#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 0.40 -0.19 1.20 3.32 -1.99 -1.65 116.42 117.51 1h4i h ASP 2 Ca 0.00 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 56.89 1h4i h ASP 2 Cb 0.00 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1h4i h ASP 2 CO 0.00 0.66 0.02 0.11 -1.72 0.00 0.00 179.24 178.31 1h4i h LYS 3 N 0.35 0.33 -0.77 3.56 1.57 -1.99 -1.97 116.57 117.65 1h4i h LYS 3 Ca 0.05 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1h4i h LYS 3 Cb 0.65 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.89 1h4i h LYS 3 CO 0.05 0.51 0.48 -0.07 -0.57 0.00 0.00 179.45 179.85 1h4i h LEU 4 N 0.10 0.91 -0.43 2.94 3.38 -1.92 0.58 115.31 120.87 1h4i h LEU 4 Ca 0.06 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1h4i h LEU 4 Cb 0.35 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1h4i h LEU 4 CO 0.01 0.69 0.18 0.58 0.09 0.00 0.00 178.44 179.98 1h4i h VAL 5 N 1.05 0.91 -0.20 1.22 2.07 -1.18 0.17 116.25 120.29 1h4i h VAL 5 Ca 0.28 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.66 1h4i h VAL 5 Cb -0.07 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 1h4i h VAL 5 CO -0.06 0.07 0.05 -0.33 0.02 0.00 0.00 177.57 177.32 1h4i h GLU 6 N 0.36 0.32 -1.00 1.57 4.39 -0.75 -2.93 114.58 116.54 1h4i h GLU 6 Ca 0.20 -0.08 0.07 0.00 0.34 0.00 0.00 59.36 59.89 1h4i h GLU 6 Cb 0.16 -0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.69 1h4i h GLU 6 CO -0.18 0.45 0.65 -0.07 -1.16 0.00 0.00 179.01 178.69 1h4i h LEU 7 N 0.13 1.02 0.00 1.33 3.38 -0.47 -0.80 115.31 119.90 1h4i h LEU 7 Ca 0.06 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1h4i h LEU 7 Cb 0.27 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1h4i h LEU 7 CO 0.00 0.64 0.00 -1.54 0.09 0.00 0.00 178.44 177.63 1h4i n SER 8 N -4.51 0.00 -0.69 -0.43 3.41 0.55 -1.29 113.62 110.65 1h4i n SER 8 Ca 0.16 0.47 0.13 0.00 -0.26 0.00 0.00 58.87 59.37 1h4i n SER 8 Cb 0.21 -0.48 0.34 0.00 -0.26 0.00 0.00 64.21 64.02 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 -1.48 1.96 -3.50 4.33 0.00 -0.31 -4.83 118.16 114.33 1h4i n LYS 9 Ca 0.02 -1.39 -0.37 0.00 0.00 0.00 0.00 58.31 56.57 1h4i n LYS 9 Cb 0.08 -1.47 -0.07 0.00 0.00 0.00 0.00 35.03 33.58 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 -1.97 6.56 0.00 3.14 0.15 -0.41 -4.94 113.70 116.22 1h4i s SER 10 Ca 0.34 0.66 0.23 0.00 0.70 0.00 0.00 55.95 57.88 1h4i s SER 10 Cb 0.21 -2.21 1.10 0.00 -1.71 0.00 0.00 66.02 63.41 1h4i s SER 10 CO 0.32 0.14 1.76 0.47 1.20 0.00 0.00 173.24 177.13 1h4i n ASP 11 N 3.15 0.00 -0.01 5.45 10.43 -1.26 -2.77 116.55 131.54 1h4i n ASP 11 Ca -0.12 0.17 0.14 0.00 2.57 0.00 0.00 54.79 57.55 1h4i n ASP 11 Cb 0.52 -0.37 0.56 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 -1.37 0.16 -4.45 -2.24 8.00 -1.26 -1.38 116.55 114.01 1h4i n ASP 12 Ca 0.09 0.14 -0.22 0.00 0.71 0.00 0.00 54.79 55.50 1h4i n ASP 12 Cb 0.22 -0.27 -0.10 0.00 -0.02 0.00 0.00 41.12 40.95 1h4i n ASP 12 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1h4i s ASN 13 N -2.88 3.00 -0.39 -2.24 0.01 -1.11 -4.59 114.94 106.72 1h4i s ASN 13 Ca 0.17 -1.17 0.04 0.00 -0.71 0.00 0.00 52.86 51.19 1h4i s ASN 13 Cb 0.19 -0.21 0.16 0.00 0.41 0.00 0.00 41.25 41.80 1h4i s ASN 13 CO 0.55 -0.27 0.41 0.86 -1.51 0.00 0.00 177.10 177.14 1h4i s TRP 14 N -2.89 -0.24 -1.25 2.20 -0.11 0.04 -4.87 118.94 111.81 1h4i s TRP 14 Ca 0.29 -1.02 0.27 0.00 1.22 0.00 0.00 56.10 56.86 1h4i s TRP 14 Cb 0.02 -0.40 0.85 0.00 -1.50 0.00 0.00 33.47 32.45 1h4i s TRP 14 CO 0.13 -0.98 1.64 1.33 -4.62 0.00 0.00 176.95 174.44 1h4i n VAL 15 N 3.89 0.00 -3.62 5.86 0.24 -1.26 -1.63 118.33 121.81 1h4i n VAL 15 Ca 0.15 -0.03 -0.10 0.00 -2.04 0.00 0.00 64.34 62.32 1h4i n VAL 15 Cb 0.47 0.04 -0.02 0.00 -1.47 0.00 0.00 33.84 32.85 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 -2.81 1.46 0.20 7.34 -1.94 -1.26 -3.93 119.30 118.36 1h4i s MET 16 Ca 0.18 -0.71 -0.33 0.00 -1.71 0.00 0.00 55.69 53.12 1h4i s MET 16 Cb 0.19 0.58 -0.13 0.00 2.01 0.00 0.00 34.83 37.48 1h4i s MET 16 CO 0.59 -0.64 1.66 -2.30 -0.01 0.00 0.00 175.02 174.31 1h4i n PRO 17 N -0.40 2.54 -0.43 2.03 -0.02 -1.26 -1.59 135.00 135.86 1h4i n PRO 17 Ca -0.12 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1h4i n PRO 17 Cb 0.63 -2.73 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 3.66 0.99 2.84 -1.23 0.00 -1.26 -4.58 105.19 105.61 1h4i n GLY 18 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.62 -2.61 118.16 110.12 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 2.25 0.46 3.14 2.20 -1.26 -4.19 114.94 117.54 1h4i s ASN 20 Ca 0.00 -1.70 0.23 0.00 -0.94 0.00 0.00 52.86 50.45 1h4i s ASN 20 Cb 0.00 0.53 1.13 0.00 -2.00 0.00 0.00 41.25 40.91 1h4i s ASN 20 CO 0.00 -0.98 1.95 1.88 -2.94 0.00 0.00 177.10 177.01 1h4i h TYR 21 N 1.95 0.00 0.00 1.54 0.99 -1.89 -1.43 116.97 118.13 1h4i h TYR 21 Ca -0.31 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.38 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 1.55 0.21 -0.19 -0.44 -0.00 0.00 0.00 178.16 179.29 1h4i h ASP 22 N 0.00 0.00 -3.89 3.88 3.32 -1.92 -1.94 116.42 115.88 1h4i h ASP 22 Ca -0.00 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.79 1h4i h ASP 22 Cb 0.52 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.15 1h4i h ASP 22 CO 0.03 0.19 -0.42 -1.20 -1.72 0.00 0.00 179.24 176.11 1h4i n SER 23 N -3.57 -4.74 -0.18 6.45 7.64 -0.54 -1.26 113.62 117.42 1h4i n SER 23 Ca -0.01 -0.31 -0.09 0.00 1.01 0.00 0.00 58.87 59.46 1h4i n SER 23 Cb 0.33 -3.37 0.01 0.00 -1.01 0.00 0.00 64.21 60.17 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 -1.58 0.83 -5.17 6.43 2.35 -1.79 -3.44 115.58 113.21 1h4i h ASN 24 Ca -0.36 -0.26 -0.41 0.00 -0.55 0.00 0.00 56.30 54.72 1h4i h ASN 24 Cb 1.23 -0.22 0.03 0.00 0.05 0.00 0.00 38.32 39.41 1h4i h ASN 24 CO 0.36 0.89 -0.63 0.59 -1.65 0.00 0.00 177.43 176.98 1h4i n ASN 25 N -4.38 -5.43 -4.29 5.81 4.13 -1.07 -1.48 115.26 108.55 1h4i n ASN 25 Ca 0.02 -0.42 -0.32 0.00 1.68 0.00 0.00 54.58 55.54 1h4i n ASN 25 Cb 0.26 -4.38 -0.16 0.00 -1.54 0.00 0.00 39.78 33.97 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 -3.16 2.52 -0.03 3.10 5.36 -1.26 -1.27 117.98 123.25 1h4i s PHE 26 Ca 0.42 -0.72 0.07 0.00 -0.96 0.00 0.00 56.93 55.74 1h4i s PHE 26 Cb -0.20 -1.64 -0.02 0.00 -0.34 0.00 0.00 43.02 40.81 1h4i s PHE 26 CO 0.52 -0.21 -0.22 0.45 -1.46 0.00 0.00 175.22 174.30 1h4i s SER 27 N -0.08 3.39 0.00 6.13 0.15 -0.10 -5.00 113.70 118.19 1h4i s SER 27 Ca -0.05 -0.38 0.27 0.00 0.70 0.00 0.00 55.95 56.48 1h4i s SER 27 Cb -0.14 -0.51 0.85 0.00 -1.71 0.00 0.00 66.02 64.50 1h4i s SER 27 CO 0.04 0.33 1.65 0.47 1.20 0.00 0.00 173.24 176.93 1h4i n ASP 28 N 2.36 0.28 -4.75 5.45 8.00 -1.26 -0.07 116.55 126.55 1h4i n ASP 28 Ca -0.16 0.08 -0.41 0.00 0.71 0.00 0.00 54.79 55.00 1h4i n ASP 28 Cb 0.51 -0.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.51 1h4i n ASP 28 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1h4i s LEU 29 N -2.99 4.35 -0.05 0.64 1.43 -1.26 -4.50 118.68 116.30 1h4i s LEU 29 Ca 0.13 2.91 0.16 0.00 -1.03 0.00 0.00 54.13 56.29 1h4i s LEU 29 Cb 0.18 -3.64 0.30 0.00 0.03 0.00 0.00 46.19 43.07 1h4i s LEU 29 CO 0.62 -0.87 1.13 2.29 0.23 0.00 0.00 176.35 179.75 1h4i n LYS 30 N 2.02 0.40 -0.11 1.70 2.85 -1.26 -3.53 118.16 120.23 1h4i n LYS 30 Ca 0.07 -2.02 -0.10 0.00 -1.05 0.00 0.00 58.31 55.22 1h4i n LYS 30 Cb 0.38 -0.56 -0.02 0.00 -0.65 0.00 0.00 35.03 34.18 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 0.63 0.50 -5.09 -1.58 4.15 -1.97 -3.35 115.11 108.40 1h4i h GLN 31 Ca -0.11 -0.10 -0.66 0.00 0.77 0.00 0.00 58.65 58.56 1h4i h GLN 31 Cb 1.52 -0.08 -0.16 0.00 0.21 0.00 0.00 27.48 28.97 1h4i h GLN 31 CO 0.05 0.52 -0.16 0.42 -1.93 0.00 0.00 178.83 177.73 1h4i s ILE 32 N -5.47 5.08 0.35 2.39 1.01 -1.26 -4.96 121.20 118.35 1h4i s ILE 32 Ca -0.13 0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.74 1h4i s ILE 32 Cb 0.09 -3.91 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 1h4i s ILE 32 CO 0.74 -0.18 0.18 0.54 0.00 0.00 0.00 174.94 176.22 1h4i s ASN 33 N 1.75 2.06 0.64 3.58 2.20 -1.26 -4.46 114.94 119.45 1h4i s ASN 33 Ca 0.15 -1.66 0.38 0.00 -0.94 0.00 0.00 52.86 50.80 1h4i s ASN 33 Cb -0.16 0.48 2.14 0.00 -2.00 0.00 0.00 41.25 41.71 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 2.03 0.00 0.00 3.55 2.10 -1.39 -1.43 116.57 121.43 1h4i h LYS 34 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 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 0.50 0.00 0.00 0.78 -2.00 0.00 0.00 179.45 178.73 1h4i h GLY 35 N 0.00 0.00 -0.10 0.07 0.00 -1.96 -3.36 103.07 97.72 1h4i h GLY 35 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1h4i h GLY 35 CO -0.00 0.00 -0.05 1.16 0.00 0.00 0.00 176.54 177.65 1h4i n ASN 36 N -2.42 0.41 -0.11 0.19 0.23 -0.63 -4.84 115.26 108.10 1h4i n ASN 36 Ca 0.05 -1.33 0.08 0.00 -0.53 0.00 0.00 54.58 52.85 1h4i n ASN 36 Cb 0.41 -0.03 0.42 0.00 -2.08 0.00 0.00 39.78 38.51 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 2.80 0.99 -0.21 3.53 2.07 -1.47 -1.49 116.25 122.47 1h4i h VAL 37 Ca 0.00 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.38 1h4i h VAL 37 Cb 0.95 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1h4i h VAL 37 CO 0.00 0.11 0.44 0.11 0.02 0.00 0.00 177.57 178.24 1h4i h LYS 38 N 0.58 0.00 -0.11 1.57 6.56 -1.87 0.71 116.57 124.01 1h4i h LYS 38 Ca 0.27 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.86 1h4i h LYS 38 Cb 0.30 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.96 1h4i h LYS 38 CO -0.08 0.00 0.00 1.04 -2.06 0.00 0.00 179.45 178.35 1h4i n GLN 39 N -3.25 1.62 -2.12 3.15 6.02 -0.56 -4.91 117.38 117.34 1h4i n GLN 39 Ca 0.03 -0.93 -0.42 0.00 -0.01 0.00 0.00 57.00 55.67 1h4i n GLN 39 Cb 0.55 -1.41 -0.03 0.00 1.02 0.00 0.00 30.24 30.37 1h4i n GLN 39 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1h4i s LEU 40 N -1.68 4.33 0.05 1.08 0.20 0.24 -0.41 118.68 122.49 1h4i s LEU 40 Ca 0.34 2.23 -0.05 0.00 0.69 0.00 0.00 54.13 57.34 1h4i s LEU 40 Cb 0.18 -3.56 -0.02 0.00 -0.43 0.00 0.00 46.19 42.36 1h4i s LEU 40 CO 0.28 -0.79 0.08 -0.13 -0.29 0.00 0.00 176.35 175.49 1h4i s ARG 41 N 2.61 0.61 0.36 1.98 3.00 -0.55 -4.89 118.95 122.07 1h4i s ARG 41 Ca 0.68 -0.86 -0.28 0.00 0.00 0.00 0.00 55.73 55.26 1h4i s ARG 41 Cb -0.34 0.23 -0.11 0.00 0.00 0.00 0.00 34.95 34.73 1h4i s ARG 41 CO 0.28 -0.15 1.50 -2.14 0.00 0.00 0.00 175.30 174.80 1h4i s PRO 42 N -2.94 4.12 -0.18 3.54 0.02 -1.26 -1.53 135.00 136.77 1h4i s PRO 42 Ca -0.02 2.56 0.14 0.00 0.02 0.00 0.00 61.00 63.70 1h4i s PRO 42 Cb 0.01 -2.98 -0.21 0.00 0.02 0.00 0.00 34.50 31.34 1h4i s PRO 42 CO -0.06 -0.54 0.03 0.00 -0.33 0.00 0.00 177.00 176.09 1h4i n ALA 43 N 0.80 1.56 -3.58 -1.55 0.00 0.16 -4.43 120.51 113.48 1h4i n ALA 43 Ca 0.02 -1.14 -0.06 0.00 0.00 0.00 0.00 53.44 52.27 1h4i n ALA 43 Cb 0.39 -0.11 -0.02 0.00 0.00 0.00 0.00 19.45 19.71 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 -2.43 -0.20 0.21 0.00 1.48 -1.18 -4.77 118.94 112.06 1h4i s TRP 44 Ca -0.12 0.16 0.01 0.00 -1.06 0.00 0.00 56.10 55.10 1h4i s TRP 44 Cb 0.06 0.51 -0.05 0.00 -1.16 0.00 0.00 33.47 32.83 1h4i s TRP 44 CO 0.69 -0.28 0.06 0.95 -4.06 0.00 0.00 176.95 174.31 1h4i s THR 45 N -2.33 0.52 -0.23 0.66 -4.23 -1.26 -1.58 115.64 107.19 1h4i s THR 45 Ca 0.07 -1.99 -0.10 0.00 -1.18 0.00 0.00 61.69 58.50 1h4i s THR 45 Cb -0.01 -2.38 0.09 0.00 1.34 0.00 0.00 72.50 71.54 1h4i s THR 45 CO -0.05 -0.22 0.51 0.12 -0.54 0.00 0.00 174.62 174.43 1h4i s PHE 46 N -3.77 -0.91 0.01 3.99 5.36 -0.67 -4.99 117.98 117.00 1h4i s PHE 46 Ca 0.31 1.74 -0.15 0.00 -0.96 0.00 0.00 56.93 57.87 1h4i s PHE 46 Cb 0.07 0.46 -0.06 0.00 -0.34 0.00 0.00 43.02 43.15 1h4i s PHE 46 CO 0.09 -0.50 0.43 0.45 -1.46 0.00 0.00 175.22 174.23 1h4i s SER 47 N 2.24 6.85 0.28 6.13 0.15 -1.26 -0.56 113.70 127.53 1h4i s SER 47 Ca -0.06 1.01 0.25 0.00 0.70 0.00 0.00 55.95 57.85 1h4i s SER 47 Cb -0.10 -2.27 0.56 0.00 -1.71 0.00 0.00 66.02 62.50 1h4i s SER 47 CO -0.15 0.31 1.63 0.71 1.20 0.00 0.00 173.24 176.94 1h4i h THR 48 N 3.70 0.00 0.00 6.45 1.35 -1.73 -3.48 112.91 119.20 1h4i h THR 48 Ca -0.51 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.66 1h4i h THR 48 Cb 1.22 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1h4i h THR 48 CO 0.62 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.50 1h4i n GLY 49 N 1.23 0.53 3.21 5.82 0.00 -1.26 -5.03 105.19 109.68 1h4i n GLY 49 Ca 0.04 -0.10 -0.15 0.00 0.00 0.00 0.00 46.02 45.81 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 2.45 0.00 0.99 1.43 -1.26 -5.14 118.68 117.15 1h4i s LEU 50 Ca 0.00 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.22 1h4i s LEU 50 Cb 0.00 -0.35 0.00 0.00 0.03 0.00 0.00 46.19 45.87 1h4i s LEU 50 CO 0.00 -0.27 0.00 0.18 0.23 0.00 0.00 176.35 176.49 1h4i n LEU 51 N 0.30 0.00 -0.67 1.79 4.77 -1.26 -3.83 117.00 118.10 1h4i n LEU 51 Ca -0.14 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 55.92 1h4i n LEU 51 Cb 0.59 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.64 1h4i n LEU 51 CO 0.29 0.00 -0.26 0.59 -1.33 0.00 0.00 177.39 176.68 1h4i n ASN 52 N 0.00 -3.85 -4.74 -1.43 3.02 -1.26 -4.72 115.26 102.28 1h4i n ASN 52 Ca 0.00 0.59 -0.42 0.00 -0.03 0.00 0.00 54.58 54.72 1h4i n ASN 52 Cb 0.00 -2.25 -0.02 0.00 -0.61 0.00 0.00 39.78 36.90 1h4i n ASN 52 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1h4i s GLY 53 N -5.79 1.80 -0.68 7.41 0.00 -1.19 -4.58 107.32 104.29 1h4i s GLY 53 Ca 0.00 1.59 -0.05 0.00 0.00 0.00 0.00 44.72 46.25 1h4i s GLY 53 CO 0.00 2.67 0.52 0.30 0.00 0.00 0.00 173.10 176.59 1h4i s HIS 54 N 0.40 3.48 0.66 1.90 3.76 -0.66 -4.32 115.29 120.52 1h4i s HIS 54 Ca 0.67 -2.57 -0.02 0.00 -0.15 0.00 0.00 55.06 53.00 1h4i s HIS 54 Cb -0.49 -3.34 0.08 0.00 1.11 0.00 0.00 32.58 29.95 1h4i s HIS 54 CO 0.43 -0.87 0.92 -1.21 -0.85 0.00 0.00 174.74 173.16 1h4i s GLU 55 N -0.06 2.07 2.92 1.40 2.02 -1.25 -3.81 118.70 121.99 1h4i s GLU 55 Ca 0.17 -0.79 0.00 0.00 0.02 0.00 0.00 54.97 54.37 1h4i s GLU 55 Cb -0.18 -2.34 0.00 0.00 0.10 0.00 0.00 34.13 31.71 1h4i s GLU 55 CO -0.05 -1.16 0.00 0.41 0.02 0.00 0.00 175.26 174.49 1h4i n GLY 56 N -2.70 -0.31 3.39 -1.39 0.00 -1.25 -4.63 105.19 98.31 1h4i n GLY 56 Ca 0.11 -1.05 -0.11 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.27 -1.32 0.74 4.61 0.00 -1.26 -2.52 121.76 120.74 1h4i s ALA 57 Ca 0.00 0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.09 1h4i s ALA 57 Cb 0.00 0.82 0.03 0.00 0.00 0.00 0.00 23.12 23.97 1h4i s ALA 57 CO 0.00 -0.73 1.08 -1.25 0.00 0.00 0.00 175.76 174.86 1h4i s PRO 58 N -3.78 2.56 0.04 0.00 0.04 -1.26 -4.68 135.00 127.93 1h4i s PRO 58 Ca 0.02 0.70 0.03 0.00 0.04 0.00 0.00 61.00 61.80 1h4i s PRO 58 Cb -0.00 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 1h4i s PRO 58 CO -0.12 -1.30 -0.00 -0.51 0.04 0.00 0.00 177.00 175.11 1h4i s LEU 59 N -5.60 3.46 -0.15 -3.56 1.43 -0.91 -4.94 118.68 108.41 1h4i s LEU 59 Ca 0.59 -0.09 -0.00 0.00 -1.03 0.00 0.00 54.13 53.60 1h4i s LEU 59 Cb -0.13 -2.08 0.03 0.00 0.03 0.00 0.00 46.19 44.03 1h4i s LEU 59 CO 0.54 0.23 -0.09 -0.69 0.23 0.00 0.00 176.35 176.57 1h4i s VAL 60 N -1.18 1.27 -0.13 -1.59 1.01 -0.64 -0.37 120.40 118.77 1h4i s VAL 60 Ca 0.22 -0.55 -0.06 0.00 0.00 0.00 0.00 61.98 61.59 1h4i s VAL 60 Cb -0.12 -1.30 0.05 0.00 0.00 0.00 0.00 36.38 35.02 1h4i s VAL 60 CO 0.14 0.31 0.30 -0.69 0.00 0.00 0.00 175.10 175.16 1h4i s VAL 61 N 1.59 -0.10 -1.26 2.92 1.01 -0.51 -0.78 120.40 123.27 1h4i s VAL 61 Ca 0.03 0.15 -0.07 0.00 0.00 0.00 0.00 61.98 62.09 1h4i s VAL 61 Cb -0.14 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 35.79 1h4i s VAL 61 CO -0.09 0.06 1.10 -0.67 0.00 0.00 0.00 175.10 175.50 1h4i n ASP 62 N 4.42 -5.38 -0.54 3.32 4.64 -1.26 -2.50 116.55 119.25 1h4i n ASP 62 Ca -0.22 -0.53 -0.07 0.00 -1.38 0.00 0.00 54.79 52.59 1h4i n ASP 62 Cb 0.53 -4.83 -0.03 0.00 -1.04 0.00 0.00 41.12 35.75 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 -1.78 0.91 3.19 0.27 0.00 -1.26 -5.02 105.19 101.49 1h4i n GLY 63 Ca -0.05 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.40 0.95 -0.09 1.61 1.02 -1.04 -1.38 119.74 118.41 1h4i s LYS 64 Ca 0.00 -0.93 0.01 0.00 0.02 0.00 0.00 55.97 55.07 1h4i s LYS 64 Cb 0.00 -1.01 -0.02 0.00 -0.52 0.00 0.00 37.83 36.27 1h4i s LYS 64 CO 0.00 0.24 -0.10 1.41 -0.92 0.00 0.00 175.35 175.97 1h4i s MET 65 N -1.55 2.94 -0.16 1.68 -2.45 0.45 -1.42 119.30 118.78 1h4i s MET 65 Ca 0.01 -0.63 -0.02 0.00 -1.25 0.00 0.00 55.69 53.81 1h4i s MET 65 Cb -0.09 -2.57 -0.01 0.00 1.25 0.00 0.00 34.83 33.40 1h4i s MET 65 CO 0.02 0.49 -0.09 0.71 1.05 0.00 0.00 175.02 177.20 1h4i s TYR 66 N -0.36 2.89 -0.02 4.11 1.51 0.50 -0.82 117.35 125.16 1h4i s TYR 66 Ca 0.04 -0.71 0.06 0.00 -1.01 0.00 0.00 57.07 55.45 1h4i s TYR 66 Cb -0.12 -1.95 -0.03 0.00 -0.11 0.00 0.00 41.96 39.75 1h4i s TYR 66 CO 0.02 -0.30 -0.19 0.42 -1.11 0.00 0.00 175.55 174.39 1h4i s ILE 67 N 0.73 2.69 0.20 2.71 1.09 -0.01 -2.15 121.20 126.46 1h4i s ILE 67 Ca -0.04 -0.93 0.09 0.00 -1.10 0.00 0.00 60.65 58.67 1h4i s ILE 67 Cb -0.15 -2.03 -0.05 0.00 -1.06 0.00 0.00 42.46 39.17 1h4i s ILE 67 CO 0.02 0.54 -0.18 -1.38 -0.10 0.00 0.00 174.94 173.84 1h4i s HIS 68 N -0.73 1.90 0.21 3.97 -3.43 -1.26 -1.53 115.29 114.42 1h4i s HIS 68 Ca 0.12 -0.47 0.01 0.00 -0.80 0.00 0.00 55.06 53.92 1h4i s HIS 68 Cb -0.10 -0.90 -0.01 0.00 -1.43 0.00 0.00 32.58 30.14 1h4i s HIS 68 CO 0.01 0.42 0.05 0.25 -2.00 0.00 0.00 174.74 173.47 1h4i n THR 69 N -0.11 0.00 -2.02 -5.38 -2.24 -1.14 -4.97 114.28 98.42 1h4i n THR 69 Ca -0.10 -1.14 -0.29 0.00 -2.27 0.00 0.00 64.05 60.25 1h4i n THR 69 Cb 0.59 0.37 0.18 0.00 -2.10 0.00 0.00 70.33 69.37 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 -2.23 3.15 0.28 3.42 1.04 -1.26 -4.45 113.70 113.65 1h4i s SER 70 Ca 0.08 0.14 -0.28 0.00 0.48 0.00 0.00 55.95 56.36 1h4i s SER 70 Cb 0.00 -0.18 -0.14 0.00 0.10 0.00 0.00 66.02 65.80 1h4i s SER 70 CO 0.05 -2.69 0.97 0.33 0.98 0.00 0.00 173.24 172.88 1h4i n PHE 71 N -3.69 1.14 0.92 5.02 -0.00 0.30 -0.47 117.46 120.69 1h4i n PHE 71 Ca 0.16 0.72 0.00 0.00 -0.00 0.00 0.00 57.45 58.33 1h4i n PHE 71 Cb 0.59 -2.23 0.00 0.00 -0.00 0.00 0.00 39.48 37.85 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 0.75 0.92 -3.28 -7.13 -0.04 -1.26 -4.95 135.00 120.00 1h4i n PRO 72 Ca 0.10 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.44 1h4i n PRO 72 Cb 0.31 -1.20 0.03 0.00 -0.04 0.00 0.00 33.50 32.60 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 0.35 -6.80 -4.90 3.54 3.02 0.38 -4.27 115.26 106.58 1h4i n ASN 73 Ca 0.00 -0.51 -0.28 0.00 -0.03 0.00 0.00 54.58 53.76 1h4i n ASN 73 Cb 0.37 -4.69 0.00 0.00 -0.61 0.00 0.00 39.78 34.85 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 -3.20 6.26 -0.02 6.41 0.01 -1.26 -4.55 114.94 118.58 1h4i s ASN 74 Ca 0.23 0.98 0.03 0.00 -0.71 0.00 0.00 52.86 53.39 1h4i s ASN 74 Cb -0.05 -2.27 -0.00 0.00 0.41 0.00 0.00 41.25 