 358 Ca -0.02 -0.49 -0.02 0.00 0.00 0.00 0.00 56.93 56.40 1h4i s PHE 358 Cb 0.12 -1.14 0.16 0.00 0.00 0.00 0.00 43.02 42.16 1h4i s PHE 358 CO 0.79 -0.17 1.54 0.87 -0.00 0.00 0.00 175.22 178.25 1h4i h LYS 359 N 6.26 0.54 -2.04 0.44 1.57 0.07 -3.46 116.57 119.94 1h4i h LYS 359 Ca -0.32 -0.31 0.40 0.00 -1.87 0.00 0.00 60.65 58.54 1h4i h LYS 359 Cb 1.17 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 33.43 1h4i h LYS 359 CO 0.48 0.91 0.99 -1.54 -0.57 0.00 0.00 179.45 179.72 1h4i s SER 360 N -6.89 0.00 -0.17 0.86 1.04 -1.24 -5.01 113.70 102.29 1h4i s SER 360 Ca -0.07 -0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.30 1h4i s SER 360 Cb 0.12 0.05 0.01 0.00 0.10 0.00 0.00 66.02 66.30 1h4i s SER 360 CO 0.83 -0.09 -0.19 -0.69 0.98 0.00 0.00 173.24 174.08 1h4i s VAL 361 N -2.01 2.21 -0.33 5.02 1.01 -1.26 0.62 120.40 125.67 1h4i s VAL 361 Ca 0.32 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 61.11 1h4i s VAL 361 Cb -0.00 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.46 1h4i s VAL 361 CO -0.02 0.53 1.25 -0.62 0.00 0.00 0.00 175.10 176.24 1h4i s ASP 362 N 1.17 6.70 0.45 3.32 -1.08 -0.54 -4.91 116.67 121.77 1h4i s ASP 362 Ca 0.02 1.08 0.22 0.00 -0.52 0.00 0.00 52.55 53.34 1h4i s ASP 362 Cb -0.14 -2.54 1.06 0.00 -1.46 0.00 0.00 42.92 39.84 1h4i s ASP 362 CO -0.09 -1.08 1.92 -0.07 0.52 0.00 0.00 175.17 176.37 1h4i h LEU 363 N 10.85 0.00 0.08 -1.34 3.38 -1.93 0.54 115.31 126.88 1h4i h LEU 363 Ca -0.25 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.58 1h4i h LEU 363 Cb 1.09 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.85 1h4i h LEU 363 CO 1.05 0.24 -0.59 0.07 0.09 0.00 0.00 178.44 179.29 1h4i h LYS 364 N 0.00 0.26 0.00 1.13 5.09 -1.97 -3.33 116.57 117.75 1h4i h LYS 364 Ca -0.00 -0.39 -0.17 0.00 0.09 0.00 0.00 60.65 60.19 1h4i h LYS 364 Cb 0.56 0.14 -0.03 0.00 0.10 0.00 0.00 32.23 33.00 1h4i h LYS 364 CO 0.03 1.15 -0.97 1.79 -2.09 0.00 0.00 179.45 179.36 1h4i h THR 365 N -0.44 0.98 0.00 0.07 1.35 -1.98 -3.47 112.91 109.42 1h4i h THR 365 Ca -0.10 -2.51 0.00 0.00 -0.55 0.00 0.00 66.41 63.25 1h4i h THR 365 Cb 1.42 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 70.27 1h4i h THR 365 CO 0.11 0.56 0.00 0.61 -0.25 0.00 0.00 175.52 176.55 1h4i n GLY 366 N 1.33 0.82 3.72 5.82 0.00 0.19 -4.83 105.19 112.23 1h4i n GLY 366 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 1h4i n GLY 366 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h4i s GLN 367 N -0.09 4.31 0.03 1.61 -1.52 -1.19 -4.80 119.66 118.00 1h4i s GLN 367 Ca 0.00 0.35 -0.30 0.00 -1.95 0.00 0.00 55.36 53.46 1h4i s GLN 367 Cb 0.00 -3.44 -0.05 0.00 -0.22 0.00 0.00 33.01 29.30 1h4i s GLN 367 CO 0.00 0.15 1.16 -1.25 -0.25 0.00 0.00 175.29 175.10 1h4i s PRO 368 N 0.66 4.44 -0.54 2.91 0.04 -1.26 -1.47 135.00 139.78 1h4i s PRO 368 Ca 0.23 1.69 -0.28 0.00 0.04 0.00 0.00 61.00 62.67 1h4i s PRO 368 Cb -0.15 -3.41 0.03 0.00 0.04 0.00 0.00 34.50 31.01 1h4i s PRO 368 CO 0.09 -0.26 1.22 0.08 0.04 0.00 0.00 177.00 178.17 1h4i s VAL 369 N 1.28 4.02 0.42 -0.36 1.01 0.20 -4.94 120.40 122.04 1h4i s VAL 369 Ca 0.57 0.95 -0.23 0.00 0.00 0.00 0.00 61.98 63.27 1h4i s VAL 369 Cb -0.27 -4.64 -0.09 0.00 0.00 0.00 0.00 36.38 31.39 1h4i s VAL 369 CO 0.27 -1.21 1.06 -0.13 0.00 0.00 0.00 175.10 175.09 1h4i s ARG 370 N 4.91 4.05 -0.40 2.72 0.52 -1.26 0.75 118.95 130.24 1h4i s ARG 370 Ca 0.46 1.50 -0.10 0.00 -0.52 0.00 0.00 55.73 57.07 1h4i s ARG 370 Cb -0.08 -2.43 0.05 0.00 0.52 0.00 0.00 34.95 33.01 1h4i s ARG 370 CO 0.27 -0.24 0.23 0.34 0.02 0.00 0.00 175.30 175.93 1h4i s ASP 371 N -1.64 5.68 0.59 0.23 -1.08 -0.83 -4.63 116.67 115.01 1h4i s ASP 371 Ca 0.60 -1.26 0.29 0.00 -0.52 0.00 0.00 52.55 51.65 1h4i s ASP 371 Cb -0.21 -2.00 1.43 0.00 -1.46 0.00 0.00 42.92 40.68 1h4i s ASP 371 CO 0.26 -0.47 1.84 -0.65 0.52 0.00 0.00 175.17 176.68 1h4i h PRO 372 N 8.43 0.00 0.00 4.34 0.11 -1.94 -1.64 132.00 141.30 1h4i h PRO 372 Ca -0.24 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.84 1h4i h PRO 372 Cb 1.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1h4i h PRO 372 CO 0.72 0.00 -0.12 1.49 -0.21 0.00 0.00 178.00 179.88 1h4i h GLU 373 N 0.00 0.00 -0.32 1.05 4.81 -1.94 -3.09 114.58 115.09 1h4i h GLU 373 Ca 0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1h4i h GLU 373 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1h4i h GLU 373 CO -0.00 0.12 0.00 0.66 -0.73 0.00 0.00 179.01 179.06 1h4i n TYR 374 N -3.35 0.99 -2.44 0.92 4.02 -0.62 -4.85 117.16 111.83 1h4i n TYR 374 Ca -0.00 -0.79 -0.26 0.00 -0.01 0.00 0.00 57.90 56.84 1h4i n TYR 374 Cb 0.32 -0.28 0.04 0.00 -0.02 0.00 0.00 39.34 39.40 1h4i n TYR 374 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1h4i s GLY 375 N -1.63 1.64 0.23 2.72 0.00 -1.17 -4.92 107.32 104.19 1h4i s GLY 375 Ca 0.40 -0.83 0.09 0.00 0.00 0.00 0.00 44.72 44.38 1h4i s GLY 375 CO 0.11 -0.54 -0.01 -0.51 0.00 0.00 0.00 173.10 172.16 1h4i s THR 376 N -2.98 3.53 -0.11 0.90 -4.23 -1.26 -4.82 115.64 106.66 1h4i s THR 376 Ca 0.55 -1.72 -0.31 0.00 -1.18 0.00 0.00 61.69 59.03 1h4i s THR 376 Cb -0.10 -2.84 0.12 0.00 1.34 0.00 0.00 72.50 71.02 1h4i s THR 376 CO 0.44 -0.26 1.02 0.00 -0.54 0.00 0.00 174.62 175.27 1h4i s ARG 377 N -3.36 0.59 0.66 3.99 1.70 -1.26 -4.93 118.95 116.34 1h4i s ARG 377 Ca 0.29 -0.09 -0.17 0.00 -0.47 0.00 0.00 55.73 55.29 1h4i s ARG 377 Cb -0.08 0.27 -0.02 0.00 -0.57 0.00 0.00 34.95 34.56 1h4i s ARG 377 CO 0.19 -0.23 1.02 -0.12 -1.08 0.00 0.00 175.30 175.08 1h4i n MET 378 N 0.15 0.78 -3.29 3.89 0.00 -1.26 -3.10 117.12 114.28 1h4i n MET 378 Ca -0.07 0.32 -0.24 0.00 -0.00 0.00 0.00 57.70 57.71 1h4i n MET 378 Cb 0.60 -2.26 0.03 0.00 0.00 0.00 0.00 33.22 31.58 1h4i n MET 378 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1h4i n ASP 379 N -1.34 -5.21 -3.66 6.12 10.43 -1.26 -4.97 116.55 116.66 1h4i n ASP 379 Ca 0.14 -0.40 -0.10 0.00 2.57 0.00 0.00 54.79 57.00 1h4i n ASP 379 Cb 0.48 -4.22 -0.08 0.00 1.84 0.00 0.00 41.12 39.15 1h4i n ASP 379 CO 0.00 0.00 0.00 -2.28 -1.07 0.00 0.00 177.20 173.85 1h4i s HIS 380 N -3.12 -0.87 -0.43 1.24 5.04 -1.18 -5.12 115.29 110.84 1h4i s HIS 380 Ca 0.41 1.84 -0.17 0.00 -1.54 0.00 0.00 55.06 55.60 1h4i s HIS 380 Cb -0.20 0.45 0.03 0.00 0.04 0.00 0.00 32.58 32.90 1h4i s HIS 380 CO 0.50 -0.44 0.41 -1.17 -2.34 0.00 0.00 174.74 171.70 1h4i s LEU 381 N 1.23 5.00 0.17 8.88 2.96 -1.26 -4.44 118.68 131.22 1h4i s LEU 381 Ca -0.07 -0.80 -0.22 0.00 -0.22 0.00 0.00 54.13 52.81 1h4i s LEU 381 Cb -0.06 -2.31 -0.08 0.00 0.50 0.00 0.00 46.19 44.24 1h4i s LEU 381 CO -0.13 -0.57 0.72 0.00 -1.32 0.00 0.00 176.35 175.06 1h4i s ALA 382 N 2.00 3.46 0.08 5.97 0.00 0.84 -4.90 121.76 129.21 1h4i s ALA 382 Ca 0.10 0.24 0.03 0.00 0.00 0.00 0.00 51.96 52.33 1h4i s ALA 382 Cb -0.18 -2.86 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1h4i s ALA 382 CO 0.12 0.32 -0.09 0.15 0.00 0.00 0.00 175.76 176.26 1h4i s LYS 383 N -1.40 0.75 -1.46 0.00 1.02 -1.26 -0.04 119.74 117.34 1h4i s LYS 383 Ca 0.37 -1.04 -0.10 0.00 0.02 0.00 0.00 55.97 55.22 1h4i s LYS 383 Cb -0.20 -0.45 0.06 0.00 -0.52 0.00 0.00 37.83 36.71 1h4i s LYS 383 CO 0.23 0.07 0.80 -0.25 -0.92 0.00 0.00 175.35 175.28 1h4i n ASP 384 N 0.83 -5.05 -4.67 2.83 8.00 -0.95 -4.94 116.55 112.59 1h4i n ASP 384 Ca -0.18 -0.54 -0.42 0.00 0.71 0.00 0.00 54.79 54.36 1h4i n ASP 384 Cb 0.57 -4.06 -0.03 0.00 -0.02 0.00 0.00 41.12 37.57 1h4i n ASP 384 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1h4i s ILE 385 N -3.18 4.82 -0.09 0.53 1.01 -0.50 -4.83 121.20 118.97 1h4i s ILE 385 Ca 0.51 1.83 0.04 0.00 0.00 0.00 0.00 60.65 63.02 1h4i s ILE 385 Cb -0.25 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.00 1h4i s ILE 385 CO 0.63 -0.01 -0.21 0.00 0.00 0.00 0.00 174.94 175.35 1h4i s PRO 387 N 0.40 2.30 1.00 0.00 0.02 -1.25 -3.05 135.00 134.41 1h4i s PRO 387 Ca -0.17 0.47 -0.16 0.00 0.02 0.00 0.00 61.00 61.16 1h4i s PRO 387 Cb -0.17 -1.96 0.21 0.00 0.02 0.00 0.00 34.50 32.60 1h4i s PRO 387 CO 0.07 -1.43 1.29 -1.54 -0.33 0.00 0.00 