#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2r n SER 20 N 0.00 3.79 -4.77 4.04 7.64 -1.26 -4.92 113.62 118.15 1h2r n SER 20 Ca 0.00 0.97 -0.40 0.00 1.01 0.00 0.00 58.87 60.45 1h2r n SER 20 Cb 0.00 -1.47 -0.03 0.00 -1.01 0.00 0.00 64.21 61.70 1h2r n SER 20 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1h2r s TYR 21 N 3.50 3.24 -0.05 1.43 6.14 -1.26 -4.38 117.35 125.97 1h2r s TYR 21 Ca 0.87 1.55 -0.01 0.00 0.64 0.00 0.00 57.07 60.12 1h2r s TYR 21 Cb -0.56 -3.47 0.03 0.00 0.42 0.00 0.00 41.96 38.38 1h2r s TYR 21 CO 0.44 -1.27 0.01 -1.12 0.64 0.00 0.00 175.55 174.25 1h2r s SER 22 N -0.78 1.01 0.00 4.32 0.01 -1.26 -0.23 113.70 116.77 1h2r s SER 22 Ca 0.49 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.73 1h2r s SER 22 Cb -0.35 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 65.60 1h2r s SER 22 CO 0.45 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.54 1h2r n GLY 23 N 4.77 -0.96 3.89 3.44 0.00 0.66 -4.98 105.19 112.01 1h2r n GLY 23 Ca -0.14 -1.55 -0.29 0.00 0.00 0.00 0.00 46.02 44.04 1h2r n GLY 23 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h2r s PRO 24 N -1.76 3.69 -0.02 1.61 0.04 -1.26 -1.08 135.00 136.21 1h2r s PRO 24 Ca 0.00 0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.38 1h2r s PRO 24 Cb 0.00 -2.41 0.03 0.00 0.04 0.00 0.00 34.50 32.16 1h2r s PRO 24 CO 0.00 -0.07 0.03 0.42 0.04 0.00 0.00 177.00 177.42 1h2r s ILE 25 N -2.47 -0.05 -0.05 0.56 1.01 -0.74 -4.93 121.20 114.55 1h2r s ILE 25 Ca 0.49 0.20 0.04 0.00 0.00 0.00 0.00 60.65 61.38 1h2r s ILE 25 Cb -0.10 -0.08 -0.00 0.00 0.01 0.00 0.00 42.46 42.28 1h2r s ILE 25 CO 0.36 0.09 -0.18 -0.69 0.00 0.00 0.00 174.94 174.52 1h2r s VAL 26 N 0.99 1.47 -0.30 2.92 1.01 -1.26 -1.16 120.40 124.07 1h2r s VAL 26 Ca -0.08 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.17 1h2r s VAL 26 Cb -0.12 -1.27 0.09 0.00 0.00 0.00 0.00 36.38 35.08 1h2r s VAL 26 CO -0.03 0.42 0.05 0.54 0.00 0.00 0.00 175.10 176.08 1h2r s VAL 27 N 0.07 1.48 -0.20 2.92 0.11 -0.22 -5.01 120.40 119.55 1h2r s VAL 27 Ca -0.05 -1.66 -0.04 0.00 -2.93 0.00 0.00 61.98 57.30 1h2r s VAL 27 Cb -0.12 -2.02 0.10 0.00 -1.53 0.00 0.00 36.38 32.81 1h2r s VAL 27 CO 0.03 -0.51 0.28 -0.62 -3.33 0.00 0.00 175.10 170.94 1h2r s ASP 28 N 1.33 0.79 0.41 3.54 3.68 -1.26 -1.28 116.67 123.88 1h2r s ASP 28 Ca 0.07 0.11 -0.16 0.00 2.13 0.00 0.00 52.55 54.70 1h2r s ASP 28 Cb -0.18 0.69 -0.09 0.00 -1.45 0.00 0.00 42.92 41.89 1h2r s ASP 28 CO -0.15 -0.30 0.85 -2.16 0.13 0.00 0.00 175.17 173.54 1h2r s PRO 29 N 2.42 3.99 -0.32 4.34 0.04 -1.26 -5.10 135.00 139.12 1h2r s PRO 29 Ca 0.07 0.79 -0.22 0.00 0.04 0.00 0.00 61.00 61.68 1h2r s PRO 29 Cb -0.15 -2.30 -0.00 0.00 0.04 0.00 0.00 34.50 32.10 1h2r s PRO 29 CO -0.12 -0.03 0.72 0.08 0.04 0.00 0.00 177.00 177.69 1h2r s VAL 30 N -2.26 4.84 0.68 -0.36 1.01 -1.03 -5.03 120.40 118.24 1h2r s VAL 30 Ca 0.56 1.00 -0.02 0.00 0.00 0.00 0.00 61.98 63.52 1h2r s VAL 30 Cb -0.10 -4.10 0.09 0.00 0.00 0.00 0.00 36.38 32.27 1h2r s VAL 30 CO 0.23 -0.24 0.94 0.42 0.00 0.00 0.00 175.10 176.45 1h2r s THR 31 N 2.84 2.32 -1.37 3.92 -4.23 -1.26 -4.55 115.64 113.31 1h2r s THR 31 Ca 0.29 -0.54 -0.08 0.00 -1.18 0.00 0.00 61.69 60.18 1h2r s THR 31 Cb -0.14 -2.77 0.02 0.00 1.34 0.00 0.00 72.50 70.95 1h2r s THR 31 CO 0.13 0.00 1.06 0.54 -0.54 0.00 0.00 174.62 175.81 1h2r n ARG 32 N -2.73 -6.91 -4.07 3.99 1.74 -1.26 -5.00 116.66 102.41 1h2r n ARG 32 Ca 0.12 0.76 -0.11 0.00 -0.77 0.00 0.00 57.85 57.85 1h2r n ARG 32 Cb 0.60 -5.73 -0.06 0.00 -1.02 0.00 0.00 32.46 26.25 1h2r n ARG 32 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1h2r s ILE 33 N -3.36 0.00 -0.14 0.55 -4.36 -1.26 -4.77 121.20 107.86 1h2r s ILE 33 Ca 0.45 -1.60 -0.15 0.00 -0.26 0.00 0.00 60.65 59.09 1h2r s ILE 33 Cb -0.21 -2.35 -0.05 0.00 1.25 0.00 0.00 42.46 41.11 1h2r s ILE 33 CO 0.76 0.00 0.33 -0.70 0.24 0.00 0.00 174.94 175.57 1h2r s GLU 34 N -3.91 4.24 0.21 0.37 -6.30 -1.05 -5.00 118.70 107.25 1h2r s GLU 34 Ca 0.28 0.18 0.00 0.00 -2.50 0.00 0.00 54.97 52.93 1h2r s GLU 34 Cb 0.02 -3.41 0.00 0.00 0.00 0.00 0.00 34.13 30.73 1h2r s GLU 34 CO 0.12 0.25 0.00 0.41 0.02 0.00 0.00 175.26 176.06 1h2r n GLY 35 N 3.26 -2.44 3.24 -1.50 0.00 -1.26 -0.68 105.19 105.80 1h2r n GLY 35 Ca -0.11 -1.89 -0.41 0.00 0.00 0.00 0.00 46.02 43.61 1h2r n GLY 35 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1h2r s HIS 36 N -0.33 3.39 -0.03 1.61 3.76 -1.26 -4.86 115.29 117.57 1h2r s HIS 36 Ca 0.00 -1.73 0.06 0.00 -0.15 0.00 0.00 55.06 53.24 1h2r s HIS 36 Cb 0.00 -3.28 -0.02 0.00 1.11 0.00 0.00 32.58 30.38 1h2r s HIS 36 CO 0.00 -0.94 -0.21 -1.17 -0.85 0.00 0.00 174.74 171.57 1h2r s LEU 37 N 1.39 2.32 -0.16 0.89 0.20 -1.26 -2.01 118.68 120.05 1h2r s LEU 37 Ca 0.05 -0.36 0.01 0.00 0.69 0.00 0.00 54.13 54.51 1h2r s LEU 37 Cb -0.25 -1.43 0.02 0.00 -0.43 0.00 0.00 46.19 44.11 1h2r s LEU 37 CO 0.00 0.33 -0.16 -0.60 -0.29 0.00 0.00 176.35 175.63 1h2r s ARG 38 N -0.64 2.53 -0.17 1.98 3.52 0.64 -2.47 118.95 124.35 1h2r s ARG 38 Ca 0.10 -0.65 -0.04 0.00 -0.13 0.00 0.00 55.73 55.01 1h2r s ARG 38 Cb -0.10 -2.26 -0.03 0.00 -1.56 0.00 0.00 34.95 31.00 1h2r s ARG 38 CO -0.00 -0.23 -0.02 0.42 -0.81 0.00 0.00 175.30 174.66 1h2r s ILE 39 N 1.41 4.01 -0.10 4.11 -1.09 -0.40 -1.13 121.20 128.01 1h2r s ILE 39 Ca 0.05 -0.31 0.03 0.00 -2.23 0.00 0.00 60.65 58.19 1h2r s ILE 39 Cb -0.13 -2.78 0.01 0.00 -1.58 0.00 0.00 42.46 37.98 1h2r s ILE 39 CO -0.11 0.48 -0.19 -1.61 -1.23 0.00 0.00 174.94 172.27 1h2r s GLU 40 N 0.50 2.53 0.11 2.79 2.02 -0.80 -1.06 118.70 124.79 1h2r s GLU 40 Ca -0.02 -0.69 0.04 0.00 0.02 0.00 0.00 54.97 54.32 1h2r s GLU 40 Cb -0.14 -2.01 -0.04 0.00 0.10 0.00 0.00 34.13 32.04 1h2r s GLU 40 CO 0.02 0.05 -0.10 0.14 0.02 0.00 0.00 175.26 175.40 1h2r s VAL 41 N 0.65 0.97 -0.22 2.63 -7.23 -0.31 -0.12 120.40 116.78 1h2r s VAL 41 Ca -0.13 -1.80 -0.03 0.00 -1.81 0.00 0.00 61.98 58.20 1h2r s VAL 41 Cb -0.16 -1.54 -0.01 0.00 0.56 0.00 0.00 36.38 35.23 1h2r s VAL 41 CO 0.03 -0.65 -0.05 -1.61 -0.31 0.00 0.00 175.10 172.51 1h2r s GLU 42 N -3.21 3.35 -0.08 4.82 2.02 0.41 -1.78 118.70 124.23 1h2r s GLU 42 Ca 0.10 -0.64 0.01 0.00 0.02 0.00 0.00 54.97 54.46 1h2r s GLU 42 Cb -0.00 -2.98 -0.03 0.00 0.10 0.00 0.00 34.13 31.22 1h2r s GLU 42 CO -0.00 -0.20 -0.10 0.54 0.02 0.00 0.00 175.26 175.52 1h2r s VAL 43 N 1.46 3.45 -0.11 2.63 0.11 -0.25 -0.61 120.40 127.09 1h2r s VAL 43 Ca 0.06 -0.56 -0.01 0.00 -2.93 0.00 0.00 61.98 58.54 1h2r s VAL 43 Cb -0.14 -2.41 0.03 0.00 -1.53 0.00 0.00 36.38 32.33 1h2r s VAL 43 CO -0.04 0.58 -0.04 -0.70 -3.33 0.00 0.00 175.10 171.57 1h2r s GLU 44 N -0.52 1.15 -1.31 1.54 2.12 -0.22 -0.24 118.70 121.22 1h2r s GLU 44 Ca 0.07 -0.19 -0.03 0.00 0.36 0.00 0.00 54.97 55.19 1h2r s GLU 44 Cb -0.12 -1.49 0.01 0.00 0.26 0.00 0.00 34.13 32.79 1h2r s GLU 44 CO 0.02 -0.33 0.87 0.09 -0.54 0.00 0.00 175.26 175.37 1h2r n ASN 45 N 5.01 -2.41 0.00 -1.70 3.02 -0.30 -2.34 115.26 116.54 1h2r n ASN 45 Ca -0.10 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 53.72 1h2r n ASN 45 Cb 0.49 -4.44 0.00 0.00 -0.61 0.00 0.00 39.78 35.22 1h2r n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h2r n GLY 46 N -1.51 0.73 3.06 7.41 0.00 0.67 -4.72 105.19 110.83 1h2r n GLY 46 Ca -0.22 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.60 1h2r n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h2r s LYS 47 N -0.23 0.84 0.15 1.61 1.02 -0.99 -0.37 119.74 121.77 1h2r s LYS 47 Ca 0.00 -0.42 -0.31 0.00 0.02 0.00 0.00 55.97 55.26 1h2r s LYS 47 Cb 0.00 -0.81 -0.08 0.00 -0.52 0.00 0.00 37.83 36.42 1h2r s LYS 47 CO 0.00 0.22 1.34 0.08 -0.92 0.00 0.00 175.35 176.07 1h2r s VAL 48 N -0.34 3.29 -0.16 3.17 1.01 -0.52 -1.05 120.40 125.81 1h2r s VAL 48 Ca 0.03 0.99 0.05 0.00 0.00 0.00 0.00 61.98 63.05 1h2r s VAL 48 Cb -0.05 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 1h2r s VAL 48 CO -0.00 0.11 0.17 2.29 0.00 0.00 0.00 175.10 177.67 1h2r n LYS 49 N 3.30 3.68 -3.60 2.72 2.85 0.22 -0.50 118.16 126.83 1h2r n LYS 49 Ca 0.09 -0.01 -0.16 0.00 -1.05 0.00 0.00 58.31 57.17 1h2r n LYS 49 Cb 0.43 -0.86 -0.07 0.00 -0.65 0.00 0.00 35.03 33.88 1h2r n LYS 49 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 1h2r s ASN 50 N -1.82 -0.51 0.02 -5.58 3.04 -1.13 -4.97 114.94 103.98 1h2r s ASN 50 Ca 0.01 0.54 -0.11 0.00 0.04 0.00 0.00 52.86 53.34 1h2r s ASN 50 Cb 0.04 0.50 0.01 0.00 -1.54 0.00 0.00 41.25 40.25 1h2r s ASN 50 CO 0.20 -0.54 0.22 0.00 -3.04 0.00 0.00 177.10 173.93 1h2r s ALA 51 N -1.17 -0.48 -0.03 1.71 0.00 -1.26 -0.45 121.76 120.07 1h2r s ALA 51 Ca -0.11 -0.06 0.01 0.00 0.00 0.00 0.00 51.96 51.80 1h2r s ALA 51 Cb -0.02 0.18 0.01 0.00 0.00 0.00 0.00 23.12 23.30 1h2r s ALA 51 CO 0.08 -0.30 -0.05 0.71 0.00 0.00 0.00 175.76 176.20 1h2r s TYR 52 N -1.91 0.66 -0.41 0.00 2.02 0.83 -4.89 117.35 113.64 1h2r s TYR 52 Ca -0.10 -0.16 -0.08 0.00 -0.37 0.00 0.00 57.07 56.37 1h2r s TYR 52 Cb -0.04 -0.55 0.08 0.00 -0.40 0.00 0.00 41.96 41.06 1h2r s TYR 52 CO -0.00 -0.12 0.24 0.45 -1.57 0.00 0.00 175.55 174.55 1h2r s SER 53 N 0.55 5.54 -0.27 2.29 0.15 -1.26 -1.90 113.70 118.80 1h2r s SER 53 Ca -0.07 -1.60 -0.05 0.00 0.70 0.00 0.00 55.95 54.93 1h2r s SER 53 Cb -0.11 -1.95 0.01 0.00 -1.71 0.00 0.00 66.02 62.27 1h2r s SER 53 CO -0.00 -0.53 0.02 -0.55 1.20 0.00 0.00 173.24 173.38 1h2r s SER 54 N 2.07 4.80 -0.22 5.45 0.15 -0.28 -4.49 113.70 121.17 1h2r s SER 54 Ca 0.03 -0.75 -0.18 0.00 0.70 0.00 0.00 55.95 55.75 1h2r s SER 54 Cb -0.23 -1.79 -0.03 0.00 -1.71 0.00 0.00 66.02 62.26 1h2r s SER 54 CO 0.01 -0.16 0.52 -0.44 1.20 0.00 0.00 173.24 174.37 1h2r s SER 55 N 1.43 6.53 -0.14 5.45 0.01 -1.26 -0.26 113.70 125.46 1h2r s SER 55 Ca 0.02 0.63 0.17 0.00 1.31 0.00 0.00 55.95 58.08 1h2r s SER 55 Cb -0.17 -2.29 0.70 0.00 0.21 0.00 0.00 66.02 64.47 1h2r s SER 55 CO -0.00 -0.22 1.61 0.35 0.41 0.00 0.00 173.24 175.39 1h2r n THR 56 N 4.76 2.04 -3.97 1.44 -2.24 -0.85 -2.28 114.28 113.17 1h2r n THR 56 Ca -0.04 -1.31 -0.16 0.00 -2.27 0.00 0.00 64.05 60.27 1h2r n THR 56 Cb 0.50 0.02 -0.15 0.00 -2.10 0.00 0.00 70.33 68.60 1h2r n THR 56 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1h2r s LEU 57 N -2.10 1.47 -0.04 3.22 1.98 -1.26 -5.06 118.68 116.89 1h2r s LEU 57 Ca 0.49 -0.04 0.05 0.00 -2.89 0.00 0.00 54.13 51.75 1h2r s LEU 57 Cb 0.34 -0.20 -0.01 0.00 0.66 0.00 0.00 46.19 46.98 1h2r s LEU 57 CO 0.21 -0.05 -0.19 0.12 -1.89 0.00 0.00 176.35 174.54 1h2r s PHE 58 N 0.63 1.85 -0.05 5.38 5.36 -1.26 -4.84 117.98 125.05 1h2r s PHE 58 Ca -0.06 -0.49 0.01 0.00 -0.96 0.00 0.00 56.93 55.42 1h2r s PHE 58 Cb -0.09 -1.23 -0.03 0.00 -0.34 0.00 0.00 43.02 41.33 1h2r s PHE 58 CO -0.01 -0.14 -0.03 0.54 -1.46 0.00 0.00 175.22 174.11 1h2r n ARG 59 N 2.98 0.52 -2.47 10.12 1.74 -0.60 -5.08 116.66 123.86 1h2r n ARG 59 Ca -0.17 0.02 -0.02 0.00 -0.77 0.00 0.00 57.85 56.91 1h2r n ARG 59 Cb 0.53 -1.09 0.01 0.00 -1.02 0.00 0.00 32.46 30.88 1h2r n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h2r n GLY 60 N 3.22 0.65 0.32 -0.13 0.00 -0.91 -4.97 105.19 103.36 1h2r n GLY 60 Ca -0.08 -0.52 0.03 0.00 0.00 0.00 0.00 46.02 45.45 1h2r n GLY 60 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1h2r h LEU 61 N -0.27 0.54 -1.12 0.99 4.07 -1.92 -1.86 115.31 115.74 1h2r h LEU 61 Ca -0.06 -0.01 -0.06 0.00 0.08 0.00 0.00 57.88 57.83 1h2r h LEU 61 Cb 1.04 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 42.63 1h2r h LEU 61 CO 0.06 0.39 0.01 -0.33 -1.08 0.00 0.00 178.44 177.49 1h2r h GLU 62 N 0.64 0.62 -0.22 1.13 5.08 -1.93 -1.22 114.58 118.68 1h2r h GLU 62 Ca 0.18 -0.14 -0.10 0.00 -1.00 0.00 0.00 59.36 58.29 1h2r h GLU 62 Cb -0.06 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 1h2r h GLU 62 CO -0.04 0.64 -0.27 0.82 -1.00 0.00 0.00 179.01 179.15 1h2r h ILE 63 N 0.59 1.33 -0.49 3.13 2.04 -1.68 -3.13 117.51 119.28 1h2r h ILE 63 Ca 0.12 -1.46 0.01 0.00 1.00 0.00 0.00 64.86 64.53 1h2r h ILE 63 Cb 0.36 1.76 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 1h2r h ILE 63 CO 0.01 0.45 0.33 0.40 0.00 0.00 0.00 178.15 179.34 1h2r h ILE 64 N 0.26 1.11 0.00 -0.67 2.04 -1.14 -2.93 117.51 116.17 1h2r h ILE 64 Ca 0.03 -0.22 -0.05 0.00 1.00 0.00 0.00 64.86 65.61 1h2r h ILE 64 Cb 0.84 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1h2r h ILE 64 CO 0.06 0.12 -0.26 -0.07 0.00 0.00 0.00 178.15 178.01 1h2r h LEU 65 N 0.64 0.00 -9.43 1.44 4.07 -1.17 -3.46 115.31 107.40 1h2r h LEU 65 Ca 0.19 0.00 -0.62 0.00 0.08 0.00 0.00 57.88 57.53 1h2r h LEU 65 Cb -0.03 0.00 0.06 0.00 1.08 0.00 0.00 40.66 41.77 1h2r h LEU 65 CO -0.04 0.26 0.61 0.29 -1.08 0.00 0.00 178.44 178.47 1h2r n LYS 66 N -3.70 1.71 -0.89 1.13 5.02 -1.11 -2.24 118.16 118.09 1h2r n LYS 66 Ca -0.01 0.62 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 1h2r n LYS 66 Cb 0.37 -2.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.08 1h2r n LYS 66 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h2r n GLY 67 N 2.80 1.13 3.96 0.72 0.00 0.77 -4.97 105.19 109.60 1h2r n GLY 67 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 1h2r n GLY 67 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h2r s ARG 68 N -0.04 2.01 0.02 1.61 0.52 -0.95 -4.57 118.95 117.56 1h2r s ARG 68 Ca 0.00 -0.67 -0.30 0.00 -0.52 0.00 0.00 55.73 54.24 1h2r s ARG 68 Cb 0.00 -2.28 -0.05 0.00 0.52 0.00 0.00 34.95 33.14 1h2r s ARG 68 CO 0.00 -1.25 1.25 0.34 0.02 0.00 0.00 175.30 175.66 1h2r s ASP 69 N -4.59 7.01 0.47 0.23 -1.08 -1.26 -0.91 116.67 116.54 1h2r s ASP 69 Ca 0.62 2.00 0.21 0.00 -0.52 0.00 0.00 52.55 54.86 1h2r s ASP 69 Cb -0.08 -2.57 1.22 0.00 -1.46 0.00 0.00 42.92 40.02 1h2r s ASP 69 CO 0.43 -0.56 1.92 -0.65 0.52 0.00 0.00 175.17 176.84 1h2r h PRO 70 N 7.19 0.23 0.00 4.34 0.11 -1.92 -0.28 132.00 141.67 1h2r h PRO 70 Ca -0.39 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 1h2r h PRO 70 Cb 1.19 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1h2r h PRO 70 CO 0.85 0.15 -0.06 0.00 -0.21 0.00 0.00 178.00 178.73 1h2r h ARG 71 N 0.24 0.00 0.00 1.05 3.08 -1.96 -2.43 114.38 114.36 1h2r h ARG 71 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.41 1h2r h ARG 71 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1h2r h ARG 71 CO -0.08 0.06 0.00 -0.44 -1.07 0.00 0.00 179.97 178.44 1h2r h ASP 72 N 0.00 0.00 -0.34 7.04 3.32 -1.43 -3.38 116.42 121.62 1h2r h ASP 72 Ca -0.00 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.12 1h2r h ASP 72 Cb 0.14 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.63 1h2r h ASP 72 CO 0.01 0.00 -0.09 0.00 -1.72 0.00 0.00 179.24 177.44 1h2r h ALA 73 N 2.31 0.21 -0.44 3.45 0.00 -1.50 -2.46 119.26 120.84 1h2r h ALA 73 Ca 0.00 0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1h2r h ALA 73 Cb 0.83 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1h2r h ALA 73 CO 0.00 -0.47 0.31 -0.56 0.00 0.00 0.00 179.25 178.53 1h2r h GLN 74 N -0.01 0.14 -0.11 0.00 3.07 -1.79 0.51 115.11 116.92 1h2r h GLN 74 Ca 0.16 -0.01 -0.21 0.00 0.09 0.00 0.00 58.65 58.68 1h2r h GLN 74 Cb 0.26 -0.03 0.00 0.00 0.08 0.00 0.00 27.48 27.79 1h2r h GLN 74 CO -0.35 0.09 -0.79 0.45 0.09 0.00 0.00 178.83 178.32 1h2r h HIS 75 N 0.14 0.85 -0.00 0.06 3.86 -1.72 -1.65 115.15 116.68 1h2r h HIS 75 Ca 0.21 -0.39 -0.00 0.00 -1.16 0.00 0.00 60.37 59.03 1h2r h HIS 75 Cb 0.64 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.99 1h2r h HIS 75 CO -0.00 1.19 -0.01 0.74 0.86 0.00 0.00 177.93 180.71 1h2r h PHE 76 N 0.42 0.01 0.00 2.45 -1.00 -1.24 -3.33 116.94 114.25 1h2r h PHE 76 Ca -0.05 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.69 1h2r h PHE 76 Cb 1.40 -0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.95 1h2r h PHE 76 CO 0.07 0.68 -0.15 1.79 -1.61 0.00 0.00 178.31 179.09 1h2r h THR 77 N -0.65 0.96 -0.15 -1.55 1.35 -0.97 -2.04 112.91 109.86 1h2r h THR 77 Ca -0.00 -0.53 -0.01 0.00 -0.55 0.00 0.00 66.41 65.32 1h2r h THR 77 Cb 0.68 1.29 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 1h2r h THR 77 CO 0.00 0.14 0.04 -0.61 -0.25 0.00 0.00 175.52 174.84 1h2r h GLN 78 N 0.00 0.21 0.00 4.72 4.15 -1.40 -0.13 115.11 122.66 1h2r h GLN 78 Ca -0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1h2r h GLN 78 Cb 0.28 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.93 1h2r h GLN 78 CO 0.02 0.20 0.00 0.54 -1.93 0.00 0.00 178.83 177.66 1h2r n ARG 79 N -4.45 0.58 -0.18 1.69 3.00 -0.77 -2.30 116.66 114.23 1h2r n ARG 79 Ca -0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 57.85 57.80 1h2r n ARG 79 Cb 0.13 -1.44 0.15 0.00 0.00 0.00 0.00 32.46 31.30 1h2r n ARG 79 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 1h2r h THR 80 N 0.00 1.24 -2.29 0.55 2.02 -1.13 -3.45 112.91 109.85 1h2r h THR 80 Ca 0.00 -0.82 -0.06 0.00 0.77 0.00 0.00 66.41 66.30 1h2r h THR 80 Cb 0.00 0.56 -0.23 0.00 -1.74 0.00 0.00 68.15 66.75 1h2r h THR 80 CO 0.00 0.32 -0.04 0.00 0.37 0.00 0.00 175.52 176.16 1h2r n GLY 82 N 3.19 -1.19 0.09 0.00 0.00 -1.26 -3.43 105.19 102.57 1h2r n GLY 82 Ca -0.16 -0.41 -0.06 0.00 0.00 0.00 0.00 46.02 45.39 1h2r n GLY 82 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1h2r h VAL 83 N 0.00 0.54 -1.44 1.61 2.07 -1.96 -3.26 116.25 113.81 1h2r h VAL 83 Ca 0.00 -1.29 -0.71 0.00 0.82 0.00 0.00 66.70 65.52 1h2r h VAL 83 Cb 0.84 1.00 -0.18 0.00 -1.52 0.00 0.00 31.29 31.43 1h2r h VAL 83 CO 0.00 0.17 1.59 0.00 0.02 0.00 0.00 177.57 179.36 1h2r h THR 85 N 2.34 0.00 0.00 0.00 1.03 -1.60 -3.15 112.91 111.53 1h2r h THR 85 Ca 0.59 0.00 -0.05 0.00 -0.01 0.00 0.00 66.41 66.94 1h2r h THR 85 Cb 0.37 0.00 -0.01 0.00 -1.07 0.00 0.00 68.15 67.44 1h2r h THR 85 CO 1.29 0.00 -0.24 0.22 -0.01 0.00 0.00 175.52 176.78 1h2r h TYR 86 N -0.00 0.00 -0.78 0.00 5.03 -1.90 -3.37 116.97 115.95 1h2r h TYR 86 Ca 0.00 0.00 0.18 0.00 2.58 0.00 0.00 58.73 61.49 1h2r h TYR 86 Cb 0.00 0.00 -0.11 0.00 1.55 0.00 0.00 36.73 38.17 1h2r h TYR 86 CO -0.78 0.24 0.23 1.79 -1.32 0.00 0.00 178.16 178.32 1h2r h THR 87 N 0.00 0.50 -0.16 1.81 1.35 -1.93 -1.25 112.91 113.23 1h2r h THR 87 Ca -0.00 -0.11 -0.14 0.00 -0.55 0.00 0.00 66.41 65.61 1h2r h THR 87 Cb 0.51 0.17 -0.01 0.00 -1.73 0.00 0.00 68.15 67.08 1h2r h THR 87 CO 0.03 0.06 -0.51 0.45 -0.25 0.00 0.00 175.52 175.30 1h2r h HIS 88 N 0.31 0.54 -0.64 4.73 3.86 -1.75 -0.39 115.15 121.81 1h2r h HIS 88 Ca 0.46 -0.18 -0.02 0.00 -1.16 0.00 0.00 60.37 59.46 1h2r h HIS 88 Cb 0.80 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 29.14 1h2r h HIS 88 CO -0.23 0.86 0.30 0.00 0.86 0.00 0.00 177.93 179.72 1h2r h ALA 89 N 1.11 0.83 -0.39 2.45 0.00 -1.52 0.15 119.26 121.88 1h2r h ALA 89 Ca 0.01 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1h2r h ALA 89 Cb 1.