39.34 1h4i s ASN 74 CO 0.78 -0.61 -0.11 -0.89 -1.51 0.00 0.00 177.10 174.76 1h4i s THR 75 N -2.79 0.88 0.03 1.60 2.01 -0.12 -2.88 115.64 114.37 1h4i s THR 75 Ca 0.48 -0.44 0.05 0.00 0.31 0.00 0.00 61.69 62.09 1h4i s THR 75 Cb -0.10 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 71.63 1h4i s THR 75 CO 0.46 0.26 -0.14 -0.36 -0.69 0.00 0.00 174.62 174.15 1h4i s PHE 76 N -0.01 1.25 -0.11 4.92 0.40 -0.58 -0.31 117.98 123.54 1h4i s PHE 76 Ca -0.00 -0.34 0.03 0.00 -0.60 0.00 0.00 56.93 56.02 1h4i s PHE 76 Cb -0.07 -0.75 0.00 0.00 0.51 0.00 0.00 43.02 42.71 1h4i s PHE 76 CO 0.00 0.03 -0.23 0.00 0.70 0.00 0.00 175.22 175.73 1h4i s ALA 77 N -0.80 2.14 -0.04 5.36 0.00 -0.63 -0.83 121.76 126.95 1h4i s ALA 77 Ca 0.02 -0.97 0.05 0.00 0.00 0.00 0.00 51.96 51.06 1h4i s ALA 77 Cb -0.08 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 1h4i s ALA 77 CO 0.01 0.17 -0.21 -0.51 0.00 0.00 0.00 175.76 175.23 1h4i s LEU 78 N 0.52 2.00 -0.09 0.00 1.43 -0.00 -0.62 118.68 121.91 1h4i s LEU 78 Ca -0.15 -0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 52.25 1h4i s LEU 78 Cb -0.17 -1.15 -0.02 0.00 0.03 0.00 0.00 46.19 44.89 1h4i s LEU 78 CO 0.05 0.21 0.96 -0.83 0.23 0.00 0.00 176.35 176.98 1h4i s GLY 79 N -0.15 2.44 0.65 -3.19 0.00 -1.26 -0.41 107.32 105.40 1h4i s GLY 79 Ca -0.01 0.35 0.39 0.00 0.00 0.00 0.00 44.72 45.45 1h4i s GLY 79 CO 0.02 1.81 2.26 1.41 0.00 0.00 0.00 173.10 178.59 1h4i h LEU 80 N 7.77 0.00 0.00 0.66 4.07 -1.58 -1.86 115.31 124.37 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 -0.34 0.44 -1.08 0.00 0.00 178.44 178.29 1h4i h ASP 81 N 0.00 0.00 -0.85 -0.43 3.45 -1.93 -3.41 116.42 113.25 1h4i h ASP 81 Ca 0.01 -0.06 -0.27 0.00 0.43 0.00 0.00 57.03 57.14 1h4i h ASP 81 Cb 0.17 0.00 -0.20 0.00 -0.56 0.00 0.00 39.33 38.74 1h4i h ASP 81 CO -0.00 0.03 -0.61 -0.67 -1.57 0.00 0.00 179.24 176.42 1h4i n ASP 82 N -2.50 -2.53 0.32 6.45 2.03 -0.76 -4.84 116.55 114.71 1h4i n ASP 82 Ca 0.04 -2.99 0.20 0.00 0.52 0.00 0.00 54.79 52.55 1h4i n ASP 82 Cb 0.48 1.28 1.05 0.00 -0.72 0.00 0.00 41.12 43.21 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 4.56 0.00 0.00 -0.67 0.11 -1.63 -2.08 132.00 132.28 1h4i h PRO 83 Ca -0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1h4i h PRO 83 Cb 1.03 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1h4i h PRO 83 CO 0.23 0.00 -0.09 0.78 -0.21 0.00 0.00 178.00 178.71 1h4i h GLY 84 N 0.00 0.00 -6.32 -0.55 0.00 -1.95 -3.41 103.07 90.84 1h4i h GLY 84 Ca 0.01 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.74 1h4i h GLY 84 CO -0.00 0.00 -0.07 -1.59 0.00 0.00 0.00 176.54 174.88 1h4i s THR 85 N -4.66 5.12 -0.41 4.70 2.01 -0.78 -5.03 115.64 116.59 1h4i s THR 85 Ca -0.04 0.89 -0.27 0.00 0.31 0.00 0.00 61.69 62.58 1h4i s THR 85 Cb 0.15 -3.82 0.02 0.00 0.01 0.00 0.00 72.50 68.87 1h4i s THR 85 CO 0.64 0.18 1.00 -0.63 -0.69 0.00 0.00 174.62 175.12 1h4i s ILE 86 N 1.64 4.46 0.08 1.82 1.01 -1.26 -4.18 121.20 124.77 1h4i s ILE 86 Ca 0.23 1.17 -0.26 0.00 0.00 0.00 0.00 60.65 61.78 1h4i s ILE 86 Cb -0.15 -4.43 -0.16 0.00 0.01 0.00 0.00 42.46 37.72 1h4i s ILE 86 CO 0.09 -0.71 1.68 -0.07 0.00 0.00 0.00 174.94 175.93 1h4i h LEU 87 N 10.47 -0.23 -7.24 2.97 4.07 -1.25 -3.47 115.31 120.63 1h4i h LEU 87 Ca -0.23 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.69 1h4i h LEU 87 Cb 1.07 0.06 -0.12 0.00 1.08 0.00 0.00 40.66 42.75 1h4i h LEU 87 CO 1.03 -0.15 0.09 -1.66 -1.08 0.00 0.00 178.44 176.67 1h4i s TRP 88 N -6.06 -0.37 -0.06 1.13 1.48 -1.23 -5.00 118.94 108.83 1h4i s TRP 88 Ca -0.14 0.10 -0.06 0.00 -1.06 0.00 0.00 56.10 54.93 1h4i s TRP 88 Cb 0.05 0.44 0.02 0.00 -1.16 0.00 0.00 33.47 32.81 1h4i s TRP 88 CO 0.65 -0.81 0.17 1.14 -4.06 0.00 0.00 176.95 174.04 1h4i s GLN 89 N -3.79 0.21 -0.18 3.25 -2.07 -1.26 -1.60 119.66 114.23 1h4i s GLN 89 Ca 0.03 0.21 0.00 0.00 -1.82 0.00 0.00 55.36 53.78 1h4i s GLN 89 Cb -0.00 0.10 0.01 0.00 -1.09 0.00 0.00 33.01 32.03 1h4i s GLN 89 CO -0.11 -0.03 -0.16 0.34 -1.32 0.00 0.00 175.29 174.01 1h4i s ASP 90 N 0.02 3.48 -0.44 12.60 2.15 0.58 -4.95 116.67 130.10 1h4i s ASP 90 Ca -0.01 -0.55 0.03 0.00 0.43 0.00 0.00 52.55 52.45 1h4i s ASP 90 Cb -0.02 -1.54 0.12 0.00 -0.30 0.00 0.00 42.92 41.18 1h4i s ASP 90 CO 0.00 0.03 0.19 -0.54 -0.17 0.00 0.00 175.17 174.68 1h4i s LYS 91 N 1.14 1.56 0.34 4.34 1.02 -1.26 -0.95 119.74 125.93 1h4i s LYS 91 Ca 0.01 -2.14 -0.28 0.00 0.02 0.00 0.00 55.97 53.57 1h4i s LYS 91 Cb -0.14 -2.91 -0.12 0.00 -0.52 0.00 0.00 37.83 34.14 1h4i s LYS 91 CO -0.06 -1.07 1.39 -2.30 -0.92 0.00 0.00 175.35 172.39 1h4i n PRO 92 N 3.66 2.36 -3.44 -1.68 -0.02 -1.26 -5.01 135.00 129.60 1h4i n PRO 92 Ca 0.05 0.83 -0.42 0.00 -2.02 0.00 0.00 63.50 61.94 1h4i n PRO 92 Cb 0.36 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.26 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 -1.70 3.21 0.17 -0.52 1.02 -1.26 -4.94 119.74 115.72 1h4i s LYS 93 Ca 0.57 -0.79 0.09 0.00 0.02 0.00 0.00 55.97 55.86 1h4i s LYS 93 Cb -0.54 -3.91 -0.04 0.00 -0.52 0.00 0.00 37.83 32.82 1h4i s LYS 93 CO 0.60 -0.66 -0.20 -0.65 -0.92 0.00 0.00 175.35 173.53 1h4i s GLN 94 N 1.82 1.35 -0.07 1.68 -0.21 -1.26 -5.11 119.66 117.86 1h4i s GLN 94 Ca 0.07 -1.44 -0.30 0.00 0.02 0.00 0.00 55.36 53.72 1h4i s GLN 94 Cb -0.18 -1.48 -0.05 0.00 1.00 0.00 0.00 33.01 32.30 1h4i s GLN 94 CO 0.11 0.31 1.50 1.21 -2.12 0.00 0.00 175.29 176.30 1h4i s ASN 95 N -2.66 6.78 0.64 5.90 3.84 -1.26 -4.88 114.94 123.29 1h4i s ASN 95 Ca 0.17 2.08 0.33 0.00 0.21 0.00 0.00 52.86 55.64 1h4i s ASN 95 Cb -0.06 -2.54 1.79 0.00 -0.55 0.00 0.00 41.25 39.89 1h4i s ASN 95 CO 0.08 -0.84 2.07 1.55 -2.79 0.00 0.00 177.10 177.16 1h4i h PRO 96 N 8.79 0.00 -0.00 0.43 0.13 -2.04 -0.86 132.00 138.45 1h4i h PRO 96 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1h4i h PRO 96 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1h4i h PRO 96 CO 0.95 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.72 1h4i h ALA 97 N 1.62 1.56 -0.84 -0.56 0.00 -2.03 -1.75 119.26 117.25 1h4i h ALA 97 Ca 0.05 -0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.15 1h4i h ALA 97 Cb 0.53 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1h4i h ALA 97 CO -0.00 -0.00 0.56 0.00 0.00 0.00 0.00 179.25 179.81 1h4i h ALA 98 N 2.00 2.25 -0.78 0.00 0.00 -1.54 -1.55 119.26 119.65 1h4i h ALA 98 Ca 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1h4i h ALA 98 Cb 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1h4i h ALA 98 CO -0.00 -0.50 0.44 0.00 0.00 0.00 0.00 179.25 179.18 1h4i h ARG 99 N 0.35 1.07 0.00 0.00 3.08 -1.54 -2.89 114.38 114.46 1h4i h ARG 99 Ca 0.43 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1h4i h ARG 99 Cb 1.12 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.95 1h4i h ARG 99 CO -0.14 0.77 0.00 0.00 -1.07 0.00 0.00 179.97 179.54 1h4i h ALA 100 N 1.40 1.00 -0.44 0.04 0.00 -1.45 -3.06 119.26 116.74 1h4i h ALA 100 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1h4i h ALA 100 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1h4i h ALA 100 CO -0.05 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.53 1h4i n VAL 101 N -2.88 1.15 -3.13 0.00 0.24 -1.09 -4.91 118.33 107.71 1h4i n VAL 101 Ca -0.01 -1.08 -0.40 0.00 -2.04 0.00 0.00 64.34 60.81 1h4i n VAL 101 Cb 0.19 0.42 -0.06 0.00 -1.47 0.00 0.00 33.84 32.92 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 -1.19 3.59 0.27 2.33 0.00 -1.16 -4.87 121.76 120.74 1h4i s ALA 102 Ca 0.32 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.87 1h4i s ALA 102 Cb 0.18 -2.99 0.37 0.00 0.00 0.00 0.00 23.12 20.67 1h4i s ALA 102 CO 0.20 -0.72 1.72 0.00 0.00 0.00 0.00 175.76 176.95 1h4i s ASP 105 N 0.24 3.68 -0.80 0.00 2.15 -1.26 -4.94 116.67 115.74 1h4i s ASP 105 Ca 0.00 0.01 -0.04 0.00 0.43 0.00 0.00 52.55 52.95 1h4i s ASP 105 Cb 0.00 -0.21 0.09 0.00 -0.30 0.00 0.00 42.92 42.50 1h4i s ASP 105 CO 0.00 -2.34 2.60 0.18 -0.17 0.00 0.00 175.17 175.44 1h4i n LEU 106 N -3.36 7.10 -4.92 -1.34 4.77 -1.26 -4.95 117.00 113.05 1h4i n LEU 106 Ca 0.15 -4.42 -0.26 0.00 -0.03 0.00 0.00 56.01 51.45 1h4i n LEU 106 Cb 0.60 -1.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 1h4i n LEU 106 CO 0.45 1.87 0.39 0.54 -1.33 0.00 0.00 177.39 179.30 1h4i s VAL 107 N -1.91 4.63 -0.15 4.08 0.11 -1.26 -0.54 120.40 125.36 1h4i s VAL 107 Ca 0.57 -0.04 -0.09 0.00 -2.93 0.00 0.00 61.98 59.48 1h4i s VAL 107 Cb 0.31 -3.75 0.05 0.00 -1.53 0.00 0.00 36.38 31.45 1h4i s VAL 107 CO -0.18 -0.67 0.37 0.21 -3.33 0.00 0.00 175.10 171.50 1h4i s ASN 108 N -4.14 -0.43 0.00 3.54 3.84 -1.26 -4.62 114.94 111.87 1h4i s ASN 108 Ca 0.47 0.78 0.28 0.00 0.21 0.00 0.00 52.86 54.60 1h4i s ASN 108 Cb -0.10 0.69 1.08 0.00 -0.55 0.00 0.00 41.25 42.37 1h4i s ASN 108 CO 0.42 -0.17 1.79 0.54 -2.79 0.00 0.00 177.10 176.89 1h4i n ARG 109 N 3.86 0.37 0.00 0.43 1.74 0.88 -3.87 116.66 120.07 1h4i n ARG 109 Ca -0.21 -0.13 0.00 0.00 -0.77 0.00 0.00 57.85 56.75 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 1.38 1.84 3.86 -0.13 0.00 -1.26 -3.89 105.19 106.99 1h4i n GLY 110 Ca 0.11 -1.68 -0.21 0.00 0.00 0.00 0.00 46.02 44.23 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 3.69 0.12 0.99 1.43 -1.26 -4.09 118.68 119.56 1h4i s LEU 111 Ca 0.00 -0.41 0.04 0.00 -1.03 0.00 0.00 54.13 52.73 1h4i s LEU 111 Cb 0.00 -2.30 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 1h4i s LEU 111 CO 0.00 -0.28 -0.10 0.00 0.23 0.00 0.00 176.35 176.20 1h4i s ALA 112 N -2.25 1.24 -0.02 4.21 0.00 -0.83 -4.33 121.76 119.77 1h4i s ALA 112 Ca 0.39 -1.33 0.04 0.00 0.00 0.00 0.00 51.96 51.06 1h4i s ALA 112 Cb -0.07 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.10 1h4i s ALA 112 CO 0.27 -0.08 -0.15 -0.47 0.00 0.00 0.00 175.76 175.32 1h4i s TYR 113 N -2.95 1.43 -0.16 0.00 6.14 -1.25 -0.63 117.35 119.92 1h4i s TYR 113 Ca 0.11 -0.33 0.02 0.00 0.64 0.00 0.00 57.07 57.50 1h4i s TYR 113 Cb 0.00 -0.95 0.02 0.00 0.42 0.00 0.00 41.96 41.45 1h4i s TYR 113 CO -0.00 -0.08 -0.21 -0.46 0.64 0.00 0.00 175.55 175.43 1h4i s TRP 114 N -0.14 2.73 -0.15 4.97 -0.00 -0.49 -4.86 118.94 121.00 1h4i s TRP 114 Ca 0.01 -1.50 0.20 0.00 -0.00 0.00 0.00 56.10 54.80 1h4i s TRP 114 Cb -0.08 -1.87 1.08 0.00 -0.00 0.00 0.00 33.47 32.59 1h4i s TRP 114 CO 0.00 -0.72 1.58 -2.30 -0.00 0.00 0.00 176.95 175.52 1h4i n PRO 115 N 4.35 0.13 0.00 5.86 -0.02 -1.26 -0.45 135.00 143.61 1h4i n PRO 115 Ca -0.21 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1h4i n PRO 115 Cb 0.51 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 1h4i n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h4i n GLY 116 N -1.29 -1.68 0.00 -1.23 0.00 -1.26 -4.18 105.19 95.55 1h4i n GLY 116 Ca -0.01 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.47 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 -1.66 0.00 -0.05 1.61 3.85 -1.04 -4.91 116.55 114.35 1h4i n ASP 117 Ca 0.00 0.00 -0.12 0.00 -0.71 0.00 0.00 54.79 53.96 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 -0.18 0.14 6.12 0.00 -1.26 -4.82 105.19 110.20 1h4i n GLY 118 Ca 0.00 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.40 0.43 -5.97 1.61 2.10 -2.04 -3.45 116.57 108.85 1h4i h LYS 119 Ca -0.27 -0.73 -0.57 0.00 -2.00 0.00 0.00 60.65 57.07 1h4i h LYS 119 Cb 1.22 0.27 -0.06 0.00 -0.90 0.00 0.00 32.23 32.76 1h4i h LYS 119 CO -0.17 1.35 -0.07 0.99 -2.00 0.00 0.00 179.45 179.56 1h4i s THR 120 N -2.57 5.01 0.81 0.07 2.01 -1.26 -5.07 115.64 114.64 1h4i s THR 120 Ca -0.14 1.13 -0.12 0.00 0.31 0.00 0.00 61.69 62.87 1h4i s THR 120 Cb 0.05 -3.88 0.08 0.00 0.01 0.00 0.00 72.50 68.75 1h4i s THR 120 CO 0.88 0.40 1.12 -2.16 -0.69 0.00 0.00 174.62 174.16 1h4i s PRO 121 N 0.02 2.01 0.57 4.92 0.04 -1.26 -2.48 135.00 138.81 1h4i s PRO 121 Ca 0.29 0.45 -0.20 0.00 0.04 0.00 0.00 61.00 61.58 1h4i s PRO 121 Cb -0.17 -1.93 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 1h4i s PRO 121 CO 0.15 -1.63 1.04 0.00 0.04 0.00 0.00 177.00 176.60 1h4i n ALA 122 N -3.41 0.42 -2.68 8.56 0.00 -1.26 -4.37 120.51 117.78 1h4i n ALA 122 Ca 0.07 0.06 -0.18 0.00 0.00 0.00 0.00 53.44 53.39 1h4i n ALA 122 Cb 0.58 -2.15 -0.12 0.00 0.00 0.00 0.00 19.45 17.76 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 -2.06 2.29 -0.18 0.00 1.43 0.40 -1.96 118.68 118.60 1h4i s LEU 123 Ca 0.73 -0.64 -0.04 0.00 -1.03 0.00 0.00 54.13 53.15 1h4i s LEU 123 Cb -0.44 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.25 1h4i s LEU 123 CO 0.49 -0.09 -0.03 -0.63 0.23 0.00 0.00 176.35 176.32 1h4i s ILE 124 N -1.40 3.78 -0.09 -0.59 -1.09 0.55 -1.40 121.20 120.96 1h4i s ILE 124 Ca -0.01 -0.38 -0.00 0.00 -2.23 0.00 0.00 60.65 58.03 1h4i s ILE 124 Cb -0.09 -2.69 -0.03 0.00 -1.58 0.00 0.00 42.46 38.07 1h4i s ILE 124 CO 0.02 0.45 -0.07 -0.76 -1.23 0.00 0.00 174.94 173.36 1h4i s LEU 125 N 0.83 3.16 -0.01 2.97 1.43 0.19 -0.18 118.68 127.07 1h4i s LEU 125 Ca -0.01 -0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 1h4i s LEU 125 Cb -0.14 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.38 1h4i s LEU 125 CO 0.02 0.32 0.15 -1.59 0.23 0.00 0.00 176.35 175.47 1h4i s LYS 126 N -0.53 0.43 0.17 1.70 -2.85 -0.52 -1.97 119.74 116.17 1h4i s LYS 126 Ca 0.08 -0.25 0.04 0.00 -1.00 0.00 0.00 55.97 54.83 1h4i s LYS 126 Cb -0.12 0.18 -0.04 0.00 -2.06 0.00 0.00 37.83 35.80 1h4i s LYS 126 CO 0.02 -0.10 0.25 0.95 0.10 0.00 0.00 175.35 176.58 1h4i s THR 127 N -1.05 5.05 0.10 3.79 -4.23 -1.26 -0.99 115.64 117.05 1h4i s THR 127 Ca -0.11 -0.87 0.08 0.00 -1.18 0.00 0.00 61.69 59.61 1h4i s THR 127 Cb -0.06 -3.63 -0.03 0.00 1.34 0.00 0.00 72.50 70.12 1h4i s THR 127 CO 0.01 -0.15 -0.21 -1.10 -0.54 0.00 0.00 174.62 172.63 1h4i s GLN 128 N -3.35 1.16 0.49 3.99 -0.21 -0.59 -4.98 119.66 116.18 1h4i s GLN 128 Ca 0.33 -1.16 0.16 0.00 0.02 0.00 0.00 55.36 54.71 1h4i s GLN 128 Cb -0.10 -1.44 1.20 0.00 1.00 0.00 0.00 33.01 33.67 1h4i s GLN 128 CO 0.27 0.34 2.08 1.25 -2.12 0.00 0.00 175.29 177.11 1h4i h LEU 129 N 4.11 0.13 0.00 2.90 7.12 -1.87 -0.70 115.31 126.99 1h4i h LEU 129 Ca -0.46 -0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.55 1h4i h LEU 129 Cb 1.18 -0.03 0.00 0.00 -0.53 0.00 0.00 40.66 41.28 1h4i h LEU 129 CO 0.40 0.09 0.00 -0.90 -0.13 0.00 0.00 178.44 177.89 1h4i n ASP 130 N -4.49 0.00 0.00 1.25 3.85 -1.26 -2.95 116.55 112.96 1h4i n ASP 130 Ca 0.02 -0.87 0.00 0.00 -0.71 0.00 0.00 54.79 53.24 1h4i n ASP 130 Cb 0.23 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.00 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 0.35 0.60 3.88 6.12 0.00 -0.27 -4.52 105.19 111.35 1h4i n GLY 131 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.94 6.50 -0.03 1.61 0.01 -1.25 -0.29 114.94 118.55 1h4i s ASN 132 Ca 0.00 1.04 0.06 0.00 -0.71 0.00 0.00 52.86 53.26 1h4i s ASN 132 Cb 0.00 -2.28 -0.01 0.00 0.41 0.00 0.00 41.25 39.36 1h4i s ASN 132 CO 0.00 -0.36 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.32 1h4i s VAL 133 N -2.32 1.75 0.03 1.60 1.01 -0.01 -1.54 120.40 120.92 1h4i s VAL 133 Ca 0.50 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.56 1h4i s VAL 133 Cb -0.10 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 1h4i s VAL 133 CO 0.31 0.49 -0.05 0.00 0.00 0.00 0.00 175.10 175.85 1h4i s ALA 134 N -0.38 0.33 -0.11 5.51 0.00 -0.16 -1.69 121.76 125.26 1h4i s ALA 134 Ca 0.05 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.37 1h4i s ALA 134 Cb -0.10 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 1h4i s ALA 134 CO 0.00 -0.09 -0.18 0.00 0.00 0.00 0.00 175.76 175.49 1h4i s ALA 135 N -1.38 2.41 0.01 0.00 0.00 -0.75 -1.43 121.76 120.61 1h4i s ALA 135 Ca -0.13 -0.94 0.08 0.00 0.00 0.00 0.00 51.96 50.98 1h4i s ALA 135 Cb -0.10 -1.00 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 1h4i s ALA 135 CO -0.00 0.29 -0.25 -0.51 0.00 0.00 0.00 175.76 175.28 1h4i s LEU 136 N 0.27 2.10 0.11 0.00 1.43 0.74 -0.84 118.68 122.50 1h4i s LEU 136 Ca -0.13 -0.50 -0.31 0.00 -1.03 0.00 0.00 54.13 52.16 1h4i s LEU 136 Cb -0.16 -1.27 -0.10 0.00 0.03 0.00 0.00 46.19 44.69 1h4i s LEU 136 CO 0.07 0.28 1.81 0.21 0.23 0.00 0.00 176.35 178.95 1h4i s ASN 137 N -0.85 6.44 0.53 2.29 3.84 0.20 -0.33 114.94 127.06 1h4i s ASN 137 Ca 0.10 2.73 0.28 0.00 0.21 0.00 0.00 52.86 56.17 1h4i s ASN 137 Cb -0.10 -2.56 1.47 0.00 -0.55 0.00 0.00 41.25 39.51 1h4i s ASN 137 CO 0.00 -0.99 2.08 0.00 -2.79 0.00 0.00 177.10 175.40 1h4i h ALA 138 N 8.63 1.29 0.00 1.71 0.00 -1.71 0.38 119.26 129.56 1h4i h ALA 138 Ca -0.46 -0.10 -0.22 0.00 0.00 0.00 0.00 54.91 54.13 1h4i h ALA 138 Cb 1.22 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1h4i h ALA 138 CO 0.95 0.14 -1.74 0.39 0.00 0.00 0.00 179.25 178.99 1h4i n GLU 139 N -3.64 0.64 -0.00 0.00 -0.58 -1.26 -4.60 120.64 111.20 1h4i n GLU 139 Ca -0.02 0.15 0.02 0.00 -0.42 0.00 0.00 57.16 56.88 1h4i n GLU 139 Cb 0.23 -1.72 -0.03 0.00 -0.57 0.00 0.00 31.44 29.36 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 -2.82 0.00 -0.90 2.62 -2.24 -1.16 -4.95 114.28 104.83 1h4i n THR 140 Ca -0.15 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1h4i n THR 140 Cb 0.92 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 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 2.25 0.83 3.77 3.38 0.00 0.13 -4.87 105.19 110.69 1h4i n GLY 141 Ca -0.01 0.00 -0.37 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 -0.10 3.75 -0.13 1.61 2.02 -1.26 -4.60 118.70 119.99 1h4i s GLU 142 Ca 0.00 1.79 -0.29 0.00 0.02 0.00 0.00 54.97 56.49 1h4i s GLU 142 Cb 0.00 -2.41 -0.01 0.00 0.10 0.00 0.00 34.13 31.81 1h4i s GLU 142 CO 0.00 -0.57 1.08 0.99 0.02 0.00 0.00 175.26 176.78 1h4i s THR 143 N -1.53 4.60 -0.19 3.63 2.01 -1.26 -0.63 115.64 122.26 1h4i s THR 143 Ca 0.64 1.90 -0.22 0.00 0.31 0.00 0.00 61.69 64.31 1h4i s THR 143 Cb -0.29 -4.22 -0.20 0.00 0.01 0.00 0.00 72.50 67.79 1h4i s THR 143 CO 0.35 -0.05 0.31 0.58 -0.69 0.00 0.00 174.62 175.12 1h4i h VAL 144 N 5.20 1.05 -3.67 3.82 2.07 -1.34 -3.48 116.25 119.90 1h4i h VAL 144 Ca -0.28 -2.21 -0.07 0.00 0.82 0.00 0.00 66.70 64.95 1h4i h VAL 144 Cb 1.13 2.42 -0.13 0.00 -1.52 0.00 0.00 31.29 33.18 1h4i h VAL 144 CO 0.90 0.38 -0.26 -1.66 0.02 0.00 0.00 177.57 176.95 1h4i s TRP 145 N -2.35 0.05 -0.22 1.57 1.48 -1.23 -5.02 118.94 113.23 1h4i s TRP 145 Ca -0.27 -0.44 -0.10 0.00 -1.06 0.00 0.00 56.10 54.23 1h4i s TRP 145 Cb 0.04 0.05 0.08 0.00 -1.16 0.00 0.00 33.47 32.49 1h4i s TRP 145 CO 0.61 -0.62 0.50 0.21 -4.06 0.00 0.00 176.95 173.60 1h4i s LYS 146 N -3.85 0.45 0.12 3.25 2.20 -1.26 -1.81 119.74 118.84 1h4i s LYS 146 Ca 0.05 1.05 0.04 0.00 -0.36 0.00 0.00 55.97 56.76 1h4i s LYS 146 Cb 0.04 0.26 -0.04 0.00 -1.51 0.00 0.00 37.83 36.57 1h4i s LYS 146 CO -0.10 -0.19 -0.11 0.14 -0.36 0.00 0.00 175.35 174.73 1h4i s VAL 147 N 2.07 1.10 -0.13 4.02 -7.23 -0.68 -4.96 120.40 114.58 1h4i s VAL 147 Ca -0.07 -1.81 -0.22 0.00 -1.81 0.00 0.00 61.98 58.08 1h4i s VAL 147 Cb -0.09 -1.57 -0.03 0.00 0.56 0.00 0.00 36.38 35.24 1h4i s VAL 147 CO -0.15 -0.60 