177.00 175.06 1h4i s SER 388 N -4.18 2.79 0.61 2.53 1.04 -0.00 -4.74 113.70 111.76 1h4i s SER 388 Ca 0.60 0.32 0.32 0.00 0.48 0.00 0.00 55.95 57.68 1h4i s SER 388 Cb -0.13 -0.40 1.88 0.00 0.10 0.00 0.00 66.02 67.48 1h4i s SER 388 CO 0.52 -2.94 2.21 0.00 0.98 0.00 0.00 173.24 174.02 1h4i h ALA 389 N -1.78 1.51 0.00 5.32 0.00 -1.85 0.45 119.26 122.90 1h4i h ALA 389 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1h4i h ALA 389 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1h4i h ALA 389 CO 0.38 -0.12 0.00 -1.33 0.00 0.00 0.00 179.25 178.18 1h4i n MET 390 N -3.62 0.04 -0.59 0.00 2.81 -1.26 -4.63 117.12 109.86 1h4i n MET 390 Ca -0.01 0.17 0.08 0.00 -1.81 0.00 0.00 57.70 56.12 1h4i n MET 390 Cb 0.18 -1.56 -0.03 0.00 -0.71 0.00 0.00 33.22 31.10 1h4i n MET 390 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1h4i n GLY 391 N 0.67 -2.11 0.41 3.03 0.00 0.16 -4.35 105.19 103.00 1h4i n GLY 391 Ca 0.05 -1.34 0.14 0.00 0.00 0.00 0.00 46.02 44.87 1h4i n GLY 391 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1h4i n TYR 392 N -3.08 0.00 -3.64 1.61 0.53 -1.01 -4.59 117.16 106.99 1h4i n TYR 392 Ca -0.01 -0.00 -0.13 0.00 -1.02 0.00 0.00 57.90 56.74 1h4i n TYR 392 Cb 0.28 0.00 -0.07 0.00 -1.03 0.00 0.00 39.34 38.51 1h4i n TYR 392 CO 0.00 0.00 0.00 -1.58 -1.02 0.00 0.00 176.86 174.26 1h4i s HIS 393 N -2.00 -0.82 0.00 -0.72 2.46 -1.26 -1.15 115.29 111.81 1h4i s HIS 393 Ca 0.39 1.91 0.00 0.00 0.47 0.00 0.00 55.06 57.84 1h4i s HIS 393 Cb 0.21 0.33 0.00 0.00 -0.13 0.00 0.00 32.58 32.99 1h4i s HIS 393 CO 0.34 -0.40 0.00 -1.71 -2.47 0.00 0.00 174.74 170.50 1h4i n ASN 394 N 2.99 0.19 0.13 9.88 2.85 -1.26 -3.78 115.26 126.26 1h4i n ASN 394 Ca -0.15 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.36 1h4i n ASN 394 Cb 0.56 0.00 0.23 0.00 1.24 0.00 0.00 39.78 41.81 1h4i n ASN 394 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 1h4i n GLN 395 N 0.00 0.06 -1.70 1.20 0.00 -1.26 -4.74 117.38 110.94 1h4i n GLN 395 Ca 0.00 0.48 -0.44 0.00 -0.00 0.00 0.00 57.00 57.05 1h4i n GLN 395 Cb 0.00 -2.04 -0.02 0.00 0.00 0.00 0.00 30.24 28.17 1h4i n GLN 395 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1h4i n GLY 396 N -1.26 1.07 3.48 1.69 0.00 -1.26 -4.82 105.19 104.08 1h4i n GLY 396 Ca -0.01 0.51 -0.43 0.00 0.00 0.00 0.00 46.02 46.09 1h4i n GLY 396 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1h4i s HIS 397 N 0.14 2.95 0.00 1.61 2.46 -1.22 -4.58 115.29 116.66 1h4i s HIS 397 Ca 0.68 -0.28 0.00 0.00 0.47 0.00 0.00 55.06 55.94 1h4i s HIS 397 Cb -0.59 -3.72 0.00 0.00 -0.13 0.00 0.00 32.58 28.14 1h4i s HIS 397 CO 0.47 -1.13 0.00 -0.25 -2.47 0.00 0.00 174.74 171.35 1h4i n ASP 398 N 6.67 -0.13 -4.17 9.88 8.00 -1.26 -1.37 116.55 134.17 1h4i n ASP 398 Ca -0.03 -0.86 -0.10 0.00 0.71 0.00 0.00 54.79 54.50 1h4i n ASP 398 Cb 0.46 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.46 1h4i n ASP 398 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1h4i s SER 399 N -1.07 0.34 -0.04 -2.24 1.04 -1.15 -4.54 113.70 106.03 1h4i s SER 399 Ca 0.00 -1.24 -0.01 0.00 0.48 0.00 0.00 55.95 55.17 1h4i s SER 399 Cb 0.00 0.30 0.03 0.00 0.10 0.00 0.00 66.02 66.45 1h4i s SER 399 CO 0.00 -0.74 0.09 -0.47 0.98 0.00 0.00 173.24 173.10 1h4i s TYR 400 N -4.04 -0.06 -0.44 5.02 6.14 -0.34 -1.52 117.35 122.11 1h4i s TYR 400 Ca 0.27 0.31 -0.18 0.00 0.64 0.00 0.00 57.07 58.11 1h4i s TYR 400 Cb 0.07 -0.19 0.03 0.00 0.42 0.00 0.00 41.96 42.29 1h4i s TYR 400 CO 0.04 -0.14 0.50 0.34 0.64 0.00 0.00 175.55 176.94 1h4i s ASP 401 N 1.23 6.23 0.25 4.32 -1.08 -0.35 -4.59 116.67 122.68 1h4i s ASP 401 Ca -0.08 -0.65 -0.05 0.00 -0.52 0.00 0.00 52.55 51.26 1h4i s ASP 401 Cb -0.12 -2.25 0.28 0.00 -1.46 0.00 0.00 42.92 39.37 1h4i s ASP 401 CO -0.04 -0.66 1.84 -0.65 0.52 0.00 0.00 175.17 176.17 1h4i h PRO 402 N 8.79 1.10 -0.33 4.34 0.11 -1.96 0.83 132.00 144.88 1h4i h PRO 402 Ca -0.26 -0.16 -0.05 0.00 0.11 0.00 0.00 66.00 65.64 1h4i h PRO 402 Cb 1.11 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1h4i h PRO 402 CO 0.84 0.86 0.02 -0.22 -0.21 0.00 0.00 178.00 179.29 1h4i h LYS 403 N 1.09 0.57 0.00 1.05 3.64 -1.98 -3.14 116.57 117.81 1h4i h LYS 403 Ca 0.26 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1h4i h LYS 403 Cb 0.13 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1h4i h LYS 403 CO -0.03 0.68 -0.52 0.00 -2.27 0.00 0.00 179.45 177.31 1h4i h ARG 404 N 0.39 0.00 -5.96 1.90 3.08 -1.92 -3.48 114.38 108.39 1h4i h ARG 404 Ca 0.10 0.00 -0.42 0.00 0.07 0.00 0.00 59.98 59.73 1h4i h ARG 404 Cb 0.41 0.00 0.10 0.00 0.08 0.00 0.00 29.97 30.55 1h4i h ARG 404 CO 0.01 0.00 -0.70 0.39 -1.07 0.00 0.00 179.97 178.60 1h4i n GLU 405 N -2.42 -7.33 -5.06 0.04 1.02 0.29 -5.00 120.64 102.17 1h4i n GLU 405 Ca 0.03 0.77 -0.29 0.00 -0.02 0.00 0.00 57.16 57.65 1h4i n GLU 405 Cb 0.48 -5.78 -0.16 0.00 -0.02 0.00 0.00 31.44 25.95 1h4i n GLU 405 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1h4i s LEU 406 N -7.28 2.01 -0.12 -4.62 2.96 -1.04 -4.56 118.68 106.02 1h4i s LEU 406 Ca 0.59 -0.42 -0.11 0.00 -0.22 0.00 0.00 54.13 53.96 1h4i s LEU 406 Cb -0.27 -1.16 -0.05 0.00 0.50 0.00 0.00 46.19 45.21 1h4i s LEU 406 CO 0.76 0.22 0.25 -0.36 -1.32 0.00 0.00 176.35 175.89 1h4i s PHE 407 N -0.19 3.55 -0.35 5.38 0.40 0.53 -1.21 117.98 126.10 1h4i s PHE 407 Ca -0.00 0.62 -0.06 0.00 -0.60 0.00 0.00 56.93 56.89 1h4i s PHE 407 Cb -0.12 -2.19 0.05 0.00 0.51 0.00 0.00 43.02 41.28 1h4i s PHE 407 CO 0.02 0.48 0.13 -0.06 0.70 0.00 0.00 175.22 176.49 1h4i s PHE 408 N -0.31 3.30 -0.09 0.36 0.40 -0.58 0.13 117.98 121.19 1h4i s PHE 408 Ca 0.16 -1.58 0.01 0.00 -0.60 0.00 0.00 56.93 54.92 1h4i s PHE 408 Cb -0.13 -2.46 -0.02 0.00 0.51 0.00 0.00 43.02 40.91 1h4i s PHE 408 CO 0.05 -0.78 -0.11 -1.64 0.70 0.00 0.00 175.22 173.44 1h4i s MET 409 N 1.37 2.96 -0.40 0.44 -1.94 -0.39 -2.95 119.30 118.39 1h4i s MET 409 Ca -0.00 -0.64 -0.22 0.00 -1.71 0.00 0.00 55.69 53.11 1h4i s MET 409 Cb -0.20 -2.56 0.01 0.00 2.01 0.00 0.00 34.83 34.09 1h4i s MET 409 CO 0.02 0.46 0.71 0.20 -0.01 0.00 0.00 175.02 176.40 1h4i s GLY 410 N -0.28 1.68 0.17 -0.03 0.00 -1.26 -2.20 107.32 105.40 1h4i s GLY 410 Ca 0.03 -0.89 0.06 0.00 0.00 0.00 0.00 44.72 43.92 1h4i s GLY 410 CO 0.03 1.64 0.07 -0.42 0.00 0.00 0.00 173.10 174.42 1h4i s ILE 411 N 2.98 4.08 -0.06 0.90 1.01 0.33 -4.72 121.20 125.72 1h4i s ILE 411 Ca 0.27 -1.28 0.01 0.00 0.00 0.00 0.00 60.65 59.66 1h4i s ILE 411 Cb -0.13 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 1h4i s ILE 411 CO 0.18 -0.12 -0.07 0.20 0.00 0.00 0.00 174.94 175.13 1h4i s ASN 412 N -3.05 4.64 -0.66 3.58 0.02 -0.30 -2.04 114.94 117.13 1h4i s ASN 412 Ca 0.29 -0.04 0.05 0.00 -1.02 0.00 0.00 52.86 52.15 1h4i s ASN 412 Cb -0.10 -1.15 0.19 0.00 0.02 0.00 0.00 41.25 40.22 1h4i s ASN 412 CO 0.21 0.35 0.56 1.57 0.02 0.00 0.00 177.10 179.81 1h4i n HIS 413 N 2.15 3.00 -4.10 2.20 -0.00 0.30 -4.44 115.22 114.34 1h4i n HIS 413 Ca -0.18 -4.19 -0.18 0.00 0.46 0.00 0.00 57.72 53.64 1h4i n HIS 413 Cb 0.53 -0.54 -0.16 0.00 -0.12 0.00 0.00 29.99 29.70 1h4i n HIS 413 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1h4i s ILE 414 N -1.66 0.40 0.52 3.57 1.01 -1.26 -0.88 121.20 122.89 1h4i s ILE 414 Ca 0.30 -0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.85 1h4i s ILE 414 Cb 0.02 -0.41 -0.01 0.00 0.01 0.00 0.00 42.46 42.08 1h4i s ILE 414 CO -0.13 0.16 0.00 0.00 0.00 0.00 0.00 174.94 174.98 1h4i s MET 416 N -3.89 1.50 0.13 0.00 0.23 -0.16 -1.85 119.30 115.25 1h4i s MET 416 Ca 0.03 -0.80 0.06 0.00 -1.03 0.00 0.00 55.69 53.95 1h4i s MET 416 Cb 0.01 0.57 -0.04 0.00 -1.53 0.00 0.00 34.83 33.84 1h4i s MET 416 CO 0.01 -0.66 -0.01 -0.51 -2.03 0.00 0.00 175.02 171.82 1h4i s ASP 417 N -2.86 4.83 -0.22 -1.18 1.01 0.12 -1.41 116.67 116.98 1h4i s ASP 417 Ca 0.08 -0.30 -0.15 0.00 0.71 0.00 0.00 52.55 52.89 1h4i s ASP 417 Cb -0.03 -1.07 0.06 0.00 1.01 0.00 0.00 42.92 42.89 1h4i s ASP 417 CO -0.02 0.14 0.55 0.86 0.21 0.00 0.00 175.17 176.90 1h4i s TRP 418 N -1.48 -0.74 -0.06 4.23 -0.11 0.95 -2.31 118.94 119.42 1h4i s TRP 418 Ca 0.26 1.61 -0.02 0.00 1.22 0.00 0.00 56.10 59.17 1h4i s TRP 418 Cb -0.11 0.35 0.04 0.00 -1.50 0.00 0.00 33.47 32.25 1h4i s TRP 418 CO 0.18 -0.38 0.11 -2.00 -4.62 0.00 0.00 176.95 170.24 1h4i s GLU 419 N 1.03 0.02 0.56 5.86 2.12 -0.87 -0.11 118.70 127.31 1h4i s GLU 419 Ca -0.06 0.39 -0.02 0.00 0.36 0.00 0.00 54.97 55.64 1h4i s GLU 419 Cb -0.06 -0.27 0.02 0.00 0.26 0.00 0.00 34.13 34.09 1h4i s GLU 419 CO -0.09 -0.23 0.82 -1.25 -0.54 0.00 0.00 175.26 173.97 1h4i s PRO 420 N 1.60 2.71 0.05 4.30 0.04 -1.26 -0.39 135.00 142.04 1h4i s PRO 420 Ca -0.04 -0.41 -0.12 0.00 0.04 0.00 0.00 61.00 60.47 1h4i s PRO 420 Cb -0.12 -2.39 0.01 0.00 0.04 0.00 0.00 34.50 32.04 1h4i s PRO 420 CO -0.05 -0.69 0.26 -0.59 0.04 0.00 0.00 177.00 175.97 1h4i s PHE 421 N -2.85 -0.02 0.32 0.56 -0.12 -0.24 -4.60 117.98 111.02 1h4i s PHE 421 Ca 0.55 -0.18 -0.26 0.00 -0.05 0.00 0.00 56.93 56.98 1h4i s PHE 421 Cb -0.10 0.04 -0.10 0.00 -0.63 0.00 0.00 43.02 42.23 1h4i s PHE 421 CO 0.41 -0.49 0.95 -1.64 -0.05 0.00 0.00 175.22 174.41 1h4i s MET 422 N -2.75 4.57 -0.02 1.99 -1.94 -1.26 -4.61 119.30 115.28 1h4i s MET 422 Ca -0.04 1.36 -0.29 0.00 -1.71 0.00 0.00 55.69 55.01 1h4i s MET 422 Cb -0.00 -2.80 0.07 0.00 2.01 0.00 0.00 34.83 34.10 1h4i s MET 422 CO -0.05 0.26 0.64 -0.48 -0.01 0.00 0.00 175.02 175.38 1h4i s LEU 423 N -2.05 -0.51 0.61 -0.03 -0.00 -1.26 -5.03 118.68 110.40 1h4i s LEU 423 Ca 0.50 0.58 -0.07 0.00 -0.00 0.00 0.00 54.13 55.14 1h4i s LEU 423 Cb -0.19 2.44 0.01 0.00 -0.00 0.00 0.00 46.19 48.44 1h4i s LEU 423 CO 0.25 -0.64 0.95 -2.84 -0.00 0.00 0.00 176.35 174.06 1h4i s PRO 424 N -1.51 2.95 -0.20 1.48 0.02 -1.26 -5.07 135.00 131.40 1h4i s PRO 424 Ca -0.10 0.13 -0.08 0.00 0.02 0.00 0.00 61.00 60.98 1h4i s PRO 424 Cb -0.00 -2.21 -0.04 0.00 0.02 0.00 0.00 34.50 32.26 1h4i s PRO 424 CO 0.07 -0.76 0.08 -0.47 -0.33 0.00 0.00 177.00 175.59 1h4i s TYR 425 N -3.07 3.23 -0.08 6.54 6.14 -1.26 -4.91 117.35 123.94 1h4i s TYR 425 Ca 0.55 0.02 -0.02 0.00 0.64 0.00 0.00 57.07 58.26 1h4i s TYR 425 Cb -0.11 -2.14 0.03 0.00 0.42 0.00 0.00 41.96 40.16 1h4i s TYR 425 CO 0.47 0.05 0.02 1.03 0.64 0.00 0.00 175.55 177.76 1h4i s ARG 426 N 0.71 0.48 0.02 4.97 3.00 -1.26 -5.10 118.95 121.76 1h4i s ARG 426 Ca 0.04 0.10 -0.36 0.00 0.00 0.00 0.00 55.73 55.51 1h4i s ARG 426 Cb -0.13 -1.02 -0.15 0.00 0.00 0.00 0.00 34.95 33.65 1h4i s ARG 426 CO 0.02 -0.35 1.56 0.00 0.00 0.00 0.00 175.30 176.53 1h4i n ALA 427 N 5.17 0.12 0.00 2.13 0.00 -1.26 -1.05 120.51 125.62 1h4i n ALA 427 Ca -0.07 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1h4i n ALA 427 Cb 0.50 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.70 1h4i n ALA 427 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h4i n GLY 428 N 3.35 3.37 3.93 0.00 0.00 -1.24 -4.86 105.19 109.74 1h4i n GLY 428 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 1h4i n GLY 428 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h4i s GLN 429 N -0.75 3.50 0.59 1.61 -0.21 -0.21 -4.68 119.66 119.51 1h4i s GLN 429 Ca 0.00 -0.39 -0.19 0.00 0.02 0.00 0.00 55.36 54.79 1h4i s GLN 429 Cb 0.00 -2.85 -0.04 0.00 1.00 0.00 0.00 33.01 31.13 1h4i s GLN 429 CO 0.00 0.40 1.24 -0.06 -2.12 0.00 0.00 175.29 174.76 1h4i s PHE 430 N -1.89 2.34 -0.38 0.91 0.08 -1.26 -4.67 117.98 113.12 1h4i s PHE 430 Ca 0.38 1.49 0.10 0.00 0.12 0.00 0.00 56.93 59.02 1h4i s PHE 430 Cb -0.11 -3.56 0.31 0.00 -0.57 0.00 0.00 43.02 39.09 1h4i s PHE 430 CO 0.29 -2.41 0.65 0.34 -0.10 0.00 0.00 175.22 174.00 1h4i n PHE 431 N -1.50 -0.07 -0.06 0.36 7.35 0.67 -4.83 117.46 119.37 1h4i n PHE 431 Ca 0.13 -3.70 -0.05 0.00 -0.76 0.00 0.00 57.45 53.08 1h4i n PHE 431 Cb 0.49 -0.36 -0.02 0.00 0.35 0.00 0.00 39.48 39.93 1h4i n PHE 431 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1h4i n VAL 432 N 0.71 1.13 -2.34 -2.13 0.31 -1.25 -4.20 118.33 110.57 1h4i n VAL 432 Ca 0.23 0.25 -0.09 0.00 -0.01 0.00 0.00 64.34 64.72 1h4i n VAL 432 Cb 0.61 -2.18 0.00 0.00 -0.91 0.00 0.00 33.84 31.36 1h4i n VAL 432 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1h4i n GLY 433 N 1.57 0.05 3.28 2.92 0.00 -1.26 -0.44 105.19 111.31 1h4i n GLY 433 Ca -0.08 -0.45 -0.13 0.00 0.00 0.00 0.00 46.02 45.35 1h4i n GLY 433 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4i s ALA 434 N -2.60 -0.94 -0.14 4.61 0.00 -1.26 -1.08 121.76 120.35 1h4i s ALA 434 Ca 0.05 0.82 0.02 0.00 0.00 0.00 0.00 51.96 52.85 1h4i s ALA 434 Cb -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 23.12 22.76 1h4i s ALA 434 CO 0.07 -0.22 -0.19 -0.08 0.00 0.00 0.00 175.76 175.34 1h4i s THR 435 N -0.45 2.39 0.31 0.00 -1.32 0.47 -4.96 115.64 112.08 1h4i s THR 435 Ca -0.06 -0.88 0.11 0.00 -1.21 0.00 0.00 61.69 59.65 1h4i s THR 435 Cb -0.04 -1.97 -0.06 0.00 -1.51 0.00 0.00 72.50 68.92 1h4i s THR 435 CO 0.02 0.54 -0.15 -0.76 -2.21 0.00 0.00 174.62 172.06 1h4i s LEU 436 N 0.67 2.66 -0.08 9.08 1.02 -1.26 -2.04 118.68 128.71 1h4i s LEU 436 Ca -0.09 -1.11 -0.03 0.00 0.02 0.00 0.00 54.13 52.92 1h4i s LEU 436 Cb -0.16 -1.05 0.04 0.00 0.02 0.00 0.00 46.19 45.04 1h4i s LEU 436 CO 0.02 -0.07 0.09 0.21 0.02 0.00 0.00 176.35 176.62 1h4i s ASN 437 N -3.56 1.34 0.15 2.29 2.47 -0.98 -4.43 114.94 112.23 1h4i s ASN 437 Ca 0.31 -0.04 0.09 0.00 0.42 0.00 0.00 52.86 53.64 1h4i s ASN 437 Cb -0.02 -0.06 -0.04 0.00 -1.45 0.00 0.00 41.25 39.68 1h4i s ASN 437 CO 0.16 -0.27 -0.13 -0.04 -3.72 0.00 0.00 177.10 173.09 1h4i s MET 438 N 2.19 1.93 0.30 0.43 -1.94 -1.25 -0.70 119.30 120.27 1h4i s MET 438 Ca 0.04 -1.24 -0.19 0.00 -1.71 0.00 0.00 55.69 52.59 1h4i s MET 438 Cb -0.13 -2.13 0.02 0.00 2.01 0.00 0.00 34.83 34.60 1h4i s MET 438 CO -0.05 0.45 0.72 1.52 -0.01 0.00 0.00 175.02 177.65 1h4i s TYR 439 N -1.48 -0.10 0.63 -0.03 1.13 -0.77 -3.34 117.35 113.40 1h4i s TYR 439 Ca 0.22 -0.39 -0.18 0.00 -1.41 0.00 0.00 57.07 55.31 1h4i s TYR 439 Cb -0.09 0.69 -0.02 0.00 -1.10 0.00 0.00 41.96 41.44 1h4i s TYR 439 CO 0.13 -1.28 1.22 -2.30 -2.51 0.00 0.00 175.55 170.81 1h4i n PRO 440 N -0.47 1.10 -1.62 -3.49 -0.02 -1.26 -1.03 135.00 128.20 1h4i n PRO 440 Ca -0.05 0.43 -0.30 0.00 -2.02 0.00 0.00 63.50 61.57 1h4i n PRO 440 Cb 0.59 -2.45 0.19 0.00 -0.02 0.00 0.00 33.50 31.81 1h4i n PRO 440 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1h4i s GLY 441 N -1.32 1.69 0.57 -1.23 0.00 -0.06 -4.45 107.32 102.51 1h4i s GLY 441 Ca 0.81 -1.02 0.33 0.00 0.00 0.00 0.00 44.72 44.83 1h4i s GLY 441 CO 0.42 -0.25 1.77 -2.55 0.00 0.00 0.00 173.10 172.49 1h4i h PRO 442 N -1.89 0.00 -0.01 2.90 0.11 -1.95 0.92 132.00 132.09 1h4i h PRO 442 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1h4i h PRO 442 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1h4i h PRO 442 CO 0.41 0.00 -0.27 1.63 -0.21 0.00 0.00 178.00 179.56 1h4i n LYS 443 N -3.91 0.99 -2.09 1.05 5.02 -1.26 -4.94 118.16 113.02 1h4i n LYS 443 Ca 0.20 -0.64 -0.10 0.00 -2.02 0.00 0.00 58.31 55.75 1h4i n LYS 443 Cb 1.10 -1.49 0.03 0.00 -0.02 0.00 0.00 35.03 34.66 1h4i n LYS 443 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h4i n GLY 444 N 1.34 2.11 3.32 0.72 0.00 0.32 -5.02 105.19 107.99 1h4i n GLY 444 Ca 0.12 -2.19 -0.45 0.00 0.00 0.00 0.00 46.02 43.50 1h4i n GLY 444 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h4i s ASP 445 N -2.75 6.17 0.20 1.61 -1.08 0.27 -4.88 116.67 116.21 1h4i s ASP 445 Ca 0.28 -1.69 0.25 0.00 -0.52 0.00 0.00 52.55 50.86 1h4i s ASP 445 Cb -0.02 -2.20 0.90 0.00 -1.46 0.00 0.00 42.92 40.14 1h4i s ASP 445 CO 0.18 -0.81 1.74 -1.14 0.52 0.00 0.00 175.17 175.66 1h4i n ARG 446 N 5.23 0.20 -0.01 4.34 0.63 -1.26 -0.79 116.66 125.00 1h4i n ARG 446 Ca -0.13 0.29 -0.21 0.00 -0.92 0.00 0.00 57.85 56.87 1h4i n ARG 446 Cb 0.41 -1.80 -0.14 0.00 0.45 0.00 0.00 32.46 31.39 1h4i n ARG 446 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1h4i n GLN 447 N -2.15 0.74 0.00 -0.14 3.00 -1.26 -4.14 117.38 113.42 1h4i n GLN 447 Ca 0.04 0.30 0.13 0.00 -0.01 0.00 0.00 57.00 57.45 1h4i n GLN 447 Cb 0.32 -1.71 0.31 0.00 0.00 0.00 0.00 30.24 