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1h2r h ALA 89 CO 0.09 0.39 0.05 1.25 0.00 0.00 0.00 179.25 181.03 1h2r h LEU 90 N 0.88 0.64 -0.25 0.00 5.85 -1.08 -1.45 115.31 119.90 1h2r h LEU 90 Ca 0.22 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1h2r h LEU 90 Cb 0.12 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1h2r h LEU 90 CO -0.03 0.75 0.11 0.00 -0.34 0.00 0.00 178.44 178.94 1h2r h ALA 91 N 0.91 0.32 -0.54 1.25 0.00 -0.80 0.19 119.26 120.60 1h2r h ALA 91 Ca 0.12 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1h2r h ALA 91 Cb 0.39 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1h2r h ALA 91 CO 0.01 -0.11 0.14 0.77 0.00 0.00 0.00 179.25 180.06 1h2r h SER 92 N 0.26 0.81 -0.59 0.00 0.02 -0.96 -0.64 113.55 112.45 1h2r h SER 92 Ca 0.08 -0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 60.73 1h2r h SER 92 Cb 0.13 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 1h2r h SER 92 CO -0.01 0.83 0.07 0.74 -1.14 0.00 0.00 176.83 177.32 1h2r h THR 93 N 0.75 1.26 -0.31 -2.27 2.02 -1.15 0.12 112.91 113.33 1h2r h THR 93 Ca 0.17 -1.03 -0.06 0.00 0.77 0.00 0.00 66.41 66.26 1h2r h THR 93 Cb 0.33 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 1h2r h THR 93 CO 0.00 0.38 -0.05 0.03 0.37 0.00 0.00 175.52 176.25 1h2r h ARG 94 N 0.90 0.50 -0.05 6.66 3.08 -0.79 0.16 114.38 124.84 1h2r h ARG 94 Ca 0.18 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1h2r h ARG 94 Cb 0.46 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.44 1h2r h ARG 94 CO 0.02 0.57 -0.00 0.00 -1.07 0.00 0.00 179.97 179.48 1h2r h VAL 96 N -0.22 1.31 -0.50 0.00 2.07 -0.63 -0.92 116.25 117.36 1h2r h VAL 96 Ca 0.01 -1.89 0.10 0.00 0.82 0.00 0.00 66.70 65.74 1h2r h VAL 96 Cb 0.35 1.85 -0.08 0.00 -1.52 0.00 0.00 31.29 31.88 1h2r h VAL 96 CO 0.00 0.59 0.02 0.44 0.02 0.00 0.00 177.57 178.64 1h2r h ASP 97 N 0.49 -0.18 0.07 0.57 3.45 -0.67 0.15 116.42 120.30 1h2r h ASP 97 Ca -0.01 0.12 -0.00 0.00 0.43 0.00 0.00 57.03 57.56 1h2r h ASP 97 Cb 1.23 0.20 0.00 0.00 -0.56 0.00 0.00 39.33 40.20 1h2r h ASP 97 CO 0.13 -0.06 -0.03 -1.13 -1.57 0.00 0.00 179.24 176.57 1h2r h ASN 98 N 0.13 -0.08 -0.61 6.45 -0.73 -1.06 -0.08 115.58 119.60 1h2r h ASN 98 Ca 0.26 -0.11 0.05 0.00 1.87 0.00 0.00 56.30 58.36 1h2r h ASN 98 Cb 0.38 0.02 -0.04 0.00 0.27 0.00 0.00 38.32 38.96 1h2r h ASN 98 CO -0.41 0.06 0.40 0.00 -0.37 0.00 0.00 177.43 177.12 1h2r h ALA 99 N 0.71 1.75 0.00 1.57 0.00 -0.57 -1.77 119.26 120.94 1h2r h ALA 99 Ca -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1h2r h ALA 99 Cb 0.19 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1h2r h ALA 99 CO 0.02 0.17 -0.26 0.28 0.00 0.00 0.00 179.25 179.46 1h2r h VAL 100 N 0.65 0.12 -0.04 0.00 2.07 -0.85 -3.43 116.25 114.77 1h2r h VAL 100 Ca 0.25 -1.18 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 1h2r h VAL 100 Cb 0.19 1.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1h2r h VAL 100 CO -0.07 0.07 -0.01 0.61 0.02 0.00 0.00 177.57 178.19 1h2r n GLY 101 N 1.14 0.38 3.87 2.17 0.00 -0.11 -4.79 105.19 107.84 1h2r n GLY 101 Ca 0.03 -0.97 -0.34 0.00 0.00 0.00 0.00 46.02 44.74 1h2r n GLY 101 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1h2r s VAL 102 N -2.02 5.01 -0.36 1.61 -7.23 -0.79 -5.04 120.40 111.59 1h2r s VAL 102 Ca 0.00 0.47 -0.00 0.00 -1.81 0.00 0.00 61.98 60.64 1h2r s VAL 102 Cb 0.00 -3.65 0.09 0.00 0.56 0.00 0.00 36.38 33.38 1h2r s VAL 102 CO 0.00 0.15 0.10 -1.00 -0.31 0.00 0.00 175.10 174.04 1h2r s HIS 103 N -1.55 3.56 0.75 2.82 0.09 -1.26 -4.72 115.29 114.98 1h2r s HIS 103 Ca 0.39 -2.48 -0.14 0.00 -0.00 0.00 0.00 55.06 52.83 1h2r s HIS 103 Cb -0.13 -2.85 0.05 0.00 -0.00 0.00 0.00 32.58 29.65 1h2r s HIS 103 CO 0.20 -0.93 1.17 0.96 -0.00 0.00 0.00 174.74 176.15 1h2r s ILE 104 N 1.09 2.48 0.75 0.60 -4.36 -1.26 -4.90 121.20 115.60 1h2r s ILE 104 Ca 0.06 0.21 -0.14 0.00 -0.26 0.00 0.00 60.65 60.52 1h2r s ILE 104 Cb -0.21 -2.68 0.05 0.00 1.25 0.00 0.00 42.46 40.87 1h2r s ILE 104 CO -0.05 -0.15 1.17 -2.84 0.24 0.00 0.00 174.94 173.31 1h2r s PRO 105 N -4.14 2.09 0.26 0.37 0.02 -1.26 -4.84 135.00 127.50 1h2r s PRO 105 Ca 0.71 1.60 -0.01 0.00 0.02 0.00 0.00 61.00 63.32 1h2r s PRO 105 Cb -0.26 -1.84 0.55 0.00 0.02 0.00 0.00 34.50 32.97 1h2r s PRO 105 CO 0.48 -1.84 1.73 0.87 -0.33 0.00 0.00 177.00 177.91 1h2r h LYS 106 N -0.57 0.49 -0.09 5.54 1.57 -1.94 0.09 116.57 121.65 1h2r h LYS 106 Ca -0.46 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.20 1h2r h LYS 106 Cb 1.28 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 1h2r h LYS 106 CO 0.49 0.32 -0.33 -0.91 -0.57 0.00 0.00 179.45 178.45 1h2r h ASN 107 N 0.50 0.18 -0.37 0.86 -0.26 -1.92 -1.83 115.58 112.74 1h2r h ASN 107 Ca 0.47 -0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 56.11 1h2r h ASN 107 Cb 0.74 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.94 1h2r h ASN 107 CO -0.42 0.51 0.10 0.00 -1.06 0.00 0.00 177.43 176.56 1h2r h ALA 108 N 1.51 0.49 -0.30 -0.83 0.00 -1.21 -0.26 119.26 118.65 1h2r h ALA 108 Ca 0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1h2r h ALA 108 Cb 0.67 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1h2r h ALA 108 CO 0.05 0.15 0.09 1.15 0.00 0.00 0.00 179.25 180.68 1h2r h THR 109 N 0.45 1.21 0.02 0.00 2.02 -1.28 -1.13 112.91 114.20 1h2r h THR 109 Ca 0.12 -0.68 0.01 0.00 0.77 0.00 0.00 66.41 66.63 1h2r h THR 109 Cb 0.28 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1h2r h THR 109 CO -0.00 0.23 -0.07 1.88 0.37 0.00 0.00 175.52 177.92 1h2r h TYR 110 N 0.33 -0.18 -0.39 3.16 0.05 -1.20 -0.18 116.97 118.55 1h2r h TYR 110 Ca 0.10 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.87 1h2r h TYR 110 Cb 0.26 0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.06 1h2r h TYR 110 CO 0.01 -0.11 0.20 0.82 -1.05 0.00 0.00 178.16 178.03 1h2r h ILE 111 N -0.13 1.16 -0.88 -2.88 2.04 -1.02 0.42 117.51 116.22 1h2r h ILE 111 Ca 0.02 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.45 1h2r h ILE 111 Cb 0.16 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 36.93 1h2r h ILE 111 CO -0.06 0.17 0.58 0.03 0.00 0.00 0.00 178.15 178.87 1h2r h ARG 112 N 0.50 1.16 -0.23 2.37 3.08 -1.08 -1.83 114.38 118.35 1h2r h ARG 112 Ca 0.14 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.07 1h2r h ARG 112 Cb 0.09 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1h2r h ARG 112 CO -0.02 0.77 -0.02 -0.91 -1.07 0.00 0.00 179.97 178.72 1h2r h ASN 113 N 1.19 0.42 -0.80 7.04 -0.26 -0.73 -2.16 115.58 120.28 1h2r h ASN 113 Ca 0.32 -0.33 -0.01 0.00 -0.56 0.00 0.00 56.30 55.72 1h2r h ASN 113 Cb -0.13 -0.11 -0.04 0.00 -1.06 0.00 0.00 38.32 36.98 1h2r h ASN 113 CO -0.07 0.65 0.48 -0.07 -1.06 0.00 0.00 177.43 177.36 1h2r h LEU 114 N 0.18 0.97 -0.59 1.61 3.38 -0.66 -0.06 115.31 120.14 1h2r h LEU 114 Ca 0.06 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 1h2r h LEU 114 Cb 0.45 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1h2r h LEU 114 CO 0.02 0.76 -0.30 0.58 0.09 0.00 0.00 178.44 179.58 1h2r h VAL 115 N 1.12 1.28 -0.54 1.22 2.07 -1.28 -1.62 116.25 118.49 1h2r h VAL 115 Ca 0.29 -1.45 -0.11 0.00 0.82 0.00 0.00 66.70 66.25 1h2r h VAL 115 Cb -0.03 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1h2r h VAL 115 CO -0.05 0.48 -0.10 0.25 0.02 0.00 0.00 177.57 178.17 1h2r h LEU 116 N 0.68 1.01 -0.75 2.57 5.85 -0.90 -1.33 115.31 122.43 1h2r h LEU 116 Ca 0.08 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 1h2r h LEU 116 Cb 0.84 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 1h2r h LEU 116 CO 0.07 1.11 0.45 1.23 -0.34 0.00 0.00 178.44 180.96 1h2r h GLY 117 N 0.95 1.09 1.38 3.75 0.00 -0.79 -1.77 103.07 107.67 1h2r h GLY 117 Ca 0.14 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 1h2r h GLY 117 CO 0.05 0.44 -0.03 0.00 0.00 0.00 0.00 176.54 177.00 1h2r h ALA 118 N 1.24 1.10 -0.81 3.60 0.00 -1.07 -2.70 119.26 120.62 1h2r h ALA 118 Ca 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1h2r h ALA 118 Cb -0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1h2r h ALA 118 CO -0.05 0.57 0.47 0.37 0.00 0.00 0.00 179.25 180.61 1h2r h GLN 119 N 0.70 1.12 -0.53 0.00 5.75 -0.49 -2.25 115.11 119.40 1h2r h GLN 119 Ca 0.13 -0.11 0.02 0.00 -0.15 0.00 0.00 58.65 58.54 1h2r h GLN 119 Cb 0.47 -0.23 -0.03 0.00 1.07 0.00 0.00 27.48 28.76 1h2r h GLN 119 CO 0.02 0.80 0.32 1.88 -2.65 0.00 0.00 178.83 179.21 1h2r h TYR 120 N 1.12 0.61 -0.30 3.99 -1.99 -1.02 0.39 116.97 119.76 1h2r h TYR 120 Ca 0.29 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.99 1h2r h TYR 120 Cb -0.01 -0.20 -0.01 0.00 2.00 0.00 0.00 36.73 38.51 1h2r h TYR 