0.65 -1.61 -0.31 0.00 0.00 175.10 173.08 1h4i s GLU 148 N -3.12 4.33 -0.15 4.82 2.02 -1.26 -0.83 118.70 124.51 1h4i s GLU 148 Ca 0.10 0.72 0.02 0.00 0.02 0.00 0.00 54.97 55.83 1h4i s GLU 148 Cb -0.01 -3.50 -0.10 0.00 0.10 0.00 0.00 34.13 30.62 1h4i s GLU 148 CO 0.01 -0.06 -0.12 -1.71 0.02 0.00 0.00 175.26 173.40 1h4i n ASN 149 N 4.32 2.78 -4.23 -0.19 5.15 0.60 -4.97 115.26 118.73 1h4i n ASN 149 Ca -0.02 -0.07 -0.17 0.00 -0.60 0.00 0.00 54.58 53.72 1h4i n ASN 149 Cb 0.51 -0.16 -0.11 0.00 -0.53 0.00 0.00 39.78 39.49 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 -5.38 1.88 -0.24 1.20 0.01 -0.88 -5.07 113.70 105.23 1h4i s SER 150 Ca -0.19 -0.82 0.01 0.00 1.31 0.00 0.00 55.95 56.26 1h4i s SER 150 Cb 0.05 -0.05 0.04 0.00 0.21 0.00 0.00 66.02 66.27 1h4i s SER 150 CO 0.36 -0.18 -0.11 -0.62 0.41 0.00 0.00 173.24 173.09 1h4i s ASP 151 N -2.50 4.11 0.51 2.44 2.15 -1.22 -4.39 116.67 117.77 1h4i s ASP 151 Ca 0.09 -1.07 0.27 0.00 0.43 0.00 0.00 52.55 52.26 1h4i s ASP 151 Cb -0.04 -1.57 1.37 0.00 -0.30 0.00 0.00 42.92 42.38 1h4i s ASP 151 CO 0.02 -0.13 2.04 0.16 -0.17 0.00 0.00 175.17 177.09 1h4i h ILE 152 N 6.39 0.57 0.00 4.11 3.07 -1.71 -1.48 117.51 128.45 1h4i h ILE 152 Ca -0.29 -0.62 -0.00 0.00 1.55 0.00 0.00 64.86 65.50 1h4i h ILE 152 Cb 1.08 1.40 -0.00 0.00 -0.27 0.00 0.00 36.82 39.04 1h4i h ILE 152 CO 0.54 0.13 -0.01 0.11 -1.05 0.00 0.00 178.15 177.87 1h4i h LYS 153 N 0.00 0.00 -0.26 0.16 1.79 -1.94 0.91 116.57 117.23 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 0.39 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 1h4i h LYS 153 CO 0.02 0.01 0.00 1.55 -1.08 0.00 0.00 179.45 179.95 1h4i n VAL 154 N -3.39 0.75 -0.62 0.50 3.14 -0.82 -3.83 118.33 114.05 1h4i n VAL 154 Ca -0.03 -0.87 0.00 0.00 -2.96 0.00 0.00 64.34 60.48 1h4i n VAL 154 Cb 0.11 0.68 0.00 0.00 -1.06 0.00 0.00 33.84 33.57 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 0.54 0.64 3.55 7.55 0.00 0.32 -3.72 105.19 114.06 1h4i n GLY 155 Ca 0.10 -0.46 -0.37 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.42 5.76 0.40 1.61 0.15 -0.62 -4.45 113.70 114.13 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 -2.06 -0.03 0.00 -1.71 0.00 0.00 66.02 62.22 1h4i s SER 156 CO 0.00 -0.04 0.12 0.42 1.20 0.00 0.00 173.24 174.94 1h4i s THR 157 N 1.67 0.67 -0.09 6.45 -4.23 -1.13 -2.40 115.64 116.59 1h4i s THR 157 Ca 0.07 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.60 1h4i s THR 157 Cb -0.16 -2.39 0.01 0.00 1.34 0.00 0.00 72.50 71.31 1h4i s THR 157 CO 0.08 0.00 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.27 1h4i s LEU 158 N -3.60 1.62 0.00 4.79 1.43 -1.15 -2.52 118.68 119.25 1h4i s LEU 158 Ca 0.25 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1h4i s LEU 158 Cb 0.03 -0.95 0.00 0.00 0.03 0.00 0.00 46.19 45.31 1h4i s LEU 158 CO 0.14 0.01 0.00 0.35 0.23 0.00 0.00 176.35 177.08 1h4i n THR 159 N 4.11 0.00 -2.31 5.49 -2.24 -1.26 -3.45 114.28 114.61 1h4i n THR 159 Ca -0.20 -0.06 -0.35 0.00 -2.27 0.00 0.00 64.05 61.17 1h4i n THR 159 Cb 0.51 0.48 -0.01 0.00 -2.10 0.00 0.00 70.33 69.22 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 -1.34 3.28 0.21 2.28 2.07 -1.26 -0.09 121.20 126.35 1h4i s ILE 160 Ca 0.00 0.80 -0.25 0.00 -1.41 0.00 0.00 60.65 59.79 1h4i s ILE 160 Cb 0.00 -3.33 -0.08 0.00 0.13 0.00 0.00 42.46 39.18 1h4i s ILE 160 CO 0.00 -0.16 0.82 0.00 -1.91 0.00 0.00 174.94 173.68 1h4i s ALA 161 N -1.80 3.39 0.87 1.50 0.00 -1.26 -4.61 121.76 119.85 1h4i s ALA 161 Ca 0.71 0.39 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 1h4i s ALA 161 Cb -0.23 -3.00 0.12 0.00 0.00 0.00 0.00 23.12 20.01 1h4i s ALA 161 CO 0.26 0.27 1.10 -2.14 0.00 0.00 0.00 175.76 175.25 1h4i s PRO 162 N -1.43 1.41 -0.05 0.00 0.02 -1.26 -4.80 135.00 128.89 1h4i s PRO 162 Ca 0.40 1.10 0.00 0.00 0.02 0.00 0.00 61.00 62.52 1h4i s PRO 162 Cb -0.22 -1.81 0.02 0.00 0.02 0.00 0.00 34.50 32.52 1h4i s PRO 162 CO 0.26 -2.22 -0.02 -0.47 -0.33 0.00 0.00 177.00 174.22 1h4i s TYR 163 N -2.83 0.60 -0.26 6.54 5.04 -0.98 -4.49 117.35 120.96 1h4i s TYR 163 Ca 0.64 -0.13 -0.08 0.00 -2.44 0.00 0.00 57.07 55.05 1h4i s TYR 163 Cb -0.19 -0.62 -0.03 0.00 0.35 0.00 0.00 41.96 41.47 1h4i s TYR 163 CO 0.57 -0.20 0.09 0.08 -1.34 0.00 0.00 175.55 174.75 1h4i s VAL 164 N 1.19 4.43 -0.09 3.14 1.01 -1.26 -0.23 120.40 128.59 1h4i s VAL 164 Ca -0.07 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1h4i s VAL 164 Cb -0.14 -3.12 0.02 0.00 0.00 0.00 0.00 36.38 33.15 1h4i s VAL 164 CO -0.02 0.28 -0.09 -0.69 0.00 0.00 0.00 175.10 174.58 1h4i s VAL 165 N 1.62 1.03 0.00 2.92 1.01 -0.59 -4.59 120.40 121.81 1h4i s VAL 165 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.70 1h4i s VAL 165 Cb -0.16 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.21 1h4i s VAL 165 CO 0.05 0.36 0.00 0.29 0.00 0.00 0.00 175.10 175.79 1h4i n LYS 166 N 4.51 0.00 -1.27 2.72 4.76 -1.26 -1.00 118.16 126.62 1h4i n LYS 166 Ca -0.17 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 0.13 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 6.37 4.35 -4.27 4.39 10.43 -1.26 -4.52 116.55 132.05 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 42.19 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 1.09 -0.15 -1.24 1.02 -0.17 -1.37 119.74 115.44 1h4i s LYS 168 Ca 0.52 -1.25 0.01 0.00 0.02 0.00 0.00 55.97 55.27 1h4i s LYS 168 Cb 0.44 -1.07 0.01 0.00 -0.52 0.00 0.00 37.83 36.68 1h4i s LYS 168 CO 0.02 0.22 -0.19 0.08 -0.92 0.00 0.00 175.35 174.56 1h4i s VAL 169 N -1.92 2.32 -0.20 3.17 1.01 -0.32 -1.55 120.40 122.92 1h4i s VAL 169 Ca 0.09 -0.89 -0.12 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 0.04 0.53 0.20 -0.63 0.00 0.00 0.00 175.10 175.24 1h4i s ILE 170 N 0.87 5.36 -0.12 2.22 -1.09 0.68 -1.14 121.20 127.97 1h4i s ILE 170 Ca -0.05 0.32 0.03 0.00 -2.23 0.00 0.00 60.65 58.72 1h4i s ILE 170 Cb -0.15 -3.54 0.01 0.00 -1.58 0.00 0.00 42.46 37.20 1h4i s ILE 170 CO -0.02 0.39 -0.20 -0.63 -1.23 0.00 0.00 174.94 173.25 1h4i s ILE 171 N 0.62 1.84 0.00 2.92 -1.09 0.74 -2.32 121.20 123.92 1h4i s ILE 171 Ca 0.11 -0.86 0.00 0.00 -2.23 0.00 0.00 60.65 57.67 1h4i s ILE 171 Cb -0.12 -1.63 0.00 0.00 -1.58 0.00 0.00 42.46 39.12 1h4i s ILE 171 CO 0.02 0.51 0.00 0.61 -1.23 0.00 0.00 174.94 174.85 1h4i n GLY 172 N 3.97 1.05 3.46 6.18 0.00 -1.26 -1.02 105.19 117.57 1h4i n GLY 172 Ca -0.20 -1.52 -0.11 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.51 0.01 1.61 1.04 -0.02 -4.77 113.70 110.06 1h4i s SER 173 Ca 0.00 -0.04 -0.03 0.00 0.48 0.00 0.00 55.95 56.36 1h4i s SER 173 Cb 0.00 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 1h4i s SER 173 CO 0.00 -0.92 0.05 -0.44 0.98 0.00 0.00 173.24 172.90 1h4i s SER 174 N -2.71 0.15 0.00 7.02 0.01 -1.05 -2.88 113.70 114.24 1h4i s SER 174 Ca 0.02 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.91 1h4i s SER 174 Cb -0.01 0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.37 1h4i s SER 174 CO -0.11 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 173.81 1h4i n GLY 175 N 1.51 -0.27 0.33 3.44 0.00 -1.26 -2.83 105.19 106.11 1h4i n GLY 175 Ca -0.23 0.00 0.16 0.00 0.00 0.00 0.00 46.02 45.95 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 1.78 0.00 4.61 0.00 -1.89 0.23 119.26 123.99 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 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1h4i h ALA 176 CO 0.00 -0.23 0.00 0.39 0.00 0.00 0.00 179.25 179.41 1h4i n GLU 177 N -3.86 0.04 -0.26 0.00 4.71 -1.26 -1.80 120.64 118.21 1h4i n GLU 177 Ca 0.01 0.21 0.08 0.00 -0.01 0.00 0.00 57.16 57.45 1h4i n GLU 177 Cb 0.27 -1.56 0.18 0.00 -1.01 0.00 0.00 31.44 29.32 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 -1.64 2.90 -2.60 -4.62 4.32 0.78 -0.43 117.00 115.72 1h4i n LEU 178 Ca 0.04 -3.18 -0.19 0.00 -0.02 0.00 0.00 56.01 52.66 1h4i n LEU 178 Cb 0.23 -0.48 0.03 0.00 -1.62 0.00 0.00 43.42 41.58 1h4i n LEU 178 CO 0.19 0.79 -0.02 0.61 -1.22 0.00 0.00 177.39 177.74 1h4i n GLY 179 N -1.14 -0.36 3.71 -0.72 0.00 -0.74 -4.71 105.19 101.22 1h4i n GLY 179 Ca 0.19 -0.00 -0.40 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 4.99 -0.08 1.61 1.01 -0.93 -4.44 120.40 119.48 1h4i s VAL 180 Ca 0.24 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.52 1h4i s VAL 180 Cb -0.11 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1h4i s VAL 180 CO 0.30 0.21 1.16 -0.60 0.00 0.00 0.00 175.10 176.16 1h4i s ARG 181 N 1.00 4.35 0.50 2.72 3.52 -1.26 -2.61 118.95 127.17 1h4i s ARG 181 Ca 0.41 1.60 -0.22 0.00 -0.13 0.00 0.00 55.73 57.38 1h4i s ARG 181 Cb -0.18 -3.58 -0.06 0.00 -1.56 0.00 0.00 34.95 29.57 1h4i s ARG 181 CO 0.20 -0.45 1.23 0.20 -0.81 0.00 0.00 175.30 175.66 1h4i s GLY 182 N 1.43 2.81 -0.05 8.12 0.00 0.12 -4.85 107.32 114.88 1h4i s GLY 182 Ca 0.54 1.06 -0.29 0.00 0.00 0.00 0.00 44.72 46.03 1h4i s GLY 182 CO 0.20 1.53 0.64 -2.52 0.00 0.00 0.00 173.10 172.94 1h4i s TYR 183 N -1.48 -0.61 0.11 1.90 -0.85 -1.26 -1.12 117.35 114.05 1h4i s TYR 183 Ca 0.67 1.05 0.08 0.00 -0.52 0.00 0.00 57.07 58.35 1h4i s TYR 183 Cb -0.32 0.37 -0.04 0.00 0.38 0.00 0.00 41.96 42.35 1h4i s TYR 183 CO 0.38 -0.58 -0.19 -0.48 -1.52 0.00 0.00 175.55 173.16 1h4i s LEU 184 N -1.15 2.33 0.03 -3.49 2.34 -0.61 -3.98 118.68 114.15 1h4i s LEU 184 Ca -0.11 -0.72 0.03 0.00 0.06 0.00 0.00 54.13 53.39 1h4i s LEU 184 Cb -0.01 -0.82 -0.02 0.00 -0.56 0.00 0.00 46.19 44.78 1h4i s LEU 184 CO 0.09 0.01 -0.09 -0.89 -1.06 0.00 0.00 176.35 174.41 1h4i s THR 185 N -1.41 0.71 -0.12 5.48 2.01 -0.19 -1.41 115.64 120.70 1h4i s THR 185 Ca 0.08 -0.88 0.02 0.00 0.31 0.00 0.00 61.69 61.21 1h4i s THR 185 Cb -0.09 -0.69 -0.01 0.00 0.01 0.00 0.00 72.50 71.72 1h4i s THR 185 CO 0.04 -0.15 -0.18 0.00 -0.69 0.00 0.00 174.62 173.64 1h4i s ALA 186 N -0.95 2.40 0.15 7.40 0.00 -0.07 -0.18 121.76 130.51 1h4i s ALA 186 Ca -0.04 -0.95 0.10 0.00 0.00 0.00 0.00 51.96 51.07 1h4i s ALA 186 Cb -0.08 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 1h4i s ALA 186 CO 0.01 0.21 -0.20 0.71 0.00 0.00 0.00 175.76 176.49 1h4i s TYR 187 N 0.43 2.45 -0.08 0.00 1.51 -0.30 -0.49 117.35 120.88 1h4i s TYR 187 Ca -0.13 -0.30 -0.30 0.00 -1.01 0.00 0.00 57.07 55.33 1h4i s TYR 187 Cb -0.17 -1.26 -0.04 0.00 -0.11 0.00 0.00 41.96 40.38 1h4i s TYR 187 CO 0.06 0.43 1.40 0.34 -1.11 0.00 0.00 175.55 176.66 1h4i s ASP 188 N -2.38 6.86 0.67 2.29 -1.08 0.13 -1.17 116.67 121.98 1h4i s ASP 188 Ca 0.19 1.97 0.41 0.00 -0.52 0.00 0.00 52.55 54.60 1h4i s ASP 188 Cb -0.09 -2.55 2.22 0.00 -1.46 0.00 0.00 42.92 41.04 1h4i s ASP 188 CO 0.10 -0.77 2.25 1.62 0.52 0.00 0.00 175.17 178.90 1h4i h VAL 189 N 5.28 0.02 0.00 1.11 3.04 -1.53 -0.18 116.25 123.99 1h4i h VAL 189 Ca -0.34 0.00 -0.19 0.00 -1.01 0.00 0.00 66.70 65.16 1h4i h VAL 189 Cb 1.15 0.91 -0.03 0.00 -2.01 0.00 0.00 31.29 31.31 1h4i h VAL 189 CO 0.94 0.00 -1.69 0.29 -1.01 0.00 0.00 177.57 176.10 1h4i n LYS 190 N -3.06 0.64 0.00 4.17 5.02 -1.26 -4.64 118.16 119.03 1h4i n LYS 190 Ca -0.03 0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1h4i n LYS 190 Cb 0.15 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 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 -2.79 0.00 -0.63 -0.18 -2.24 -1.05 -4.96 114.28 102.42 1h4i n THR 191 Ca -0.14 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1h4i n THR 191 Cb 0.88 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 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 1.61 0.71 3.71 3.38 0.00 -0.10 -4.93 105.19 109.56 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 -0.37 4.31 -0.06 1.61 2.12 -1.25 -4.69 118.70 120.38 1h4i s GLU 193 Ca 0.00 2.02 -0.30 0.00 0.36 0.00 0.00 54.97 57.05 1h4i s GLU 193 Cb 0.00 -3.38 -0.04 0.00 0.26 0.00 0.00 34.13 30.97 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 1.59 4.23 -0.23 4.30 0.74 -1.26 0.18 119.66 129.22 1h4i s GLN 194 Ca 0.64 1.97 -0.17 0.00 0.05 0.00 0.00 55.36 57.86 1h4i s GLN 194 Cb -0.34 -3.77 -0.17 0.00 1.10 0.00 0.00 33.01 29.82 1h4i s GLN 194 CO 0.29 -0.71 0.02 0.28 -0.55 0.00 0.00 175.29 174.62 1h4i n VAL 195 N 5.14 1.55 -3.61 1.34 0.31 0.36 -4.91 118.33 118.51 1h4i n VAL 195 Ca 0.15 -0.23 -0.16 0.00 -0.01 0.00 0.00 64.34 64.09 1h4i n VAL 195 Cb 0.44 -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 -0.46 -0.03 3.52 1.48 -1.11 -4.99 118.94 114.91 1h4i s TRP 196 Ca -0.32 0.72 -0.01 0.00 -1.06 0.00 0.00 56.10 55.43 1h4i s TRP 196 Cb 0.09 0.30 0.03 0.00 -1.16 0.00 0.00 33.47 32.73 1h4i s TRP 196 CO 0.58 -0.55 0.05 0.50 -4.06 0.00 0.00 176.95 173.46 1h4i s ARG 197 N -1.50 -0.06 -0.03 3.25 3.52 -1.26 -0.89 118.95 121.97 1h4i s ARG 197 Ca -0.11 0.30 0.07 0.00 -0.13 0.00 0.00 55.73 55.86 1h4i s ARG 197 Cb -0.02 -0.40 -0.01 0.00 -1.56 0.00 0.00 34.95 32.96 1h4i s ARG 197 CO 0.06 -0.26 -0.24 0.00 -0.81 0.00 0.00 175.30 174.05 1h4i s ALA 198 N 1.71 2.03 0.32 6.12 0.00 -0.50 -4.92 121.76 126.52 1h4i s ALA 198 Ca -0.01 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 50.98 1h4i s ALA 198 Cb -0.12 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 1h4i s ALA 198 CO -0.03 0.45 0.47 0.71 0.00 0.00 0.00 175.76 177.36 1h4i s TYR 199 N -0.37 3.26 -0.21 0.00 1.51 -0.17 -1.57 117.35 119.79 1h4i s TYR 199 Ca 0.04 -0.06 0.22 0.00 -1.01 0.00 0.00 57.07 56.27 1h4i s TYR 199 Cb -0.11 -1.89 -0.07 0.00 -0.11 0.00 0.00 41.96 39.78 1h4i s TYR 199 CO 0.01 0.10 0.93 0.00 -1.11 0.00 0.00 175.55 175.47 1h4i n ALA 200 N -1.64 2.63 -2.26 3.71 0.00 -0.27 -4.40 120.51 118.28 1h4i n ALA 200 Ca -0.03 -0.30 -0.15 0.00 0.00 0.00 0.00 53.44 52.96 1h4i n ALA 200 Cb 0.58 -1.03 -0.10 0.00 0.00 0.00 0.00 19.45 18.90 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 -3.39 0.20 0.00 0.00 -4.23 -1.26 -4.09 115.64 102.88 1h4i s THR 201 Ca -0.02 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.49 1h4i s THR 201 Cb 0.11 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.41 1h4i s THR 201 CO 0.82 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.51 1h4i n GLY 202 N -0.40 -1.81 3.69 3.99 0.00 -0.60 -4.69 105.19 105.38 1h4i n GLY 202 Ca 0.02 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 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 1.92 -0.08 1.61 -0.02 -1.26 -3.43 135.00 133.74 1h4i n PRO 203 Ca 0.00 0.68 0.22 0.00 -2.02 0.00 0.00 63.50 62.38 1h4i n PRO 203 Cb 0.00 -2.34 0.66 0.00 -0.02 0.00 0.00 33.50 31.80 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 2.14 0.08 -0.72 2.55 3.32 -1.95 0.10 116.42 121.94 1h4i h ASP 204 Ca -0.47 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 1h4i h ASP 204 Cb 1.30 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.80 1h4i h ASP 204 CO 0.60 0.04 0.30 0.07 -1.72 0.00 0.00 179.24 178.53 1h4i h LYS 205 N 0.08 1.08 -0.08 3.56 -0.00 -1.98 -1.39 116.57 117.84 1h4i h LYS 205 Ca 0.32 -0.18 -0.18 0.00 -0.00 0.00 0.00 60.65 60.61 1h4i h LYS 205 Cb 1.17 -0.18 -0.01 0.00 -0.00 0.00 0.00 32.23 33.21 1h4i h LYS 205 CO -0.03 0.87 -0.72 -0.44 -0.00 0.00 0.00 179.45 179.14 1h4i h ASP 206 N 1.06 0.47 0.77 7.07 3.32 -1.19 -3.02 116.42 124.89 1h4i h ASP 206 Ca 0.25 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1h4i h ASP 206 Cb 0.19 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 1h4i h ASP 206 CO -0.02 1.04 -0.11 -0.07 -1.72 0.00 0.00 179.24 178.36 1h4i h LEU 207 N 0.27 0.00 -2.68 1.55 3.38 -0.64 -0.43 115.31 116.77 1h4i h LEU 207 Ca -0.03 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.66 1h4i h LEU 207 Cb 1.29 0.00 0.15 0.00 0.09 0.00 0.00 40.66 42.18 1h4i h LEU 207 CO 0.12 0.11 -0.81 -0.11 0.09 0.00 0.00 178.44 177.84 1h4i n LEU 208 N -3.32 -4.90 -4.83 1.67 0.00 -0.58 -4.53 117.00 100.51 1h4i n LEU 208 Ca -0.00 -0.75 -0.37 0.00 0.00 0.00 0.00 56.01 54.90 1h4i n LEU 208 Cb 0.32 -2.97 -0.06 0.00 0.00 0.00 0.00 43.42 40.71 1h4i n LEU 208 CO 0.29 0.10 0.29 -0.76 0.00 0.00 0.00 177.39 177.31 1h4i s LEU 209 N -5.57 4.41 0.57 -1.96 1.43 -1.25 -1.32 118.68 114.99 1h4i s LEU 209 Ca 0.42 1.21 -0.17 0.00 -1.03 0.00 0.00 54.13 54.56 1h4i s LEU 209 Cb -0.09 -3.21 -0.05 0.00 0.03 0.00 0.00 46.19 42.88 1h4i s LEU 209 CO 0.78 0.15 1.05 0.00 0.23 0.00 0.00 176.35 178.56 1h4i s ALA 210 N -1.35 2.78 0.42 4.21 0.00 -0.52 -4.71 121.76 122.58 1h4i s ALA 210 Ca 0.36 0.43 0.14 0.00 0.00 0.00 0.00 51.96 52.89 1h4i s ALA 210 Cb -0.17 -3.23 1.01 0.00 0.00 0.00 0.00 23.12 20.73 1h4i s ALA 210 CO 0.20 -0.70 1.95 0.66 0.00 0.00 0.00 175.76 177.87 1h4i h SER 211 N 0.67 0.41 -0.83 0.00 4.64 -1.98 -1.17 113.55 115.30 1h4i h SER 211 Ca -0.47 0.01 -0.36 0.00 -0.47 0.00 0.00 61.79 60.50 1h4i h SER 211 Cb 1.22 -0.07 -0.22 0.00 -0.31 0.00 0.00 62.40 63.02 1h4i h SER 211 CO 0.58 0.23 0.46 -0.90 -0.87 0.00 0.00 176.83 176.33 1h4i n ASP 212 N -4.48 4.14 -4.68 4.97 5.75 -1.26 -5.00 116.55 116.00 1h4i n ASP 212 Ca 0.12 -3.34 -0.46 0.00 -0.01 0.00 0.00 54.79 51.09 1h4i n ASP 212 Cb 0.42 -0.78 -0.04 0.00 -1.03 0.00 0.00 41.12 39.69 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 -0.63 2.37 -2.47 2.11 7.35 -0.44 -2.06 117.46 123.69 1h4i n PHE 213 Ca 0.48 0.07 -0.19 0.00 -0.76 0.00 0.00 57.45 57.06 1h4i n PHE 213 Cb 1.49 -2.63 -0.01 0.00 0.35 0.00 0.00 39.48 38.68 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 5.11 -5.40 -0.31 -2.13 3.02 -0.79 -4.89 115.26 109.87 1h4i n ASN 214 Ca 0.19 0.01 0.06 0.00 -0.03 0.00 0.00 54.58 54.81 1h4i n ASN 214 Cb 0.31 -4.50 0.26 0.00 -0.61 0.00 0.00 39.78 35.24 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 -0.12 1.01 0.00 2.41 2.04 -1.66 -0.90 117.51 120.29 1h4i h ILE 215 Ca -0.45 -0.34 -0.14 0.00 1.00 0.00 0.00 64.86 64.94 1h4i h ILE 215 Cb 1.33 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1h4i h ILE 215 CO 0.52 0.18 -0.96 0.11 0.00 0.00 0.00 178.15 178.01 1h4i h LYS 216 N 0.98 0.00 -2.11 2.37 1.79 -1.86 -3.38 116.57 114.37 1h4i h LYS 216 Ca 0.42 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 58.34 1h4i h LYS 216 Cb 0.32 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.57 1h4i h LYS 216 CO -0.18 0.42 -0.93 0.09 -1.08 0.00 0.00 179.45 177.77 1h4i n ASN 217 N -3.07 2.10 0.33 0.86 3.02 -0.89 -4.93 115.26 112.69 1h4i n ASN 217 Ca -0.04 -3.18 0.21 0.00 -0.03 0.00 0.00 54.58 51.54 1h4i n ASN 217 Cb 0.79 -0.62 1.11 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 3.46 0.00 0.00 3.52 0.13 -1.38 0.12 132.00 137.84 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 -3.11 0.02 0.23 1.56 1.44 -1.26 -1.86 115.22 112.25 1h4i n HIS 219 Ca -0.03 0.01 0.12 0.00 -2.01 0.00 0.00 57.72 55.81 1h4i n HIS 219 Cb 0.15 -0.51 0.46 0.00 0.12 0.00 0.00 29.99 30.20 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 -1.29 -3.49 116.97 111.78 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 0.33 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.06 1h4i h TYR 220 CO 0.00 0.15 0.00 0.41 -0.00 0.00 0.00 178.16 178.72 1h4i n GLY 221 N 0.30 2.90 0.00 3.88 0.00 -0.78 -4.80 105.19 106.69 1h4i n GLY 221 Ca 0.01 -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 0.24 0.00 -3.14 1.61 6.02 -1.26 -4.84 117.38 116.01 1h4i n GLN 222 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.68 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 0.78 3.79 0.00 -1.09 1.02 -1.26 -4.32 119.74 118.67 1h4i s LYS 223 Ca 0.00 0.36 0.00 0.00 0.02 0.00 0.00 55.97 56.35 1h4i s LYS 223 Cb 0.00 -2.51 0.00 0.00 -0.52 0.00 0.00 37.83 34.80 1h4i s LYS 223 CO 0.00 0.13 0.00 0.41 -0.92 0.00 0.00 175.35 174.97 1h4i n GLY 224 N -0.80 0.35 0.14 -3.33 0.00 -1.26 -4.91 105.19 95.39 1h4i n GLY 224 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.51 0.99 3.38 -1.90 -0.33 115.31 114.94 1h4i h LEU 225 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h4i h LEU 225 Cb 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1h4i h LEU 225 CO 0.00 0.46 -0.00 1.23 0.09 0.00 0.00 178.44 180.22 1h4i h GLY 226 N 3.56 0.00 0.00 0.83 0.00 -1.79 -2.06 103.07 103.60 1h4i h GLY 226 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.21 1h4i h GLY 226 CO 0.06 0.00 -1.39 -1.30 0.00 0.00 0.00 176.54 173.90 1h4i n THR 227 N -3.77 0.40 0.21 4.70 -2.24 -1.22 -1.56 114.28 110.79 1h4i n THR 227 Ca -0.03 -0.20 0.06 0.00 -2.27 0.00 0.00 64.05 61.61 1h4i n THR 227 Cb 0.08 -0.81 0.55 0.00 -2.10 0.00 0.00 70.33 68.06 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 0.08 -3.29 3.38 0.00 -0.96 -2.27 103.07 100.87 1h4i h GLY 228 Ca -0.16 -0.04 -0.22 0.00 0.00 0.00 0.00 47.33 46.92 1h4i h GLY 228 CO -0.01 0.03 0.28 -1.30 0.00 0.00 0.00 176.54 175.54 1h4i n THR 229 N -4.44 2.45 -4.10 4.70 -2.24 -0.78 -4.87 114.28 104.99 1h4i n THR 229 Ca -0.02 -1.30 -0.11 0.00 -2.27 0.00 0.00 64.05 60.35 1h4i n THR 229 Cb 0.15 -0.47 -0.11 0.00 -2.10 0.00 0.00 70.33 67.80 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 -2.47 0.67 -0.28 4.78 0.52 -0.85 -1.18 118.94 120.13 1h4i s TRP 230 Ca 0.43 -0.76 -0.12 0.00 0.02 0.00 0.00 56.10 55.68 1h4i s TRP 230 Cb 0.35 -0.42 -0.05 0.00 -1.15 0.00 0.00 33.47 32.21 1h4i s TRP 230 CO 0.10 -0.17 0.21 -2.00 0.02 0.00 0.00 176.95 175.11 1h4i s GLU 231 N -2.81 3.91 3.87 4.98 2.12 -1.25 -4.97 118.70 124.56 1h4i s GLU 231 Ca 0.00 -0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.02 1h4i s GLU 231 Cb -0.01 -3.67 0.00 0.00 0.26 0.00 0.00 34.13 30.70 1h4i s GLU 231 CO -0.03 -0.22 0.00 0.41 -0.54 0.00 0.00 175.26 174.88 1h4i n GLY 232 N 5.03 0.76 0.12 -1.50 0.00 -1.26 -3.15 105.19 105.18 1h4i n GLY 232 Ca -0.13 -0.74 0.07 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.37 0.36 0.16 1.61 10.43 -1.26 -4.36 116.55 122.11 1h4i n ASP 233 Ca 0.00 -1.67 0.18 0.00 2.57 0.00 0.00 54.79 55.87 1h4i n ASP 233 Cb 0.00 -0.03 0.69 0.00 1.84 0.00 0.00 41.12 43.62 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 3.48 1.93 0.00 2.24 0.00 -1.94 0.13 119.26 125.10 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 0.10 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1h4i h ALA 234 CO 0.00 -0.67 0.00 0.11 0.00 0.00 0.00 179.25 178.69 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 0.14 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.09 1h4i h TRP 235 Cb 1.17 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.33 1h4i h TRP 235 CO 0.00 0.00 -0.14 0.87 -1.28 0.00 0.00 178.44 177.89 1h4i h LYS 236 N 0.00 0.00 -0.65 0.12 1.57 -1.10 -2.27 116.57 114.24 1h4i h LYS 236 Ca 0.00 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.33 1h4i h LYS 236 Cb 0.36 0.00 -0.42 0.00 0.08 0.00 0.00 32.23 32.25 1h4i h LYS 236 CO 0.00 0.14 -0.92 0.44 -0.57 0.00 0.00 179.45 178.54 1h4i n ILE 237 N -3.93 2.12 1.66 1.86 -5.35 -1.16 -4.29 119.36 110.27 1h4i n ILE 237 Ca -0.02 -3.80 0.13 0.00 -0.27 0.00 0.00 62.75 58.78 1h4i n ILE 237 Cb 0.23 -0.34 0.60 0.00 -1.74 0.00 0.00 39.64 38.38 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 -0.67 -0.40 7.00 3.28 0.00 -0.86 -4.33 105.19 109.22 1h4i n GLY 238 Ca 0.32 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 1.03 -0.16 1.57 -0.02 0.00 -1.07 -2.12 105.19 104.43 1h4i n GLY 239 Ca 0.18 -1.04 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 0.56 3.73 -0.02 0.00 0.09 0.10 105.19 109.65 1h4i n GLY 240 Ca 0.00 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.25 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 2.24 -0.28 2.61 -4.23 -1.26 -3.34 115.64 109.38 1h4i s THR 241 Ca 0.00 0.13 0.02 0.00 -1.18 0.00 0.00 61.69 60.66 1h4i s THR 241 Cb 0.00 -2.88 0.06 0.00 1.34 0.00 0.00 72.50 71.02 1h4i s THR 241 CO 0.00 -0.05 -0.07 0.54 -0.54 0.00 0.00 174.62 174.51 1h4i s ASN 242 N -1.73 4.59 -0.04 3.99 4.22 -1.14 0.34 114.94 125.17 1h4i s ASN 242 Ca 0.78 -1.43 0.06 0.00 -2.14 0.00 0.00 52.86 50.12 1h4i s ASN 242 Cb -0.32 -1.60 0.09 0.00 1.28 0.00 0.00 41.25 40.69 1h4i s ASN 242 CO 0.42 -0.23 0.99 -2.67 -2.04 0.00 0.00 177.10 173.57 1h4i n TRP 243 N 4.47 0.00 0.00 1.54 4.27 -1.20 -0.84 117.44 125.68 1h4i n TRP 243 Ca -0.12 -0.57 0.00 0.00 -3.89 0.00 0.00 57.50 52.91 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 -0.70 0.61 3.53 -1.67 0.00 -1.26 -4.45 105.19 101.25 1h4i n GLY 244 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 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 2.51 2.27 0.31 1.61 0.52 -1.22 -4.67 118.94 120.27 1h4i s TRP 245 Ca 0.00 -0.66 0.04 0.00 0.02 0.00 0.00 56.10 55.50 1h4i s TRP 245 Cb 0.00 -1.43 -0.06 0.00 -1.15 0.00 0.00 33.47 30.83 1h4i s TRP 245 CO 0.00 0.39 0.03 0.71 0.02 0.00 0.00 176.95 178.10 1h4i s TYR 246 N -2.83 1.91 0.07 -1.98 1.51 -1.26 -4.51 117.35 110.26 1h4i s TYR 246 Ca 0.33 -0.91 -0.08 0.00 -1.01 0.00 0.00 57.07 55.39 1h4i s TYR 246 Cb 0.06 -1.21 -0.00 0.00 -0.11 0.00 0.00 41.96 40.70 1h4i s TYR 246 CO 0.16 0.04 0.18 0.00 -1.11 0.00 0.00 175.55 174.82 1h4i s ALA 247 N -3.27 -0.23 -0.07 3.71 0.00 -0.82 -4.73 121.76 116.35 1h4i s ALA 247 Ca 0.34 -0.55 -0.07 0.00 0.00 0.00 0.00 51.96 51.69 1h4i s ALA 247 Cb 0.08 0.41 0.02 0.00 0.00 0.00 0.00 23.12 23.63 1h4i s ALA 247 CO 0.14 -0.46 0.19 -0.47 0.00 0.00 0.00 175.76 175.17 1h4i s TYR 248 N -3.46 -0.21 -0.27 0.00 5.04 -0.73 -0.80 117.35 116.91 1h4i s TYR 248 Ca 0.02 0.51 0.03 0.00 -2.44 0.00 0.00 57.07 55.19 1h4i s TYR 248 Cb 0.03 0.07 0.06 0.00 0.35 0.00 0.00 41.96 42.48 1h4i s TYR 248 CO -0.09 -0.10 -0.08 0.34 -1.34 0.00 0.00 175.55 174.28 1h4i s ASP 249 N 0.11 4.52 0.60 4.32 -1.08 -1.02 -4.34 116.67 119.77 1h4i s ASP 249 Ca -0.00 -1.47 0.31 0.00 -0.52 0.00 0.00 52.55 50.87 1h4i s ASP 249 Cb -0.01 -1.57 1.89 0.00 -1.46 0.00 0.00 42.92 41.77 1h4i s ASP 249 CO 0.00 -0.22 2.27 -0.65 0.52 0.00 0.00 175.17 177.09 1h4i h PRO 250 N 7.77 0.00 -0.03 4.34 0.11 -1.95 0.28 132.00 142.53 1h4i h PRO 250 Ca -0.18 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.81 1h4i h PRO 250 Cb 1.04 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1h4i h PRO 250 CO 0.47 0.00 -0.56 0.78 -0.21 0.00 0.00 178.00 178.48 1h4i h GLY 251 N 0.00 0.10 0.00 -0.55 0.00 -1.97 -3.19 103.07 97.46 1h4i h GLY 251 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.22 1h4i h GLY 251 CO -0.00 0.10 -1.03 -1.30 0.00 0.00 0.00 176.54 174.31 1h4i n THR 252 N -3.88 0.00 -1.44 4.70 -2.24 -0.90 -4.98 114.28 105.54 1h4i n THR 252 Ca -0.02 -0.22 -0.15 0.00 -2.27 0.00 0.00 64.05 61.39 1h4i n THR 252 Cb 0.58 0.71 -0.06 0.00 -2.10 0.00 0.00 70.33 69.45 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 -1.58 -5.12 -4.89 3.42 5.15 0.94 -4.97 115.26 108.21 1h4i n ASN 253 Ca 0.01 0.37 -0.35 0.00 -0.60 0.00 0.00 54.58 54.01 1h4i n ASN 253 Cb 0.28 -3.95 -0.05 0.00 -0.53 0.00 0.00 39.78 35.53 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 -3.44 4.38 -0.16 1.20 1.43 -1.19 -0.44 118.68 120.46 1h4i s LEU 254 Ca 0.00 0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 53.46 1h4i s LEU 254 Cb 0.00 -2.37 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 1h4i s LEU 254 CO 0.00 0.33 0.07 0.27 0.23 0.00 0.00 176.35 177.25 1h4i s ILE 255 N -1.18 4.85 -0.09 -0.59 -4.36 0.48 -2.45 121.20 117.86 1h4i s ILE 255 Ca 0.22 -0.02 -0.01 0.00 -0.26 0.00 0.00 60.65 60.57 1h4i s ILE 255 Cb -0.12 -3.15 -0.03 0.00 1.25 0.00 0.00 42.46 40.40 1h4i s ILE 255 CO 0.12 0.50 -0.02 -0.31 0.24 0.00 0.00 174.94 175.47 1h4i s TYR 256 N -0.01 3.08 0.04 1.37 2.02 0.02 -1.64 117.35 122.22 1h4i s TYR 256 Ca 0.06 0.08 -0.28 0.00 -0.37 0.00 0.00 57.07 56.56 1h4i s TYR 256 Cb -0.12 -1.79 0.10 0.00 -0.40 0.00 0.00 41.96 39.75 1h4i s TYR 256 CO 0.01 0.36 1.08 -0.59 -1.57 0.00 0.00 175.55 174.84 1h4i s PHE 257 N -0.68 -0.13 0.15 2.71 -0.12 -1.12 -1.94 117.98 116.85 1h4i s PHE 257 Ca 0.11 -0.05 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 -0.54 -0.19 0.20 -0.05 0.00 0.00 175.22 174.66 1h4i s GLY 258 N -2.80 1.69 0.07 1.99 0.00 -1.26 -0.96 107.32 106.05 1h4i s GLY 258 Ca 0.11 -1.46 -0.03 0.00 0.00 0.00 0.00 44.72 43.34 1h4i s GLY 258 CO -0.02 -1.46 0.27 -0.51 0.00 0.00 0.00 173.10 171.37 1h4i s THR 259 N -1.37 5.31 0.00 0.90 -4.23 -0.72 -4.36 115.64 111.17 1h4i s THR 259 Ca 0.19 -0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.56 1h4i s THR 259 Cb -0.09 -3.61 0.00 0.00 1.34 0.00 0.00 72.50 70.14 1h4i s THR 259 CO 0.10 0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.95 1h4i n GLY 260 N 0.42 -2.16 3.80 3.99 0.00 0.15 -2.18 105.19 109.21 1h4i n GLY 260 Ca -0.06 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.41 6.01 0.59 1.61 4.22 -1.26 -1.27 114.94 123.43 1h4i s ASN 261 Ca 0.00 1.82 -0.13 0.00 -2.14 0.00 0.00 52.86 52.41 1h4i s ASN 261 Cb 0.00 -2.54 -0.04 0.00 1.28 0.00 0.00 41.25 39.95 1h4i s ASN 261 CO 0.00 -1.01 1.02 -2.16 -2.04 0.00 0.00 177.10 172.91 1h4i s PRO 262 N -3.85 3.58 0.00 3.55 0.04 -1.26 -0.73 135.00 136.33 1h4i s PRO 262 Ca 0.64 0.90 0.06 0.00 0.04 0.00 0.00 61.00 62.64 1h4i s PRO 262 Cb -0.16 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 1h4i s PRO 262 CO 0.32 -0.58 -0.17 0.00 0.04 0.00 0.00 177.00 176.61 1h4i s ALA 263 N -2.89 2.59 0.92 8.56 0.00 -0.90 -4.47 121.76 125.58 1h4i s ALA 263 Ca 0.58 -1.10 -0.10 0.00 0.00 0.00 0.00 51.96 51.33 1h4i s ALA 263 Cb -0.12 -0.81 0.16 0.00 0.00 0.00 0.00 23.12 22.35 1h4i s ALA 263 CO 0.45 0.56 1.00 -0.35 0.00 0.00 0.00 175.76 177.42 1h4i n PRO 264 N 1.90 -0.78 0.18 0.00 -0.04 -1.26 -4.58 135.00 130.42 1h4i n PRO 264 Ca -0.16 -1.75 0.05 0.00 -0.04 0.00 0.00 63.50 61.59 1h4i n PRO 264 Cb 0.52 -0.96 0.31 0.00 -0.04 0.00 0.00 33.50 33.34 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 -1.37 0.00 -2.01 0.54 4.06 -0.98 -3.41 115.95 112.78 1h4i h TRP 265 Ca -0.32 0.00 -0.51 0.00 2.06 0.00 0.00 58.89 60.12 1h4i h TRP 265 Cb 0.95 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.08 1h4i h TRP 265 CO 0.00 0.39 1.41 1.21 -3.56 0.00 0.00 178.44 177.89 1h4i s ASN 266 N -6.46 5.18 0.49 -3.49 3.84 -1.16 -4.81 114.94 108.53 1h4i s ASN 266 Ca 0.00 0.71 0.17 0.00 0.21 0.00 0.00 52.86 53.95 1h4i s ASN 266 Cb 0.11 -2.52 1.17 0.00 -0.55 0.00 0.00 41.25 39.46 1h4i s ASN 266 CO 0.69 -2.38 2.07 1.05 -2.79 0.00 0.00 177.10 175.74 1h4i h GLU 267 N 15.71 0.00 0.00 0.43 -0.00 -1.84 -2.65 114.58 126.23 1h4i h GLU 267 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.09 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 1.17 0.11 0.00 1.15 -0.00 0.00 0.00 179.01 181.43 1h4i h THR 268 N 0.00 0.00 -0.04 -1.06 2.02 -1.91 -2.42 112.91 109.50 1h4i h THR 268 Ca -0.00 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1h4i h THR 268 Cb 0.20 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1h4i h THR 268 CO 0.01 0.00 0.00 0.23 0.37 0.00 0.00 175.52 176.13 1h4i n MET 269 N -2.54 1.79 -3.05 6.66 2.81 -1.00 -4.55 117.12 117.23 1h4i n MET 269 Ca 0.01 -1.15 -0.17 0.00 -1.81 0.00 0.00 57.70 54.58 1h4i n MET 269 Cb 0.21 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.22 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 0.39 0.58 -1.82 0.03 1.85 -0.91 -4.94 116.66 111.84 1h4i n ARG 270 Ca 0.18 -2.62 -0.39 0.00 -1.00 0.00 0.00 57.85 54.02 1h4i n ARG 270 Cb 0.39 -1.42 0.02 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 -0.07 3.57 0.00 2.89 0.04 -1.26 -4.87 135.00 135.30 1h4i s PRO 271 Ca 0.33 2.34 0.00 0.00 0.04 0.00 0.00 61.00 63.71 1h4i s PRO 271 Cb 0.13 -2.56 0.00 0.00 0.04 0.00 0.00 34.50 32.11 1h4i s PRO 271 CO -0.16 -0.88 0.00 0.41 0.04 0.00 0.00 177.00 176.41 1h4i n GLY 272 N 0.62 3.12 0.16 0.56 0.00 -1.26 -3.92 105.19 104.47 1h4i n GLY 272 Ca 0.06 -2.00 0.12 0.00 0.00 0.00 0.00 46.02 44.20 1h4i n GLY 272 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1h4i h ASP 273 N 0.00 0.00 -6.12 1.61 5.19 -1.86 -3.35 116.42 111.89 1h4i h ASP 273 Ca 0.00 0.00 -0.43 0.00 -0.62 0.00 0.00 57.03 55.98 1h4i h ASP 273 Cb 0.00 0.00 0.04 0.00 0.18 0.00 0.00 39.33 39.55 1h4i h ASP 273 CO 0.00 0.00 -0.81 0.59 -3.12 0.00 0.00 179.24 175.90 1h4i n ASN 274 N -2.31 -2.15 -4.66 6.45 5.03 -0.32 -1.64 115.26 115.65 1h4i n ASN 274 Ca 0.00 -0.80 -0.39 0.00 0.87 0.00 0.00 54.58 54.26 1h4i n ASN 274 Cb 0.14 -4.08 0.03 0.00 -1.02 0.00 0.00 39.78 34.86 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 -4.39 1.37 -0.68 3.52 5.02 -1.26 -3.13 118.16 118.62 1h4i n LYS 275 Ca -0.21 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 1h4i n LYS 275 Cb 0.64 -2.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.39 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 -0.98 0.00 -3.03 2.13 5.03 -1.26 -4.52 117.44 114.81 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 -3.47 4.81 -1.53 -0.99 -4.23 -1.18 -3.92 115.64 105.13 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 70.15 1h4i s THR 277 CO 0.00 -0.38 0.69 0.23 -0.54 0.00 0.00 174.62 174.63 1h4i n MET 278 N -0.94 -5.35 -4.60 3.99 2.81 -0.40 -4.83 117.12 107.81 1h4i n MET 278 Ca 0.02 0.90 -0.24 0.00 -1.81 0.00 0.00 57.70 56.57 1h4i n MET 278 Cb 0.54 -5.78 -0.14 0.00 -0.71 0.00 0.00 33.22 27.13 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 -3.20 1.47 -0.32 2.03 -4.23 -1.24 -0.98 115.64 109.17 1h4i s THR 279 Ca 0.34 -1.07 -0.26 0.00 -1.18 0.00 0.00 61.69 59.53 1h4i s THR 279 Cb -0.15 -1.28 0.01 0.00 1.34 0.00 0.00 72.50 72.41 1h4i s THR 279 CO 0.43 0.19 0.92 -0.63 -0.54 0.00 0.00 174.62 174.98 1h4i s ILE 280 N -0.74 4.65 0.17 2.99 1.01 0.17 -1.75 121.20 127.69 1h4i s ILE 280 Ca 0.06 1.41 0.06 0.00 0.00 0.00 0.00 60.65 62.17 1h4i s ILE 280 Cb -0.08 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 1h4i s ILE 280 CO 0.01 -0.38 0.07 -0.36 0.00 0.00 0.00 174.94 174.29 1h4i s PHE 281 N 3.29 3.01 -0.24 3.97 0.40 -0.13 -1.35 117.98 126.94 1h4i s PHE 281 Ca 0.38 -0.07 -0.01 0.00 -0.60 0.00 0.00 56.93 56.63 1h4i s PHE 281 Cb -0.13 -1.45 0.07 0.00 0.51 0.00 0.00 43.02 42.02 1h4i s PHE 281 CO 0.14 0.52 0.03 0.20 0.70 0.00 0.00 175.22 176.81 1h4i s GLY 282 N -3.02 0.97 0.03 4.36 0.00 -0.90 -2.77 107.32 105.99 1h4i s GLY 282 Ca 0.29 -1.16 0.07 0.00 0.00 0.00 0.00 44.72 43.92 1h4i s GLY 282 CO 0.21 1.34 -0.20 0.50 0.00 0.00 0.00 173.10 174.96 1h4i s ARG 283 N 1.66 2.07 0.18 2.90 0.52 -0.65 -0.63 118.95 124.99 1h4i s ARG 283 Ca 0.01 -0.97 -0.31 0.00 -0.52 0.00 0.00 55.73 53.94 1h4i s ARG 283 Cb -0.18 -2.16 -0.09 0.00 0.52 0.00 0.00 34.95 33.04 1h4i s ARG 283 CO -0.12 0.54 1.44 0.34 0.02 0.00 0.00 175.30 177.52 1h4i s ASP 284 N -1.27 6.72 0.34 0.23 2.15 0.35 -0.39 116.67 124.80 1h4i s ASP 284 Ca 0.13 2.52 0.02 0.00 0.43 0.00 0.00 52.55 55.65 1h4i s ASP 284 Cb -0.10 -2.60 0.61 0.00 -0.30 0.00 0.00 42.92 40.52 1h4i s ASP 284 CO 0.04 -0.69 2.00 0.00 -0.17 0.00 0.00 175.17 176.34 1h4i h ALA 285 N 6.01 1.54 0.06 3.66 0.00 -1.10 0.19 119.26 129.62 1h4i h ALA 285 Ca -0.44 -0.04 -0.30 0.00 0.00 0.00 0.00 54.91 54.12 1h4i h ALA 285 Cb 1.21 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1h4i h ALA 285 CO 0.84 0.42 -1.64 -0.44 0.00 0.00 0.00 179.25 178.42 1h4i h ASP 286 N 0.90 0.21 0.00 0.00 3.45 -1.91 -3.40 116.42 115.68 1h4i h ASP 286 Ca 0.26 -0.37 0.00 0.00 0.43 0.00 0.00 57.03 57.35 1h4i h ASP 286 Cb -0.06 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 38.64 1h4i h ASP 286 CO -0.06 1.32 -1.12 0.35 -1.57 0.00 0.00 179.24 178.16 1h4i n THR 287 N -3.29 0.00 -0.98 0.35 -2.24 -1.23 -4.91 114.28 101.98 1h4i n THR 287 Ca -0.18 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1h4i n THR 287 Cb 1.04 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.78 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 1.73 0.63 3.73 3.38 0.00 0.65 -4.91 105.19 110.40 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 4.41 -0.17 1.61 2.02 -1.26 -4.46 118.70 120.68 1h4i s GLU 289 Ca 0.00 1.95 -0.29 0.00 0.02 0.00 0.00 54.97 56.65 1h4i s GLU 289 Cb 0.00 -3.25 -0.01 0.00 0.10 0.00 0.00 34.13 30.98 1h4i s GLU 289 CO 0.00 -0.25 1.15 0.00 0.02 0.00 0.00 175.26 176.19 1h4i s ALA 290 N 0.46 3.64 -0.02 5.21 0.00 -0.44 -0.50 121.76 130.12 1h4i s ALA 290 Ca 0.58 0.36 -0.00 0.00 0.00 0.00 0.00 51.96 52.90 1h4i s ALA 290 Cb -0.34 -3.57 -0.26 0.00 0.00 0.00 0.00 23.12 18.95 1h4i s ALA 290 CO 0.34 -1.05 0.76 0.87 0.00 0.00 0.00 175.76 176.68 1h4i h LYS 291 N 7.77 0.19 -3.26 0.00 1.57 -1.23 -1.39 116.57 120.22 1h4i h LYS 291 Ca -0.25 -0.33 -0.08 0.00 -1.87 0.00 0.00 60.65 58.12 1h4i h LYS 291 Cb 1.10 0.12 -0.16 0.00 0.08 0.00 0.00 32.23 33.37 1h4i h LYS 291 CO 0.96 1.01 -0.20 -0.59 -0.57 0.00 0.00 179.45 180.06 1h4i s PHE 292 N -2.61 -0.15 -0.25 -1.35 -0.12 -1.18 -1.89 117.98 110.44 1h4i s PHE 292 Ca -0.10 0.01 -0.04 0.00 -0.05 0.00 0.00 56.93 56.75 1h4i s PHE 292 Cb 0.07 0.14 0.13 0.00 -0.63 0.00 0.00 43.02 42.73 1h4i s PHE 292 CO 0.83 -0.54 0.44 0.20 -0.05 0.00 0.00 175.22 176.10 1h4i s GLY 293 N -2.15 -0.52 -0.28 1.99 0.00 -1.26 -2.12 107.32 102.98 1h4i s GLY 293 Ca -0.04 1.27 -0.05 0.00 0.00 0.00 0.00 44.72 45.90 1h4i s GLY 293 CO -0.04 2.76 0.04 -0.47 0.00 0.00 0.00 173.10 175.38 1h4i s TYR 294 N 2.63 3.12 -0.37 1.90 5.04 -0.46 -4.87 117.35 124.34 1h4i s TYR 294 Ca 0.10 -1.11 -0.29 0.00 -2.44 0.00 0.00 57.07 53.33 1h4i s TYR 294 Cb -0.14 -2.20 0.02 0.00 0.35 0.00 0.00 41.96 39.99 1h4i s TYR 294 CO -0.16 -0.61 1.09 -1.14 -1.34 0.00 0.00 175.55 173.39 1h4i s GLN 295 N 1.46 3.94 0.02 4.97 0.74 -1.26 -0.66 119.66 128.87 1h4i s GLN 295 Ca 0.02 0.89 -0.20 0.00 0.05 0.00 0.00 55.36 56.12 1h4i s GLN 295 Cb -0.17 -3.80 -0.19 0.00 1.10 0.00 0.00 33.01 29.96 1h4i s GLN 295 CO 0.00 -1.06 1.21 0.87 -0.55 0.00 0.00 175.29 175.76 1h4i h LYS 296 N 8.48 0.42 -3.15 1.67 1.57 -1.38 -3.41 116.57 120.77 1h4i h LYS 296 Ca -0.21 -0.34 -0.62 0.00 -1.87 0.00 0.00 60.65 57.61 1h4i h LYS 296 Cb 1.06 0.07 -0.41 0.00 0.08 0.00 0.00 32.23 33.03 1h4i h LYS 296 CO 1.06 0.97 -0.67 0.99 -0.57 0.00 0.00 179.45 181.24 1h4i s THR 297 N -3.67 2.19 0.31 -0.16 2.01 -1.24 -4.71 115.64 110.37 1h4i s THR 297 Ca -0.14 -3.27 -0.29 0.00 0.31 0.00 0.00 61.69 58.30 1h4i s THR 297 Cb 0.04 -2.50 -0.10 0.00 0.01 0.00 0.00 72.50 69.95 1h4i s THR 297 CO 0.80 -0.90 1.32 -2.84 -0.69 0.00 0.00 174.62 172.31 1h4i s PRO 298 N -0.34 4.36 -0.84 4.92 0.02 -1.26 -3.63 135.00 138.23 1h4i s PRO 298 Ca 0.20 2.20 -0.03 0.00 0.02 0.00 0.00 61.00 63.39 1h4i s PRO 298 Cb -0.19 -3.09 -0.00 0.00 0.02 0.00 0.00 34.50 31.24 1h4i s PRO 298 CO -0.05 -0.21 0.66 1.58 -0.33 0.00 0.00 177.00 178.66 1h4i n HIS 299 N 1.11 -2.36 -1.69 6.54 -0.00 -0.65 -4.85 115.22 113.31 1h4i n HIS 299 Ca 0.01 0.89 -0.44 0.00 -0.00 0.00 0.00 57.72 58.18 1h4i n HIS 299 Cb 0.42 -3.34 -0.02 0.00 -0.00 0.00 0.00 29.99 27.05 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 -2.31 2.97 0.00 0.26 4.64 -1.24 -4.90 116.55 115.97 1h4i n ASP 300 Ca -0.18 1.15 0.00 0.00 -1.38 0.00 0.00 54.79 54.39 1h4i n ASP 300 Cb 0.61 -1.47 0.00 0.00 -1.04 0.00 0.00 41.12 39.22 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 1.83 1.61 -0.03 -0.67 1.02 -1.26 -4.70 120.64 118.44 1h4i n GLU 301 Ca 0.10 -1.04 0.00 0.00 -0.02 0.00 0.00 57.16 56.20 1h4i n GLU 301 Cb 0.33 -0.