29.16 1h4i n GLN 447 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1h4i n ASN 448 N -3.60 1.11 -3.67 1.08 5.15 -1.21 -4.98 115.26 109.13 1h4i n ASN 448 Ca -0.32 -0.92 -0.21 0.00 -0.60 0.00 0.00 54.58 52.53 1h4i n ASN 448 Cb 1.00 0.20 0.04 0.00 -0.53 0.00 0.00 39.78 40.49 1h4i n ASN 448 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1h4i n TYR 449 N -0.65 -1.97 -4.15 1.20 4.02 0.03 -4.93 117.16 110.71 1h4i n TYR 449 Ca 0.11 0.86 -0.10 0.00 -0.01 0.00 0.00 57.90 58.76 1h4i n TYR 449 Cb 0.36 -4.47 -0.10 0.00 -0.02 0.00 0.00 39.34 35.11 1h4i n TYR 449 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1h4i s GLU 450 N -5.93 0.83 0.00 -0.72 2.02 -1.10 -4.67 118.70 109.14 1h4i s GLU 450 Ca 0.03 -1.36 0.00 0.00 0.02 0.00 0.00 54.97 53.66 1h4i s GLU 450 Cb -0.02 0.05 0.00 0.00 0.10 0.00 0.00 34.13 34.27 1h4i s GLU 450 CO 0.80 -0.14 0.00 0.41 0.02 0.00 0.00 175.26 176.35 1h4i n GLY 451 N -0.04 0.47 1.18 -1.39 0.00 0.76 -0.57 105.19 105.60 1h4i n GLY 451 Ca -0.10 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 45.74 1h4i n GLY 451 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h4i n LEU 452 N -0.61 3.50 -4.14 0.99 7.99 0.31 -4.13 117.00 120.90 1h4i n LEU 452 Ca 0.00 -1.57 -0.14 0.00 -0.01 0.00 0.00 56.01 54.29 1h4i n LEU 452 Cb 0.31 -0.30 -0.06 0.00 -0.11 0.00 0.00 43.42 43.25 1h4i n LEU 452 CO 0.00 0.78 0.01 -0.83 -1.51 0.00 0.00 177.39 175.84 1h4i s GLY 453 N -1.38 1.55 0.10 -0.72 0.00 -1.06 -0.54 107.32 105.27 1h4i s GLY 453 Ca 0.41 -1.60 -0.23 0.00 0.00 0.00 0.00 44.72 43.30 1h4i s GLY 453 CO 0.32 -1.14 0.56 1.20 0.00 0.00 0.00 173.10 174.04 1h4i s GLN 454 N -3.50 1.16 -0.05 2.90 -0.21 -0.86 -1.63 119.66 117.46 1h4i s GLN 454 Ca 0.34 -0.35 -0.00 0.00 0.02 0.00 0.00 55.36 55.36 1h4i s GLN 454 Cb 0.02 0.53 0.03 0.00 1.00 0.00 0.00 33.01 34.59 1h4i s GLN 454 CO 0.19 -0.46 -0.00 -1.50 -2.12 0.00 0.00 175.29 171.39 1h4i s ILE 455 N -3.10 0.30 0.08 1.08 2.07 -0.10 -0.52 121.20 121.02 1h4i s ILE 455 Ca -0.02 0.09 0.03 0.00 -1.41 0.00 0.00 60.65 59.35 1h4i s ILE 455 Cb -0.00 -0.42 -0.03 0.00 0.13 0.00 0.00 42.46 42.13 1h4i s ILE 455 CO -0.07 0.21 -0.10 -0.54 -1.91 0.00 0.00 174.94 172.53 1h4i s LYS 456 N 1.48 0.76 -0.23 3.50 1.02 -0.93 -1.07 119.74 124.27 1h4i s LYS 456 Ca -0.03 -1.03 -0.07 0.00 0.02 0.00 0.00 55.97 54.86 1h4i s LYS 456 Cb -0.13 -0.51 -0.03 0.00 -0.52 0.00 0.00 37.83 36.64 1h4i s LYS 456 CO -0.03 0.09 0.07 0.00 -0.92 0.00 0.00 175.35 174.56 1h4i s ALA 457 N -2.03 3.23 0.02 5.17 0.00 -0.49 -1.26 121.76 126.40 1h4i s ALA 457 Ca 0.01 -1.02 0.06 0.00 0.00 0.00 0.00 51.96 51.01 1h4i s ALA 457 Cb -0.06 -2.03 -0.02 0.00 0.00 0.00 0.00 23.12 21.01 1h4i s ALA 457 CO 0.00 -0.29 -0.18 -0.47 0.00 0.00 0.00 175.76 174.82 1h4i s TYR 458 N 1.25 1.60 -0.23 0.00 5.04 0.12 -0.37 117.35 124.76 1h4i s TYR 458 Ca 0.05 -0.33 -0.06 0.00 -2.44 0.00 0.00 57.07 54.28 1h4i s TYR 458 Cb -0.15 -0.99 -0.02 0.00 0.35 0.00 0.00 41.96 41.16 1h4i s TYR 458 CO 0.03 0.03 0.03 1.21 -1.34 0.00 0.00 175.55 175.51 1h4i s ASN 459 N -0.81 4.87 0.39 4.32 3.84 -0.22 -0.34 114.94 126.99 1h4i s ASN 459 Ca 0.06 -0.25 0.16 0.00 0.21 0.00 0.00 52.86 53.04 1h4i s ASN 459 Cb -0.08 -1.86 0.81 0.00 -0.55 0.00 0.00 41.25 39.58 1h4i s ASN 459 CO 0.01 -0.01 1.84 0.00 -2.79 0.00 0.00 177.10 176.15 1h4i h ALA 460 N 8.08 1.31 0.05 1.71 0.00 -1.88 0.17 119.26 128.69 1h4i h ALA 460 Ca -0.39 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.07 1h4i h ALA 460 Cb 1.17 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1h4i h ALA 460 CO 0.59 0.42 -0.71 0.82 0.00 0.00 0.00 179.25 180.38 1h4i h ILE 461 N 0.00 1.40 0.00 0.00 1.08 -1.94 -3.36 117.51 114.69 1h4i h ILE 461 Ca -0.00 -2.36 -0.12 0.00 -0.39 0.00 0.00 64.86 61.99 1h4i h ILE 461 Cb 0.65 2.97 -0.02 0.00 -3.07 0.00 0.00 36.82 37.36 1h4i h ILE 461 CO 0.04 0.59 -0.61 0.74 -0.69 0.00 0.00 178.15 178.22 1h4i h THR 462 N -0.74 0.94 -0.02 -0.27 2.02 -1.97 -3.47 112.91 109.40 1h4i h THR 462 Ca -0.16 -2.35 -0.01 0.00 0.77 0.00 0.00 66.41 64.66 1h4i h THR 462 Cb 1.34 2.45 -0.00 0.00 -1.74 0.00 0.00 68.15 70.20 1h4i h THR 462 CO -0.00 0.54 -0.01 0.61 0.37 0.00 0.00 175.52 177.03 1h4i n GLY 463 N 1.25 0.43 3.83 2.16 0.00 0.58 -5.02 105.19 108.43 1h4i n GLY 463 Ca 0.01 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 1h4i n GLY 463 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h4i s ASP 464 N -2.08 6.90 -0.36 1.61 2.15 -1.21 -4.84 116.67 118.83 1h4i s ASP 464 Ca 0.00 1.16 -0.12 0.00 0.43 0.00 0.00 52.55 54.01 1h4i s ASP 464 Cb 0.00 -2.32 0.01 0.00 -0.30 0.00 0.00 42.92 40.31 1h4i s ASP 464 CO 0.00 0.12 0.23 -0.31 -0.17 0.00 0.00 175.17 175.05 1h4i s TYR 465 N -1.41 3.23 0.36 -5.34 1.51 -1.26 -1.05 117.35 113.39 1h4i s TYR 465 Ca 0.37 -0.57 0.04 0.00 -1.01 0.00 0.00 57.07 55.91 1h4i s TYR 465 Cb -0.16 -2.48 0.69 0.00 -0.11 0.00 0.00 41.96 39.90 1h4i s TYR 465 CO 0.19 -0.51 1.98 -0.22 -1.11 0.00 0.00 175.55 175.88 1h4i h LYS 466 N 8.49 0.64 -1.89 -0.62 1.63 -1.08 -3.45 116.57 120.29 1h4i h LYS 466 Ca -0.29 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.45 1h4i h LYS 466 Cb 1.13 -0.13 -0.20 0.00 -0.60 0.00 0.00 32.23 32.43 1h4i h LYS 466 CO 0.67 0.49 0.34 1.67 -3.45 0.00 0.00 179.45 179.17 1h4i s TRP 467 N -5.39 -0.53 -0.01 1.91 1.48 -1.25 -4.98 118.94 110.17 1h4i s TRP 467 Ca -0.09 0.86 0.01 0.00 -1.06 0.00 0.00 56.10 55.82 1h4i s TRP 467 Cb 0.17 0.44 0.00 0.00 -1.16 0.00 0.00 33.47 32.92 1h4i s TRP 467 CO 0.75 -0.51 -0.03 -1.21 -4.06 0.00 0.00 176.95 171.89 1h4i s GLU 468 N -1.36 0.28 -0.01 3.25 2.02 -1.26 -1.39 118.70 120.23 1h4i s GLU 468 Ca -0.06 -0.10 0.01 0.00 0.02 0.00 0.00 54.97 54.84 1h4i s GLU 468 Cb -0.00 -0.29 0.01 0.00 0.10 0.00 0.00 34.13 33.94 1h4i s GLU 468 CO 0.05 0.05 -0.02 0.15 0.02 0.00 0.00 175.26 175.51 1h4i s LYS 469 N 0.05 0.20 0.50 1.61 -0.14 -0.24 -4.99 119.74 116.73 1h4i s LYS 469 Ca -0.00 -0.04 -0.16 0.00 -1.36 0.00 0.00 55.97 54.41 1h4i s LYS 469 Cb -0.03 -0.24 -0.08 0.00 -1.68 0.00 0.00 37.83 35.80 1h4i s LYS 469 CO -0.00 0.00 0.97 -1.64 -0.76 0.00 0.00 175.35 173.92 1h4i s MET 470 N 0.21 3.95 0.05 1.68 -1.94 -1.26 -0.92 119.30 121.06 1h4i s MET 470 Ca -0.02 0.92 0.03 0.00 -1.71 0.00 0.00 55.69 54.91 1h4i s MET 470 Cb -0.04 -2.16 -0.03 0.00 2.01 0.00 0.00 34.83 34.62 1h4i s MET 470 CO -0.01 -0.24 -0.09 -1.21 -0.01 0.00 0.00 175.02 173.47 1h4i s GLU 471 N -4.01 0.59 0.16 2.03 0.41 -0.65 -4.86 118.70 112.37 1h4i s GLU 471 Ca 0.58 -0.82 -0.16 0.00 -0.41 0.00 0.00 54.97 54.16 1h4i s GLU 471 Cb -0.10 -0.38 0.07 0.00 -1.78 0.00 0.00 34.13 31.95 1h4i s GLU 471 CO 0.30 0.07 1.74 -0.09 -0.49 0.00 0.00 175.26 176.79 1h4i h ARG 472 N 4.38 0.22 -5.68 1.61 2.43 -1.94 -2.79 114.38 112.61 1h4i h ARG 472 Ca -0.37 -0.01 -0.61 0.00 -0.81 0.00 0.00 59.98 58.18 1h4i h ARG 472 Cb 1.20 -0.05 -0.13 0.00 -0.42 0.00 0.00 29.97 30.57 1h4i h ARG 472 CO 0.42 0.15 -0.62 -0.06 -1.51 0.00 0.00 179.97 178.35 1h4i s PHE 473 N -6.16 2.44 0.20 2.20 0.40 -1.26 -0.17 117.98 115.62 1h4i s PHE 473 Ca -0.13 -0.66 -0.33 0.00 -0.60 0.00 0.00 56.93 55.21 1h4i s PHE 473 Cb 0.12 -1.64 -0.14 0.00 0.51 0.00 0.00 43.02 41.87 1h4i s PHE 473 CO 0.71 0.44 1.46 0.00 0.70 0.00 0.00 175.22 178.53 1h4i n ALA 474 N -0.90 0.99 -2.76 5.36 0.00 -1.05 -3.05 120.51 119.11 1h4i n ALA 474 Ca -0.05 0.43 -0.43 0.00 0.00 0.00 0.00 53.44 53.39 1h4i n ALA 474 Cb 0.66 -2.28 -0.01 0.00 0.00 0.00 0.00 19.45 17.82 1h4i n ALA 474 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1h4i s VAL 475 N 0.35 4.52 0.41 0.00 1.01 -0.87 -4.50 120.40 121.32 1h4i s VAL 475 Ca 0.74 -1.95 -0.07 0.00 0.00 0.00 0.00 61.98 60.69 1h4i s VAL 475 Cb -0.69 -5.01 0.09 0.00 0.00 0.00 0.00 36.38 30.78 1h4i s VAL 475 CO 0.45 -1.79 0.56 1.87 0.00 0.00 0.00 175.10 176.19 1h4i n TRP 476 N 7.19 -4.00 0.00 5.22 -0.00 -1.26 -3.95 117.44 120.63 1h4i n TRP 476 Ca 0.38 -0.49 0.00 0.00 -0.00 0.00 0.00 57.50 57.39 1h4i n TRP 476 Cb 0.46 -0.43 0.00 0.00 -0.00 0.00 0.00 31.31 31.34 1h4i n TRP 476 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1h4i