120 CO -0.00 0.35 0.02 -0.07 -0.00 0.00 0.00 178.16 178.46 1h2r h LEU 121 N 0.65 0.51 0.03 3.88 3.38 -1.35 -1.69 115.31 120.71 1h2r h LEU 121 Ca 0.21 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1h2r h LEU 121 Cb 0.01 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.62 1h2r h LEU 121 CO -0.09 0.67 -0.01 -0.74 0.09 0.00 0.00 178.44 178.36 1h2r h HIS 122 N 0.33 -0.03 0.20 1.13 2.76 -1.22 -2.39 115.15 115.93 1h2r h HIS 122 Ca 0.09 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.26 1h2r h HIS 122 Cb 0.40 0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.35 1h2r h HIS 122 CO 0.03 0.08 -0.22 0.22 -1.30 0.00 0.00 177.93 176.74 1h2r h ASP 123 N -0.14 -0.60 -0.50 3.26 1.82 -0.86 -2.42 116.42 116.97 1h2r h ASP 123 Ca -0.00 0.06 -0.09 0.00 -0.39 0.00 0.00 57.03 56.61 1h2r h ASP 123 Cb 0.13 0.21 -0.02 0.00 0.68 0.00 0.00 39.33 40.33 1h2r h ASP 123 CO 0.01 -0.32 -0.01 0.45 -1.61 0.00 0.00 179.24 177.75 1h2r h HIS 124 N -0.47 1.02 -0.35 0.28 3.86 -1.36 -0.47 115.15 117.66 1h2r h HIS 124 Ca 0.00 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.04 1h2r h HIS 124 Cb 0.45 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.63 1h2r h HIS 124 CO -0.17 0.92 0.18 0.82 0.86 0.00 0.00 177.93 180.54 1h2r h ILE 125 N 0.86 1.15 -0.53 2.45 2.04 -1.38 -1.27 117.51 120.84 1h2r h ILE 125 Ca 0.16 -0.42 -0.08 0.00 1.00 0.00 0.00 64.86 65.53 1h2r h ILE 125 Cb 0.52 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 1h2r h ILE 125 CO 0.03 0.16 0.03 0.58 0.00 0.00 0.00 178.15 178.94 1h2r h VAL 126 N 0.43 1.25 0.05 1.67 2.07 -1.27 -2.52 116.25 117.93 1h2r h VAL 126 Ca 0.12 -1.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 1h2r h VAL 126 Cb 0.09 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1h2r h VAL 126 CO -0.02 0.36 -0.02 -0.74 0.02 0.00 0.00 177.57 177.17 1h2r h HIS 127 N 0.82 -0.06 0.23 1.57 -0.00 -0.77 0.11 115.15 117.05 1h2r h HIS 127 Ca 0.16 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.53 1h2r h HIS 127 Cb 0.45 0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.87 1h2r h HIS 127 CO 0.03 0.21 -0.21 0.35 -0.00 0.00 0.00 177.93 178.31 1h2r h PHE 128 N -0.33 -0.55 0.04 5.26 3.04 -1.16 0.30 116.94 123.54 1h2r h PHE 128 Ca -0.01 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.94 1h2r h PHE 128 Cb 0.30 0.21 0.00 0.00 2.56 0.00 0.00 35.95 39.02 1h2r h PHE 128 CO 0.01 -0.31 -0.02 1.88 -2.02 0.00 0.00 178.31 177.85 1h2r h TYR 129 N -0.46 -0.05 0.00 0.41 0.05 -1.50 0.18 116.97 115.60 1h2r h TYR 129 Ca -0.01 -0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.65 1h2r h TYR 129 Cb 0.42 0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.16 1h2r h TYR 129 CO -0.14 0.61 -0.92 0.45 -1.05 0.00 0.00 178.16 177.11 1h2r h HIS 130 N -0.88 0.00 0.00 4.88 3.86 -0.91 -3.31 115.15 118.79 1h2r h HIS 130 Ca -0.01 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.96 1h2r h HIS 130 Cb 0.68 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.11 1h2r h HIS 130 CO 0.17 0.52 -1.90 1.28 0.86 0.00 0.00 177.93 178.86 1h2r n LEU 131 N -3.06 2.58 -0.09 2.43 4.77 -0.89 -4.86 117.00 117.89 1h2r n LEU 131 Ca -0.03 -0.02 -0.17 0.00 -0.03 0.00 0.00 56.01 55.76 1h2r n LEU 131 Cb 0.77 -0.53 -0.10 0.00 -2.33 0.00 0.00 43.42 41.23 1h2r n LEU 131 CO 0.42 0.67 -0.18 -0.74 -1.33 0.00 0.00 177.39 176.23 1h2r h HIS 132 N -0.13 0.00 -1.23 -1.77 2.76 -0.46 -3.42 115.15 110.90 1h2r h HIS 132 Ca -0.36 0.00 0.38 0.00 -2.20 0.00 0.00 60.37 58.19 1h2r h HIS 132 Cb 1.50 0.00 -0.12 0.00 1.55 0.00 0.00 27.41 30.34 1h2r h HIS 132 CO 0.00 1.11 0.79 0.00 -1.30 0.00 0.00 177.93 178.54 1h2r h ALA 133 N -0.41 2.59 0.00 5.26 0.00 -0.72 -1.20 119.26 124.78 1h2r h ALA 133 Ca -0.18 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1h2r h ALA 133 Cb 1.06 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1h2r h ALA 133 CO -0.11 -1.15 0.00 1.28 0.00 0.00 0.00 179.25 179.27 1h2r n LEU 134 N -4.67 0.00 0.09 0.00 4.77 -1.26 -0.73 117.00 115.20 1h2r n LEU 134 Ca 0.33 0.46 0.12 0.00 -0.03 0.00 0.00 56.01 56.90 1h2r n LEU 134 Cb 1.26 -0.46 0.25 0.00 -2.33 0.00 0.00 43.42 42.15 1h2r n LEU 134 CO 0.22 -0.34 0.57 0.44 -1.33 0.00 0.00 177.39 176.95 1h2r h ASP 135 N 0.00 0.00 0.00 -1.43 3.32 -1.52 -3.38 116.42 113.41 1h2r h ASP 135 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1h2r h ASP 135 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1h2r h ASP 135 CO 0.00 0.05 -0.97 0.49 -1.72 0.00 0.00 179.24 177.10 1h2r n PHE 136 N -2.26 0.00 -4.10 4.55 3.01 -0.25 -4.95 117.46 113.47 1h2r n PHE 136 Ca 0.04 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.16 1h2r n PHE 136 Cb 0.45 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.82 1h2r n PHE 136 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1h2r s VAL 137 N -1.94 4.61 -0.66 -4.37 1.01 0.09 -4.58 120.40 114.56 1h2r s VAL 137 Ca 0.00 -0.10 -0.16 0.00 0.00 0.00 0.00 61.98 61.72 1h2r s VAL 137 Cb 0.00 -3.06 0.16 0.00 0.00 0.00 0.00 36.38 33.48 1h2r s VAL 137 CO 0.00 0.48 0.63 -0.62 0.00 0.00 0.00 175.10 175.59 1h2r s ASP 138 N 0.26 6.40 0.27 3.32 -1.08 -1.26 -4.68 116.67 119.90 1h2r s ASP 138 Ca 0.02 -2.08 -0.02 0.00 -0.52 0.00 0.00 52.55 49.96 1h2r s ASP 138 Cb -0.13 -2.22 0.43 0.00 -1.46 0.00 0.00 42.92 39.54 1h2r s ASP 138 CO 0.01 -0.79 1.89 0.58 0.52 0.00 0.00 175.17 177.38 1h2r h VAL 139 N 5.50 1.08 0.00 1.11 2.07 -1.95 -2.16 116.25 121.90 1h2r h VAL 139 Ca -0.14 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 1h2r h VAL 139 Cb 1.08 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1h2r h VAL 139 CO 0.95 0.21 -0.17 0.71 0.02 0.00 0.00 177.57 179.29 1h2r h THR 140 N 1.15 0.76 0.00 2.57 1.35 -1.95 -2.30 112.91 114.49 1h2r h THR 140 Ca 0.43 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1h2r h THR 140 Cb 0.19 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 1h2r h THR 140 CO -0.17 0.17 0.00 0.00 -0.25 0.00 0.00 175.52 175.26 1h2r n ALA 141 N -2.34 1.70 0.33 6.62 0.00 -0.81 -2.59 120.51 123.41 1h2r n ALA 141 Ca -0.02 0.07 0.15 0.00 0.00 0.00 0.00 53.44 53.64 1h2r n ALA 141 Cb 0.27 -1.38 0.58 0.00 0.00 0.00 0.00 19.45 18.92 1h2r n ALA 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h2r h ALA 142 N 2.30 1.00 0.00 0.00 0.00 -1.50 -2.94 119.26 118.13 1h2r h ALA 142 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1h2r h ALA 142 Cb 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1h2r h ALA 142 CO 0.00 0.00 -0.40 -0.07 0.00 0.00 0.00 179.25 178.78 1h2r h LEU 143 N 0.00 0.00 -2.52 0.00 4.07 -1.69 -3.09 115.31 112.08 1h2r h LEU 143 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1h2r h LEU 143 Cb 0.51 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.25 1h2r h LEU 143 CO 0.00 0.40 0.00 2.29 -1.08 0.00 0.00 178.44 180.05 1h2r n LYS 144 N -3.96 3.16 -2.67 1.13 2.85 -1.11 -4.97 118.16 112.60 1h2r n LYS 144 Ca -0.02 -2.21 -0.28 0.00 -1.05 0.00 0.00 58.31 54.75 1h2r n LYS 144 Cb 0.44 -1.77 -0.01 0.00 -0.65 0.00 0.00 35.03 33.04 1h2r n LYS 144 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1h2r s ALA 145 N -1.81 3.37 -0.43 0.58 0.00 -1.17 -4.93 121.76 117.37 1h2r s ALA 145 Ca 0.40 -0.39 -0.16 0.00 0.00 0.00 0.00 51.96 51.81 1h2r s ALA 145 Cb 0.26 -2.65 0.03 0.00 0.00 0.00 0.00 23.12 20.76 1h2r s ALA 145 CO 0.19 -0.25 0.36 0.34 0.00 0.00 0.00 175.76 176.39 1h2r s ASP 146 N -3.80 6.14 0.51 0.00 3.68 -1.26 -4.96 116.67 116.97 1h2r s ASP 146 Ca 0.49 -0.95 0.20 0.00 2.13 0.00 0.00 52.55 54.42 1h2r s ASP 146 Cb -0.10 -2.18 1.32 0.00 -1.45 0.00 0.00 42.92 40.50 1h2r s ASP 146 CO 0.41 -0.53 2.10 1.55 0.13 0.00 0.00 175.17 178.83 1h2r h PRO 147 N 8.69 0.00 -0.25 4.34 0.13 -1.94 -0.82 132.00 142.15 1h2r h PRO 147 Ca -0.27 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.81 1h2r h PRO 147 Cb 1.