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.93 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 -0.28 0.00 -3.50 -0.32 8.01 -1.26 -4.49 117.44 115.60 1h4i n TRP 302 Ca 0.00 0.00 -0.18 0.00 -1.31 0.00 0.00 57.50 56.01 1h4i n TRP 302 Cb 0.30 -0.00 0.08 0.00 -2.01 0.00 0.00 31.31 29.68 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 0.00 -2.07 -2.60 -0.99 2.03 -1.26 -3.86 116.55 107.80 1h4i n ASP 303 Ca 0.00 -0.66 -0.29 0.00 0.52 0.00 0.00 54.79 54.36 1h4i n ASP 303 Cb 0.51 -4.88 -0.05 0.00 -0.72 0.00 0.00 41.12 35.99 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 -4.21 1.76 -0.92 -0.67 0.53 -1.26 -4.70 117.16 107.69 1h4i n TYR 304 Ca -0.28 -2.03 -0.44 0.00 -1.02 0.00 0.00 57.90 54.13 1h4i n TYR 304 Cb 0.67 -1.40 -0.09 0.00 -1.03 0.00 0.00 39.34 37.49 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 0.83 0.13 -0.45 -0.72 0.00 -1.26 -4.55 120.51 114.49 1h4i n ALA 305 Ca 0.50 0.15 -0.00 0.00 0.00 0.00 0.00 53.44 54.09 1h4i n ALA 305 Cb 0.51 -1.52 -0.00 0.00 0.00 0.00 0.00 19.45 18.44 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 5.41 2.28 0.62 0.00 0.00 -1.14 -4.44 105.19 107.91 1h4i n GLY 306 Ca 0.40 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.53 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 1.56 0.17 -0.58 1.61 0.24 -1.26 -3.54 118.33 116.54 1h4i n VAL 307 Ca 0.00 -0.37 -0.30 0.00 -2.04 0.00 0.00 64.34 61.63 1h4i n VAL 307 Cb 0.45 0.53 0.21 0.00 -1.47 0.00 0.00 33.84 33.56 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 0.46 -1.50 -4.61 -1.34 3.02 -1.26 -3.43 115.26 106.59 1h4i n ASN 308 Ca 0.17 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.30 1h4i n ASN 308 Cb 0.38 -1.24 -0.00 0.00 -0.61 0.00 0.00 39.78 38.31 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 -4.61 2.17 -4.05 2.41 3.14 -1.26 -4.49 118.33 111.65 1h4i n VAL 309 Ca 0.05 -0.50 -0.34 0.00 -2.96 0.00 0.00 64.34 60.58 1h4i n VAL 309 Cb 0.55 -1.14 -0.14 0.00 -1.06 0.00 0.00 33.84 32.05 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 -1.80 3.31 -0.16 1.45 -1.94 -1.26 -4.29 119.30 114.61 1h4i s MET 310 Ca 0.60 -0.67 0.01 0.00 -1.71 0.00 0.00 55.69 53.92 1h4i s MET 310 Cb -0.62 -2.88 0.02 0.00 2.01 0.00 0.00 34.83 33.36 1h4i s MET 310 CO 0.59 -0.15 -0.16 -1.64 -0.01 0.00 0.00 175.02 173.65 1h4i s MET 311 N 1.31 2.56 0.14 2.03 -1.94 -0.37 -4.65 119.30 118.38 1h4i s MET 311 Ca 0.04 -0.69 -0.15 0.00 -1.71 0.00 0.00 55.69 53.18 1h4i s MET 311 Cb -0.14 -2.31 -0.07 0.00 2.01 0.00 0.00 34.83 34.31 1h4i s MET 311 CO -0.04 -0.24 0.56 -0.51 -0.01 0.00 0.00 175.02 174.78 1h4i s LEU 312 N 1.40 4.36 0.23 -0.03 1.43 -0.39 -0.11 118.68 125.58 1h4i s LEU 312 Ca 0.05 1.11 -0.17 0.00 -1.03 0.00 0.00 54.13 54.09 1h4i s LEU 312 Cb -0.13 -3.24 0.01 0.00 0.03 0.00 0.00 46.19 42.87 1h4i s LEU 312 CO -0.11 0.12 0.56 -0.94 0.23 0.00 0.00 176.35 176.20 1h4i s SER 313 N -1.64 -0.20 -0.19 2.29 1.04 -0.85 -4.86 113.70 109.29 1h4i s SER 313 Ca 0.37 -0.67 -0.01 0.00 0.48 0.00 0.00 55.95 56.12 1h4i s SER 313 Cb -0.16 0.62 0.05 0.00 0.10 0.00 0.00 66.02 66.64 1h4i s SER 313 CO 0.19 -1.16 -0.02 -1.61 0.98 0.00 0.00 173.24 171.62 1h4i s GLU 314 N -3.94 1.24 0.11 4.02 2.02 -1.26 0.16 118.70 121.05 1h4i s GLU 314 Ca 0.14 -0.63 0.01 0.00 0.02 0.00 0.00 54.97 54.52 1h4i s GLU 314 Cb -0.02 -2.21 -0.04 0.00 0.10 0.00 0.00 34.13 31.96 1h4i s GLU 314 CO 0.04 -0.55 -0.04 -0.65 0.02 0.00 0.00 175.26 174.08 1h4i s GLN 315 N 1.63 0.89 -0.02 1.61 -0.21 -1.05 -4.93 119.66 117.58 1h4i s GLN 315 Ca -0.02 -1.38 -0.24 0.00 0.02 0.00 0.00 55.36 53.74 1h4i s GLN 315 Cb -0.17 -0.15 -0.04 0.00 1.00 0.00 0.00 33.01 33.65 1h4i s GLN 315 CO -0.07 -0.07 0.71 0.15 -2.12 0.00 0.00 175.29 173.89 1h4i s LYS 316 N -3.88 4.44 0.00 2.91 1.02 -1.26 -0.27 119.74 122.71 1h4i s LYS 316 Ca 0.15 0.93 0.00 0.00 0.02 0.00 0.00 55.97 57.07 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 0.17 0.00 -0.40 -0.92 0.00 0.00 175.35 174.18 1h4i n ASP 317 N 3.33 -0.32 0.27 2.83 5.68 0.15 -4.82 116.55 123.65 1h4i n ASP 317 Ca -0.02 -0.56 0.14 0.00 -0.50 0.00 0.00 54.79 53.84 1h4i n ASP 317 Cb 0.51 0.00 0.72 0.00 -1.14 0.00 0.00 41.12 41.21 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 -0.26 0.11 1.57 -1.91 -2.40 116.57 113.67 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 0.11 0.00 -0.25 -0.57 0.00 0.00 179.45 178.74 1h4i n ASP 319 N -3.42 2.31 0.00 0.86 8.00 -1.26 -4.91 116.55 118.13 1h4i n ASP 319 Ca -0.01 -1.83 0.00 0.00 0.71 0.00 0.00 54.79 53.66 1h4i n ASP 319 Cb 0.27 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.20 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 1.26 0.74 3.73 0.44 0.00 -0.90 -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 45.78 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 -0.25 4.59 -0.34 1.61 1.02 -1.26 -4.72 119.74 120.39 1h4i s LYS 321 Ca 0.00 1.30 -0.29 0.00 0.02 0.00 0.00 55.97 57.00 1h4i s LYS 321 Cb 0.00 -3.40 0.02 0.00 -0.52 0.00 0.00 37.83 33.92 1h4i s LYS 321 CO 0.00 0.14 1.11 0.00 -0.92 0.00 0.00 175.35 175.68 1h4i s ALA 322 N 0.35 3.43 0.17 5.17 0.00 -1.26 0.29 121.76 129.91 1h4i s ALA 322 Ca 0.45 -0.10 0.06 0.00 0.00 0.00 0.00 51.96 52.37 1h4i s ALA 322 Cb -0.21 -3.72 -0.04 0.00 0.00 0.00 0.00 23.12 19.15 1h4i s ALA 322 CO 0.27 -1.64 0.10 1.03 0.00 0.00 0.00 175.76 175.52 1h4i s ARG 323 N 3.83 2.75 -0.36 0.00 1.81 0.63 -4.96 118.95 122.66 1h4i s ARG 323 Ca 0.47 -0.95 -0.13 0.00 -1.72 0.00 0.00 55.73 53.40 1h4i s ARG 323 Cb -0.12 -2.55 0.00 0.00 -0.45 0.00 0.00 34.95 31.83 1h4i s ARG 323 CO 0.19 0.47 0.24 0.15 -0.68 0.00 0.00 175.30 175.67 1h4i s LYS 324 N -3.10 3.24 0.40 3.54 -0.14 -1.26 -2.52 119.74 119.89 1h4i s LYS 324 Ca 0.30 -0.82 0.07 0.00 -1.36 0.00 0.00 55.97 54.17 1h4i s LYS 324 Cb -0.10 -3.82 -0.07 0.00 -1.68 0.00 0.00 37.83 32.16 1h4i s LYS 324 CO 0.22 -0.56 0.05 -0.51 -0.76 0.00 0.00 175.35 173.78 1h4i s LEU 325 N 1.68 2.94 -0.02 3.17 1.43 0.12 -0.69 118.68 127.31 1h4i s LEU 325 Ca 0.05 -1.25 0.01 0.00 -1.03 0.00 0.00 54.13 51.92 1h4i s LEU 325 Cb -0.18 -1.09 0.01 0.00 0.03 0.00 0.00 46.19 44.96 1h4i s LEU 325 CO 0.09 -0.43 -0.03 -1.48 0.23 0.00 0.00 176.35 174.72 1h4i s LEU 326 N -3.75 1.56 -0.07 1.79 0.05 -0.72 -2.00 118.68 115.54 1h4i s LEU 326 Ca 0.36 -0.09 0.05 0.00 0.05 0.00 0.00 54.13 54.51 1h4i s LEU 326 Cb 0.07 -0.31 -0.01 0.00 -2.05 0.00 0.00 46.19 43.89 1h4i s LEU 326 CO 0.19 -0.02 -0.24 -0.89 -0.55 0.00 0.00 176.35 174.85 1h4i s THR 327 N 0.53 2.16 -0.26 5.48 2.01 0.85 -1.72 115.64 124.68 1h4i s THR 327 Ca -0.06 -1.01 -0.03 0.00 0.31 0.00 0.00 61.69 60.89 1h4i s THR 327 Cb -0.09 -1.80 0.10 0.00 0.01 0.00 0.00 72.50 70.72 1h4i s THR 327 CO -0.00 0.57 0.19 -2.28 -0.69 0.00 0.00 174.62 172.40 1h4i s HIS 328 N 0.00 -0.05 -0.42 4.92 5.04 0.92 -1.24 115.29 124.46 1h4i s HIS 328 Ca -0.08 -0.39 -0.28 0.00 -1.54 0.00 0.00 55.06 52.77 1h4i s HIS 328 Cb -0.15 -0.64 0.02 0.00 0.04 0.00 0.00 32.58 31.85 1h4i s HIS 328 CO 0.05 -0.77 1.08 -1.25 -2.34 0.00 0.00 174.74 171.51 1h4i s PRO 329 N 2.23 3.81 0.55 2.88 0.04 -1.26 -1.04 135.00 142.20 1h4i s PRO 329 Ca 0.08 0.66 -0.02 0.00 0.04 0.00 0.00 61.00 61.76 1h4i s PRO 329 Cb -0.15 -3.85 0.02 0.00 0.04 0.00 0.00 34.50 30.55 1h4i s PRO 329 CO -0.27 -1.19 0.80 0.34 0.04 0.00 0.00 177.00 176.72 1h4i s ASP 330 N 2.16 5.49 0.34 6.66 2.15 -0.38 -4.71 116.67 128.39 1h4i s ASP 330 Ca 0.45 0.34 0.04 0.00 0.43 0.00 0.00 52.55 53.81 1h4i s ASP 330 Cb -0.09 -1.35 0.62 0.00 -0.30 0.00 0.00 42.92 41.80 1h4i s ASP 330 CO 0.25 -1.03 1.92 0.03 -0.17 0.00 0.00 175.17 176.17 1h4i h ARG 331 N 0.03 0.63 0.00 4.34 2.47 -1.81 -2.97 114.38 117.06 1h4i h ARG 331 Ca -0.45 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 58.18 1h4i h ARG 331 Cb 1.27 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 29.48 1h4i h ARG 331 CO 0.57 0.55 0.00 0.27 0.56 0.00 0.00 179.97 181.92 1h4i n ASN 332 N -4.34 0.00 0.00 7.04 0.23 -1.26 -2.28 115.26 114.65 1h4i n ASN 332 Ca 0.03 -0.14 0.00 0.00 -0.53 0.00 0.00 54.58 53.94 1h4i n ASN 332 Cb 0.17 -0.08 0.00 0.00 -2.08 0.00 0.00 39.78 37.80 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 -0.52 0.66 3.37 4.83 0.00 -1.12 -4.66 105.19 107.74 1h4i n GLY 333 Ca 0.05 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 -2.34 2.74 -0.21 -0.61 -1.09 -1.26 -0.06 121.20 118.37 1h4i s ILE 334 Ca 0.00 -0.81 -0.14 0.00 -2.23 0.00 0.00 60.65 57.47 1h4i s ILE 334 Cb 0.00 -2.08 -0.04 0.00 -1.58 0.00 0.00 42.46 38.75 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 -0.12 5.26 -0.09 2.92 1.01 0.13 -1.24 120.40 128.26 1h4i s VAL 335 Ca -0.03 0.54 -0.02 0.00 0.00 0.00 0.00 61.98 62.47 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 0.29 -0.01 -0.31 0.00 0.00 0.00 175.10 175.11 1h4i s TYR 336 N 1.15 3.11 -0.13 5.22 1.51 -0.21 -1.46 117.35 126.53 1h4i s TYR 336 Ca 0.15 0.13 -0.00 0.00 -1.01 0.00 0.00 57.07 56.34 1h4i s TYR 336 Cb -0.14 -1.79 0.02 0.00 -0.11 0.00 0.00 41.96 39.94 1h4i s TYR 336 CO 0.06 0.41 -0.10 0.99 -1.11 0.00 0.00 175.55 175.80 1h4i s THR 337 N -0.78 1.28 0.21 -0.71 2.01 0.44 -0.06 115.64 118.04 1h4i s THR 337 Ca 0.12 -0.46 0.09 0.00 0.31 0.00 0.00 61.69 61.75 1h4i s THR 337 Cb -0.11 -1.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.10 1h4i s THR 337 CO 0.02 0.39 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.41 1h4i s LEU 338 N 1.61 2.53 -0.15 4.42 1.43 -0.70 -0.00 118.68 127.81 1h4i s LEU 338 Ca 0.05 -0.98 -0.29 0.00 -1.03 0.00 0.00 54.13 51.88 1h4i s LEU 338 Cb -0.13 -0.85 -0.01 0.00 0.03 0.00 0.00 46.19 45.23 1h4i s LEU 338 CO -0.09 -0.07 1.24 -0.62 0.23 0.00 0.00 176.35 177.04 1h4i s ASP 339 N -3.18 6.97 0.00 2.29 -1.08 0.94 -1.75 116.67 120.87 1h4i s ASP 339 Ca 0.23 1.69 0.18 0.00 -0.52 0.00 0.00 52.55 54.12 1h4i s ASP 339 Cb -0.03 -2.54 0.84 0.00 -1.46 0.00 0.00 42.92 39.72 1h4i s ASP 339 CO 0.09 -0.73 1.55 -2.11 0.52 0.00 0.00 175.17 174.49 1h4i n ARG 340 N 6.39 0.15 0.04 4.34 1.85 0.13 -0.14 116.66 129.43 1h4i n ARG 340 Ca 0.13 0.15 -0.20 0.00 -1.00 0.00 0.00 57.85 56.93 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 0.84 0.00 8.89 1.35 -1.91 -3.42 112.91 118.66 1h4i h THR 341 Ca 0.00 -2.50 0.00 0.00 -0.55 0.00 0.00 66.41 63.36 1h4i h THR 341 Cb 0.22 2.63 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1h4i h THR 341 CO 0.00 0.84 0.00 -0.90 -0.25 0.00 0.00 175.52 175.21 1h4i n ASP 342 N -3.48 0.18 0.00 5.36 5.68 -1.20 -5.02 116.55 118.06 1h4i n ASP 342 Ca -0.26 -0.51 0.00 0.00 -0.50 0.00 0.00 54.79 53.52 1h4i n ASP 342 Cb 1.06 0.51 0.00 0.00 -1.14 0.00 0.00 41.12 41.54 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 0.51 0.71 3.75 6.12 0.00 0.81 -4.71 105.19 112.37 1h4i n GLY 343 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.11 3.63 0.04 4.61 0.00 -1.24 -4.63 121.76 122.05 1h4i s ALA 344 Ca 0.00 1.33 -0.30 0.00 0.00 0.00 0.00 51.96 52.99 1h4i s ALA 344 Cb 0.00 -3.56 -0.06 0.00 0.00 0.00 0.00 23.12 19.50 1h4i s ALA 344 CO 0.00 -0.75 1.38 -0.51 0.00 0.00 0.00 175.76 175.88 1h4i s LEU 345 N -0.40 4.34 -0.23 0.00 1.43 -1.26 -0.04 118.68 122.52 1h4i s LEU 345 Ca 0.59 2.16 -0.12 0.00 -1.03 0.00 0.00 54.13 55.74 1h4i s LEU 345 Cb -0.42 -3.57 -0.10 0.00 0.03 0.00 0.00 46.19 42.13 1h4i s LEU 345 CO 0.43 -0.68 -0.30 0.52 0.23 0.00 0.00 176.35 176.56 1h4i n VAL 346 N 4.39 1.26 -3.73 -1.59 0.31 1.00 -4.89 118.33 115.09 1h4i n VAL 346 Ca 0.12 -0.31 -0.13 0.00 -0.01 0.00 0.00 64.34 64.00 1h4i n VAL 346 Cb 0.44 -1.82 -0.08 0.00 -0.91 0.00 0.00 33.84 31.47 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 -7.05 -0.23 -0.40 4.52 1.04 -0.86 -4.99 113.70 105.73 1h4i s SER 347 Ca -0.32 0.10 0.04 0.00 0.48 0.00 0.00 55.95 56.24 1h4i s SER 347 Cb 0.12 0.35 0.16 0.00 0.10 0.00 0.00 66.02 66.75 1h4i s SER 347 CO 0.40 -0.51 0.41 0.00 0.98 0.00 0.00 173.24 174.52 1h4i s ALA 348 N -1.59 -0.25 0.23 5.32 0.00 -1.25 -0.42 121.76 123.80 1h4i s ALA 348 Ca -0.11 -1.22 0.05 0.00 0.00 0.00 0.00 51.96 50.67 1h4i s ALA 348 Cb -0.04 -2.04 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 1h4i s ALA 348 CO 0.03 -2.13 0.35 -0.80 0.00 0.00 0.00 175.76 173.21 1h4i s ASN 349 N 1.09 6.30 0.25 0.00 0.01 -0.54 -4.67 114.94 117.39 1h4i s ASN 349 Ca 0.21 0.07 -0.30 0.00 -0.71 0.00 0.00 52.86 52.14 1h4i s ASN 349 Cb -0.11 -1.85 -0.09 0.00 0.41 0.00 0.00 41.25 39.61 1h4i s ASN 349 CO -0.05 -0.05 0.98 -0.54 -1.51 0.00 0.00 177.10 175.93 1h4i s LYS 350 N -3.88 4.80 0.34 -0.60 1.02 -1.26 0.17 119.74 120.33 1h4i s LYS 350 Ca 0.34 1.58 0.15 0.00 0.02 0.00 0.00 55.97 58.06 1h4i s LYS 350 Cb -0.09 -3.25 0.61 0.00 -0.52 0.00 0.00 37.83 34.58 1h4i s LYS 350 CO 0.29 0.43 1.73 -0.07 -0.92 0.00 0.00 175.35 176.81 1h4i h LEU 351 N 4.05 0.00 -7.15 3.17 3.38 -0.82 -3.45 115.31 114.48 1h4i h LEU 351 Ca -0.45 0.00 -0.08 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 41.74 1h4i h LEU 351 CO 0.68 0.45 -0.00 -0.62 0.09 0.00 0.00 178.44 179.03 1h4i s ASP 352 N -6.68 -0.57 0.29 -0.43 2.15 -1.26 -5.04 116.67 105.13 1h4i s ASP 352 Ca -0.01 0.91 0.20 0.00 0.43 0.00 0.00 52.55 54.08 1h4i s ASP 352 Cb 0.12 0.90 1.07 0.00 -0.30 0.00 0.00 42.92 44.72 1h4i s ASP 352 CO 0.72 -0.35 1.61 -0.90 -0.17 0.00 0.00 175.17 176.08 1h4i n ASP 353 N 2.06 0.52 -0.27 -0.34 5.68 -1.26 -2.28 116.55 120.66 1h4i n ASP 353 Ca -0.16 0.74 0.08 0.00 -0.50 0.00 0.00 54.79 54.95 1h4i n ASP 353 Cb 0.56 -0.81 0.38 0.00 -1.14 0.00 0.00 41.12 40.11 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 -2.19 0.12 -0.04 2.12 -2.24 -1.26 -4.63 114.28 106.15 1h4i n THR 354 Ca -0.01 -0.17 -0.05 0.00 -2.27 0.00 0.00 64.05 61.54 1h4i n THR 354 Cb 0.03 0.04 -0.04 0.00 -2.10 0.00 0.00 70.33 68.26 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 1.00 0.00 0.00 2.28 2.07 -1.73 -3.43 116.25 116.44 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 0.22 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.99 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 -3.69 0.00 0.11 0.57 0.23 -1.26 -3.66 115.26 107.56 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 0.13 -0.15 0.09 0.00 -2.08 0.00 0.00 39.78 37.77 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 1.50 -3.92 3.53 3.04 -1.87 -3.42 116.25 115.10 1h4i h VAL 357 Ca 0.00 -2.42 -0.54 0.00 -1.01 0.00 0.00 66.70 62.74 1h4i h VAL 357 Cb 0.00 2.30 -0.31 0.00 -2.01 0.00 0.00 31.29 31.27 1h4i h VAL 357 CO 0.00 0.69 -0.83 -0.36 -1.01 0.00 0.00 177.57 176.07 1h4i s PHE 358 N -3.41 1.57 0.20 3.17 2.99 -1.26 -1.91 117.98 119.33 1h4i s PHE 358 Ca -0.01 -0.43 -0.03 0.00 0.00 0.00 0.00 56.93 56.46 1h4i s PHE 358 Cb 0.12 -1.06 0.13 0.00 0.00 0.00 0.00 43.02 42.21 1h4i s PHE 358 CO 0.79 -0.14 1.53 0.87 -0.00 0.00 0.00 175.22 178.27 1h4i h LYS 359 N 6.22 0.60 0.00 0.44 1.57 0.23 -3.47 116.57 122.17 1h4i h LYS 359 Ca -0.33 -0.35 0.33 0.00 -1.87 0.00 0.00 60.65 58.43 1h4i h LYS 359 Cb 1.17 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.44 1h4i h LYS 359 CO 0.48 0.95 0.83 -1.13 -0.57 0.00 0.00 179.45 180.01 1h4i n SER 360 N -3.99 -0.90 -4.10 0.86 3.41 -1.24 -5.01 113.62 102.64 1h4i n SER 360 Ca -0.03 -1.08 -0.32 0.00 -0.26 0.00 0.00 58.87 57.18 1h4i n SER 360 Cb 0.57 1.37 -0.16 0.00 -0.26 0.00 0.00 64.21 65.73 1h4i n SER 360 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1h4i s VAL 361 N -2.01 1.99 -0.29 -3.33 1.01 -1.26 0.71 120.40 117.22 1h4i s VAL 361 Ca 0.27 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 1h4i s VAL 361 Cb -0.00 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.55 1h4i s VAL 361 CO -0.02 0.49 1.31 -0.62 0.00 0.00 0.00 175.10 176.26 1h4i s ASP 362 N 1.31 6.68 0.44 3.32 -1.08 -0.53 -4.91 116.67 121.90 1h4i s ASP 362 Ca 0.04 1.25 0.21 0.00 -0.52 0.00 0.00 52.55 53.54 1h4i s ASP 362 Cb -0.13 -2.54 1.01 0.00 -1.46 0.00 0.00 42.92 39.80 1h4i s ASP 362 CO -0.12 -1.06 1.89 -0.07 0.52 0.00 0.00 175.17 176.33 1h4i h LEU 363 N 10.82 0.00 0.10 -1.34 3.38 -1.93 0.56 115.31 126.90 1h4i h LEU 363 Ca -0.26 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.54 1h4i h LEU 363 Cb 1.10 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.87 1h4i h LEU 363 CO 1.03 0.25 -0.70 0.07 0.09 0.00 0.00 178.44 179.18 1h4i h LYS 364 N 0.00 0.31 0.00 1.13 5.09 -1.97 -3.33 116.57 117.80 1h4i h LYS 364 Ca -0.00 -0.46 -0.18 0.00 0.09 0.00 0.00 60.65 60.10 1h4i h LYS 364 Cb 0.61 0.16 -0.03 0.00 0.10 0.00 0.00 32.23 33.08 1h4i h LYS 364 CO 0.03 1.19 -1.08 1.79 -2.09 0.00 0.00 179.45 179.29 1h4i h THR 365 N -0.34 1.00 0.00 0.07 1.35 -1.98 -3.47 112.91 109.54 1h4i h THR 365 Ca -0.12 -2.57 0.00 0.00 -0.55 0.00 0.00 66.41 63.17 1h4i h THR 365 Cb 1.51 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 70.37 1h4i h THR 365 CO 0.13 0.57 0.00 0.61 -0.25 0.00 0.00 175.52 176.58 1h4i n GLY 366 N 1.36 0.84 3.72 5.82 0.00 0.19 -4.84 105.19 112.28 1h4i n GLY 366 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.10 4.33 0.04 1.61 -1.52 -1.19 -4.80 119.66 118.03 1h4i s GLN 367 Ca 0.00 0.40 -0.30 0.00 -1.95 0.00 0.00 55.36 53.50 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 0.16 1.14 -1.25 -0.25 0.00 0.00 175.29 175.09 1h4i s PRO 368 N 0.63 4.46 -0.54 2.91 0.04 -1.26 -1.45 135.00 139.78 1h4i s PRO 368 Ca 0.25 1.67 -0.28 0.00 0.04 0.00 0.00 61.00 62.67 1h4i s PRO 368 Cb -0.15 -3.39 0.03 0.00 0.04 0.00 0.00 34.50 31.03 1h4i s PRO 368 CO 0.09 -0.21 1.19 0.08 0.04 0.00 0.00 177.00 178.19 1h4i s VAL 369 N 1.10 4.07 0.44 -0.36 1.01 0.22 -4.94 120.40 121.93 1h4i s VAL 369 Ca 0.57 1.00 -0.22 0.00 0.00 0.00 0.00 61.98 63.33 1h4i s VAL 369 Cb -0.27 -4.67 -0.09 0.00 0.00 0.00 0.00 36.38 31.35 1h4i s VAL 369 CO 0.28 -1.22 1.05 -0.13 0.00 0.00 0.00 175.10 175.09 1h4i s ARG 370 N 4.82 3.99 -0.41 2.72 0.52 -1.26 0.88 118.95 130.21 1h4i s ARG 370 Ca 0.45 1.48 -0.09 0.00 -0.52 0.00 0.00 55.73 57.05 1h4i s ARG 370 Cb -0.07 -2.36 0.07 0.00 0.52 0.00 0.00 34.95 33.10 1h4i s ARG 370 CO 0.28 -0.28 0.24 0.34 0.02 0.00 0.00 175.30 175.89 1h4i s ASP 371 N -1.70 5.61 0.59 0.23 -1.08 -0.80 -4.63 116.67 114.89 1h4i s ASP 371 Ca 0.62 -1.42 0.29 0.00 -0.52 0.00 0.00 