n GLY 477 N 1.35 1.61 0.00 5.87 0.00 -1.22 -4.86 105.19 107.94 1h4i n GLY 477 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1h4i n GLY 477 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4i n GLY 478 N 0.00 -0.73 3.24 -0.02 0.00 -1.26 -2.70 105.19 103.73 1h4i n GLY 478 Ca 0.00 -2.17 -0.09 0.00 0.00 0.00 0.00 46.02 43.76 1h4i n GLY 478 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h4i s THR 479 N 0.00 0.11 -0.09 2.61 2.01 -0.47 -4.47 115.64 115.33 1h4i s THR 479 Ca 0.00 -1.47 -0.05 0.00 0.31 0.00 0.00 61.69 60.48 1h4i s THR 479 Cb 0.00 -1.72 0.04 0.00 0.01 0.00 0.00 72.50 70.83 1h4i s THR 479 CO 0.00 -0.49 0.22 -0.32 -0.69 0.00 0.00 174.62 173.35 1h4i s MET 480 N -3.95 0.20 0.18 4.92 1.75 -0.41 -3.98 119.30 118.00 1h4i s MET 480 Ca 0.14 0.46 0.10 0.00 -1.25 0.00 0.00 55.69 55.15 1h4i s MET 480 Cb 0.05 -0.09 -0.04 0.00 2.84 0.00 0.00 34.83 37.59 1h4i s MET 480 CO -0.04 -0.14 -0.20 0.00 -0.65 0.00 0.00 175.02 174.00 1h4i s ALA 481 N 1.04 2.65 0.11 4.11 0.00 -0.33 -0.37 121.76 128.97 1h4i s ALA 481 Ca -0.08 -1.56 0.04 0.00 0.00 0.00 0.00 51.96 50.36 1h4i s ALA 481 Cb -0.09 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 1h4i s ALA 481 CO -0.07 0.46 -0.10 0.99 0.00 0.00 0.00 175.76 177.05 1h4i s THR 482 N -1.59 0.96 -2.00 0.00 2.01 -0.76 -0.90 115.64 113.36 1h4i s THR 482 Ca 0.21 -1.76 0.10 0.00 0.31 0.00 0.00 61.69 60.55 1h4i s THR 482 Cb -0.08 -1.50 0.29 0.00 0.01 0.00 0.00 72.50 71.22 1h4i s THR 482 CO 0.11 -0.63 1.12 0.00 -0.69 0.00 0.00 174.62 174.53 1h4i n ALA 483 N 0.33 2.20 -0.17 7.40 0.00 0.56 -2.38 120.51 128.45 1h4i n ALA 483 Ca -0.14 -0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.31 1h4i n ALA 483 Cb 0.59 -1.17 0.29 0.00 0.00 0.00 0.00 19.45 19.16 1h4i n ALA 483 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h4i n GLY 484 N 0.20 2.20 2.82 0.00 0.00 -1.25 -4.80 105.19 104.36 1h4i n GLY 484 Ca 0.08 -0.68 -0.19 0.00 0.00 0.00 0.00 46.02 45.23 1h4i n GLY 484 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h4i n ASP 485 N 0.84 -5.40 -4.23 1.61 10.43 -1.00 -1.10 116.55 117.71 1h4i n ASP 485 Ca 0.21 -0.25 -0.24 0.00 2.57 0.00 0.00 54.79 57.07 1h4i n ASP 485 Cb 0.75 -4.22 -0.14 0.00 1.84 0.00 0.00 41.12 39.34 1h4i n ASP 485 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1h4i s LEU 486 N -5.66 2.17 -0.18 0.64 1.02 -1.25 -1.82 118.68 113.60 1h4i s LEU 486 Ca 0.26 -0.51 0.01 0.00 0.02 0.00 0.00 54.13 53.92 1h4i s LEU 486 Cb -0.12 -0.89 0.03 0.00 0.02 0.00 0.00 46.19 45.23 1h4i s LEU 486 CO 0.33 0.13 -0.16 -0.69 0.02 0.00 0.00 176.35 175.98 1h4i s VAL 487 N -0.81 1.83 -0.04 -1.59 1.01 -0.42 -1.83 120.40 118.55 1h4i s VAL 487 Ca 0.06 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 1h4i s VAL 487 Cb -0.09 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 1h4i s VAL 487 CO 0.02 0.42 0.06 -0.36 0.00 0.00 0.00 175.10 175.23 1h4i s PHE 488 N 1.36 3.26 -0.02 5.22 0.40 0.51 -0.96 117.98 127.75 1h4i s PHE 488 Ca 0.03 0.22 -0.29 0.00 -0.60 0.00 0.00 56.93 56.30 1h4i s PHE 488 Cb -0.14 -1.76 0.08 0.00 0.51 0.00 0.00 43.02 41.71 1h4i s PHE 488 CO -0.11 0.54 0.73 1.52 0.70 0.00 0.00 175.22 178.60 1h4i s TYR 489 N -1.08 -0.56 0.14 0.36 -0.85 -0.95 -1.29 117.35 113.12 1h4i s TYR 489 Ca 0.19 0.81 0.03 0.00 -0.52 0.00 0.00 57.07 57.58 1h4i s TYR 489 Cb -0.12 0.46 -0.04 0.00 0.38 0.00 0.00 41.96 42.64 1h4i s TYR 489 CO 0.09 -0.61 0.22 0.20 -1.52 0.00 0.00 175.55 173.93 1h4i s GLY 490 N -1.61 1.77 0.24 5.49 0.00 -1.26 -0.48 107.32 111.47 1h4i s GLY 490 Ca -0.06 -1.07 0.10 0.00 0.00 0.00 0.00 44.72 43.69 1h4i s GLY 490 CO 0.02 -1.07 -0.18 -0.51 0.00 0.00 0.00 173.10 171.36 1h4i s THR 491 N -1.71 2.18 0.38 0.90 -4.23 -0.14 -4.75 115.64 108.28 1h4i s THR 491 Ca 0.33 -2.28 0.19 0.00 -1.18 0.00 0.00 61.69 58.75 1h4i s THR 491 Cb -0.11 -2.17 0.19 0.00 1.34 0.00 0.00 72.50 71.75 1h4i s THR 491 CO 0.26 -0.43 1.94 -0.07 -0.54 0.00 0.00 174.62 175.78 1h4i h LEU 492 N 2.51 0.00 -0.85 4.79 3.38 -1.79 0.72 115.31 124.07 1h4i h LEU 492 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1h4i h LEU 492 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1h4i h LEU 492 CO 0.59 0.24 0.00 -0.90 0.09 0.00 0.00 178.44 178.46 1h4i n ASP 493 N -3.92 1.20 -0.17 -0.43 5.75 -1.26 -3.73 116.55 113.98 1h4i n ASP 493 Ca -0.02 -2.05 0.00 0.00 -0.01 0.00 0.00 54.79 52.71 1h4i n ASP 493 Cb 0.32 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 1h4i n ASP 493 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1h4i n GLY 494 N 0.64 1.05 3.22 6.12 0.00 -1.01 -4.74 105.19 110.47 1h4i n GLY 494 Ca 0.06 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 1h4i n GLY 494 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h4i s TYR 495 N -2.34 1.13 -0.18 1.61 1.51 -1.25 -1.30 117.35 116.53 1h4i s TYR 495 Ca 0.00 -0.79 -0.01 0.00 -1.01 0.00 0.00 57.07 55.25 1h4i s TYR 495 Cb 0.00 -0.60 -0.00 0.00 -0.11 0.00 0.00 41.96 41.25 1h4i s TYR 495 CO 0.00 0.00 -0.11 -1.17 -1.11 0.00 0.00 175.55 173.16 1h4i s LEU 496 N -3.04 2.62 0.23 -1.29 2.96 -0.89 -0.96 118.68 118.30 1h4i s LEU 496 Ca 0.14 -0.45 0.11 0.00 -0.22 0.00 0.00 54.13 53.71 1h4i s LEU 496 Cb 0.03 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 1h4i s LEU 496 CO -0.01 0.04 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.38 1h4i s LYS 497 N 1.07 1.85 -0.08 1.98 1.02 0.37 -1.21 119.74 124.73 1h4i s LYS 497 Ca -0.00 -1.50 -0.00 0.00 0.02 0.00 0.00 55.97 54.49 1h4i s LYS 497 Cb -0.15 -1.97 0.02 0.00 -0.52 0.00 0.00 37.83 35.22 1h4i s LYS 497 CO -0.03 0.38 -0.06 0.00 -0.92 0.00 0.00 175.35 174.73 1h4i s ALA 498 N -2.03 1.03 0.18 5.17 0.00 -0.58 -2.23 121.76 123.30 1h4i s ALA 498 Ca 0.26 -0.33 0.10 0.00 0.00 0.00 0.00 51.96 51.99 1h4i s ALA 498 Cb -0.07 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 1h4i s ALA 498 CO 0.14 -0.29 -0.14 1.03 0.00 0.00 0.00 175.76 176.50 1h4i s ARG 499 N 1.51 1.89 -0.14 0.00 0.52 -0.14 -1.49 118.95 121.11 1h4i s ARG 499 Ca -0.00 -1.33 -0.29 0.00 -0.52 0.00 0.00 55.73 53.58 1h4i s ARG 499 Cb -0.13 -2.07 -0.03 0.00 0.52 0.00 0.00 34.95 33.24 1h4i s ARG 499 CO -0.04 0.43 1.50 0.34 0.02 0.00 0.00 175.30 177.55 1h4i s ASP 500 N -2.74 6.70 0.54 0.23 3.68 -0.47 -1.31 116.67 123.30 1h4i s ASP 500 Ca 0.23 1.89 0.26 0.00 2.13 0.00 0.00 52.55 57.06 1h4i s ASP 500 Cb -0.09 -2.53 1.43 0.00 -1.45 0.00 0.00 42.92 40.28 1h4i s ASP 500 CO 0.13 -0.95 1.99 0.28 0.13 0.00 0.00 175.17 176.75 1h4i h SER 501 N 9.34 0.00 0.44 -0.34 0.02 -1.68 0.48 113.55 121.81 1h4i h SER 501 Ca -0.33 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.31 1h4i h SER 501 Cb 1.14 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.65 1h4i h SER 501 CO 0.97 0.00 -1.68 0.44 -1.14 0.00 0.00 176.83 175.43 1h4i h ASP 502 N 0.00 0.19 0.00 3.07 3.45 -1.91 -3.42 116.42 117.79 1h4i h ASP 502 Ca 0.25 -0.35 -0.02 0.00 0.43 0.00 0.00 57.03 57.35 1h4i h ASP 502 Cb 1.05 -0.06 -0.00 0.00 -0.56 0.00 0.00 39.33 39.76 1h4i h ASP 502 CO -0.00 1.31 -1.21 0.35 -1.57 0.00 0.00 179.24 178.11 1h4i n THR 503 N -3.27 0.06 -0.64 0.35 -2.24 -1.05 -4.85 114.28 102.63 1h4i n THR 503 Ca -0.19 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1h4i n THR 503 Cb 1.04 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1h4i n THR 503 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h4i n GLY 504 N 2.36 0.81 3.74 3.38 0.00 0.16 -4.88 105.19 110.76 1h4i n GLY 504 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1h4i n GLY 504 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h4i s ASP 505 N -2.89 6.48 -0.18 1.61 -0.00 -1.26 -4.60 116.67 115.82 1h4i s ASP 505 Ca 0.00 2.83 -0.29 0.00 -0.00 0.00 0.00 52.55 55.08 1h4i s ASP 505 Cb 0.00 -2.62 -0.01 0.00 -0.00 0.00 0.00 42.92 40.28 1h4i s ASP 505 CO 0.00 -0.85 1.26 -0.22 -0.00 0.00 0.00 175.17 175.37 1h4i s LEU 506 N -0.14 4.15 -0.09 1.23 2.96 -1.26 -1.37 118.68 124.17 1h4i s LEU 506 Ca 0.64 1.65 0.17 0.00 -0.22 0.00 0.00 54.13 56.36 1h4i s LEU 506 Cb -0.46 -3.54 -0.25 