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1h2r h PRO 147 CO 0.78 0.09 -0.05 0.00 -0.23 0.00 0.00 178.00 178.59 1h2r h ALA 148 N 1.91 0.35 -0.47 -0.56 0.00 -1.93 0.34 119.26 118.89 1h2r h ALA 148 Ca -0.00 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 1h2r h ALA 148 Cb 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1h2r h ALA 148 CO 0.01 0.13 -0.20 0.87 0.00 0.00 0.00 179.25 180.07 1h2r h LYS 149 N 0.23 0.97 -0.77 0.00 6.56 -1.92 -2.63 116.57 119.01 1h2r h LYS 149 Ca 0.07 -0.41 -0.02 0.00 -1.06 0.00 0.00 60.65 59.23 1h2r h LYS 149 Cb 0.50 -0.04 -0.04 0.00 -0.57 0.00 0.00 32.23 32.09 1h2r h LYS 149 CO 0.02 1.08 0.40 0.00 -2.06 0.00 0.00 179.45 178.90 1h2r h ALA 150 N 0.86 1.26 -0.48 3.86 0.00 -1.05 -1.97 119.26 121.74 1h2r h ALA 150 Ca 0.11 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1h2r h ALA 150 Cb 0.77 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1h2r h ALA 150 CO 0.06 0.59 -0.04 0.00 0.00 0.00 0.00 179.25 179.87 1h2r h ALA 151 N 1.36 1.03 0.23 0.00 0.00 -0.73 -0.41 119.26 120.75 1h2r h ALA 151 Ca 0.27 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1h2r h ALA 151 Cb 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1h2r h ALA 151 CO -0.04 0.59 -0.11 0.87 0.00 0.00 0.00 179.25 180.56 1h2r h LYS 152 N 0.76 -0.30 0.14 0.00 1.57 -1.06 -0.85 116.57 116.82 1h2r h LYS 152 Ca 0.14 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1h2r h LYS 152 Cb 0.51 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 1h2r h LYS 152 CO 0.03 -0.20 -0.17 0.28 -0.57 0.00 0.00 179.45 178.82 1h2r h VAL 153 N -0.32 0.62 -0.52 0.50 2.07 -1.16 -1.93 116.25 115.52 1h2r h VAL 153 Ca -0.03 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.57 1h2r h VAL 153 Cb 0.24 0.62 -0.07 0.00 -1.52 0.00 0.00 31.29 30.57 1h2r h VAL 153 CO 0.05 0.00 0.14 0.00 0.02 0.00 0.00 177.57 177.78 1h2r h ALA 154 N 0.47 0.61 0.00 1.67 0.00 -0.98 -1.16 119.26 119.86 1h2r h ALA 154 Ca 0.01 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1h2r h ALA 154 Cb 0.35 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1h2r h ALA 154 CO -0.07 -0.27 -0.07 0.77 0.00 0.00 0.00 179.25 179.61 1h2r h SER 155 N 0.29 0.00 1.26 0.00 0.02 -0.93 -2.75 113.55 111.43 1h2r h SER 155 Ca 0.26 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.07 1h2r h SER 155 Cb 0.33 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 1h2r h SER 155 CO -0.31 0.07 -0.76 0.77 -1.14 0.00 0.00 176.83 175.46 1h2r h SER 156 N 0.00 0.00 0.26 3.07 4.64 -0.42 -3.30 113.55 117.80 1h2r h SER 156 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h2r h SER 156 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1h2r h SER 156 CO 0.01 0.60 -0.45 2.30 -0.87 0.00 0.00 176.83 178.42 1h2r n ILE 157 N -3.18 0.00 -3.84 0.95 -5.35 -0.97 -4.94 119.36 102.02 1h2r n ILE 157 Ca -0.01 -0.09 -0.12 0.00 -0.27 0.00 0.00 62.75 62.27 1h2r n ILE 157 Cb 0.79 0.53 -0.11 0.00 -1.74 0.00 0.00 39.64 39.12 1h2r n ILE 157 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1h2r s SER 158 N -2.72 -0.06 0.35 7.28 0.15 -1.11 -4.83 113.70 112.76 1h2r s SER 158 Ca 0.17 0.02 0.26 0.00 0.70 0.00 0.00 55.95 57.10 1h2r s SER 158 Cb 0.18 0.27 1.21 0.00 -1.71 0.00 0.00 66.02 65.97 1h2r s SER 158 CO 0.62 -0.25 1.78 1.55 1.20 0.00 0.00 173.24 178.14 1h2r h PRO 159 N 4.89 0.00 -6.24 5.44 0.13 -1.88 -3.39 132.00 130.95 1h2r h PRO 159 Ca -0.29 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.25 1h2r h PRO 159 Cb 1.19 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.22 1h2r h PRO 159 CO 0.40 0.00 0.64 0.50 -0.23 0.00 0.00 178.00 179.32 1h2r s ARG 160 N -3.50 3.55 -0.02 0.86 3.52 -1.26 -5.02 118.95 117.07 1h2r s ARG 160 Ca 0.01 0.20 -0.28 0.00 -0.13 0.00 0.00 55.73 55.53 1h2r s ARG 160 Cb 0.08 -3.93 -0.03 0.00 -1.56 0.00 0.00 34.95 29.51 1h2r s ARG 160 CO 0.34 -1.27 0.90 0.15 -0.81 0.00 0.00 175.30 174.61 1h2r s LYS 161 N 3.90 4.52 0.02 5.12 1.02 -1.26 -4.51 119.74 128.54 1h2r s LYS 161 Ca 0.39 1.26 0.08 0.00 0.02 0.00 0.00 55.97 57.72 1h2r s LYS 161 Cb -0.10 -3.46 -0.03 0.00 -0.52 0.00 0.00 37.83 33.73 1h2r s LYS 161 CO 0.27 -0.03 -0.24 0.95 -0.92 0.00 0.00 175.35 175.38 1h2r s THR 162 N 1.00 2.30 0.44 2.17 -4.23 -1.26 -5.02 115.64 111.04 1h2r s THR 162 Ca 0.48 -1.21 0.06 0.00 -1.18 0.00 0.00 61.69 59.84 1h2r s THR 162 Cb -0.20 -1.88 0.01 0.00 1.34 0.00 0.00 72.50 71.77 1h2r s THR 162 CO 0.25 0.45 0.61 0.42 -0.54 0.00 0.00 174.62 175.81 1h2r s THR 163 N -0.76 3.02 0.25 3.99 -4.23 -1.26 -4.65 115.64 112.00 1h2r s THR 163 Ca 0.12 -0.91 -0.06 0.00 -1.18 0.00 0.00 61.69 59.66 1h2r s THR 163 Cb -0.10 -3.04 0.25 0.00 1.34 0.00 0.00 72.50 70.95 1h2r s THR 163 CO 0.01 -0.02 1.92 0.00 -0.54 0.00 0.00 174.62 176.00 1h2r h ALA 164 N 0.52 1.27 -0.79 3.99 0.00 -1.87 -2.33 119.26 120.04 1h2r h ALA 164 Ca -0.41 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.44 1h2r h ALA 164 Cb 1.28 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1h2r h ALA 164 CO 0.47 0.62 0.52 0.00 0.00 0.00 0.00 179.25 180.87 1h2r h ALA 165 N 1.37 1.01 -0.30 0.00 0.00 -1.95 -0.28 119.26 119.11 1h2r h ALA 165 Ca 0.37 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.26 1h2r h ALA 165 Cb -0.12 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.31 1h2r h ALA 165 CO -0.09 0.43 0.06 -0.44 0.00 0.00 0.00 179.25 179.21 1h2r h ASP 166 N 1.08 0.02 0.82 0.00 3.32 -1.82 -2.11 116.42 117.72 1h2r h ASP 166 Ca 0.29 0.05 -0.15 0.00 0.02 0.00 0.00 57.03 57.24 1h2r h ASP 166 Cb -0.12 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1h2r h ASP 166 CO -0.06 0.05 -0.73 -0.07 -1.72 0.00 0.00 179.24 176.71 1h2r h LEU 167 N 0.17 0.00 -0.84 1.55 3.38 -1.26 -3.17 115.31 115.14 1h2r h LEU 167 Ca 0.14 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 1h2r h LEU 167 Cb 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1h2r h LEU 167 CO -0.18 0.73 -0.13 0.50 0.09 0.00 0.00 178.44 179.45 1h2r h LYS 168 N 0.00 0.73 -0.78 1.13 3.64 -0.81 -1.94 116.57 118.54 1h2r h LYS 168 Ca -0.01 -0.25 0.08 0.00 -1.27 0.00 0.00 60.65 59.21 1h2r h LYS 168 Cb 1.33 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 33.02 1h2r h LYS 168 CO 0.09 0.83 0.44 0.00 -2.27 0.00 0.00 179.45 178.54 1h2r h ALA 169 N 1.20 1.08 -0.40 5.00 0.00 -1.36 0.96 119.26 125.74 1h2r h ALA 169 Ca 0.11 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 1h2r h ALA 169 Cb 0.59 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1h2r h ALA 169 CO 0.04 0.09 -0.10 0.28 0.00 0.00 0.00 179.25 179.55 1h2r h VAL 170 N 0.76 1.28 -0.77 0.00 2.07 -1.53 -2.61 116.25 115.44 1h2r h VAL 170 Ca 0.36 -1.20 0.02 0.00 0.82 0.00 0.00 66.70 66.71 1h2r h VAL 170 Cb 0.30 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 1h2r h VAL 170 CO -0.23 0.40 0.50 1.56 0.02 0.00 0.00 177.57 179.82 1h2r h GLN 171 N 0.59 0.97 -0.38 1.57 4.20 -0.51 -1.06 115.11 120.48 1h2r h GLN 171 Ca 0.10 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1h2r h GLN 171 Cb 0.63 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1h2r h GLN 171 CO 0.04 0.64 0.18 -0.44 -0.67 0.00 0.00 178.83 178.58 1h2r h ASP 172 N 1.00 0.50 -0.35 1.46 3.45 -0.72 -0.58 116.42 121.17 1h2r h ASP 172 Ca 0.30 -0.13 -0.01 0.00 0.43 0.00 0.00 57.03 57.62 1h2r h ASP 172 Cb -0.05 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 1h2r h ASP 172 CO -0.09 0.49 0.19 0.50 -1.57 0.00 0.00 179.24 178.77 1h2r h LYS 173 N 0.48 0.49 -0.58 3.56 1.63 -1.08 -2.16 116.57 118.91 1h2r h LYS 173 Ca 0.13 -0.06 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 1h2r h LYS 173 Cb 0.13 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1h2r h LYS 173 CO -0.02 0.41 0.31 1.25 -3.45 0.00 0.00 179.45 177.95 1h2r h LEU 174 N 0.44 0.73 -0.05 5.20 6.46 -1.06 -2.40 115.31 124.63 1h2r h LEU 174 Ca 0.12 -0.10 0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1h2r h LEU 174 Cb 0.06 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.78 1h2r h LEU 174 CO -0.02 0.62 -0.05 0.50 -0.62 0.00 0.00 178.44 178.87 1h2r h LYS 175 N 0.79 -0.07 -0.63 1.25 3.64 -0.81 -0.63 116.57 120.11 1h2r h LYS 175 Ca 0.20 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1h2r h LYS 175 Cb 0.05 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1h2r h LYS 175 CO -0.03 -0.04 0.42 1.15 -2.27 0.00 0.00 179.45 178.67 1h2r h THR 176 N -0.07 1.15 -0.17 1.00 2.02 -1.32 -1.03 112.91 114.50 1h2r h THR 176 Ca 0.04 -0.29 0.02 0.00 0.77 0.00 0.00 66.41 66.95 1h2r h THR 176 Cb 0.12 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 1h2r h THR 176 CO -0.09 0.15 0.03 0.15 0.37 0.00 0.00 175.52 176.13 1h2r h PHE 177 N 0.85 0.04 -0.58 3.16 3.04 -1.05 -2.66 116.94 119.74 1h2r h PHE 177 Ca 0.24 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 62.14 1h2r h PHE 177 Cb -0.08 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 38.41 1h2r h PHE 177 CO -0.03 0.01 0.14 0.28 -2.02 0.00 0.00 178.31 176.69 1h2r h VAL 178 N 0.09 1.23 0.00 1.41 2.07 -0.83 -2.43 116.25 117.80 1h2r h VAL 178 Ca 0.08 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1h2r h VAL 178 Cb 0.07 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1h2r h VAL 178 CO -0.11 0.32 0.00 -0.62 0.02 0.00 0.00 177.57 177.18 1h2r n GLU 179 N -4.26 0.16 0.17 1.57 1.02 -0.41 -2.21 120.64 116.67 1h2r n GLU 179 Ca 0.04 0.15 0.05 0.00 -0.02 0.00 0.00 57.16 57.38 1h2r n GLU 179 Cb 0.24 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.34 1h2r n GLU 179 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1h2r h THR 180 N 0.00 0.80 0.00 2.62 1.35 -1.19 -3.47 112.91 113.02 1h2r h THR 180 Ca 0.00 -1.82 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 1h2r h THR 180 Cb 0.21 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 1h2r h THR 180 CO 0.00 0.40 0.00 0.61 -0.25 0.00 0.00 175.52 176.28 1h2r n GLY 181 N 0.76 1.14 3.20 5.82 0.00 -0.94 -4.98 105.19 110.20 1h2r n GLY 181 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1h2r n GLY 181 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h2r s GLN 182 N -0.35 3.08 0.22 1.61 -0.21 -1.26 -4.90 119.66 117.85 1h2r s GLN 182 Ca 0.00 -2.54 0.25 0.00 0.02 0.00 0.00 55.36 53.09 1h2r s GLN 182 Cb 0.00 -4.07 0.90 0.00 1.00 0.00 0.00 33.01 30.84 1h2r s GLN 182 CO 0.00 -1.23 1.75 1.28 -2.12 0.00 0.00 175.29 174.96 1h2r n LEU 183 N 3.65 0.69 0.00 2.90 4.77 -1.26 -4.87 117.00 122.89 1h2r n LEU 183 Ca 