52.55 51.52 1h4i s ASP 371 Cb -0.20 -1.98 1.37 0.00 -1.46 0.00 0.00 42.92 40.65 1h4i s ASP 371 CO 0.25 -0.50 1.76 -0.65 0.52 0.00 0.00 175.17 176.55 1h4i h PRO 372 N 8.38 0.00 0.00 4.34 0.11 -1.94 -1.34 132.00 141.55 1h4i h PRO 372 Ca -0.23 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.86 1h4i h PRO 372 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1h4i h PRO 372 CO 0.73 0.00 -0.12 1.49 -0.21 0.00 0.00 178.00 179.89 1h4i h GLU 373 N 0.00 0.00 -0.32 1.05 4.81 -1.94 -3.06 114.58 115.12 1h4i h GLU 373 Ca 0.30 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1h4i h GLU 373 Cb 1.63 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.01 1h4i h GLU 373 CO -0.00 0.12 0.00 0.66 -0.73 0.00 0.00 179.01 179.05 1h4i n TYR 374 N -3.33 1.01 -2.57 0.92 4.02 -0.51 -4.86 117.16 111.85 1h4i n TYR 374 Ca -0.00 -0.80 -0.25 0.00 -0.01 0.00 0.00 57.90 56.84 1h4i n TYR 374 Cb 0.32 -0.29 0.03 0.00 -0.02 0.00 0.00 39.34 39.38 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 -1.65 1.62 0.23 2.72 0.00 -1.16 -4.92 107.32 104.16 1h4i s GLY 375 Ca 0.41 -0.89 0.09 0.00 0.00 0.00 0.00 44.72 44.33 1h4i s GLY 375 CO 0.11 -0.63 -0.01 -0.51 0.00 0.00 0.00 173.10 172.06 1h4i s THR 376 N -2.86 3.50 -0.14 0.90 -4.23 -1.26 -4.82 115.64 106.72 1h4i s THR 376 Ca 0.53 -1.74 -0.31 0.00 -1.18 0.00 0.00 61.69 59.00 1h4i s THR 376 Cb -0.10 -2.82 0.13 0.00 1.34 0.00 0.00 72.50 71.04 1h4i s THR 376 CO 0.42 -0.27 1.06 0.00 -0.54 0.00 0.00 174.62 175.30 1h4i s ARG 377 N -3.36 0.52 0.64 3.99 1.70 -1.26 -4.92 118.95 116.26 1h4i s ARG 377 Ca 0.29 -0.06 -0.18 0.00 -0.47 0.00 0.00 55.73 55.32 1h4i s ARG 377 Cb -0.08 0.24 -0.03 0.00 -0.57 0.00 0.00 34.95 34.52 1h4i s ARG 377 CO 0.19 -0.20 0.98 -0.12 -1.08 0.00 0.00 175.30 175.07 1h4i n MET 378 N 0.22 0.80 -3.13 3.89 0.00 -1.26 -2.95 117.12 114.68 1h4i n MET 378 Ca -0.06 0.32 -0.22 0.00 -0.00 0.00 0.00 57.70 57.74 1h4i n MET 378 Cb 0.59 -2.21 0.02 0.00 0.00 0.00 0.00 33.22 31.62 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 -1.11 -5.20 -3.67 6.12 10.43 -1.26 -4.96 116.55 116.90 1h4i n ASP 379 Ca 0.14 -0.31 -0.10 0.00 2.57 0.00 0.00 54.79 57.09 1h4i n ASP 379 Cb 0.48 -4.23 -0.09 0.00 1.84 0.00 0.00 41.12 39.13 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 -3.07 -0.81 -0.42 1.24 5.04 -1.15 -5.12 115.29 110.99 1h4i s HIS 380 Ca 0.33 1.70 -0.17 0.00 -1.54 0.00 0.00 55.06 55.39 1h4i s HIS 380 Cb -0.16 0.42 0.02 0.00 0.04 0.00 0.00 32.58 32.90 1h4i s HIS 380 CO 0.41 -0.42 0.41 -1.17 -2.34 0.00 0.00 174.74 171.63 1h4i s LEU 381 N 1.30 4.93 0.19 8.88 2.96 -1.26 -4.46 118.68 131.22 1h4i s LEU 381 Ca -0.08 -0.74 -0.22 0.00 -0.22 0.00 0.00 54.13 52.88 1h4i s LEU 381 Cb -0.06 -2.34 -0.08 0.00 0.50 0.00 0.00 46.19 44.21 1h4i s LEU 381 CO -0.13 -0.56 0.73 0.00 -1.32 0.00 0.00 176.35 175.06 1h4i s ALA 382 N 2.04 3.45 0.07 5.97 0.00 0.85 -4.90 121.76 129.23 1h4i s ALA 382 Ca 0.10 0.22 0.03 0.00 0.00 0.00 0.00 51.96 52.32 1h4i s ALA 382 Cb -0.18 -2.85 -0.03 0.00 0.00 0.00 0.00 23.12 20.06 1h4i s ALA 382 CO 0.13 0.32 -0.09 0.15 0.00 0.00 0.00 175.76 176.27 1h4i s LYS 383 N -1.57 0.71 -1.46 0.00 1.02 -1.26 -0.07 119.74 117.11 1h4i s LYS 383 Ca 0.39 -1.00 -0.09 0.00 0.02 0.00 0.00 55.97 55.29 1h4i s LYS 383 Cb -0.19 -0.41 0.04 0.00 -0.52 0.00 0.00 37.83 36.75 1h4i s LYS 383 CO 0.23 0.06 0.76 -0.25 -0.92 0.00 0.00 175.35 175.23 1h4i n ASP 384 N 0.91 -5.22 -4.67 2.83 8.00 -0.90 -4.94 116.55 112.56 1h4i n ASP 384 Ca -0.19 -0.48 -0.42 0.00 0.71 0.00 0.00 54.79 54.42 1h4i n ASP 384 Cb 0.57 -4.20 -0.03 0.00 -0.02 0.00 0.00 41.12 37.43 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 -3.17 4.81 -0.09 0.53 1.01 -0.46 -4.82 121.20 119.01 1h4i s ILE 385 Ca 0.47 1.84 0.04 0.00 0.00 0.00 0.00 60.65 63.00 1h4i s ILE 385 Cb -0.22 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 38.02 1h4i s ILE 385 CO 0.57 -0.02 -0.22 0.00 0.00 0.00 0.00 174.94 175.27 1h4i s PRO 387 N 0.37 2.10 0.96 0.00 0.02 -1.25 -3.06 135.00 134.13 1h4i s PRO 387 Ca -0.17 0.40 -0.16 0.00 0.02 0.00 0.00 61.00 61.09 1h4i s PRO 387 Cb -0.17 -1.94 0.20 0.00 0.02 0.00 0.00 34.50 32.60 1h4i s PRO 387 CO 0.08 -1.56 1.30 -1.54 -0.33 0.00 0.00 177.00 174.95 1h4i s SER 388 N -4.21 3.09 0.64 2.53 1.04 -0.09 -4.71 113.70 111.98 1h4i s SER 388 Ca 0.61 0.34 0.36 0.00 0.48 0.00 0.00 55.95 57.74 1h4i s SER 388 Cb -0.13 -0.43 2.03 0.00 0.10 0.00 0.00 66.02 67.60 1h4i s SER 388 CO 0.52 -2.75 2.23 0.00 0.98 0.00 0.00 173.24 174.22 1h4i h ALA 389 N -1.66 1.33 0.00 5.32 0.00 -1.85 0.61 119.26 123.02 1h4i h ALA 389 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1h4i h ALA 389 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1h4i h ALA 389 CO 0.40 -0.11 0.00 -1.33 0.00 0.00 0.00 179.25 178.21 1h4i n MET 390 N -3.37 0.06 -0.57 0.00 2.81 -1.26 -4.64 117.12 110.15 1h4i n MET 390 Ca -0.02 0.15 0.07 0.00 -1.81 0.00 0.00 57.70 56.09 1h4i n MET 390 Cb 0.17 -1.59 -0.03 0.00 -0.71 0.00 0.00 33.22 31.06 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 0.90 -2.09 0.45 3.03 0.00 0.21 -4.33 105.19 103.36 1h4i n GLY 391 Ca 0.05 -1.35 0.13 0.00 0.00 0.00 0.00 46.02 44.85 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 -3.04 0.05 -3.63 1.61 0.53 -0.96 -4.60 117.16 107.12 1h4i n TYR 392 Ca -0.01 -0.03 -0.12 0.00 -1.02 0.00 0.00 57.90 56.73 1h4i n TYR 392 Cb 0.27 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 -1.95 -0.80 0.00 -0.72 2.46 -1.26 -1.13 115.29 111.89 1h4i s HIS 393 Ca 0.37 1.85 0.00 0.00 0.47 0.00 0.00 55.06 57.75 1h4i s HIS 393 Cb 0.20 0.36 0.00 0.00 -0.13 0.00 0.00 32.58 33.01 1h4i s HIS 393 CO 0.32 -0.39 0.00 -1.71 -2.47 0.00 0.00 174.74 170.49 1h4i n ASN 394 N 2.99 0.37 0.10 9.88 2.85 -1.26 -3.70 115.26 126.49 1h4i n ASN 394 Ca -0.15 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.35 1h4i n ASN 394 Cb 0.56 0.00 0.18 0.00 1.24 0.00 0.00 39.78 41.76 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 0.05 -1.70 1.20 0.00 -1.26 -4.74 117.38 110.92 1h4i n GLN 395 Ca 0.00 0.44 -0.43 0.00 -0.00 0.00 0.00 57.00 57.00 1h4i n GLN 395 Cb 0.00 -1.99 -0.02 0.00 0.00 0.00 0.00 30.24 28.23 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 1.04 3.47 1.69 0.00 -1.26 -4.82 105.19 104.04 1h4i n GLY 396 Ca -0.00 0.48 -0.43 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.01 2.98 0.00 1.61 2.46 -1.23 -4.58 115.29 116.52 1h4i s HIS 397 Ca 0.66 -0.39 0.00 0.00 0.47 0.00 0.00 55.06 55.81 1h4i s HIS 397 Cb -0.58 -3.67 0.00 0.00 -0.13 0.00 0.00 32.58 28.20 1h4i s HIS 397 CO 0.49 -1.11 0.00 -0.25 -2.47 0.00 0.00 174.74 171.40 1h4i n ASP 398 N 6.52 -0.22 -4.22 9.88 8.00 -1.26 -1.39 116.55 133.85 1h4i n ASP 398 Ca -0.04 -0.87 -0.13 0.00 0.71 0.00 0.00 54.79 54.46 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 -1.11 0.55 -0.07 -2.24 1.04 -1.14 -4.54 113.70 106.18 1h4i s SER 399 Ca 0.00 -1.33 -0.03 0.00 0.48 0.00 0.00 55.95 55.07 1h4i s SER 399 Cb 0.00 0.28 0.04 0.00 0.10 0.00 0.00 66.02 66.44 1h4i s SER 399 CO 0.00 -0.76 0.16 -0.47 0.98 0.00 0.00 173.24 173.15 1h4i s TYR 400 N -3.99 -0.18 -0.42 5.02 6.14 -0.55 -1.68 117.35 121.69 1h4i s TYR 400 Ca 0.34 0.53 -0.18 0.00 0.64 0.00 0.00 57.07 58.40 1h4i s TYR 400 Cb 0.07 -0.08 0.02 0.00 0.42 0.00 0.00 41.96 42.39 1h4i s TYR 400 CO 0.10 -0.18 0.45 0.34 0.64 0.00 0.00 175.55 176.90 1h4i s ASP 401 N 1.25 6.21 0.25 4.32 -1.08 -0.28 -4.59 116.67 122.75 1h4i s ASP 401 Ca -0.09 -0.63 -0.04 0.00 -0.52 0.00 0.00 52.55 51.28 1h4i s ASP 401 Cb -0.11 -2.23 0.29 0.00 -1.46 0.00 0.00 42.92 39.41 1h4i s ASP 401 CO -0.06 -0.59 1.81 -0.65 0.52 0.00 0.00 175.17 176.20 1h4i h PRO 402 N 8.73 1.01 -0.42 4.34 0.11 -1.96 0.71 132.00 144.51 1h4i h PRO 402 Ca -0.26 -0.19 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 1h4i h PRO 402 Cb 1.11 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1h4i h PRO 402 CO 0.80 0.85 -0.06 -0.22 -0.21 0.00 0.00 178.00 179.16 1h4i h LYS 403 N 0.98 0.78 0.00 1.05 3.64 -1.98 -3.17 116.57 117.87 1h4i h LYS 403 Ca 0.22 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1h4i h LYS 403 Cb 0.24 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1h4i h LYS 403 CO -0.01 0.88 -0.63 0.00 -2.27 0.00 0.00 179.45 177.42 1h4i h ARG 404 N 0.60 0.00 -6.04 1.90 3.08 -1.93 -3.48 114.38 108.51 1h4i h ARG 404 Ca 0.11 0.00 -0.43 0.00 0.07 0.00 0.00 59.98 59.73 1h4i h ARG 404 Cb 0.57 0.00 0.06 0.00 0.08 0.00 0.00 29.97 30.68 1h4i h ARG 404 CO 0.03 0.00 -0.73 0.39 -1.07 0.00 0.00 179.97 178.59 1h4i n GLU 405 N -2.17 -6.67 -5.02 0.04 1.02 0.24 -4.99 120.64 103.09 1h4i n GLU 405 Ca 0.03 0.72 -0.28 0.00 -0.02 0.00 0.00 57.16 57.61 1h4i n GLU 405 Cb 0.45 -5.67 -0.16 0.00 -0.02 0.00 0.00 31.44 26.04 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 -7.19 2.01 -0.17 -4.62 2.96 -1.02 -4.55 118.68 106.10 1h4i s LEU 406 Ca 0.54 -0.40 -0.10 0.00 -0.22 0.00 0.00 54.13 53.96 1h4i s LEU 406 Cb -0.25 -1.10 -0.05 0.00 0.50 0.00 0.00 46.19 45.29 1h4i s LEU 406 CO 0.78 0.23 0.16 -0.36 -1.32 0.00 0.00 176.35 175.83 1h4i s PHE 407 N -0.28 3.48 -0.38 5.38 0.40 0.45 -1.13 117.98 125.92 1h4i s PHE 407 Ca 0.03 0.44 -0.08 0.00 -0.60 0.00 0.00 56.93 56.72 1h4i s PHE 407 Cb -0.10 -2.11 0.06 0.00 0.51 0.00 0.00 43.02 41.37 1h4i s PHE 407 CO 0.01 0.43 0.18 -0.06 0.70 0.00 0.00 175.22 176.48 1h4i s PHE 408 N -0.10 3.30 -0.09 0.36 0.40 -0.68 0.10 117.98 121.27 1h4i s PHE 408 Ca 0.12 -1.47 0.01 0.00 -0.60 0.00 0.00 56.93 54.98 1h4i s PHE 408 Cb -0.12 -2.60 -0.02 0.00 0.51 0.00 0.00 43.02 40.79 1h4i s PHE 408 CO 0.01 -0.78 -0.11 -1.64 0.70 0.00 0.00 175.22 173.40 1h4i s MET 409 N 1.41 2.99 -0.44 0.44 -1.94 -0.45 -2.89 119.30 118.42 1h4i s MET 409 Ca 0.01 -0.63 -0.23 0.00 -1.71 0.00 0.00 55.69 53.12 1h4i s MET 409 Cb -0.21 -2.58 0.02 0.00 2.01 0.00 0.00 34.83 34.08 1h4i s MET 409 CO 0.03 0.46 0.80 0.20 -0.01 0.00 0.00 175.02 176.49 1h4i s GLY 410 N -0.28 1.59 0.16 -0.03 0.00 -1.26 -2.19 107.32 105.32 1h4i s GLY 410 Ca 0.03 -0.92 0.05 0.00 0.00 0.00 0.00 44.72 43.88 1h4i s GLY 410 CO 0.03 1.81 0.12 -0.42 0.00 0.00 0.00 173.10 174.63 1h4i s ILE 411 N 3.31 4.41 -0.03 0.90 1.01 0.39 -4.71 121.20 126.48 1h4i s ILE 411 Ca 0.31 -1.10 0.02 0.00 0.00 0.00 0.00 60.65 59.87 1h4i s ILE 411 Cb -0.12 -3.24 -0.03 0.00 0.01 0.00 0.00 42.46 39.07 1h4i s ILE 411 CO 0.22 -0.10 -0.05 0.20 0.00 0.00 0.00 174.94 175.21 1h4i s ASN 412 N -3.06 4.76 -0.63 3.58 0.02 -0.29 -1.97 114.94 117.36 1h4i s ASN 412 Ca 0.30 -0.05 0.05 0.00 -1.02 0.00 0.00 52.86 52.14 1h4i s ASN 412 Cb -0.10 -1.18 0.20 0.00 0.02 0.00 0.00 41.25 40.18 1h4i s ASN 412 CO 0.23 0.32 0.54 1.57 0.02 0.00 0.00 177.10 179.78 1h4i n HIS 413 N 1.82 2.54 -4.06 2.20 -0.00 0.19 -4.48 115.22 113.43 1h4i n HIS 413 Ca -0.16 -4.09 -0.17 0.00 0.46 0.00 0.00 57.72 53.76 1h4i n HIS 413 Cb 0.53 -0.47 -0.15 0.00 -0.12 0.00 0.00 29.99 29.78 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 -1.50 0.33 0.52 3.57 1.01 -1.26 -0.91 121.20 122.95 1h4i s ILE 414 Ca 0.31 -0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.88 1h4i s ILE 414 Cb 0.03 -0.34 -0.01 0.00 0.01 0.00 0.00 42.46 42.15 1h4i s ILE 414 CO -0.13 0.14 0.00 0.00 0.00 0.00 0.00 174.94 174.95 1h4i s MET 416 N -3.89 1.55 0.11 0.00 0.23 -0.13 -1.88 119.30 115.28 1h4i s MET 416 Ca 0.03 -0.89 0.07 0.00 -1.03 0.00 0.00 55.69 53.87 1h4i s MET 416 Cb 0.01 0.56 -0.04 0.00 -1.53 0.00 0.00 34.83 33.83 1h4i s MET 416 CO 0.02 -0.68 -0.08 -0.51 -2.03 0.00 0.00 175.02 171.74 1h4i s ASP 417 N -2.89 4.52 -0.20 -1.18 1.01 -0.00 -1.35 116.67 116.58 1h4i s ASP 417 Ca 0.10 -0.36 -0.14 0.00 0.71 0.00 0.00 52.55 52.86 1h4i s ASP 417 Cb -0.03 -0.90 0.06 0.00 1.01 0.00 0.00 42.92 43.06 1h4i s ASP 417 CO 0.01 0.17 0.50 0.86 0.21 0.00 0.00 175.17 176.91 1h4i s TRP 418 N -1.27 -0.67 -0.05 4.23 -0.11 0.90 -2.36 118.94 119.61 1h4i s TRP 418 Ca 0.23 1.47 -0.02 0.00 1.22 0.00 0.00 56.10 59.00 1h4i s TRP 418 Cb -0.11 0.31 0.04 0.00 -1.50 0.00 0.00 33.47 32.20 1h4i s TRP 418 CO 0.15 -0.35 0.10 -2.00 -4.62 0.00 0.00 176.95 170.23 1h4i s GLU 419 N 1.01 0.01 0.53 5.86 2.12 -0.83 -0.11 118.70 127.29 1h4i s GLU 419 Ca -0.06 0.34 -0.01 0.00 0.36 0.00 0.00 54.97 55.59 1h4i s GLU 419 Cb -0.06 -0.26 0.01 0.00 0.26 0.00 0.00 34.13 34.08 1h4i s GLU 419 CO -0.09 -0.21 0.78 -1.25 -0.54 0.00 0.00 175.26 173.95 1h4i s PRO 420 N 1.44 2.85 0.03 4.30 0.04 -1.26 -0.37 135.00 142.02 1h4i s PRO 420 Ca -0.05 -0.42 -0.12 0.00 0.04 0.00 0.00 61.00 60.44 1h4i s PRO 420 Cb -0.12 -2.44 0.01 0.00 0.04 0.00 0.00 34.50 31.99 1h4i s PRO 420 CO -0.05 -0.55 0.26 -0.59 0.04 0.00 0.00 177.00 176.12 1h4i s PHE 421 N -2.76 -0.07 0.39 0.56 -0.12 -0.08 -4.60 117.98 111.30 1h4i s PHE 421 Ca 0.53 -0.03 -0.24 0.00 -0.05 0.00 0.00 56.93 57.14 1h4i s PHE 421 Cb -0.10 0.05 -0.09 0.00 -0.63 0.00 0.00 43.02 42.24 1h4i s PHE 421 CO 0.40 -0.44 1.01 -1.64 -0.05 0.00 0.00 175.22 174.50 1h4i s MET 422 N -2.16 4.25 -0.07 1.99 -1.94 -1.26 -4.60 119.30 115.49 1h4i s MET 422 Ca -0.08 1.40 -0.31 0.00 -1.71 0.00 0.00 55.69 55.00 1h4i s MET 422 Cb -0.02 -2.52 0.08 0.00 2.01 0.00 0.00 34.83 34.38 1h4i s MET 422 CO -0.01 -0.05 0.75 -0.48 -0.01 0.00 0.00 175.02 175.22 1h4i s LEU 423 N -2.64 -0.59 0.60 -0.03 -0.00 -1.26 -5.03 118.68 109.72 1h4i s LEU 423 Ca 0.57 0.65 -0.07 0.00 -0.00 0.00 0.00 54.13 55.28 1h4i s LEU 423 Cb -0.19 2.38 0.00 0.00 -0.00 0.00 0.00 46.19 48.39 1h4i s LEU 423 CO 0.24 -0.55 0.93 -2.84 -0.00 0.00 0.00 176.35 174.13 1h4i s PRO 424 N -1.18 3.03 -0.19 1.48 0.02 -1.26 -5.06 135.00 131.84 1h4i s PRO 424 Ca -0.09 0.16 -0.08 0.00 0.02 0.00 0.00 61.00 61.01 1h4i s PRO 424 Cb -0.00 -2.23 -0.04 0.00 0.02 0.00 0.00 34.50 32.25 1h4i s PRO 424 CO 0.08 -0.69 0.07 -0.47 -0.33 0.00 0.00 177.00 175.66 1h4i s TYR 425 N -3.04 3.24 -0.08 6.54 6.14 -1.26 -4.92 117.35 123.97 1h4i s TYR 425 Ca 0.54 0.04 -0.02 0.00 0.64 0.00 0.00 57.07 58.27 1h4i s TYR 425 Cb -0.11 -2.10 0.03 0.00 0.42 0.00 0.00 41.96 40.21 1h4i s TYR 425 CO 0.47 0.11 0.03 1.03 0.64 0.00 0.00 175.55 177.83 1h4i s ARG 426 N 0.52 0.35 0.05 4.97 3.00 -1.26 -5.10 118.95 121.48 1h4i s ARG 426 Ca 0.03 0.12 -0.36 0.00 0.00 0.00 0.00 55.73 55.52 1h4i s ARG 426 Cb -0.13 -1.03 -0.15 0.00 0.00 0.00 0.00 34.95 33.64 1h4i s ARG 426 CO 0.01 -0.38 1.49 0.00 0.00 0.00 0.00 175.30 176.42 1h4i n ALA 427 N 5.20 -0.12 0.00 2.13 0.00 -1.26 -1.01 120.51 125.45 1h4i n ALA 427 Ca -0.06 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1h4i n ALA 427 Cb 0.50 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.75 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 3.08 3.37 3.94 0.00 0.00 -1.24 -4.87 105.19 109.47 1h4i n GLY 428 Ca 0.19 0.00 -0.26 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 3.49 0.60 1.61 -0.21 -0.18 -4.68 119.66 119.54 1h4i s GLN 429 Ca 0.00 -0.44 -0.19 0.00 0.02 0.00 0.00 55.36 54.75 1h4i s GLN 429 Cb 0.00 -2.86 -0.03 0.00 1.00 0.00 0.00 33.01 31.12 1h4i s GLN 429 CO 0.00 0.41 1.23 -0.06 -2.12 0.00 0.00 175.29 174.76 1h4i s PHE 430 N -1.88 2.32 -0.39 0.91 0.08 -1.26 -4.67 117.98 113.08 1h4i s PHE 430 Ca 0.37 1.50 0.10 0.00 0.12 0.00 0.00 56.93 59.02 1h4i s PHE 430 Cb -0.11 -3.55 0.29 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 -1.61 -0.36 -0.06 0.36 7.35 0.43 -4.83 117.46 118.73 1h4i n PHE 431 Ca 0.14 -3.54 -0.05 0.00 -0.76 0.00 0.00 57.45 53.24 1h4i n PHE 431 Cb 0.49 -0.22 -0.02 0.00 0.35 0.00 0.00 39.48 40.08 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 0.90 1.01 -1.99 -2.13 0.31 -1.25 -4.21 118.33 110.96 1h4i n VAL 432 Ca 0.22 0.27 -0.08 0.00 -0.01 0.00 0.00 64.34 64.74 1h4i n VAL 432 Cb 0.60 -2.10 -0.01 0.00 -0.91 0.00 0.00 33.84 31.42 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 1.55 0.20 3.17 2.92 0.00 -1.26 -0.54 105.19 111.23 1h4i n GLY 433 Ca -0.08 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.38 -0.63 -0.14 4.61 0.00 -1.26 -0.90 121.76 121.06 1h4i s ALA 434 Ca 0.00 0.46 0.02 0.00 0.00 0.00 0.00 51.96 52.44 1h4i s ALA 434 Cb 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.94 1h4i s ALA 434 CO 0.00 -0.18 -0.19 -0.08 0.00 0.00 0.00 175.76 175.31 1h4i s THR 435 N -0.57 2.34 0.30 0.00 -1.32 0.50 -4.96 115.64 111.92 1h4i s THR 435 Ca -0.07 -0.89 0.11 0.00 -1.21 0.00 0.00 61.69 59.63 1h4i s THR 435 Cb -0.04 -1.95 -0.05 0.00 -1.51 0.00 0.00 72.50 68.94 1h4i s THR 435 CO 0.02 0.54 -0.15 -0.76 -2.21 0.00 0.00 174.62 172.05 1h4i s LEU 436 N 0.75 2.68 -0.07 9.08 1.02 -1.26 -1.97 118.68 128.91 1h4i s LEU 436 Ca -0.08 -1.07 -0.03 0.00 0.02 0.00 0.00 54.13 52.98 1h4i s LEU 436 Cb -0.16 -1.10 0.04 0.00 0.02 0.00 0.00 46.19 44.99 1h4i s LEU 436 CO 0.00 -0.05 0.08 0.21 0.02 0.00 0.00 176.35 176.61 1h4i s ASN 437 N -3.56 1.37 0.15 2.29 2.47 -1.00 -4.42 114.94 112.25 1h4i s ASN 437 Ca 0.31 -0.05 0.09 0.00 0.42 0.00 0.00 52.86 53.63 1h4i s ASN 437 Cb -0.03 -0.12 -0.04 0.00 -1.45 0.00 0.00 41.25 39.61 1h4i s ASN 437 CO 0.16 -0.27 -0.14 -0.04 -3.72 0.00 0.00 177.10 173.08 1h4i s MET 438 N 2.17 1.90 0.28 0.43 -1.94 -1.25 -0.82 119.30 120.07 1h4i s MET 438 Ca 0.04 -1.25 -0.21 0.00 -1.71 0.00 0.00 55.69 52.56 1h4i s MET 438 Cb -0.13 -2.11 0.02 0.00 2.01 0.00 0.00 34.83 34.62 1h4i s MET 438 CO -0.05 0.45 0.72 1.52 -0.01 0.00 0.00 175.02 177.66 1h4i s TYR 439 N -1.47 -0.18 0.60 -0.03 1.13 -0.79 -3.29 117.35 113.32 1h4i s TYR 439 Ca 0.22 -0.28 -0.19 0.00 -1.41 0.00 0.00 57.07 55.40 1h4i s TYR 439 Cb -0.09 0.71 -0.03 0.00 -1.10 0.00 0.00 41.96 41.45 1h4i s TYR 439 CO 0.13 -1.25 1.21 -2.30 -2.51 0.00 0.00 175.55 170.83 1h4i n PRO 440 N -0.46 1.21 -1.45 -3.49 -0.02 -1.26 -1.08 135.00 128.45 1h4i n PRO 440 Ca -0.04 0.46 -0.30 0.00 -2.02 0.00 0.00 63.50 61.60 1h4i n PRO 440 Cb 0.59 -2.43 0.22 0.00 -0.02 0.00 0.00 33.50 31.86 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 -1.20 1.67 0.56 -1.23 0.00 -0.09 -4.46 107.32 102.57 1h4i s GLY 441 Ca 0.77 -1.08 0.31 0.00 0.00 0.00 0.00 44.72 44.72 1h4i s GLY 441 CO 0.45 -0.23 1.86 -2.55 0.00 0.00 0.00 173.10 172.62 1h4i h PRO 442 N -2.20 0.00 -0.01 2.90 0.11 -1.95 -0.47 132.00 130.39 1h4i h PRO 442 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 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 0.35 0.00 -0.32 1.63 -0.21 0.00 0.00 178.00 179.45 1h4i n LYS 443 N -3.97 0.82 -1.69 1.05 5.02 -1.26 -4.93 118.16 113.19 1h4i n LYS 443 Ca 0.15 -0.52 -0.06 0.00 -2.02 0.00 0.00 58.31 55.85 1h4i n LYS 443 Cb 0.89 -1.49 0.02 0.00 -0.02 0.00 0.00 35.03 34.43 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 1.36 2.05 3.35 0.72 0.00 -0.19 -5.02 105.19 107.47 1h4i n GLY 444 Ca 0.11 -2.17 -0.45 0.00 0.00 0.00 0.00 46.02 43.52 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 -2.13 6.15 0.16 1.61 -1.08 0.21 -4.88 116.67 116.71 1h4i s ASP 445 Ca 0.18 -1.53 0.25 0.00 -0.52 0.00 0.00 52.55 50.93 1h4i s ASP 445 Cb -0.01 -2.19 0.92 0.00 -1.46 0.00 0.00 42.92 40.17 1h4i s ASP 445 CO 0.12 -0.73 1.76 -1.14 0.52 0.00 0.00 175.17 175.69 1h4i n ARG 446 N 5.21 0.17 -0.03 4.34 0.63 -1.26 -0.85 116.66 124.88 1h4i n ARG 446 Ca -0.13 0.23 -0.21 0.00 -0.92 0.00 0.00 57.85 56.81 1h4i n ARG 446 Cb 0.42 -1.74 -0.13 0.00 0.45 0.00 0.00 32.46 31.46 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 -2.04 0.72 0.00 -0.14 3.00 -1.26 -4.19 117.38 113.46 1h4i n GLN 447 Ca 0.05 0.30 0.13 0.00 -0.01 0.00 0.00 57.00 57.47 1h4i n GLN 447 Cb 0.34 -1.69 0.31 0.00 0.00 0.00 0.00 30.24 29.20 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 -3.64 0.93 -3.61 1.08 5.15 -1.22 -4.98 115.26 108.97 1h4i n ASN 448 Ca -0.34 -0.75 -0.20 0.00 -0.60 0.00 0.00 54.58 52.69 1h4i n ASN 448 Cb 0.98 0.21 0.05 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 -0.88 -2.05 -4.20 1.20 4.02 -0.03 -4.93 117.16 110.30 1h4i n TYR 449 Ca 0.10 0.88 -0.12 0.00 -0.01 0.00 0.00 57.90 58.75 1h4i n TYR 449 Cb 0.35 -4.63 -0.10 0.00 -0.02 0.00 0.00 39.34 34.94 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 -5.81 1.03 0.00 -0.72 2.02 -1.10 -4.67 118.70 109.46 1h4i s GLU 450 Ca 0.05 -1.50 0.00 0.00 0.02 0.00 0.00 54.97 53.54 1h4i s GLU 450 Cb -0.02 -0.02 0.00 0.00 0.10 0.00 0.00 34.13 34.19 1h4i s GLU 450 CO 0.78 -0.20 0.00 0.41 0.02 0.00 0.00 175.26 176.27 1h4i n GLY 451 N -0.18 0.48 1.21 -1.39 0.00 0.70 -0.62 105.19 105.40 1h4i n GLY 451 Ca -0.06 -0.36 0.12 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.76 3.61 -4.15 0.99 7.99 0.22 -4.10 117.00 120.82 1h4i n LEU 452 Ca 0.00 -1.64 -0.14 0.00 -0.01 0.00 0.00 56.01 54.22 1h4i n LEU 452 Cb 0.37 -0.32 -0.07 0.00 -0.11 0.00 0.00 43.42 43.29 1h4i n LEU 452 CO 0.00 0.82 -0.03 -0.83 -1.51 0.00 0.00 177.39 175.84 1h4i s GLY 453 N -1.35 1.45 0.08 -0.72 0.00 -1.02 -0.64 107.32 105.12 1h4i s GLY 453 Ca 0.42 -1.56 -0.21 0.00 0.00 0.00 0.00 44.72 43.37 1h4i s GLY 453 CO 0.32 -1.15 0.50 1.20 0.00 0.00 0.00 173.10 173.97 1h4i s GLN 454 N -3.69 1.07 -0.06 2.90 -0.21 -0.83 -1.31 119.66 117.52 1h4i s GLN 454 Ca 0.34 -0.39 -0.00 0.00 0.02 0.00 0.00 55.36 55.33 1h4i s GLN 454 Cb 0.03 0.48 0.02 0.00 1.00 0.00 0.00 33.01 34.54 1h4i s GLN 454 CO 0.17 -0.41 -0.03 -1.50 -2.12 0.00 0.00 175.29 171.40 1h4i s ILE 455 N -2.94 0.52 0.08 1.08 2.07 0.03 -0.46 121.20 121.58 1h4i s ILE 455 Ca -0.02 -0.04 0.04 0.00 -1.41 0.00 0.00 60.65 59.21 1h4i s ILE 455 Cb -0.00 -0.60 -0.03 0.00 0.13 0.00 0.00 42.46 41.96 1h4i s ILE 455 CO -0.06 0.25 -0.11 -0.54 -1.91 0.00 0.00 174.94 172.58 1h4i s LYS 456 N 1.39 0.79 -0.22 3.50 1.02 -0.93 -1.15 119.74 124.15 1h4i s LYS 456 Ca -0.03 -1.06 -0.07 0.00 0.02 0.00 0.00 55.97 54.83 1h4i s LYS 456 Cb -0.13 -0.55 -0.03 0.00 -0.52 0.00 0.00 37.83 36.59 1h4i s LYS 456 CO -0.03 0.10 0.05 0.00 -0.92 0.00 0.00 175.35 174.55 1h4i s ALA 457 N -2.06 3.18 0.01 5.17 0.00 -0.50 -1.33 121.76 126.21 1h4i s ALA 457 Ca 0.02 -1.00 0.06 0.00 0.00 0.00 0.00 51.96 51.03 1h4i s ALA 457 Cb -0.05 -1.96 -0.02 0.00 0.00 0.00 0.00 23.12 21.09 1h4i s ALA 457 CO 0.00 -0.24 -0.17 -0.47 0.00 0.00 0.00 175.76 174.88 1h4i s TYR 458 N 1.16 1.54 -0.23 0.00 5.04 0.12 -0.56 117.35 124.41 1h4i s TYR 458 Ca 0.04 -0.31 -0.06 0.00 -2.44 0.00 0.00 57.07 54.30 1h4i s TYR 458 Cb -0.14 -0.96 -0.02 0.00 0.35 0.00 0.00 41.96 41.18 1h4i s TYR 458 CO 0.03 0.01 0.03 1.21 -1.34 0.00 0.00 175.55 175.48 1h4i s ASN 459 N -0.66 4.90 0.37 4.32 3.84 -0.30 -0.41 114.94 126.99 1h4i s ASN 459 Ca 0.06 -0.23 0.15 0.00 0.21 0.00 0.00 52.86 53.05 1h4i s ASN 459 Cb -0.07 -1.86 0.71 0.00 -0.55 0.00 0.00 41.25 39.48 1h4i s ASN 459 CO 0.00 0.01 1.79 0.00 -2.79 0.00 0.00 177.10 176.11 1h4i h ALA 460 N 7.92 1.23 0.07 1.71 0.00 -1.88 0.16 119.26 128.46 1h4i h ALA 460 Ca -0.38 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.01 1h4i h ALA 460 Cb 1.17 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1h4i h ALA 460 CO 0.60 0.50 -0.78 0.82 0.00 0.00 0.00 179.25 180.38 1h4i h ILE 461 N 0.00 1.38 0.00 0.00 1.08 -1.94 -3.36 117.51 114.67 1h4i h ILE 461 Ca -0.00 -2.38 -0.12 0.00 -0.39 0.00 0.00 64.86 61.96 1h4i h ILE 461 Cb 0.76 2.98 -0.02 0.00 -3.07 0.00 0.00 36.82 37.46 1h4i h ILE 461 CO 0.05 0.61 -0.61 0.74 -0.69 0.00 0.00 178.15 178.25 1h4i h THR 462 N -0.66 0.96 -0.03 -0.27 2.02 -1.98 -3.47 112.91 109.48 1h4i h THR 462 Ca -0.17 -2.36 -0.01 0.00 0.77 0.00 0.00 66.41 64.63 1h4i h THR 462 Cb 1.41 2.46 -0.00 0.00 -1.74 0.00 0.00 68.15 70.28 1h4i h THR 462 CO 0.02 0.54 -0.01 0.61 0.37 0.00 0.00 175.52 177.05 1h4i n GLY 463 N 1.25 0.45 3.84 2.16 0.00 0.57 -5.02 105.19 108.44 1h4i n GLY 463 Ca 0.01 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.15 6.84 -0.39 1.61 2.15 -1.21 -4.84 116.67 118.67 1h4i s ASP 464 Ca 0.00 1.07 -0.13 0.00 0.43 0.00 0.00 52.55 53.92 1h4i s ASP 464 Cb 0.00 -2.29 0.02 0.00 -0.30 0.00 0.00 42.92 40.35 1h4i s ASP 464 CO 0.00 0.14 0.26 -0.31 -0.17 0.00 0.00 175.17 175.09 1h4i s TYR 465 N -1.39 3.24 0.38 -5.34 1.51 -1.26 -1.15 117.35 113.34 1h4i s TYR 465 Ca 0.35 -0.71 0.06 0.00 -1.01 0.00 0.00 57.07 55.76 1h4i s TYR 465 Cb -0.16 -2.52 0.78 0.00 -0.11 0.00 0.00 41.96 39.96 1h4i s TYR 465 CO 0.19 -0.60 2.01 -0.22 -1.11 0.00 0.00 175.55 175.82 1h4i h LYS 466 N 8.54 0.66 -1.96 -0.62 1.63 -1.21 -3.45 116.57 120.17 1h4i h LYS 466 Ca -0.27 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.50 1h4i h LYS 466 Cb 1.12 -0.15 -0.19 0.00 -0.60 0.00 0.00 32.23 32.40 1h4i h LYS 466 CO 0.70 0.44 0.33 1.67 -3.45 0.00 0.00 179.45 179.14 1h4i s TRP 467 N -5.60 -0.53 -0.00 1.91 1.48 -1.25 -4.98 118.94 109.97 1h4i s TRP 467 Ca -0.09 0.83 0.01 0.00 -1.06 0.00 0.00 56.10 55.79 1h4i s TRP 467 Cb 0.18 0.45 -0.00 0.00 -1.16 0.00 0.00 33.47 32.94 1h4i s TRP 467 CO 0.75 -0.53 -0.02 -1.21 -4.06 0.00 0.00 176.95 171.88 1h4i s GLU 468 N -1.52 0.19 -0.01 3.25 2.02 -1.26 -1.42 118.70 119.96 1h4i s GLU 468 Ca -0.06 -0.08 0.00 0.00 0.02 0.00 0.00 54.97 54.86 1h4i s GLU 468 Cb -0.00 -0.20 0.01 0.00 0.10 0.00 0.00 34.13 34.04 1h4i s GLU 468 CO 0.04 0.04 0.01 0.15 0.02 0.00 0.00 175.26 175.52 1h4i s LYS 469 N -0.00 0.02 0.52 1.61 -0.14 -0.30 -4.99 119.74 116.44 1h4i s LYS 469 Ca 0.00 0.05 -0.17 0.00 -1.36 0.00 0.00 55.97 54.49 1h4i s LYS 469 Cb -0.01 -0.10 -0.08 0.00 -1.68 0.00 0.00 37.83 35.96 1h4i s LYS 469 CO -0.00 -0.05 0.99 -1.64 -0.76 0.00 0.00 175.35 173.89 1h4i s MET 470 N 0.32 3.93 0.04 1.68 -1.94 -1.26 -0.79 119.30 121.27 1h4i s MET 470 Ca -0.03 0.97 0.02 0.00 -1.71 0.00 0.00 55.69 54.94 1h4i s MET 470 Cb -0.04 -2.13 -0.02 0.00 2.01 0.00 0.00 34.83 34.65 1h4i s MET 470 CO -0.01 -0.28 -0.07 -1.21 -0.01 0.00 0.00 175.02 173.43 1h4i s GLU 471 N -4.05 0.51 0.18 2.03 0.41 -0.43 -4.86 118.70 112.49 1h4i s GLU 471 Ca 0.59 -0.68 -0.14 0.00 -0.41 0.00 0.00 54.97 54.33 1h4i s GLU 471 Cb -0.10 -0.31 0.16 0.00 -1.78 0.00 0.00 34.13 32.10 1h4i s GLU 471 CO 0.31 0.06 1.73 -0.09 -0.49 0.00 0.00 175.26 176.78 1h4i h ARG 472 N 4.70 0.25 -5.62 1.61 2.43 -1.94 -2.70 114.38 113.11 1h4i h ARG 472 Ca -0.35 -0.02 -0.59 0.00 -0.81 0.00 0.00 59.98 58.22 1h4i h ARG 472 Cb 1.20 -0.06 -0.13 0.00 -0.42 0.00 0.00 29.97 30.56 1h4i h ARG 472 CO 0.42 0.17 -0.62 -0.06 -1.51 0.00 0.00 179.97 178.36 1h4i s PHE 473 N -6.14 2.35 0.21 2.20 0.40 -1.26 -0.21 117.98 115.52 1h4i s PHE 473 Ca -0.13 -0.69 -0.32 0.00 -0.60 0.00 0.00 56.93 55.18 1h4i s PHE 473 Cb 0.15 -1.56 -0.14 0.00 0.51 0.00 0.00 43.02 41.98 1h4i s PHE 473 CO 0.72 0.38 1.45 0.00 0.70 0.00 0.00 175.22 178.48 1h4i n ALA 474 N -0.85 1.10 -2.76 5.36 0.00 -1.05 -3.07 120.51 119.24 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 -2.29 -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 0.24 4.53 0.50 0.00 1.01 -0.85 -4.51 120.40 121.32 1h4i s VAL 475 Ca 0.72 -2.05 -0.09 0.00 0.00 0.00 0.00 61.98 60.57 1h4i s VAL 475 Cb -0.67 -5.03 0.12 0.00 0.00 0.00 0.00 36.38 30.80 1h4i s VAL 475 CO 0.46 -1.80 0.67 1.87 0.00 0.00 0.00 175.10 176.30 1h4i n TRP 476 N 7.16 -3.98 0.00 5.22 -0.00 -1.26 -4.02 117.44 120.56 1h4i n TRP 476 Ca 0.40 -0.59 0.00 0.00 -0.00 0.00 0.00 57.50 57.30 1h4i n TRP 476 Cb 0.46 -0.52 0.00 0.00 -0.00 0.00 0.00 31.31 31.24 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 0.52 1.56 0.00 5.87 0.00 -1.22 -4.86 105.19 107.05 1h4i n GLY 477 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.09 3.25 -0.02 0.00 -1.26 -2.56 105.19 103.51 1h4i n GLY 478 Ca 0.00 -2.12 -0.09 0.00 0.00 0.00 0.00 46.02 43.81 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 0.10 -0.09 2.61 2.01 -0.48 -4.47 115.64 115.32 1h4i s THR 479 Ca 0.00 -1.46 -0.06 0.00 0.31 0.00 0.00 61.69 60.48 1h4i s THR 479 Cb 0.00 -1.73 0.04 0.00 0.01 0.00 0.00 72.50 70.81 1h4i s THR 479 CO 0.00 -0.46 0.23 -0.32 -0.69 0.00 0.00 174.62 173.38 1h4i s MET 480 N -3.95 0.21 0.18 4.92 1.75 -0.40 -3.98 119.30 118.03 1h4i s MET 480 Ca 0.15 0.44 0.11 0.00 -1.25 0.00 0.00 55.69 55.14 1h4i s MET 480 Cb 0.05 -0.05 -0.04 0.00 2.84 0.00 0.00 34.83 37.63 1h4i s MET 480 CO -0.03 -0.12 -0.22 0.00 -0.65 0.00 0.00 175.02 173.99 1h4i s ALA 481 N 0.88 2.57 0.10 4.11 0.00 -0.39 -0.30 121.76 128.73 1h4i s ALA 481 Ca -0.06 -1.59 0.03 0.00 0.00 0.00 0.00 51.96 50.34 1h4i s ALA 481 Cb -0.08 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 1h4i s ALA 481 CO -0.05 0.45 -0.09 0.99 0.00 0.00 0.00 175.76 177.06 1h4i s THR 482 N -1.58 0.92 -2.00 0.00 2.01 -0.72 -0.92 115.64 113.35 1h4i s THR 482 Ca 0.20 -1.73 0.09 0.00 0.31 0.00 0.00 61.69 60.56 1h4i s THR 482 Cb -0.08 -1.46 0.25 0.00 0.01 0.00 0.00 72.50 71.22 1h4i s THR 482 CO 0.10 -0.63 1.02 0.00 -0.69 0.00 0.00 174.62 174.42 1h4i n ALA 483 N 0.39 2.13 -0.21 7.40 0.00 0.90 -2.32 120.51 128.79 1h4i n ALA 483 Ca -0.15 -0.06 0.09 0.00 0.00 0.00 0.00 53.44 53.32 1h4i n ALA 483 Cb 0.58 -1.14 0.30 0.00 0.00 0.00 0.00 19.45 19.19 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 0.11 2.23 2.64 0.00 0.00 -1.25 -4.78 105.19 104.14 1h4i n GLY 484 Ca 0.07 -0.72 -0.17 0.00 0.00 0.00 0.00 46.02 45.20 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 1.06 -4.94 -4.24 1.61 10.43 -0.98 -1.08 116.55 118.41 1h4i n ASP 485 Ca 0.22 -0.19 -0.25 0.00 2.57 0.00 0.00 54.79 57.14 1h4i n ASP 485 Cb 0.71 -3.83 -0.14 0.00 1.84 0.00 0.00 41.12 39.70 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 -5.02 2.17 -0.18 0.64 1.02 -1.24 -1.65 118.68 114.42 1h4i s LEU 486 Ca 0.20 -0.52 0.01 0.00 0.02 0.00 0.00 54.13 53.84 1h4i s LEU 486 Cb -0.09 -0.94 0.03 0.00 0.02 0.00 0.00 46.19 45.22 1h4i s LEU 486 CO 0.24 0.15 -0.14 -0.69 0.02 0.00 0.00 176.35 175.93 1h4i s VAL 487 N -0.81 1.73 -0.03 -1.59 1.01 -0.46 -1.75 120.40 118.51 1h4i s VAL 487 Ca 0.07 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 1h4i s VAL 487 Cb -0.09 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 1h4i s VAL 487 CO 0.02 0.34 0.07 -0.36 0.00 0.00 0.00 175.10 175.16 1h4i s PHE 488 N 1.39 3.28 -0.02 5.22 0.40 0.59 -1.09 117.98 127.76 1h4i s PHE 488 Ca 0.02 0.23 -0.29 0.00 -0.60 0.00 0.00 56.93 56.29 1h4i s PHE 488 Cb -0.15 -1.76 0.09 0.00 0.51 0.00 0.00 43.02 41.71 1h4i s PHE 488 CO -0.10 0.55 0.76 1.52 0.70 0.00 0.00 175.22 178.65 1h4i s TYR 489 N -1.13 -0.52 0.17 0.36 -0.85 -0.91 -1.27 117.35 113.19 1h4i s TYR 489 Ca 0.20 0.70 0.04 0.00 -0.52 0.00 0.00 57.07 57.50 1h4i s TYR 489 Cb -0.12 0.47 -0.04 0.00 0.38 0.00 0.00 41.96 42.66 1h4i s TYR 489 CO 0.11 -0.60 0.19 0.20 -1.52 0.00 0.00 175.55 173.93 1h4i s GLY 490 N -1.72 1.68 0.23 5.49 0.00 -1.26 -0.44 107.32 111.30 1h4i s GLY 490 Ca -0.04 -1.17 0.10 0.00 0.00 0.00 0.00 44.72 43.61 1h4i s GLY 490 CO 0.00 -1.18 -0.19 -0.51 0.00 0.00 0.00 173.10 171.22 1h4i s THR 491 N -1.78 2.18 0.37 0.90 -4.23 0.02 -4.75 115.64 108.35 1h4i s THR 491 Ca 0.32 -2.24 0.24 0.00 -1.18 0.00 0.00 61.69 58.83 1h4i s THR 491 Cb -0.10 -2.14 0.25 0.00 1.34 0.00 0.00 72.50 71.84 1h4i s THR 491 CO 0.25 -0.40 2.00 -0.07 -0.54 0.00 0.00 174.62 175.86 1h4i h LEU 492 N 2.61 0.00 -1.32 4.79 3.38 -1.79 0.88 115.31 123.85 1h4i h LEU 492 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 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 0.58 0.17 0.00 -0.90 0.09 0.00 0.00 178.44 178.38 1h4i n ASP 493 N -3.71 1.89 -0.16 -0.43 5.75 -1.26 -3.80 116.55 114.83 1h4i n ASP 493 Ca -0.02 -2.13 0.00 0.00 -0.01 0.00 0.00 54.79 52.64 1h4i n ASP 493 Cb 0.29 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 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 1.03 3.24 6.12 0.00 -0.99 -4.76 105.19 110.48 1h4i n GLY 494 Ca 0.09 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.33 1.26 -0.20 1.61 1.51 -1.25 -1.16 117.35 116.80 1h4i s TYR 495 Ca 0.00 -0.74 -0.02 0.00 -1.01 0.00 0.00 57.07 55.30 1h4i s TYR 495 Cb 0.00 -0.64 -0.00 0.00 -0.11 0.00 0.00 41.96 41.21 1h4i s TYR 495 CO 0.00 0.08 -0.10 -1.17 -1.11 0.00 0.00 175.55 173.25 1h4i s LEU 496 N -3.08 2.66 0.22 -1.29 2.96 -0.90 -0.80 118.68 118.45 1h4i s LEU 496 Ca 0.15 -0.45 0.10 0.00 -0.22 0.00 0.00 54.13 53.71 1h4i s LEU 496 Cb 0.02 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 1h4i s LEU 496 CO 0.01 0.01 -0.11 -0.54 -1.32 0.00 0.00 176.35 174.40 1h4i s LYS 497 N 1.25 1.97 -0.09 1.98 1.02 0.42 -1.20 119.74 125.09 1h4i s LYS 497 Ca 0.03 -1.43 -0.00 0.00 0.02 0.00 0.00 55.97 54.59 1h4i s LYS 497 Cb -0.14 -2.05 0.02 0.00 -0.52 0.00 0.00 37.83 35.14 1h4i s LYS 497 CO -0.04 0.39 -0.06 0.00 -0.92 0.00 0.00 175.35 174.72 1h4i s ALA 498 N -1.99 1.07 0.18 5.17 0.00 -0.63 -2.14 121.76 123.43 1h4i s ALA 498 Ca 0.27 -0.36 0.10 0.00 0.00 0.00 0.00 51.96 51.97 1h4i s ALA 498 Cb -0.07 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 1h4i s ALA 498 CO 0.15 -0.30 -0.14 1.03 0.00 0.00 0.00 175.76 176.50 1h4i s ARG 499 N 1.53 1.90 -0.14 0.00 0.52 -0.25 -1.44 118.95 121.08 1h4i s ARG 499 Ca 0.00 -1.34 -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 -0.05 0.43 1.47 0.34 0.02 0.00 0.00 175.30 177.51 1h4i s ASP 500 N -2.75 6.74 0.51 0.23 3.68 -0.41 -1.35 116.67 123.31 1h4i s ASP 500 Ca 0.23 1.87 0.22 0.00 2.13 0.00 0.00 52.55 57.01 1h4i s ASP 500 Cb -0.09 -2.54 1.31 0.00 -1.45 0.00 0.00 42.92 40.16 1h4i s ASP 500 CO 0.13 -0.92 2.00 0.28 0.13 0.00 0.00 175.17 176.80 1h4i h SER 501 N 9.16 0.08 0.53 -0.34 0.02 -1.63 0.50 113.55 121.87 1h4i h SER 501 Ca -0.32 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.34 1h4i h SER 501 Cb 1.14 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.64 1h4i h SER 501 CO 0.97 0.04 -1.52 0.44 -1.14 0.00 0.00 176.83 175.63 1h4i h ASP 502 N 0.09 0.22 0.00 3.07 3.45 -1.91 -3.42 116.42 117.91 1h4i h ASP 502 Ca 0.25 -0.33 -0.01 0.00 0.43 0.00 0.00 57.03 57.37 1h4i h ASP 502 Cb 0.88 -0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.58 1h4i h ASP 502 CO -0.02 1.28 -1.16 0.35 -1.57 0.00 0.00 179.24 178.12 1h4i n THR 503 N -3.33 0.03 -0.69 0.35 -2.24 -1.08 -4.86 114.28 102.45 1h4i n THR 503 Ca -0.15 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1h4i n THR 503 Cb 1.03 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 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 2.39 0.78 3.75 3.38 0.00 0.17 -4.88 105.19 110.77 1h4i n GLY 504 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.64 6.61 -0.16 1.61 -0.00 -1.26 -4.60 116.67 116.23 1h4i s ASP 505 Ca 0.00 2.72 -0.29 0.00 -0.00 0.00 0.00 52.55 54.97 1h4i s ASP 505 Cb 0.00 -2.63 -0.02 0.00 -0.00 0.00 0.00 42.92 40.28 1h4i s ASP 505 CO 0.00 -0.73 1.28 -0.22 -0.00 0.00 0.00 175.17 175.50 1h4i s LEU 506 N -0.44 4.18 -0.05 1.23 2.96 -1.26 -1.29 118.68 124.02 1h4i s LEU 506 Ca 0.60 1.71 0.16 0.00 -0.22 0.00 0.00 54.13 56.38 1h4i s LEU 506 Cb -0.43 -3.54 -0.25 0.00 0.50 0.00 0.00 46.19 42.48 1h4i s LEU 506 CO 0.44 -0.77 0.31 0.18 -1.32 0.00 0.00 176.35 175.19 1h4i n LEU 507 N 6.64 0.00 -3.58 -0.68 4.77 -0.52 -4.98 117.00 118.65 1h4i n LEU 507 Ca 0.14 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.03 1h4i n LEU 507 Cb 0.45 0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.56 1h4i n LEU 507 CO 0.56 0.07 0.81 0.86 -1.33 0.00 0.00 177.39 178.37 1h4i s TRP 508 N -3.01 -0.33 0.07 -1.77 -0.00 -1.17 -4.69 118.94 108.04 1h4i s TRP 508 Ca -0.06 0.53 -0.16 0.00 -0.00 0.00 0.00 56.10 56.41 1h4i s TRP 508 Cb 0.10 0.46 0.03 0.00 -0.00 0.00 0.00 33.47 34.06 1h4i s TRP 508 CO 0.68 -0.32 0.37 -1.59 -0.00 0.00 0.00 176.95 176.09 1h4i s LYS 509 N -1.29 0.92 -0.03 5.86 -2.85 -1.26 -1.60 119.74 119.49 1h4i s LYS 509 Ca 0.00 -0.52 0.00 0.00 -1.00 0.00 0.00 55.97 54.45 1h4i s LYS 509 Cb -0.01 0.40 0.03 0.00 -2.06 0.00 0.00 37.83 36.20 1h4i s LYS 509 CO -0.00 -0.32 0.01 0.12 0.10 0.00 0.00 175.35 175.25 1h4i s PHE 510 N -2.90 0.28 -0.77 1.78 5.36 -0.34 -4.97 117.98 116.40 1h4i s PHE 510 Ca -0.03 0.02 -0.26 0.00 -0.96 0.00 0.00 56.93 55.71 1h4i s PHE 510 Cb 0.00 -0.40 -0.01 0.00 -0.34 0.00 0.00 43.02 42.27 1h4i s PHE 510 CO -0.05 -0.13 1.73 0.21 -1.46 0.00 0.00 175.22 175.51 1h4i s LYS 511 N 1.11 2.83 0.63 10.12 2.47 -1.26 -2.12 119.74 133.51 1h4i s LYS 511 Ca -0.09 -0.03 -0.07 0.00 -1.56 0.00 0.00 55.97 54.22 1h4i s LYS 511 Cb -0.13 -4.68 0.02 0.00 -1.46 0.00 0.00 37.83 31.57 1h4i s LYS 511 CO -0.02 -2.76 0.96 0.96 0.16 0.00 0.00 175.35 174.65 1h4i s ILE 512 N 8.27 3.43 0.17 5.43 -4.36 -0.31 -5.02 121.20 128.81 1h4i s ILE 512 Ca 0.60 0.08 -0.18 0.00 -0.26 0.00 0.00 60.65 60.88 1h4i s ILE 512 Cb -0.08 -3.40 0.10 0.00 1.25 0.00 0.00 42.46 40.32 1h4i s ILE 512 CO 0.09 -0.44 1.65 -0.65 0.24 0.00 0.00 174.94 175.83 1h4i h PRO 513 N -0.35 -0.08 -4.90 0.37 0.11 -1.95 -3.44 132.00 121.77 1h4i h PRO 513 Ca -0.45 0.01 -0.44 0.00 0.11 0.00 0.00 66.00 65.22 1h4i h PRO 513 Cb 1.26 0.02 -0.14 0.00 0.11 0.00 0.00 31.00 32.25 1h4i h PRO 513 CO 0.61 -0.05 -0.54 -1.54 -0.21 0.00 0.00 178.00 176.28 1h4i s SER 514 N -5.16 1.69 0.72 -2.05 1.04 -1.26 -4.73 113.70 103.95 1h4i s SER 514 Ca -0.14 -1.61 -0.15 0.00 0.48 0.00 0.00 55.95 54.53 1h4i s SER 514 Cb 0.14 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.74 1h4i s SER 514 CO 0.70 -0.93 1.19 -0.83 0.98 0.00 0.00 173.24 174.35 1h4i s GLY 515 N -3.40 2.29 -0.16 7.32 0.00 -1.25 -4.23 107.32 107.90 1h4i s GLY 515 Ca 0.35 0.81 -0.06 0.00 0.00 0.00 0.00 44.72 45.82 1h4i s GLY 515 CO 0.19 1.21 0.05 0.00 0.00 0.00 0.00 173.10 174.55 1h4i s ALA 516 N -2.07 3.38 -0.01 3.20 0.00 0.27 -1.38 121.76 125.15 1h4i s ALA 516 Ca 0.73 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.95 1h4i s ALA 516 Cb -0.27 -1.81 0.03 0.00 0.00 0.00 0.00 23.12 21.07 1h4i s ALA 516 CO 0.45 0.28 0.90 0.44 0.00 0.00 0.00 175.76 177.83 1h4i n ILE 517 N 3.19 0.83 -4.35 0.00 -5.35 -1.26 -4.03 119.36 108.39 1h4i n ILE 517 Ca -0.17 -0.87 -0.29 0.00 -0.27 0.00 0.00 62.75 61.15 1h4i n ILE 517 Cb 0.53 0.54 -0.04 0.00 -1.74 0.00 0.00 39.64 38.93 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 -0.47 3.21 3.65 3.28 0.00 -1.25 -3.42 105.19 110.19 1h4i n GLY 518 Ca 0.02 -2.34 -0.28 0.00 0.00 0.00 0.00 46.02 43.43 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 -2.72 2.84 0.60 1.61 -0.85 -1.05 -4.34 117.35 113.45 1h4i s TYR 519 Ca 0.14 -0.13 -0.16 0.00 -0.52 0.00 0.00 57.07 56.40 1h4i s TYR 519 Cb -0.01 -1.41 -0.03 0.00 0.38 