0.00 0.50 0.00 0.00 46.19 42.44 1h4i s LEU 506 CO 0.43 -0.79 0.25 0.18 -1.32 0.00 0.00 176.35 175.10 1h4i n LEU 507 N 6.70 0.00 -3.56 -0.68 4.77 -0.55 -4.98 117.00 118.70 1h4i n LEU 507 Ca 0.14 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.02 1h4i n LEU 507 Cb 0.45 0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.68 1h4i n LEU 507 CO 0.56 0.18 0.75 0.86 -1.33 0.00 0.00 177.39 178.41 1h4i s TRP 508 N -2.89 -0.37 0.04 -1.77 -0.00 -1.18 -4.71 118.94 108.07 1h4i s TRP 508 Ca -0.07 0.55 -0.19 0.00 -0.00 0.00 0.00 56.10 56.38 1h4i s TRP 508 Cb 0.09 0.47 0.04 0.00 -0.00 0.00 0.00 33.47 34.07 1h4i s TRP 508 CO 0.73 -0.40 0.44 -1.59 -0.00 0.00 0.00 176.95 176.13 1h4i s LYS 509 N -1.61 0.95 -0.03 5.86 -2.85 -1.26 -1.53 119.74 119.28 1h4i s LYS 509 Ca -0.00 -0.33 0.01 0.00 -1.00 0.00 0.00 55.97 54.65 1h4i s LYS 509 Cb -0.01 0.43 0.02 0.00 -2.06 0.00 0.00 37.83 36.21 1h4i s LYS 509 CO -0.01 -0.33 -0.02 0.12 0.10 0.00 0.00 175.35 175.22 1h4i s PHE 510 N -2.47 0.43 -0.73 1.78 5.36 -0.35 -4.97 117.98 117.04 1h4i s PHE 510 Ca -0.05 -0.06 -0.26 0.00 -0.96 0.00 0.00 56.93 55.59 1h4i s PHE 510 Cb -0.01 -0.44 0.00 0.00 -0.34 0.00 0.00 43.02 42.23 1h4i s PHE 510 CO -0.02 -0.12 1.62 0.21 -1.46 0.00 0.00 175.22 175.45 1h4i s LYS 511 N 0.81 2.91 0.59 10.12 2.47 -1.26 -2.10 119.74 133.28 1h4i s LYS 511 Ca -0.09 0.04 -0.06 0.00 -1.56 0.00 0.00 55.97 54.30 1h4i s LYS 511 Cb -0.12 -4.48 0.01 0.00 -1.46 0.00 0.00 37.83 31.78 1h4i s LYS 511 CO -0.01 -2.54 0.90 0.96 0.16 0.00 0.00 175.35 174.81 1h4i s ILE 512 N 7.60 3.71 0.17 5.43 -4.36 -0.42 -5.01 121.20 128.32 1h4i s ILE 512 Ca 0.54 0.01 -0.18 0.00 -0.26 0.00 0.00 60.65 60.76 1h4i s ILE 512 Cb -0.09 -3.47 0.12 0.00 1.25 0.00 0.00 42.46 40.26 1h4i s ILE 512 CO 0.13 -0.48 1.64 -0.65 0.24 0.00 0.00 174.94 175.82 1h4i h PRO 513 N -0.16 -0.08 -4.91 0.37 0.11 -1.95 -3.44 132.00 121.94 1h4i h PRO 513 Ca -0.45 0.01 -0.46 0.00 0.11 0.00 0.00 66.00 65.21 1h4i h PRO 513 Cb 1.25 0.02 -0.14 0.00 0.11 0.00 0.00 31.00 32.25 1h4i h PRO 513 CO 0.61 -0.06 -0.53 -1.54 -0.21 0.00 0.00 178.00 176.27 1h4i s SER 514 N -5.16 1.80 0.76 -2.05 1.04 -1.26 -4.72 113.70 104.11 1h4i s SER 514 Ca -0.14 -1.63 -0.13 0.00 0.48 0.00 0.00 55.95 54.52 1h4i s SER 514 Cb 0.15 0.46 0.06 0.00 0.10 0.00 0.00 66.02 66.79 1h4i s SER 514 CO 0.71 -0.94 1.17 -0.83 0.98 0.00 0.00 173.24 174.32 1h4i s GLY 515 N -3.42 2.11 -0.15 7.32 0.00 -1.24 -4.25 107.32 107.69 1h4i s GLY 515 Ca 0.35 0.71 -0.04 0.00 0.00 0.00 0.00 44.72 45.73 1h4i s GLY 515 CO 0.19 1.11 -0.01 0.00 0.00 0.00 0.00 173.10 174.39 1h4i s ALA 516 N -2.27 3.14 -0.00 3.20 0.00 0.21 -1.32 121.76 124.72 1h4i s ALA 516 Ca 0.70 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.87 1h4i s ALA 516 Cb -0.25 -1.63 0.01 0.00 0.00 0.00 0.00 23.12 21.24 1h4i s ALA 516 CO 0.49 0.26 0.90 0.44 0.00 0.00 0.00 175.76 177.85 1h4i n ILE 517 N 3.34 0.81 -4.20 0.00 -5.35 -1.26 -4.06 119.36 108.64 1h4i n ILE 517 Ca -0.17 -0.83 -0.26 0.00 -0.27 0.00 0.00 62.75 61.22 1h4i n ILE 517 Cb 0.53 0.58 -0.02 0.00 -1.74 0.00 0.00 39.64 38.98 1h4i n ILE 517 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1h4i n GLY 518 N -0.42 3.14 3.65 3.28 0.00 -1.25 -3.40 105.19 110.19 1h4i n GLY 518 Ca 0.00 -2.32 -0.27 0.00 0.00 0.00 0.00 46.02 43.44 1h4i n GLY 518 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1h4i s TYR 519 N -2.53 2.83 0.60 1.61 -0.85 -1.01 -4.34 117.35 113.67 1h4i s TYR 519 Ca 0.16 -0.14 -0.16 0.00 -0.52 0.00 0.00 57.07 56.42 1h4i s TYR 519 Cb -0.01 -1.39 -0.03 0.00 0.38 0.00 0.00 41.96 40.91 1h4i s TYR 519 CO 0.10 0.51 1.07 -2.14 -1.52 0.00 0.00 175.55 173.56 1h4i s PRO 520 N -2.82 3.23 0.14 -3.49 0.02 -1.26 -4.57 135.00 126.25 1h4i s PRO 520 Ca 0.27 1.24 -0.00 0.00 0.02 0.00 0.00 61.00 62.52 1h4i s PRO 520 Cb -0.10 -2.02 -0.04 0.00 0.02 0.00 0.00 34.50 32.36 1h4i s PRO 520 CO 0.18 -0.89 0.04 0.00 -0.33 0.00 0.00 177.00 176.00 1h4i s MET 521 N -4.08 0.96 0.07 5.54 0.23 -0.70 -4.71 119.30 116.61 1h4i s MET 521 Ca 0.64 -1.45 -0.06 0.00 -1.03 0.00 0.00 55.69 53.79 1h4i s MET 521 Cb -0.17 0.11 -0.01 0.00 -1.53 0.00 0.00 34.83 33.23 1h4i s MET 521 CO 0.38 -0.22 0.12 -0.08 -2.03 0.00 0.00 175.02 173.18 1h4i s THR 522 N -3.94 0.16 0.11 3.16 -1.32 -1.26 -1.07 115.64 111.49 1h4i s THR 522 Ca 0.23 -1.33 -0.26 0.00 -1.21 0.00 0.00 61.69 59.12 1h4i s THR 522 Cb 0.07 -1.31 0.08 0.00 -1.51 0.00 0.00 72.50 69.83 1h4i s THR 522 CO 0.02 -0.74 1.06 -0.72 -2.21 0.00 0.00 174.62 172.03 1h4i s TYR 523 N -3.66 -0.07 0.11 9.09 -0.85 -0.80 -4.78 117.35 116.41 1h4i s TYR 523 Ca 0.04 -0.20 0.10 0.00 -0.52 0.00 0.00 57.07 56.49 1h4i s TYR 523 Cb 0.05 0.63 -0.04 0.00 0.38 0.00 0.00 41.96 42.98 1h4i s TYR 523 CO -0.10 -0.70 -0.25 0.99 -1.52 0.00 0.00 175.55 173.98 1h4i s THR 524 N -2.86 2.40 0.03 -3.49 2.01 -0.37 -0.92 115.64 112.45 1h4i s THR 524 Ca 0.15 -1.64 -0.04 0.00 0.31 0.00 0.00 61.69 60.48 1h4i s THR 524 Cb -0.00 -2.06 -0.01 0.00 0.01 0.00 0.00 72.50 70.44 1h4i s THR 524 CO 0.01 0.13 -0.07 1.57 -0.69 0.00 0.00 174.62 175.57 1h4i n HIS 525 N 1.01 0.00 -2.88 4.92 -0.00 -0.51 -4.37 115.22 113.39 1h4i n HIS 525 Ca -0.17 0.00 -0.16 0.00 0.46 0.00 0.00 57.72 57.85 1h4i n HIS 525 Cb 0.53 -0.10 -0.00 0.00 -0.12 0.00 0.00 29.99 30.29 1h4i n HIS 525 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1h4i n LYS 526 N -3.55 1.52 -0.00 1.57 5.02 -1.26 -4.85 118.16 116.61 1h4i n LYS 526 Ca -0.03 -3.59 0.00 0.00 -2.02 0.00 0.00 58.31 52.67 1h4i n LYS 526 Cb 0.11 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.49 1h4i n LYS 526 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h4i n GLY 527 N 0.01 0.38 3.46 0.72 0.00 -1.26 -5.05 105.19 103.45 1h4i n GLY 527 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 1h4i n GLY 527 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1h4i s THR 528 N -2.13 3.23 -0.03 2.61 -4.23 -1.26 -5.09 115.64 108.74 1h4i s THR 528 Ca 0.00 -0.63 -0.25 0.00 -1.18 0.00 0.00 61.69 59.63 1h4i s THR 528 Cb 0.00 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.48 1h4i s THR 528 CO 0.00 0.56 0.77 -1.58 -0.54 0.00 0.00 174.62 173.84 1h4i s GLN 529 N -0.27 4.48 0.02 3.99 0.74 -1.26 -1.42 119.66 125.93 1h4i s GLN 529 Ca 0.02 1.04 0.08 0.00 0.05 0.00 0.00 55.36 56.55 1h4i s GLN 529 Cb -0.13 -3.43 -0.02 0.00 1.10 0.00 0.00 33.01 30.53 1h4i s GLN 529 CO 0.03 0.08 -0.23 0.71 -0.55 0.00 0.00 175.29 175.33 1h4i s TYR 530 N 0.67 2.05 -0.14 1.67 1.51 -0.09 -4.49 117.35 118.53 1h4i s TYR 530 Ca 0.41 -0.39 -0.00 0.00 -1.01 0.00 0.00 57.07 56.08 1h4i s TYR 530 Cb -0.19 -1.26 -0.01 0.00 -0.11 0.00 0.00 41.96 40.39 1h4i s TYR 530 CO 0.21 0.05 -0.13 0.08 -1.11 0.00 0.00 175.55 174.65 1h4i s VAL 531 N -0.69 2.94 0.08 0.71 1.01 -0.69 -1.90 120.40 121.86 1h4i s VAL 531 Ca 0.09 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.47 1h4i s VAL 531 Cb -0.09 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1h4i s VAL 531 CO 0.01 0.52 -0.24 0.00 0.00 0.00 0.00 175.10 175.39 1h4i s ALA 532 N 0.54 2.04 -0.08 5.51 0.00 -0.23 -0.34 121.76 129.21 1h4i s ALA 532 Ca -0.09 -1.26 -0.15 0.00 0.00 0.00 0.00 51.96 50.46 1h4i s ALA 532 Cb -0.16 -0.36 0.03 0.00 0.00 0.00 0.00 23.12 22.64 1h4i s ALA 532 CO 0.04 0.46 0.37 -1.50 0.00 0.00 0.00 175.76 175.12 1h4i s ILE 533 N -0.95 0.03 0.51 0.00 2.07 -0.86 -1.72 121.20 120.27 1h4i s ILE 533 Ca 0.10 -0.22 -0.16 0.00 -1.41 0.00 0.00 60.65 58.96 1h4i s ILE 533 Cb -0.10 -0.60 -0.08 0.00 0.13 0.00 0.00 42.46 41.82 1h4i s ILE 533 CO 0.04 -0.12 0.97 -0.31 -1.91 0.00 0.00 174.94 173.60 1h4i s TYR 534 N -0.59 3.46 0.11 3.50 4.12 -1.26 -1.47 117.35 125.22 1h4i s TYR 534 Ca -0.07 1.42 0.06 0.00 0.02 0.00 0.00 57.07 58.51 1h4i s TYR 534 Cb -0.04 -2.76 -0.04 0.00 -1.52 0.00 0.00 41.96 37.61 1h4i s TYR 534 CO 0.03 -0.35 -0.16 1.52 0.02 0.00 0.00 175.55 176.60 1h4i s TYR 535 N -2.62 1.48 0.00 2.71 -0.85 -0.52 -4.64 117.35 112.91 1h4i s TYR 535 Ca 0.58 -0.49 0.00 0.00 -0.52 0.00 0.00 57.07 56.64 1h4i s TYR 535 Cb -0.10 -0.79 0.00 0.00 0.38 0.00 