0.11 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.70 1h2r n LEU 183 Cb 0.42 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1h2r n LEU 183 CO 0.33 -0.35 0.00 0.61 -1.33 0.00 0.00 177.39 176.66 1h2r n GLY 184 N 0.69 2.54 0.32 -0.72 0.00 -1.26 -1.16 105.19 105.59 1h2r n GLY 184 Ca 0.04 0.35 0.18 0.00 0.00 0.00 0.00 46.02 46.59 1h2r n GLY 184 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1h2r h PRO 185 N 0.00 0.00 -0.21 1.61 0.11 -2.06 -1.40 132.00 130.06 1h2r h PRO 185 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1h2r h PRO 185 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1h2r h PRO 185 CO 0.00 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.98 1h2r n PHE 186 N -3.56 0.26 0.00 0.65 3.72 -0.31 -4.83 117.46 113.39 1h2r n PHE 186 Ca -0.02 -0.13 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 1h2r n PHE 186 Cb 0.16 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 1h2r n PHE 186 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1h2r n THR 187 N 0.82 0.00 -1.51 4.37 -1.04 -0.53 -1.72 114.28 114.67 1h2r n THR 187 Ca 0.17 0.56 -0.35 0.00 -2.04 0.00 0.00 64.05 62.39 1h2r n THR 187 Cb 0.46 -0.88 0.06 0.00 -1.82 0.00 0.00 70.33 68.14 1h2r n THR 187 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1h2r n ASN 188 N -0.61 7.53 -4.68 8.00 5.03 -1.26 -5.01 115.26 124.27 1h2r n ASN 188 Ca 0.00 -3.74 -0.43 0.00 0.87 0.00 0.00 54.58 51.27 1h2r n ASN 188 Cb 0.00 -1.03 -0.01 0.00 -1.02 0.00 0.00 39.78 37.72 1h2r n ASN 188 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1h2r n ALA 189 N -0.64 1.18 0.26 5.41 0.00 -0.70 -4.87 120.51 121.16 1h2r n ALA 189 Ca 0.57 0.38 0.18 0.00 0.00 0.00 0.00 53.44 54.58 1h2r n ALA 189 Cb 0.50 -2.25 0.92 0.00 0.00 0.00 0.00 19.45 18.62 1h2r n ALA 189 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1h2r h TYR 190 N 3.21 0.00 -0.00 0.00 0.99 -1.93 -1.08 116.97 118.16 1h2r h TYR 190 Ca -0.45 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.28 1h2r h TYR 190 Cb 1.28 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.01 1h2r h TYR 190 CO 0.53 0.00 -0.25 1.97 -0.00 0.00 0.00 178.16 180.41 1h2r n PHE 191 N -3.51 0.00 -1.89 4.88 1.16 -1.26 -4.67 117.46 112.17 1h2r n PHE 191 Ca -0.00 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.16 1h2r n PHE 191 Cb 0.26 -0.19 -0.03 0.00 -1.61 0.00 0.00 39.48 37.91 1h2r n PHE 191 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1h2r s LEU 192 N -2.63 4.37 0.00 5.98 1.43 -0.41 -1.19 118.68 126.24 1h2r s LEU 192 Ca 0.22 2.61 0.00 0.00 -1.03 0.00 0.00 54.13 55.94 1h2r s LEU 192 Cb 0.19 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.83 1h2r s LEU 192 CO 0.54 -0.87 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1h2r n GLY 193 N 3.89 0.55 0.00 -3.19 0.00 -1.26 -4.80 105.19 100.38 1h2r n GLY 193 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1h2r n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2r n GLY 194 N -2.90 -1.20 3.44 -0.02 0.00 -0.33 -5.08 105.19 99.10 1h2r n GLY 194 Ca 0.00 -1.54 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 1h2r n GLY 194 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1h2r s HIS 195 N -3.12 -0.72 0.56 1.61 5.04 -1.26 -4.84 115.29 112.56 1h2r s HIS 195 Ca 0.00 1.57 0.26 0.00 -1.54 0.00 0.00 55.06 55.35 1h2r s HIS 195 Cb 0.00 0.33 1.48 0.00 0.04 0.00 0.00 32.58 34.44 1h2r s HIS 195 CO 0.00 -0.37 2.04 -1.00 -2.34 0.00 0.00 174.74 173.07 1h2r h PRO 196 N 6.30 0.00 -0.00 2.88 0.13 -1.98 -2.09 132.00 137.24 1h2r h PRO 196 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1h2r h PRO 196 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1h2r h PRO 196 CO 0.20 0.00 -0.08 0.00 -0.23 0.00 0.00 178.00 177.89 1h2r n ALA 197 N -2.49 2.73 -2.58 -0.56 0.00 -1.26 -4.77 120.51 111.58 1h2r n ALA 197 Ca 0.05 -0.28 -0.40 0.00 0.00 0.00 0.00 53.44 52.82 1h2r n ALA 197 Cb 0.46 -1.34 -0.09 0.00 0.00 0.00 0.00 19.45 18.48 1h2r n ALA 197 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1h2r s TYR 198 N -2.36 3.23 -0.29 0.00 1.51 -0.79 -4.98 117.35 113.67 1h2r s TYR 198 Ca 0.32 0.19 0.19 0.00 -1.01 0.00 0.00 57.07 56.76 1h2r s TYR 198 Cb 0.20 -2.59 -0.27 0.00 -0.11 0.00 0.00 41.96 39.19 1h2r s TYR 198 CO 0.45 -0.30 0.54 0.66 -1.11 0.00 0.00 175.55 175.78 1h2r n TYR 199 N 5.32 0.00 -1.74 2.71 0.53 -1.26 -4.86 117.16 117.86 1h2r n TYR 199 Ca -0.10 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.38 1h2r n TYR 199 Cb 0.50 -0.31 0.02 0.00 -1.03 0.00 0.00 39.34 38.52 1h2r n TYR 199 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 1h2r n LEU 200 N -1.96 4.88 -4.90 7.72 4.32 -1.26 -5.02 117.00 120.78 1h2r n LEU 200 Ca -0.01 1.10 -0.28 0.00 -0.02 0.00 0.00 56.01 56.79 1h2r n LEU 200 Cb 0.44 -1.57 0.05 0.00 -1.62 0.00 0.00 43.42 40.72 1h2r n LEU 200 CO 0.40 -0.35 0.67 1.51 -1.22 0.00 0.00 177.39 178.40 1h2r s ASP 201 N -0.55 5.35 0.22 -1.43 1.47 -1.26 -4.88 116.67 115.60 1h2r s ASP 201 Ca 0.63 0.90 -0.08 0.00 1.18 0.00 0.00 52.55 55.18 1h2r s ASP 201 Cb -0.46 -1.72 0.34 0.00 -0.34 0.00 0.00 42.92 40.74 1h2r s ASP 201 CO 0.56 -1.32 1.73 -0.65 0.68 0.00 0.00 175.17 176.17 1h2r h PRO 202 N -0.53 0.39 -0.25 2.11 0.11 -1.92 -2.00 132.00 129.91 1h2r h PRO 202 Ca -0.45 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.64 1h2r h PRO 202 Cb 1.27 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1h2r h PRO 202 CO 0.63 0.26 0.14 0.93 -0.21 0.00 0.00 178.00 179.75 1h2r h GLU 203 N 0.40 0.29 -0.26 1.05 3.07 -1.91 -0.84 114.58 116.39 1h2r h GLU 203 Ca 0.35 -0.02 -0.08 0.00 -0.50 0.00 0.00 59.36 59.10 1h2r h GLU 203 Cb 0.48 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1h2r h GLU 203 CO -0.36 0.19 -0.20 1.15 -1.40 0.00 0.00 179.01 178.40 1h2r h THR 204 N 0.30 1.25 -0.68 1.13 2.02 -1.89 -1.45 112.91 113.58 1h2r h THR 204 Ca 0.10 -1.15 -0.05 0.00 0.77 0.00 0.00 66.41 66.07 1h2r h THR 204 Cb -0.01 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.65 1h2r h THR 204 CO -0.04 0.37 0.23 0.78 0.37 0.00 0.00 175.52 177.22 1h2r h ASN 205 N 0.42 0.99 -0.49 4.18 -0.26 -0.98 -1.27 115.58 118.17 1h2r h ASN 205 Ca 0.07 -0.20 -0.07 0.00 -0.56 0.00 0.00 56.30 55.53 1h2r h ASN 205 Cb 0.59 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.57 1h2r h ASN 205 CO 0.04 0.92 0.01 0.25 -1.06 0.00 0.00 177.43 177.59 1h2r h LEU 206 N 0.99 0.83 -0.32 1.61 5.85 -0.69 -0.89 115.31 122.70 1h2r h LEU 206 Ca 0.22 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1h2r h LEU 206 Cb 0.28 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1h2r h LEU 206 CO -0.01 0.93 0.17 0.40 -0.34 0.00 0.00 178.44 179.59 1h2r h ILE 207 N 0.71 1.14 -0.76 4.05 2.04 -1.11 -1.01 117.51 122.57 1h2r h ILE 207 Ca 0.14 -0.38 -0.05 0.00 1.00 0.00 0.00 64.86 65.57 1h2r h ILE 207 Cb 0.50 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 1h2r h ILE 207 CO 0.02 0.14 0.29 0.00 0.00 0.00 0.00 178.15 178.60 1h2r h ALA 208 N 1.03 1.07 -0.41 1.87 0.00 -1.14 -1.90 119.26 119.78 1h2r h ALA 208 Ca 0.11 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1h2r h ALA 208 Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1h2r h ALA 208 CO -0.02 0.65 -0.14 1.15 0.00 0.00 0.00 179.25 180.89 1h2r h THR 209 N 1.11 1.28 -0.70 0.00 2.02 -0.95 -0.66 112.91 115.01 1h2r h THR 209 Ca 0.25 -1.26 0.01 0.00 0.77 0.00 0.00 66.41 66.18 1h2r h THR 209 Cb 0.23 1.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.83 1h2r h THR 209 CO -0.02 0.42 0.46 0.00 0.37 0.00 0.00 175.52 176.75 1h2r h ALA 210 N 0.84 0.89 0.00 6.16 0.00 -1.02 -1.44 119.26 124.68 1h2r h ALA 210 Ca 0.10 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1h2r h ALA 210 Cb 0.68 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1h2r h ALA 210 CO 0.05 0.29 -0.57 0.45 0.00 0.00 0.00 179.25 179.47 1h2r h HIS 211 N 0.93 0.00 -0.31 0.00 3.86 -1.15 -0.79 115.15 117.69 1h2r h HIS 211 Ca 0.26 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.43 1h2r h HIS 211 Cb -0.09 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 1h2r h HIS 211 CO -0.03 0.57 0.03 -0.92 0.86 0.00 0.00 177.93 178.45 1h2r h TYR 212 N 0.00 0.57 -0.39 2.45 3.20 -0.55 0.79 116.97 123.03 1h2r h TYR 212 Ca -0.01 -0.09 -0.07 0.00 3.14 0.00 0.00 58.73 61.70 1h2r h TYR 212 Cb 1.02 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.12 1h2r h TYR 212 CO 0.00 0.63 -0.04 -0.07 -1.64 0.00 0.00 178.16 177.04 1h2r h LEU 213 N 0.35 0.72 -1.07 2.82 4.07 -1.18 -2.79 115.31 118.23 1h2r h LEU 213 Ca 0.09 -0.34 -0.03 0.00 0.08 0.00 0.00 57.88 57.69 1h2r h LEU 213 Cb 0.38 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 41.89 1h2r h LEU 213 CO 0.01 0.89 0.31 -0.08 -1.08 0.00 0.00 178.44 178.49 1h2r h GLU 214 N 0.54 0.97 -0.19 1.13 4.81 -0.94 -2.51 114.58 118.39 1h2r h GLU 214 Ca 0.11 -0.14 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1h2r h GLU 214 Cb 0.54 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1h2r h GLU 214 CO 0.03 0.76 -0.10 0.00 -0.73 0.00 0.00 179.01 178.98 1h2r h ALA 215 N 1.38 1.49 -0.68 2.92 0.00 -0.64 -1.66 119.26 122.07 1h2r h ALA 215 Ca 0.24 