0.00 0.00 41.96 40.89 1h4i s TYR 519 CO 0.09 0.50 1.07 -2.14 -1.52 0.00 0.00 175.55 173.54 1h4i s PRO 520 N -2.74 3.24 0.13 -3.49 0.02 -1.26 -4.57 135.00 126.33 1h4i s PRO 520 Ca 0.26 1.24 -0.01 0.00 0.02 0.00 0.00 61.00 62.51 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 -0.88 0.04 0.00 -0.33 0.00 0.00 177.00 176.01 1h4i s MET 521 N -4.07 0.91 0.08 5.54 0.23 -0.68 -4.72 119.30 116.60 1h4i s MET 521 Ca 0.64 -1.43 -0.04 0.00 -1.03 0.00 0.00 55.69 53.83 1h4i s MET 521 Cb -0.17 0.17 -0.02 0.00 -1.53 0.00 0.00 34.83 33.28 1h4i s MET 521 CO 0.37 -0.23 0.08 -0.08 -2.03 0.00 0.00 175.02 173.14 1h4i s THR 522 N -3.98 0.17 0.08 3.16 -1.32 -1.26 -1.07 115.64 111.42 1h4i s THR 522 Ca 0.22 -1.57 -0.27 0.00 -1.21 0.00 0.00 61.69 58.87 1h4i s THR 522 Cb 0.07 -1.54 0.09 0.00 -1.51 0.00 0.00 72.50 69.61 1h4i s THR 522 CO 0.01 -0.76 1.12 -0.72 -2.21 0.00 0.00 174.62 172.06 1h4i s TYR 523 N -3.92 -0.04 0.11 9.09 -0.85 -0.82 -4.77 117.35 116.15 1h4i s TYR 523 Ca 0.09 -0.19 0.10 0.00 -0.52 0.00 0.00 57.07 56.55 1h4i s TYR 523 Cb 0.06 0.61 -0.04 0.00 0.38 0.00 0.00 41.96 42.98 1h4i s TYR 523 CO -0.08 -0.60 -0.26 0.99 -1.52 0.00 0.00 175.55 174.07 1h4i s THR 524 N -2.65 2.19 0.03 -3.49 2.01 -0.48 -0.65 115.64 112.60 1h4i s THR 524 Ca 0.16 -1.65 -0.03 0.00 0.31 0.00 0.00 61.69 60.49 1h4i s THR 524 Cb 0.01 -1.92 -0.01 0.00 0.01 0.00 0.00 72.50 70.58 1h4i s THR 524 CO 0.00 0.15 -0.06 1.57 -0.69 0.00 0.00 174.62 175.60 1h4i n HIS 525 N 1.15 0.00 -2.78 4.92 -0.00 -0.53 -4.38 115.22 113.60 1h4i n HIS 525 Ca -0.18 0.00 -0.16 0.00 0.46 0.00 0.00 57.72 57.84 1h4i n HIS 525 Cb 0.53 -0.09 0.00 0.00 -0.12 0.00 0.00 29.99 30.31 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 -3.41 1.71 0.00 1.57 5.02 -1.26 -4.84 118.16 116.95 1h4i n LYS 526 Ca -0.02 -3.66 0.00 0.00 -2.02 0.00 0.00 58.31 52.60 1h4i n LYS 526 Cb 0.09 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 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 -0.07 0.29 3.50 0.72 0.00 -1.26 -5.06 105.19 103.31 1h4i n GLY 527 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.08 3.40 -0.06 2.61 -4.23 -1.26 -5.09 115.64 108.92 1h4i s THR 528 Ca 0.00 -0.57 -0.24 0.00 -1.18 0.00 0.00 61.69 59.70 1h4i s THR 528 Cb 0.00 -2.40 -0.04 0.00 1.34 0.00 0.00 72.50 71.41 1h4i s THR 528 CO 0.00 0.57 0.73 -1.58 -0.54 0.00 0.00 174.62 173.80 1h4i s GLN 529 N -0.41 4.44 0.04 3.99 0.74 -1.26 -1.45 119.66 125.75 1h4i s GLN 529 Ca 0.05 0.93 0.09 0.00 0.05 0.00 0.00 55.36 56.48 1h4i s GLN 529 Cb -0.12 -3.45 -0.03 0.00 1.10 0.00 0.00 33.01 30.51 1h4i s GLN 529 CO 0.02 0.04 -0.25 0.71 -0.55 0.00 0.00 175.29 175.26 1h4i s TYR 530 N 0.87 2.17 -0.12 1.67 1.51 0.17 -4.50 117.35 119.12 1h4i s TYR 530 Ca 0.39 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 56.05 1h4i s TYR 530 Cb -0.18 -1.31 -0.01 0.00 -0.11 0.00 0.00 41.96 40.35 1h4i s TYR 530 CO 0.19 0.09 -0.15 0.08 -1.11 0.00 0.00 175.55 174.65 1h4i s VAL 531 N -0.77 2.85 0.08 0.71 1.01 -0.66 -1.95 120.40 121.68 1h4i s VAL 531 Ca 0.10 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.42 1h4i s VAL 531 Cb -0.10 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 1h4i s VAL 531 CO 0.02 0.53 -0.21 0.00 0.00 0.00 0.00 175.10 175.44 1h4i s ALA 532 N 0.32 1.77 -0.08 5.51 0.00 -0.23 -0.18 121.76 128.87 1h4i s ALA 532 Ca -0.12 -1.17 -0.17 0.00 0.00 0.00 0.00 51.96 50.49 1h4i s ALA 532 Cb -0.16 -0.28 0.04 0.00 0.00 0.00 0.00 23.12 22.72 1h4i s ALA 532 CO 0.06 0.37 0.42 -1.50 0.00 0.00 0.00 175.76 175.11 1h4i s ILE 533 N -1.04 0.03 0.45 0.00 2.07 -0.87 -1.68 121.20 120.15 1h4i s ILE 533 Ca 0.07 -0.21 -0.17 0.00 -1.41 0.00 0.00 60.65 58.93 1h4i s ILE 533 Cb -0.10 -0.67 -0.09 0.00 0.13 0.00 0.00 42.46 41.74 1h4i s ILE 533 CO 0.03 -0.11 0.91 -0.31 -1.91 0.00 0.00 174.94 173.55 1h4i s TYR 534 N -0.65 3.40 0.12 3.50 4.12 -1.26 -1.39 117.35 125.18 1h4i s TYR 534 Ca -0.07 1.41 0.08 0.00 0.02 0.00 0.00 57.07 58.50 1h4i s TYR 534 Cb -0.04 -2.72 -0.04 0.00 -1.52 0.00 0.00 41.96 37.65 1h4i s TYR 534 CO 0.04 -0.19 -0.18 1.52 0.02 0.00 0.00 175.55 176.75 1h4i s TYR 535 N -2.37 1.67 0.00 2.71 -0.85 -0.54 -4.63 117.35 113.34 1h4i s TYR 535 Ca 0.58 -0.46 0.00 0.00 -0.52 0.00 0.00 57.07 56.67 1h4i s TYR 535 Cb -0.10 -0.89 0.00 0.00 0.38 0.00 0.00 41.96 41.35 1h4i s TYR 535 CO 0.24 0.21 0.00 0.41 -1.52 0.00 0.00 175.55 174.89 1h4i n GLY 536 N 0.81 1.29 3.77 5.49 0.00 -0.48 -2.06 105.19 114.02 1h4i n GLY 536 Ca -0.17 -0.18 -0.35 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 3.05 -0.51 1.61 0.11 -0.83 -1.66 120.40 122.17 1h4i s VAL 537 Ca 0.00 0.64 0.00 0.00 -2.93 0.00 0.00 61.98 59.69 1h4i s VAL 537 Cb 0.00 -3.24 0.00 0.00 -1.53 0.00 0.00 36.38 31.61 1h4i s VAL 537 CO 0.00 -0.16 0.00 0.61 -3.33 0.00 0.00 175.10 172.22 1h4i n GLY 538 N 0.18 -0.62 7.00 6.54 0.00 -1.26 -3.15 105.19 113.87 1h4i n GLY 538 Ca 0.12 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.28 0.11 -0.02 0.00 -1.26 -2.53 105.19 101.22 1h4i n GLY 539 Ca 0.00 -1.07 -0.10 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.96 -2.90 115.95 119.97 1h4i h TRP 540 Ca 0.00 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 60.97 1h4i h TRP 540 Cb 0.00 -0.08 -0.00 0.00 -2.10 0.00 0.00 29.16 26.97 1h4i h TRP 540 CO 0.00 0.25 -0.10 -1.00 -2.79 0.00 0.00 178.44 174.80 1h4i h PRO 541 N 0.19 0.00 -0.68 2.65 0.13 -1.94 -2.90 132.00 129.45 1h4i h PRO 541 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1h4i h PRO 541 Cb 0.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.21 1h4i h PRO 541 CO -0.01 0.10 0.00 0.41 -0.23 0.00 0.00 178.00 178.28 1h4i n GLY 542 N -1.03 2.68 0.23 1.56 0.00 -1.05 -4.46 105.19 103.11 1h4i n GLY 542 Ca -0.02 -0.83 0.05 0.00 0.00 0.00 0.00 46.02 45.21 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 4.16 1.12 -0.11 1.61 3.04 -1.31 0.31 116.25 125.06 1h4i h VAL 543 Ca 0.00 -0.57 -0.04 0.00 -1.01 0.00 0.00 66.70 65.09 1h4i h VAL 543 Cb 1.29 1.26 -0.00 0.00 -2.01 0.00 0.00 31.29 31.83 1h4i h VAL 543 CO 0.15 0.17 -0.07 1.23 -1.01 0.00 0.00 177.57 178.03 1h4i h GLY 544 N 0.51 0.27 0.82 3.17 0.00 -1.83 -0.36 103.07 105.65 1h4i h GLY 544 Ca 0.01 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.03 1h4i h GLY 544 CO 0.02 0.23 -0.07 -2.00 0.00 0.00 0.00 176.54 174.72 1h4i h LEU 545 N -0.12 0.43 -0.66 3.11 5.85 -1.77 0.15 115.31 122.30 1h4i h LEU 545 Ca 0.02 -0.38 -0.04 0.00 0.84 0.00 0.00 57.88 58.33 1h4i h LEU 545 Cb 0.55 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1h4i h LEU 545 CO 0.02 0.71 0.28 0.58 -0.34 0.00 0.00 178.44 179.69 1h4i h VAL 546 N 0.15 1.24 -0.51 1.05 2.07 -0.42 -3.09 116.25 116.73 1h4i h VAL 546 Ca 0.05 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1h4i h VAL 546 Cb 0.53 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1h4i h VAL 546 CO 0.02 0.29 0.00 0.49 0.02 0.00 0.00 177.57 178.39 1h4i n PHE 547 N -4.42 0.77 -3.70 1.57 3.01 -0.15 -4.97 117.46 109.57 1h4i n PHE 547 Ca 0.05 -0.53 -0.25 0.00 1.01 0.00 0.00 57.45 57.73 1h4i n PHE 547 Cb 0.16 -0.05 0.03 0.00 -0.01 0.00 0.00 39.48 39.61 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 0.93 -2.97 -4.91 4.37 -0.08 0.34 -4.97 116.55 109.25 1h4i n ASP 548 Ca 0.18 -0.92 -0.31 0.00 -1.51 0.00 0.00 54.79 52.23 1h4i n ASP 548 Cb 0.56 -3.72 -0.04 0.00 2.34 0.00 0.00 41.12 40.26 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 -6.54 4.34 0.00 -2.67 1.43 -0.11 -5.03 118.68 110.09 1h4i s LEU 549 Ca 0.21 0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 1h4i s LEU 549 Cb -0.07 -3.04 0.00 0.00 0.03 0.00 0.00 46.19 43.12 1h4i s LEU 549 CO 0.84 0.14 0.00 0.00 0.23 0.00 0.00 176.35 177.56 1h4i n ALA 550 N 0.26 2.00 -1.66 4.21 0.00 -1.26 -4.76 120.51 119.29 1h4i n ALA 550 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.97 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 -3.47 0.00 0.00 0.00 177.50 174.03 1h4i n ASP 551 N -2.40 4.13 0.15 0.00 -0.08 -1.26 -4.83 116.55 112.26 1h4i n ASP 551 Ca 0.00 0.91 0.19 0.00 -1.51 0.00 0.00 54.79 54.38 1h4i n ASP 551 Cb 0.49 -1.52 0.75 0.00 2.34 0.00 0.00 41.12 43.18 1h4i n ASP 551 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1h4i h PRO 552 N 10.47 0.00 0.00 -0.67 0.13 -1.95 0.29 132.00 140.27 1h4i h PRO 552 Ca -0.50 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 -0.34 1.15 -0.23 0.00 0.00 178.00 179.52 1h4i h THR 553 N 0.00 0.00 -4.08 1.56 2.02 -1.87 -1.41 112.91 109.12 1h4i h THR 553 Ca 0.15 -0.81 -0.47 0.00 0.77 0.00 0.00 66.41 66.05 1h4i h THR 553 Cb 1.04 1.62 0.14 0.00 -1.74 0.00 0.00 68.15 69.21 1h4i h THR 553 CO -0.00 0.00 0.26 0.00 0.37 0.00 0.00 175.52 176.14 1h4i s ALA 554 N -3.22 1.52 -1.44 6.16 0.00 0.10 -2.30 121.76 122.59 1h4i s ALA 554 Ca 0.06 -0.26 -0.06 0.00 0.00 0.00 0.00 51.96 51.70 1h4i s ALA 554 Cb 0.09 -3.13 0.01 0.00 0.00 0.00 0.00 23.12 20.09 1h4i s ALA 554 CO 0.69 -2.38 0.76 0.41 0.00 0.00 0.00 175.76 175.24 1h4i n GLY 555 N -1.47 -0.48 3.31 0.00 0.00 -1.26 -2.12 105.19 103.17 1h4i n GLY 555 Ca 0.06 0.14 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 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 -4.19 -2.63 0.00 0.99 4.77 -1.25 -1.81 117.00 112.88 1h4i n LEU 556 Ca -0.07 -0.42 0.00 0.00 -0.03 0.00 0.00 56.01 55.49 1h4i n LEU 556 Cb 0.60 -2.80 0.00 0.00 -2.33 0.00 0.00 43.42 38.89 1h4i n LEU 556 CO 0.51 0.34 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 1h4i n GLY 557 N -1.59 1.69 0.18 -0.72 0.00 -0.90 -4.81 105.19 99.03 1h4i n GLY 557 Ca -0.05 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.02 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 0.94 -0.02 4.61 0.00 -1.37 -3.32 119.26 120.11 1h4i h ALA 558 Ca 0.00 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.55 1h4i h ALA 558 Cb 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1h4i h ALA 558 CO 0.00 0.52 -0.08 0.28 0.00 0.00 0.00 179.25 179.96 1h4i h VAL 559 N 0.00 0.78 -0.53 0.00 2.07 -1.65 -2.04 116.25 114.88 1h4i h VAL 559 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1h4i h VAL 559 Cb 0.98 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 1h4i h VAL 559 CO 0.05 0.00 0.31 1.23 0.02 0.00 0.00 177.57 179.18 1h4i h GLY 560 N -0.13 0.78 1.45 2.17 0.00 -1.35 -2.41 103.07 103.57 1h4i h GLY 560 Ca 0.04 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 1h4i h GLY 560 CO -0.10 0.32 0.29 0.00 0.00 0.00 0.00 176.54 177.05 1h4i h ALA 561 N 1.15 1.51 -0.59 3.60 0.00 -1.51 -2.95 119.26 120.47 1h4i h ALA 561 Ca 0.19 -0.08 -0.29 0.00 0.00 0.00 0.00 54.91 54.73 1h4i h ALA 561 Cb 0.01 -0.22 -0.17 0.00 0.00 0.00 0.00 17.79 17.41 1h4i h ALA 561 CO -0.03 0.41 0.19 1.19 0.00 0.00 0.00 179.25 181.01 1h4i n PHE 562 N -4.40 1.84 0.22 0.00 3.01 -0.78 -4.71 117.46 112.63 1h4i n PHE 562 Ca 0.05 -1.63 0.17 0.00 1.01 0.00 0.00 57.45 57.05 1h4i n PHE 562 Cb 0.10 -0.65 0.84 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 1.15 0.00 0.00 -1.08 2.10 -1.25 -1.69 116.57 115.79 1h4i h LYS 563 Ca 0.35 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.00 1h4i h LYS 563 Cb 2.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.43 1h4i h LYS 563 CO 0.65 0.00 -0.47 1.63 -2.00 0.00 0.00 179.45 179.25 1h4i n LYS 564 N -3.82 0.01 -0.26 0.07 4.76 -1.26 -4.41 118.16 113.25 1h4i n LYS 564 Ca 0.01 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.50 1h4i n LYS 564 Cb 0.28 -1.51 0.19 0.00 -1.84 0.00 0.00 35.03 32.15 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 0.27 -2.51 -0.35 5.85 -1.67 -2.30 115.31 114.60 1h4i h LEU 565 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1h4i h LEU 565 Cb 0.51 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.63 1h4i h LEU 565 CO 0.00 0.09 0.05 0.00 -0.34 0.00 0.00 178.44 178.24 1h4i h ALA 566 N 1.56 1.04 -0.00 1.25 0.00 -1.77 -0.40 119.26 120.93 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 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1h4i h ALA 566 CO -0.41 -0.04 -0.06 0.09 0.00 0.00 0.00 179.25 178.82 1h4i n ASN 567 N -2.86 0.41 0.00 0.00 5.03 -0.86 -3.90 115.26 113.08 1h4i n ASN 567 Ca -0.03 -0.68 0.00 0.00 0.87 0.00 0.00 54.58 54.75 1h4i n ASN 567 Cb 0.10 -0.08 0.00 0.00 -1.02 0.00 0.00 39.78 38.78 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 -0.91 0.00 -3.47 3.10 4.02 -0.20 -5.11 117.16 114.60 1h4i n TYR 568 Ca 0.17 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.94 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 -0.89 0.00 0.33 -0.72 -1.32 -0.95 -4.70 115.64 107.39 1h4i s THR 569 Ca 0.00 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.53 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 0.03 -1.10 -2.21 0.00 0.00 174.62 171.34 1h4i s GLN 570 N -3.16 1.67 1.08 7.08 -1.52 -1.26 -4.29 119.66 119.25 1h4i s GLN 570 Ca 0.01 -1.91 -0.12 0.00 -1.95 0.00 0.00 55.36 51.39 1h4i s GLN 570 Cb -0.01 -1.03 0.24 0.00 -0.22 0.00 0.00 33.01 31.99 1h4i s GLN 570 CO -0.09 -0.12 1.07 -1.64 -0.25 0.00 0.00 175.29 174.26 1h4i s MET 571 N -3.83 -0.28 0.00 2.91 -1.94 -1.26 -4.53 119.30 110.37 1h4i s MET 571 Ca 0.35 1.06 -0.01 0.00 -1.71 0.00 0.00 55.69 55.37 1h4i s MET 571 Cb 0.08 -1.61 0.00 0.00 2.01 0.00 0.00 34.83 35.31 1h4i s MET 571 CO 0.15 -3.36 0.06 0.41 -0.01 0.00 0.00 175.02 172.27 1h4i n GLY 572 N 0.56 0.84 0.00 -0.03 0.00 -1.26 -4.86 105.19 100.44 1h4i n GLY 572 Ca 0.06 -0.87 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 -0.04 -0.02 0.00 -0.02 0.00 -1.23 -4.09 105.19 99.79 1h4i n GLY 573 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.77 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 -1.06 3.06 -0.02 0.00 -0.87 -1.90 105.19 104.40 1h4i n GLY 574 Ca 0.00 -0.94 -0.22 0.00 0.00 0.00 0.00 46.02 44.86 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 1.00 -0.11 1.61 1.01 0.28 -1.46 120.40 119.72 1h4i s VAL 575 Ca 0.00 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.50 1h4i s VAL 575 Cb 0.00 -0.85 -0.00 0.00 0.00 0.00 0.00 36.38 35.53 1h4i s VAL 575 CO 0.00 0.29 -0.21 -0.69 0.00 0.00 0.00 175.10 174.49 1h4i s VAL 576 N -0.08 2.30 -0.13 2.92 1.01 -0.49 -1.66 120.40 124.27 1h4i s VAL 576 Ca 0.01 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.06 1h4i s VAL 576 Cb -0.07 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 1h4i s VAL 576 CO 0.00 0.55 -0.14 -0.69 0.00 0.00 0.00 175.10 174.82 1h4i s VAL 577 N 0.42 2.95 0.27 2.92 1.01 -0.62 -2.05 120.40 125.30 1h4i s VAL 577 Ca -0.15 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.22 1h4i s VAL 577 Cb -0.17 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1h4i s VAL 577 CO 0.07 0.52 0.05 -0.36 0.00 0.00 0.00 175.10 175.38 1h4i s PHE 578 N 0.45 2.79 0.00 5.22 0.40 0.74 0.41 117.98 127.99 1h4i s PHE 578 Ca -0.10 -0.21 -0.29 0.00 -0.60 0.00 0.00 56.93 55.73 1h4i s PHE 578 Cb -0.16 -1.27 0.10 0.00 0.51 0.00 0.00 43.02 42.20 1h4i s PHE 578 CO 0.05 0.58 0.90 -1.54 0.70 0.00 0.00 175.22 175.90 1h4i s SER 579 N -3.73 -0.35 0.12 1.36 1.04 -0.58 -1.66 113.70 109.92 1h4i s SER 579 Ca 0.32 -0.03 -0.32 0.00 0.48 0.00 0.00 55.95 56.41 1h4i s SER 579 Cb -0.06 0.39 -0.11 0.00 0.10 0.00 0.00 66.02 66.33 1h4i s SER 579 CO 0.21 -0.63 1.82 0.18 0.98 0.00 0.00 173.24 175.79 1h4i n LEU 580 N -0.26 3.96 -0.66 2.42 4.77 -1.26 -1.34 117.00 124.62 1h4i n LEU 580 Ca -0.08 1.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.81 1h4i n LEU 580 Cb 0.62 -1.53 -0.04 0.00 -2.33 0.00 0.00 43.42 40.14 1h4i n LEU 580 CO 0.11 0.14 -0.08 0.47 -1.33 0.00 0.00 177.39 176.69 1h4i n ASP 581 N 5.40 -5.31 -1.92 -1.43 8.00 0.45 -2.74 116.55 119.01 1h4i n ASP 581 Ca 0.18 0.21 -0.21 0.00 0.71 0.00 0.00 54.79 55.69 1h4i n ASP 581 Cb 0.36 -3.57 -0.06 0.00 -0.02 0.00 0.00 41.12 37.84 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 -0.24 0.99 3.77 0.44 0.00 -0.45 -4.91 105.19 104.79 1h4i n GLY 582 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 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 -4.28 3.99 0.00 1.61 1.02 -1.11 -4.39 119.74 116.58 1h4i s LYS 583 Ca 0.00 2.26 0.00 0.00 0.02 0.00 0.00 55.97 58.25 1h4i s LYS 583 Cb 0.00 -2.81 0.00 0.00 -0.52 0.00 0.00 37.83 34.50 1h4i s LYS 583 CO 0.00 -0.51 0.00 0.41 -0.92 0.00 0.00 175.35 174.33 1h4i n GLY 584 N 0.65 2.11 0.27 -3.33 0.00 -1.26 -4.78 105.19 98.85 1h4i n GLY 584 Ca 0.03 -0.84 0.07 0.00 0.00 0.00 0.00 46.02 45.28 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 0.11 -0.79 1.61 0.11 -1.88 -2.83 132.00 128.33 1h4i h PRO 585 Ca 0.00 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.94 1h4i h PRO 585 Cb 0.00 -0.02 -0.10 0.00 0.11 0.00 0.00 31.00 30.99 1h4i h PRO 585 CO 0.00 0.08 0.20 0.66 -0.21 0.00 0.00 178.00 178.74 1h4i n TYR 586 N -4.51 1.99 0.26 0.65 4.02 -1.26 -4.24 117.16 114.08 1h4i n TYR 586 Ca -0.02 -0.97 0.12 0.00 -0.01 0.00 0.00 57.90 57.02 1h4i n TYR 586 Cb 0.09 -0.58 0.71 0.00 -0.02 0.00 0.00 39.34 39.54 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 2.31 0.00 -3.41 7.72 5.19 -1.89 -3.10 116.42 123.23 1h4i h ASP 587 Ca 0.20 0.00 -0.72 0.00 -0.62 0.00 0.00 57.03 55.88 1h4i h ASP 587 Cb 2.01 0.00 -0.26 0.00 0.18 0.00 0.00 39.33 41.26 1h4i h ASP 587 CO 0.59 0.12 -0.43 -0.62 -3.12 0.00 0.00 179.24 175.79 1h4i s ASP 588 N -6.23 5.81 0.39 6.45 -1.08 -1.26 -4.95 116.67 115.79 1h4i s ASP 588 Ca -0.03 -1.42 0.25 0.00 -0.52 0.00 0.00 52.55 50.83 1h4i s ASP 588 Cb 0.13 -2.05 1.37 0.00 -1.46 0.00 0.00 42.92 40.91 1h4i s ASP 588 CO 0.59 -0.56 1.77 1.55 0.52 0.00 0.00 175.17 179.03 1h4i h PRO 589 N 8.52 0.00 0.00 4.34 0.13 -1.89 -2.26 132.00 140.83 1h4i h PRO 589 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 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 0.79 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.65 1h4i n ASN 590 N -2.40 0.55 -4.71 1.44 3.02 -1.26 -4.64 115.26 107.27 1h4i n ASN 590 Ca -0.02 0.56 -0.42 0.00 -0.03 0.00 0.00 54.58 54.67 1h4i n ASN 590 Cb 0.07 -0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 38.50 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 -3.09 3.40 0.00 2.41 1.01 -0.85 -2.63 120.40 120.65 1h4i s VAL 591 Ca 0.11 0.98 0.00 0.00 0.00 0.00 0.00 61.98 63.07 1h4i s VAL 591 Cb 0.14 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.89 1h4i s VAL 591 CO 0.55 0.07 0.00 0.61 0.00 0.00 0.00 175.10 176.33 1h4i n GLY 592 N 3.50 1.25 3.79 4.51 0.00 -1.26 -4.92 105.19 112.06 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 -0.46 4.37 0.29 1.61 0.41 -1.08 -5.03 118.70 118.82 1h4i s GLU 593 Ca 0.00 1.33 -0.29 0.00 -0.41 0.00 0.00 54.97 55.60 1h4i s GLU 593 Cb 0.00 -2.56 -0.10 0.00 -1.78 0.00 0.00 34.13 29.69 1h4i s GLU 593 CO 0.00 0.07 1.13 -0.46 -0.49 0.00 0.00 175.26 175.52 1h4i s TRP 594 N -1.77 3.48 0.00 1.61 -0.00 -1.26 -5.12 118.94 115.87 1h4i s TRP 594 Ca 0.55 1.65 0.00 0.00 -0.00 0.00 0.00 56.10 58.30 1h4i s TRP 594 Cb -0.17 -3.35 0.00 0.00 -0.00 0.00 0.00 33.47 29.95 1h4i s TRP 594 CO 0.22 -0.78 0.04 1.17 -0.00 0.00 0.00 176.95 177.60