0.00 41.96 41.45 1h4i s TYR 535 CO 0.32 0.15 0.00 0.41 -1.52 0.00 0.00 175.55 174.91 1h4i n GLY 536 N 0.83 1.15 3.77 5.49 0.00 -0.43 -2.22 105.19 113.78 1h4i n GLY 536 Ca -0.18 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 1h4i n GLY 536 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h4i s VAL 537 N 0.00 2.92 -0.07 1.61 0.11 -0.83 -1.47 120.40 122.67 1h4i s VAL 537 Ca 0.00 0.63 0.00 0.00 -2.93 0.00 0.00 61.98 59.68 1h4i s VAL 537 Cb 0.00 -3.29 0.00 0.00 -1.53 0.00 0.00 36.38 31.56 1h4i s VAL 537 CO 0.00 -0.07 0.00 0.61 -3.33 0.00 0.00 175.10 172.31 1h4i n GLY 538 N 0.40 -0.71 7.00 6.54 0.00 -1.26 -3.18 105.19 113.97 1h4i n GLY 538 Ca 0.10 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1h4i n GLY 538 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4i n GLY 539 N 0.00 0.02 0.11 -0.02 0.00 -1.26 -2.59 105.19 101.44 1h4i n GLY 539 Ca 0.00 -0.99 -0.11 0.00 0.00 0.00 0.00 46.02 44.92 1h4i n GLY 539 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1h4i h TRP 540 N 0.00 0.26 0.00 1.61 7.01 -1.95 -2.88 115.95 119.99 1h4i h TRP 540 Ca 0.00 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.96 1h4i h TRP 540 Cb 0.00 -0.08 -0.00 0.00 -2.10 0.00 0.00 29.16 26.98 1h4i h TRP 540 CO 0.00 0.31 -0.10 -1.00 -2.79 0.00 0.00 178.44 174.86 1h4i h PRO 541 N 0.14 0.00 -0.61 2.65 0.13 -1.94 -2.94 132.00 129.43 1h4i h PRO 541 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1h4i h PRO 541 Cb 0.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.29 1h4i h PRO 541 CO -0.01 0.10 0.00 0.41 -0.23 0.00 0.00 178.00 178.27 1h4i n GLY 542 N -0.98 2.78 0.23 1.56 0.00 -1.07 -4.48 105.19 103.24 1h4i n GLY 542 Ca -0.02 -0.79 0.06 0.00 0.00 0.00 0.00 46.02 45.27 1h4i n GLY 542 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1h4i h VAL 543 N 3.73 1.07 -0.09 1.61 3.04 -1.32 0.33 116.25 124.63 1h4i h VAL 543 Ca 0.00 -0.49 -0.03 0.00 -1.01 0.00 0.00 66.70 65.17 1h4i h VAL 543 Cb 1.24 1.26 -0.00 0.00 -2.01 0.00 0.00 31.29 31.78 1h4i h VAL 543 CO 0.14 0.14 -0.06 1.23 -1.01 0.00 0.00 177.57 178.00 1h4i h GLY 544 N 0.44 0.21 0.84 3.17 0.00 -1.83 -0.62 103.07 105.28 1h4i h GLY 544 Ca -0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 1h4i h GLY 544 CO 0.02 0.19 -0.06 -2.00 0.00 0.00 0.00 176.54 174.69 1h4i h LEU 545 N -0.20 0.46 -0.52 3.11 5.85 -1.77 0.13 115.31 122.37 1h4i h LEU 545 Ca 0.02 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 1h4i h LEU 545 Cb 0.55 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 1h4i h LEU 545 CO 0.02 0.73 0.22 0.58 -0.34 0.00 0.00 178.44 179.64 1h4i h VAL 546 N 0.20 1.21 -0.55 1.05 2.07 -0.39 -3.11 116.25 116.73 1h4i h VAL 546 Ca 0.06 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1h4i h VAL 546 Cb 0.52 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1h4i h VAL 546 CO 0.02 0.25 0.00 0.49 0.02 0.00 0.00 177.57 178.35 1h4i n PHE 547 N -4.55 0.91 -3.71 1.57 3.01 -0.24 -4.96 117.46 109.48 1h4i n PHE 547 Ca 0.02 -0.55 -0.26 0.00 1.01 0.00 0.00 57.45 57.67 1h4i n PHE 547 Cb 0.15 -0.08 0.03 0.00 -0.01 0.00 0.00 39.48 39.56 1h4i n PHE 547 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1h4i n ASP 548 N 1.00 -3.14 -4.91 4.37 -0.08 0.27 -4.97 116.55 109.08 1h4i n ASP 548 Ca 0.20 -0.93 -0.32 0.00 -1.51 0.00 0.00 54.79 52.23 1h4i n ASP 548 Cb 0.63 -3.65 -0.04 0.00 2.34 0.00 0.00 41.12 40.40 1h4i n ASP 548 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1h4i s LEU 549 N -6.55 4.35 0.00 -2.67 1.43 -0.21 -5.03 118.68 109.99 1h4i s LEU 549 Ca 0.24 0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 1h4i s LEU 549 Cb -0.08 -2.93 0.00 0.00 0.03 0.00 0.00 46.19 43.21 1h4i s LEU 549 CO 0.84 0.17 0.00 0.00 0.23 0.00 0.00 176.35 177.60 1h4i n ALA 550 N 0.43 2.00 -1.66 4.21 0.00 -1.26 -4.76 120.51 119.46 1h4i n ALA 550 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 1h4i n ALA 550 Cb 0.51 0.45 -0.03 0.00 0.00 0.00 0.00 19.45 20.38 1h4i n ALA 550 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1h4i s ASP 551 N -3.79 6.41 0.62 0.00 -1.08 -1.26 -4.83 116.67 112.75 1h4i s ASP 551 Ca 0.00 2.65 0.29 0.00 -0.52 0.00 0.00 52.55 54.97 1h4i s ASP 551 Cb 0.00 -2.53 1.51 0.00 -1.46 0.00 0.00 42.92 40.44 1h4i s ASP 551 CO 0.00 -1.09 1.89 1.55 0.52 0.00 0.00 175.17 178.04 1h4i h PRO 552 N 10.77 0.00 0.00 4.34 0.13 -1.95 0.27 132.00 145.56 1h4i h PRO 552 Ca -0.49 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1h4i h PRO 552 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1h4i h PRO 552 CO 0.94 0.00 -0.50 1.15 -0.23 0.00 0.00 178.00 179.36 1h4i h THR 553 N 0.00 0.02 -3.98 1.56 2.02 -1.87 -1.52 112.91 109.13 1h4i h THR 553 Ca 0.11 -1.04 -0.47 0.00 0.77 0.00 0.00 66.41 65.79 1h4i h THR 553 Cb 0.96 1.77 0.15 0.00 -1.74 0.00 0.00 68.15 69.30 1h4i h THR 553 CO -0.00 0.01 0.22 0.00 0.37 0.00 0.00 175.52 176.13 1h4i s ALA 554 N -3.27 1.27 -1.40 6.16 0.00 0.93 -2.12 121.76 123.34 1h4i s ALA 554 Ca 0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 51.96 51.72 1h4i s ALA 554 Cb 0.07 -3.15 0.01 0.00 0.00 0.00 0.00 23.12 20.05 1h4i s ALA 554 CO 0.73 -2.58 0.65 0.41 0.00 0.00 0.00 175.76 174.97 1h4i n GLY 555 N -1.14 -0.42 3.33 0.00 0.00 -1.26 -2.07 105.19 103.63 1h4i n GLY 555 Ca 0.06 0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1h4i n GLY 555 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h4i n LEU 556 N -3.86 -2.66 0.00 0.99 4.77 -1.25 -1.81 117.00 113.18 1h4i n LEU 556 Ca -0.09 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 1h4i n LEU 556 Cb 0.60 -2.81 0.00 0.00 -2.33 0.00 0.00 43.42 38.88 1h4i n LEU 556 CO 0.46 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 1h4i n GLY 557 N -1.61 1.77 0.18 -0.72 0.00 -0.88 -4.81 105.19 99.12 1h4i n GLY 557 Ca -0.05 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.03 1h4i n GLY 557 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4i h ALA 558 N 0.00 0.93 -0.07 4.61 0.00 -1.37 -3.32 119.26 120.05 1h4i h ALA 558 Ca 0.00 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.59 1h4i h ALA 558 Cb 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1h4i h ALA 558 CO 0.00 0.47 -0.03 0.28 0.00 0.00 0.00 179.25 179.96 1h4i h VAL 559 N 0.00 0.89 -0.53 0.00 2.07 -1.66 -1.99 116.25 115.03 1h4i h VAL 559 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1h4i h VAL 559 Cb 0.97 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1h4i h VAL 559 CO 0.05 0.00 0.27 1.23 0.02 0.00 0.00 177.57 179.14 1h4i h GLY 560 N -0.03 0.80 1.40 2.17 0.00 -1.36 -2.57 103.07 103.47 1h4i h GLY 560 Ca 0.04 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 46.96 1h4i h GLY 560 CO -0.09 0.37 0.27 0.00 0.00 0.00 0.00 176.54 177.09 1h4i h ALA 561 N 1.10 1.42 -0.67 3.60 0.00 -1.52 -2.96 119.26 120.23 1h4i h ALA 561 Ca 0.18 -0.12 -0.34 0.00 0.00 0.00 0.00 54.91 54.63 1h4i h ALA 561 Cb 0.09 -0.23 -0.20 0.00 0.00 0.00 0.00 17.79 17.45 1h4i h ALA 561 CO -0.03 0.46 0.28 1.19 0.00 0.00 0.00 179.25 181.15 1h4i n PHE 562 N -4.37 2.07 0.26 0.00 3.01 -0.76 -4.70 117.46 112.97 1h4i n PHE 562 Ca 0.05 -1.71 0.15 0.00 1.01 0.00 0.00 57.45 56.95 1h4i n PHE 562 Cb 0.13 -0.71 0.88 0.00 -0.01 0.00 0.00 39.48 39.76 1h4i n PHE 562 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 1h4i h LYS 563 N 1.05 0.00 0.00 -1.08 2.10 -1.29 -1.90 116.57 115.45 1h4i h LYS 563 Ca 0.42 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.07 1h4i h LYS 563 Cb 2.