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.03 1h2r h ALA 215 Cb 0.12 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1h2r h ALA 215 CO -0.03 0.36 0.45 -0.07 0.00 0.00 0.00 179.25 179.96 1h2r h LEU 216 N 0.29 0.55 0.07 0.00 3.38 -1.19 -0.17 115.31 118.25 1h2r h LEU 216 Ca 0.06 0.01 -0.32 0.00 0.09 0.00 0.00 57.88 57.71 1h2r h LEU 216 Cb 0.35 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1h2r h LEU 216 CO 0.02 0.34 -1.80 0.03 0.09 0.00 0.00 178.44 177.13 1h2r h ARG 217 N 0.62 0.16 -0.27 1.13 3.08 -1.53 -3.36 114.38 114.20 1h2r h ARG 217 Ca 0.30 -0.27 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1h2r h ARG 217 Cb 0.38 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 1h2r h ARG 217 CO -0.10 0.91 -0.03 1.25 -1.07 0.00 0.00 179.97 180.94 1h2r h LEU 218 N 0.04 0.39 -1.80 3.04 6.46 -0.83 -2.51 115.31 120.10 1h2r h LEU 218 Ca -0.33 -0.07 -0.03 0.00 -0.12 0.00 0.00 57.88 57.33 1h2r h LEU 218 Cb 2.02 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 41.85 1h2r h LEU 218 CO 0.10 0.48 -0.14 0.06 -0.62 0.00 0.00 178.44 178.32 1h2r h GLN 219 N 0.41 0.00 -0.36 1.25 -0.00 -1.18 -1.68 115.11 113.56 1h2r h GLN 219 Ca 0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 58.65 58.67 1h2r h GLN 219 Cb 0.32 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.78 1h2r h GLN 219 CO 0.01 0.14 -0.09 -0.39 -0.00 0.00 0.00 178.83 178.50 1h2r h VAL 220 N 0.00 1.23 -0.11 1.86 -1.51 -1.60 0.40 116.25 116.53 1h2r h VAL 220 Ca -0.00 -1.02 -0.22 0.00 -1.23 0.00 0.00 66.70 64.23 1h2r h VAL 220 Cb 0.39 1.06 0.01 0.00 -2.13 0.00 0.00 31.29 30.61 1h2r h VAL 220 CO 0.02 0.34 -0.81 0.11 -1.23 0.00 0.00 177.57 176.00 1h2r h LYS 221 N 0.56 0.66 -0.61 5.19 1.57 -1.41 -0.09 116.57 122.44 1h2r h LYS 221 Ca 0.10 -0.57 -0.06 0.00 -1.87 0.00 0.00 60.65 58.26 1h2r h LYS 221 Cb 0.48 0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 1h2r h LYS 221 CO 0.03 1.18 0.15 0.00 -0.57 0.00 0.00 179.45 180.25 1h2r h ALA 222 N 0.65 1.11 -0.25 3.86 0.00 -1.00 -2.26 119.26 121.37 1h2r h ALA 222 Ca -0.06 -0.22 -0.17 0.00 0.00 0.00 0.00 54.91 54.46 1h2r h ALA 222 Cb 1.43 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1h2r h ALA 222 CO 0.16 0.60 -0.50 0.00 0.00 0.00 0.00 179.25 179.50 1h2r h ALA 223 N 1.25 0.40 -0.92 0.00 0.00 -0.84 -3.09 119.26 116.05 1h2r h ALA 223 Ca 0.20 -0.49 0.13 0.00 0.00 0.00 0.00 54.91 54.74 1h2r h ALA 223 Cb 0.32 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.97 1h2r h ALA 223 CO -0.00 0.58 0.59 -0.09 0.00 0.00 0.00 179.25 180.33 1h2r h ARG 224 N 0.53 0.78 -0.89 0.00 2.43 -0.72 -0.88 114.38 115.63 1h2r h ARG 224 Ca 0.01 -0.05 0.19 0.00 -0.81 0.00 0.00 59.98 59.32 1h2r h ARG 224 Cb 1.11 -0.18 -0.07 0.00 -0.42 0.00 0.00 29.97 30.42 1h2r h ARG 224 CO 0.11 0.52 0.58 0.00 -1.51 0.00 0.00 179.97 179.67 1h2r h ALA 225 N 1.58 2.11 -0.21 2.80 0.00 -1.33 -0.37 119.26 123.85 1h2r h ALA 225 Ca 0.46 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 55.22 1h2r h ALA 225 Cb 0.61 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1h2r h ALA 225 CO -0.22 -0.38 -0.55 0.52 0.00 0.00 0.00 179.25 178.62 1h2r h MET 226 N 0.47 0.62 0.00 0.00 2.86 -1.29 -3.15 114.93 114.44 1h2r h MET 226 Ca 0.46 -0.39 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1h2r h MET 226 Cb 1.05 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.75 1h2r h MET 226 CO -0.18 1.01 -0.14 0.00 1.06 0.00 0.00 176.91 178.65 1h2r h ALA 227 N 0.91 0.99 -0.44 6.32 0.00 -1.06 0.54 119.26 126.52 1h2r h ALA 227 Ca 0.01 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.87 1h2r h ALA 227 Cb 1.10 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 1h2r h ALA 227 CO 0.11 0.17 0.04 0.28 0.00 0.00 0.00 179.25 179.85 1h2r h VAL 228 N 0.00 0.71 0.00 0.00 2.07 -1.37 -1.63 116.25 116.02 1h2r h VAL 228 Ca -0.00 -0.05 -0.36 0.00 0.82 0.00 0.00 66.70 67.11 1h2r h VAL 228 Cb 0.75 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 1h2r h VAL 228 CO 0.02 0.03 -2.36 0.49 0.02 0.00 0.00 177.57 175.77 1h2r n PHE 229 N -5.16 0.00 1.20 1.57 3.72 -1.22 -4.66 117.46 112.91 1h2r n PHE 229 Ca 0.04 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.53 1h2r n PHE 229 Cb 0.22 -0.98 0.33 0.00 -0.94 0.00 0.00 39.48 38.12 1h2r n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1h2r n GLY 230 N 1.77 0.27 3.44 1.37 0.00 0.19 -4.80 105.19 107.44 1h2r n GLY 230 Ca -0.32 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1h2r n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2r n ALA 231 N 0.29 0.00 -3.64 4.61 0.00 -0.63 -2.18 120.51 118.96 1h2r n ALA 231 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.57 1h2r n ALA 231 Cb 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.74 1h2r n ALA 231 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1h2r s LYS 232 N 0.00 0.67 -0.13 0.00 0.00 -1.26 -4.88 119.74 114.14 1h2r s LYS 232 Ca 0.00 -0.35 -0.06 0.00 0.00 0.00 0.00 55.97 55.56 1h2r s LYS 232 Cb 0.00 0.24 0.05 0.00 0.00 0.00 0.00 37.83 38.13 1h2r s LYS 232 CO 0.00 -0.30 0.30 1.21 0.00 0.00 0.00 175.35 176.56 1h2r s ASN 233 N -2.80 -0.28 0.71 0.03 3.04 -1.26 -3.49 114.94 110.89 1h2r s ASN 233 Ca 0.12 0.65 -0.11 0.00 0.04 0.00 0.00 52.86 53.56 1h2r s ASN 233 Cb 0.01 0.57 0.02 0.00 -1.54 0.00 0.00 41.25 40.31 1h2r s ASN 233 CO -0.03 -0.18 1.07 -2.84 -3.04 0.00 0.00 177.10 172.08 1h2r s PRO 234 N 1.45 2.77 -0.31 0.43 0.02 -1.26 -5.02 135.00 133.08 1h2r s PRO 234 Ca -0.08 0.98 -0.11 0.00 0.02 0.00 0.00 61.00 61.81 1h2r s PRO 234 Cb -0.10 -1.97 0.01 0.00 0.02 0.00 0.00 34.50 32.47 1h2r s PRO 234 CO -0.10 -1.23 0.43 0.72 -0.33 0.00 0.00 177.00 176.50 1h2r n HIS 235 N -3.22 -2.51 -0.85 6.54 8.25 -1.26 -5.03 115.22 117.14 1h2r n HIS 235 Ca 0.08 1.01 -0.32 0.00 -0.26 0.00 0.00 57.72 58.23 1h2r n HIS 235 Cb 0.54 -3.37 0.15 0.00 1.12 0.00 0.00 29.99 28.43 1h2r n HIS 235 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1h2r s THR 236 N -2.17 2.08 -0.44 1.59 2.01 -1.23 -4.74 115.64 112.74 1h2r s THR 236 Ca 0.18 0.03 0.07 0.00 0.31 0.00 0.00 61.69 62.27 1h2r s THR 236 Cb -0.05 -2.19 0.24 0.00 0.01 0.00 0.00 72.50 70.51 1h2r s THR 236 CO 0.55 -0.03 0.71 1.67 -0.69 0.00 0.00 174.62 176.83 1h2r n GLN 237 N -3.91 0.72 0.00 4.92 7.27 -0.93 -4.91 117.38 120.55 1h2r n GLN 237 Ca 0.12 -2.44 0.00 0.00 0.07 0.00 0.00 57.00 54.76 1h2r n GLN 237 Cb 0.52 -1.36 0.00 0.00 2.41 0.00 0.00 30.24 31.80 1h2r n GLN 237 CO 0.00 0.00 0.00 1.97 0.07 0.00 0.00 177.06 179.10 1h2r n PHE 238 N 1.62 0.00 -3.91 3.69 1.16 -1.26 -4.73 117.46 114.03 1h2r n PHE 238 Ca 0.15 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.40 1h2r n PHE 238 Cb 0.58 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.40 1h2r n PHE 238 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 1h2r s THR 239 N 0.00 5.40 0.09 1.97 -4.23 -1.26 -1.09 115.64 116.52 1h2r s THR 239 Ca 0.00 -0.14 -0.09 0.00 -1.18 0.00 0.00 61.69 60.29 1h2r s THR 239 Cb 0.00 -3.50 -0.00 0.00 1.34 0.00 0.00 72.50 70.33 1h2r s THR 239 CO 0.00 0.35 0.19 0.68 -0.54 0.00 0.00 174.62 175.30 1h2r s VAL 240 N -1.29 0.14 0.14 2.29 -7.23 -1.08 -4.91 120.40 108.47 1h2r s VAL 240 Ca 0.26 -1.20 -0.31 0.00 -1.81 0.00 0.00 61.98 58.92 1h2r s VAL 240 Cb -0.13 -1.36 -0.11 0.00 0.56 0.00 0.00 36.38 35.35 1h2r s VAL 240 CO 0.17 -0.64 1.76 -0.69 -0.31 0.00 0.00 175.10 175.38 1h2r s VAL 241 N -3.87 2.46 0.00 1.32 1.01 -1.26 -2.04 120.40 118.02 1h2r s VAL 241 Ca 0.05 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.16 1h2r s VAL 241 Cb 0.05 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.35 1h2r s VAL 241 CO -0.11 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.61 1h2r n GLY 242 N 4.10 1.21 0.00 4.51 0.00 -1.26 -4.87 105.19 108.87 1h2r n GLY 242 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1h2r n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2r n GLY 243 N -1.52 -0.29 3.26 -0.02 0.00 -0.87 -0.75 105.19 105.00 1h2r n GLY 243 Ca 0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 1h2r n GLY 243 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1h2r s VAL 244 N -1.02 0.66 -0.54 1.61 -7.23 -0.37 -2.64 120.40 110.87 1h2r s VAL 244 Ca 0.00 -1.99 0.13 0.00 -1.81 0.00 0.00 61.98 58.32 1h2r s VAL 244 Cb 0.00 -2.25 -0.16 0.00 0.56 0.00 0.00 36.38 34.54 1h2r s VAL 244 CO 0.00 -0.36 0.53 0.35 -0.31 0.00 0.00 175.10 175.31 1h2r n THR 245 N -0.30 0.00 -2.40 5.32 -2.24 -0.25 -4.32 114.28 110.09 1h2r n THR 245 Ca -0.05 -0.20 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 1h2r n THR 245 Cb 0.64 0.88 -0.00 0.00 -2.10 0.00 0.00 70.33 69.74 1h2r n THR 245 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h2r h TYR 247 N 7.41 0.00 0.00 0.00 0.05 -1.97 -1.03 116.97 121.43 1h2r h TYR 247 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.24 1h2r h TYR 247 Cb 0.83 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.57 1h2r h TYR 247 CO 1.42 0.00 0.00 0.22 -1.05 0.00 0.00 178.16 178.75 1h2r h ASP 248 N 0.00 0.00 0.57 3.88 -0.00 -1.98 -2.08 116.42 116.81 1h2r h ASP 248 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.07 