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.59 1h4i h LYS 563 CO 0.74 0.00 -0.49 1.63 -2.00 0.00 0.00 179.45 179.33 1h4i n LYS 564 N -3.86 0.10 -0.25 0.07 4.76 -1.26 -4.40 118.16 113.31 1h4i n LYS 564 Ca -0.01 0.03 0.06 0.00 -2.87 0.00 0.00 58.31 55.51 1h4i n LYS 564 Cb 0.16 -1.56 0.19 0.00 -1.84 0.00 0.00 35.03 31.98 1h4i n LYS 564 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1h4i h LEU 565 N 0.00 0.11 -2.44 -0.35 5.85 -1.71 -2.18 115.31 114.60 1h4i h LEU 565 Ca 0.00 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1h4i h LEU 565 Cb 0.58 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1h4i h LEU 565 CO 0.00 0.01 0.05 0.00 -0.34 0.00 0.00 178.44 178.16 1h4i h ALA 566 N 1.59 1.05 -0.00 1.25 0.00 -1.77 -0.65 119.26 120.73 1h4i h ALA 566 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1h4i h ALA 566 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1h4i h ALA 566 CO -0.47 -0.05 -0.06 0.09 0.00 0.00 0.00 179.25 178.76 1h4i n ASN 567 N -2.83 0.35 0.00 0.00 5.03 -0.82 -3.89 115.26 113.10 1h4i n ASN 567 Ca -0.02 -0.58 0.00 0.00 0.87 0.00 0.00 54.58 54.84 1h4i n ASN 567 Cb 0.11 -0.11 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1h4i n ASN 567 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1h4i n TYR 568 N -0.98 0.00 -3.47 3.10 4.02 -0.29 -5.10 117.16 114.44 1h4i n TYR 568 Ca 0.16 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.93 1h4i n TYR 568 Cb 0.25 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.54 1h4i n TYR 568 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 1h4i s THR 569 N -0.97 0.00 0.37 -0.72 -1.32 -0.96 -4.71 115.64 107.32 1h4i s THR 569 Ca 0.00 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.52 1h4i s THR 569 Cb 0.00 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.93 1h4i s THR 569 CO 0.00 0.00 0.05 -1.10 -2.21 0.00 0.00 174.62 171.36 1h4i s GLN 570 N -3.02 1.79 1.03 7.08 -1.52 -1.26 -4.30 119.66 119.46 1h4i s GLN 570 Ca 0.00 -2.02 -0.12 0.00 -1.95 0.00 0.00 55.36 51.27 1h4i s GLN 570 Cb -0.01 -1.07 0.21 0.00 -0.22 0.00 0.00 33.01 31.92 1h4i s GLN 570 CO -0.07 -0.20 1.08 -1.64 -0.25 0.00 0.00 175.29 174.21 1h4i s MET 571 N -3.83 0.18 0.00 2.91 -1.94 -1.26 -4.52 119.30 110.85 1h4i s MET 571 Ca 0.33 1.01 -0.03 0.00 -1.71 0.00 0.00 55.69 55.29 1h4i s MET 571 Cb 0.08 -1.67 0.01 0.00 2.01 0.00 0.00 34.83 35.26 1h4i s MET 571 CO 0.15 -3.03 0.14 0.41 -0.01 0.00 0.00 175.02 172.68 1h4i n GLY 572 N 0.08 0.76 0.00 -0.03 0.00 -1.26 -4.85 105.19 99.88 1h4i n GLY 572 Ca 0.06 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1h4i n GLY 572 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4i n GLY 573 N -0.10 -0.02 0.00 -0.02 0.00 -1.24 -4.09 105.19 99.72 1h4i n GLY 573 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.78 1h4i n GLY 573 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4i n GLY 574 N 0.00 -1.27 3.14 -0.02 0.00 -0.94 -1.83 105.19 104.27 1h4i n GLY 574 Ca 0.00 -1.01 -0.25 0.00 0.00 0.00 0.00 46.02 44.76 1h4i n GLY 574 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h4i s VAL 575 N -3.00 1.35 -0.11 1.61 1.01 0.38 -1.43 120.40 120.21 1h4i s VAL 575 Ca 0.00 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.30 1h4i s VAL 575 Cb 0.00 -1.14 -0.00 0.00 0.00 0.00 0.00 36.38 35.24 1h4i s VAL 575 CO 0.00 0.38 -0.21 -0.69 0.00 0.00 0.00 175.10 174.59 1h4i s VAL 576 N -0.23 2.33 -0.14 2.92 1.01 -0.54 -1.58 120.40 124.17 1h4i s VAL 576 Ca 0.03 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.09 1h4i s VAL 576 Cb -0.08 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 1h4i s VAL 576 CO 0.00 0.55 -0.15 -0.69 0.00 0.00 0.00 175.10 174.81 1h4i s VAL 577 N 0.40 2.82 0.27 2.92 1.01 -0.62 -2.03 120.40 125.17 1h4i s VAL 577 Ca -0.16 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.18 1h4i s VAL 577 Cb -0.17 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 1h4i s VAL 577 CO 0.07 0.52 0.09 -0.36 0.00 0.00 0.00 175.10 175.43 1h4i s PHE 578 N 0.55 2.86 0.04 5.22 0.40 0.54 0.41 117.98 128.00 1h4i s PHE 578 Ca -0.09 -0.20 -0.28 0.00 -0.60 0.00 0.00 56.93 55.76 1h4i s PHE 578 Cb -0.16 -1.33 0.09 0.00 0.51 0.00 0.00 43.02 42.13 1h4i s PHE 578 CO 0.04 0.54 0.89 -1.54 0.70 0.00 0.00 175.22 175.85 1h4i s SER 579 N -3.76 -0.33 0.13 1.36 1.04 -0.61 -1.71 113.70 109.82 1h4i s SER 579 Ca 0.33 -0.10 -0.31 0.00 0.48 0.00 0.00 55.95 56.35 1h4i s SER 579 Cb -0.07 0.42 -0.10 0.00 0.10 0.00 0.00 66.02 66.37 1h4i s SER 579 CO 0.22 -0.71 1.78 -0.76 0.98 0.00 0.00 173.24 174.75 1h4i s LEU 580 N -2.61 4.39 -0.97 2.42 1.43 -1.26 -1.48 118.68 120.59 1h4i s LEU 580 Ca 0.07 2.74 0.00 0.00 -1.03 0.00 0.00 54.13 55.90 1h4i s LEU 580 Cb -0.01 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.64 1h4i s LEU 580 CO -0.06 -0.98 0.00 0.47 0.23 0.00 0.00 176.35 176.01 1h4i n ASP 581 N 5.30 -5.44 -2.07 2.29 8.00 0.42 -2.62 116.55 122.42 1h4i n ASP 581 Ca 0.17 0.23 -0.21 0.00 0.71 0.00 0.00 54.79 55.69 1h4i n ASP 581 Cb 0.38 -3.74 -0.04 0.00 -0.02 0.00 0.00 41.12 37.69 1h4i n ASP 581 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1h4i n GLY 582 N -0.09 0.48 3.77 0.44 0.00 -0.62 -4.91 105.19 104.26 1h4i n GLY 582 Ca -0.09 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 1h4i n GLY 582 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h4i s LYS 583 N -4.54 4.13 0.00 1.61 1.02 -1.08 -4.43 119.74 116.46 1h4i s LYS 583 Ca 0.00 2.12 0.00 0.00 0.02 0.00 0.00 55.97 58.11 1h4i s LYS 583 Cb 0.00 -2.87 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 1h4i s LYS 583 CO 0.00 -0.34 0.00 0.41 -0.92 0.00 0.00 175.35 174.50 1h4i n GLY 584 N 0.72 2.18 0.27 -3.33 0.00 -1.26 -4.77 105.19 99.01 1h4i n GLY 584 Ca 0.02 -0.85 0.10 0.00 0.00 0.00 0.00 46.02 45.30 1h4i n GLY 584 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1h4i h PRO 585 N 0.00 0.00 -0.73 1.61 0.11 -1.88 -2.75 132.00 128.36 1h4i h PRO 585 Ca 0.00 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.95 1h4i h PRO 585 Cb 0.00 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.02 1h4i h PRO 585 CO 0.00 0.00 0.20 0.66 -0.21 0.00 0.00 178.00 178.65 1h4i n TYR 586 N -4.37 2.25 0.27 0.65 4.02 -1.26 -4.26 117.16 114.46 1h4i n TYR 586 Ca -0.02 -1.02 0.13 0.00 -0.01 0.00 0.00 57.90 56.98 1h4i n TYR 586 Cb 0.12 -0.62 0.77 0.00 -0.02 0.00 0.00 39.34 39.59 1h4i n TYR 586 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1h4i h ASP 587 N 2.85 0.00 -3.44 7.72 5.19 -1.88 -3.10 116.42 123.76 1h4i h ASP 587 Ca 0.19 0.00 -0.72 0.00 -0.62 0.00 0.00 57.03 55.88 1h4i h ASP 587 Cb 2.17 0.00 -0.27 0.00 0.18 0.00 0.00 39.33 41.41 1h4i h ASP 587 CO 0.65 0.09 -0.45 -0.62 -3.12 0.00 0.00 179.24 175.79 1h4i s ASP 588 N -6.13 5.73 0.44 6.45 -1.08 -1.26 -4.95 116.67 115.87 1h4i s ASP 588 Ca -0.03 -1.43 0.27 0.00 -0.52 0.00 0.00 52.55 50.84 1h4i s ASP 588 Cb 0.13 -2.02 1.49 0.00 -1.46 0.00 0.00 42.92 41.06 1h4i s ASP 588 CO 0.57 -0.54 1.82 1.55 0.52 0.00 0.00 175.17 179.09 1h4i h PRO 589 N 8.47 0.00 0.00 4.34 0.13 -1.89 -2.21 132.00 140.84 1h4i h PRO 589 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1h4i h PRO 589 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1h4i h PRO 589 CO 0.77 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.63 1h4i n ASN 590 N -2.50 0.77 -4.71 1.44 3.02 -1.26 -4.63 115.26 107.39 1h4i n ASN 590 Ca -0.02 0.60 -0.42 0.00 -0.03 0.00 0.00 54.58 54.71 1h4i n ASN 590 Cb 0.11 -0.80 -0.03 0.00 -0.61 0.00 0.00 39.78 38.45 1h4i n ASN 590 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1h4i s VAL 591 N -3.16 3.25 0.00 2.41 1.01 -0.83 -2.46 120.40 120.62 1h4i s VAL 591 Ca 0.09 0.87 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1h4i s VAL 591 Cb 0.12 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1h4i s VAL 591 CO 0.54 0.06 0.00 0.61 0.00 0.00 0.00 175.10 176.31 1h4i n GLY 592 N 3.56 1.37 3.79 4.51 0.00 -1.26 -4.93 105.19 112.23 1h4i n GLY 592 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1h4i n GLY 592 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h4i s GLU 593 N -0.45 4.23 0.33 1.61 0.41 -1.03 -5.03 118.70 118.78 1h4i s GLU 593 Ca 0.00 1.41 -0.28 0.00 -0.41 0.00 0.00 54.97 55.69 1h4i s GLU 593 Cb 0.00 -2.50 -0.09 0.00 -1.78 0.00 0.00 34.13 29.75 1h4i s GLU 593 CO 0.00 -0.07 1.14 -0.46 -0.49 0.00 0.00 175.26 175.38 1h4i s TRP 594 N -1.75 3.34 0.00 1.61 -0.00 -1.26 -5.13 118.94 115.75 1h4i s TRP 594 Ca 0.58 1.62 0.00 0.00 -0.00 0.00 0.00 56.10 58.29 1h4i s TRP 594 Cb -0.19 -3.35 0.00 0.00 -0.00 0.00 0.00 33.47 29.93 1h4i s TRP 594 CO 0.24 -0.94 0.01 1.17 -0.00 0.00 0.00 176.95 177.44