1h2r h ASP 248 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.48 1h2r h ASP 248 CO -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 179.24 179.24 1h2r n ALA 249 N -2.01 1.60 0.35 -0.78 0.00 -0.39 -2.32 120.51 116.96 1h2r n ALA 249 Ca -0.01 0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.59 1h2r n ALA 249 Cb 0.14 -1.31 0.19 0.00 0.00 0.00 0.00 19.45 18.47 1h2r n ALA 249 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1h2r h LEU 250 N 0.00 0.00 -9.89 0.00 4.07 -1.56 -3.42 115.31 104.51 1h2r h LEU 250 Ca 0.00 -0.04 -0.50 0.00 0.08 0.00 0.00 57.88 57.43 1h2r h LEU 250 Cb 0.29 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.05 1h2r h LEU 250 CO 0.00 0.02 0.46 0.42 -1.08 0.00 0.00 178.44 178.25 1h2r s THR 251 N -3.21 3.51 0.44 0.22 -4.23 -0.98 -4.94 115.64 106.46 1h2r s THR 251 Ca 0.06 1.33 0.14 0.00 -1.18 0.00 0.00 61.69 62.03 1h2r s THR 251 Cb 0.09 -3.77 0.32 0.00 1.34 0.00 0.00 72.50 70.48 1h2r s THR 251 CO 0.69 0.17 2.01 1.55 -0.54 0.00 0.00 174.62 178.50 1h2r h PRO 252 N 3.08 0.36 -0.22 3.99 0.13 -1.91 -1.71 132.00 135.71 1h2r h PRO 252 Ca -0.48 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 1h2r h PRO 252 Cb 1.22 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1h2r h PRO 252 CO 0.64 0.24 0.09 1.96 -0.23 0.00 0.00 178.00 180.70 1h2r h GLN 253 N 0.37 0.34 -0.37 0.86 7.50 -1.93 0.55 115.11 122.43 1h2r h GLN 253 Ca 0.22 -0.06 -0.14 0.00 0.50 0.00 0.00 58.65 59.17 1h2r h GLN 253 Cb 0.41 -0.05 -0.01 0.00 0.05 0.00 0.00 27.48 27.88 1h2r h GLN 253 CO -0.05 0.40 -0.34 0.00 -1.50 0.00 0.00 178.83 177.33 1h2r h ARG 254 N 0.21 0.84 -0.65 1.46 2.47 -1.64 -1.33 114.38 115.75 1h2r h ARG 254 Ca 0.07 -0.41 -0.06 0.00 -1.26 0.00 0.00 59.98 58.32 1h2r h ARG 254 Cb 0.19 -0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.48 1h2r h ARG 254 CO -0.01 1.05 0.16 0.82 0.56 0.00 0.00 179.97 182.55 1h2r h ILE 255 N 0.70 1.25 -0.54 2.04 2.04 -1.21 -0.90 117.51 120.90 1h2r h ILE 255 Ca 0.07 -0.92 -0.12 0.00 1.00 0.00 0.00 64.86 64.89 1h2r h ILE 255 Cb 0.90 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1h2r h ILE 255 CO 0.08 0.35 -0.13 0.00 0.00 0.00 0.00 178.15 178.45 1h2r h ALA 256 N 1.19 0.75 -0.05 1.87 0.00 -0.67 -0.21 119.26 122.15 1h2r h ALA 256 Ca 0.21 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1h2r h ALA 256 Cb 0.35 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1h2r h ALA 256 CO 0.00 0.68 0.03 1.49 0.00 0.00 0.00 179.25 181.44 1h2r h GLU 257 N 0.91 0.06 0.11 0.00 4.81 -0.90 -1.54 114.58 118.04 1h2r h GLU 257 Ca 0.14 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1h2r h GLU 257 Cb 0.70 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 1h2r h GLU 257 CO 0.05 0.10 -0.14 0.35 -0.73 0.00 0.00 179.01 178.64 1h2r h PHE 258 N 0.01 -0.36 -0.94 0.92 3.04 -1.02 -2.67 116.94 115.92 1h2r h PHE 258 Ca 0.02 0.00 0.12 0.00 3.98 0.00 0.00 57.97 62.09 1h2r h PHE 258 Cb 0.05 0.14 -0.08 0.00 2.56 0.00 0.00 35.95 38.62 1h2r h PHE 258 CO -0.06 -0.21 0.57 1.49 -2.02 0.00 0.00 178.31 178.08 1h2r h GLU 259 N -0.29 0.86 -0.48 1.11 4.81 -0.88 -0.25 114.58 119.47 1h2r h GLU 259 Ca 0.01 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.13 1h2r h GLU 259 Cb 0.29 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1h2r h GLU 259 CO -0.06 0.57 0.07 0.00 -0.73 0.00 0.00 179.01 178.86 1h2r h ALA 260 N 1.53 0.63 -0.52 2.92 0.00 -1.09 0.18 119.26 122.91 1h2r h ALA 260 Ca 0.48 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 1h2r h ALA 260 Cb 0.51 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1h2r h ALA 260 CO -0.28 0.37 0.13 -0.07 0.00 0.00 0.00 179.25 179.41 1h2r h LEU 261 N 0.66 0.78 0.15 0.00 -0.00 -1.05 -2.52 115.31 113.34 1h2r h LEU 261 Ca 0.14 -0.23 -0.01 0.00 -0.00 0.00 0.00 57.88 57.79 1h2r h LEU 261 Cb 0.41 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 40.86 1h2r h LEU 261 CO 0.01 0.81 -0.07 -0.25 -0.00 0.00 0.00 178.44 178.94 1h2r h TRP 262 N 0.72 -0.19 -0.59 1.13 7.01 -0.83 -0.76 115.95 122.45 1h2r h TRP 262 Ca 0.16 -0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.24 1h2r h TRP 262 Cb 0.32 0.06 -0.07 0.00 -2.10 0.00 0.00 29.16 27.38 1h2r h TRP 262 CO 0.02 -0.10 0.24 0.87 -2.79 0.00 0.00 178.44 176.68 1h2r h LYS 263 N -0.22 0.42 -0.45 2.65 1.57 -0.92 0.13 116.57 119.75 1h2r h LYS 263 Ca -0.02 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1h2r h LYS 263 Cb 0.17 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1h2r h LYS 263 CO 0.03 0.28 0.11 1.49 -0.57 0.00 0.00 179.45 180.80 1h2r h GLU 264 N 0.44 0.72 -0.65 3.15 4.81 -1.27 -1.03 114.58 120.74 1h2r h GLU 264 Ca 0.29 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1h2r h GLU 264 Cb 0.32 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1h2r h GLU 264 CO -0.27 0.71 0.33 1.15 -0.73 0.00 0.00 179.01 180.21 1h2r h THR 265 N 0.60 1.22 -0.55 0.32 2.02 -0.57 -1.89 112.91 114.04 1h2r h THR 265 Ca 0.14 -0.58 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 1h2r h THR 265 Cb 0.32 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1h2r h THR 265 CO 0.00 0.24 0.11 0.50 0.37 0.00 0.00 175.52 176.74 1h2r h LYS 266 N 0.90 0.86 -0.58 6.66 3.64 -0.59 -1.53 116.57 125.92 1h2r h LYS 266 Ca 0.23 -0.19 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 1h2r h LYS 266 Cb 0.08 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1h2r h LYS 266 CO -0.03 0.79 0.12 0.00 -2.27 0.00 0.00 179.45 178.06 1h2r h ALA 267 N 1.29 1.11 -0.56 5.00 0.00 -0.76 -0.73 119.26 124.61 1h2r h ALA 267 Ca 0.18 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1h2r h ALA 267 Cb 0.34 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1h2r h ALA 267 CO 0.00 0.59 0.02 0.35 0.00 0.00 0.00 179.25 180.21 1h2r h PHE 268 N 0.88 1.05 0.23 0.00 3.04 -0.80 0.40 116.94 121.74 1h2r h PHE 268 Ca 0.18 -0.18 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 1h2r h PHE 268 Cb 0.35 -0.28 -0.00 0.00 2.56 0.00 0.00 35.95 38.59 1h2r h PHE 268 CO 0.02 0.95 -0.12 0.28 -2.02 0.00 0.00 178.31 177.42 1h2r h VAL 269 N 0.85 0.75 -0.43 1.41 2.07 -0.96 -0.42 116.25 119.52 1h2r h VAL 269 Ca 0.16 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.60 1h2r h VAL 269 Cb 0.52 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1h2r h VAL 269 CO 0.03 0.00 -0.05 0.44 0.02 0.00 0.00 177.57 178.00 1h2r h ASP 270 N -0.33 0.80 0.17 0.57 3.45 -1.00 -1.22 116.42 118.86 1h2r h ASP 270 Ca -0.03 -0.34 0.00 0.00 0.43 0.00 0.00 57.03 57.10 1h2r h ASP 270 Cb 0.26 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 38.81 1h2r h ASP 270 CO 0.04 0.94 -1.66 -0.62 -1.57 0.00 0.00 179.24 176.37 1h2r n GLU 271 N -4.35 0.54 0.03 3.56 1.02 0.12 -4.49 120.64 117.08 1h2r n GLU 271 Ca -0.00 -0.12 -0.01 0.00 -0.02 0.00 0.00 57.16 57.01 1h2r n GLU 271 Cb 0.34 -1.57 -0.00 0.00 -0.02 0.00 0.00 31.44 30.19 1h2r n GLU 271 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1h2r n VAL 272 N -2.20 1.18 0.34 2.62 0.31 -0.28 -4.69 118.33 115.61 1h2r n VAL 272 Ca -0.02 0.36 -0.18 0.00 -0.01 0.00 0.00 64.34 64.49 1h2r n VAL 272 Cb 0.53 -1.63 -0.09 0.00 -0.91 0.00 0.00 33.84 31.74 1h2r n VAL 272 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1h2r h TYR 273 N -0.10 -1.09 -0.21 3.52 3.20 -1.19 -2.27 116.97 118.83 1h2r h TYR 273 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1h2r h TYR 273 Cb 0.10 0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 1h2r h TYR 273 CO -0.04 -0.60 0.14 0.82 -1.64 0.00 0.00 178.16 176.83 1h2r h ILE 274 N -0.97 1.06 -0.76 1.81 1.08 -1.48 -0.88 117.51 117.38 1h2r h ILE 274 Ca -0.07 -0.11 0.03 0.00 -0.39 0.00 0.00 64.86 64.32 1h2r h ILE 274 Cb 0.80 0.75 -0.04 0.00 -3.07 0.00 0.00 36.82 35.26 1h2r h ILE 274 CO 0.05 0.06 0.50 -0.65 -0.69 0.00 0.00 178.15 177.41 1h2r h PRO 275 N 0.28 0.91 -0.47 2.37 0.11 -1.78 -1.65 132.00 131.77 1h2r h PRO 275 Ca 0.08 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.02 1h2r h PRO 275 Cb -0.03 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 30.86 1h2r h PRO 275 CO -0.02 0.60 -0.15 -0.44 -0.21 0.00 0.00 178.00 177.78 1h2r h ASP 276 N 0.94 0.95 -0.33 -2.05 5.19 -1.07 -1.78 116.42 118.28 1h2r h ASP 276 Ca 0.30 -0.38 0.04 0.00 -0.62 0.00 0.00 57.03 56.37 1h2r h ASP 276 Cb 0.02 -0.26 -0.04 0.00 0.18 0.00 0.00 39.33 39.24 1h2r h ASP 276 CO -0.08 1.11 0.11 0.25 -3.12 0.00 0.00 179.24 177.51 1h2r h LEU 277 N 0.78 0.12 -0.78 1.55 6.46 -0.52 -1.13 115.31 121.79 1h2r h LEU 277 Ca 0.11 0.04 -0.09 0.00 -0.12 0.00 0.00 57.88 57.82 1h2r h LEU 277 Cb 0.72 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.65 1h2r h LEU 277 CO 0.05 0.11 -0.07 -0.07 -0.62 0.00 0.00 178.44 177.84 1h2r h LEU 278 N 0.25 0.83 -0.43 2.25 4.07 -1.22 0.03 115.31 121.09 1h2r h LEU 278 Ca 0.15 -0.24 -0.09 0.00 0.08 0.00 0.00 57.88 57.78 1h2r h LEU 278 Cb 0.12 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 1h2r h LEU 278 CO -0.15 0.94 -0.08 0.58 -1.08 0.00 0.00 178.44 178.64 1h2r h VAL 279 N 0.77 1.27 -0.36 1.22 2.07 -1.03 -1.81 116.25 118.38 1h2r h VAL 279 Ca 0.13 -1.18 -0.09 0.00 0.82 0.00 0.00 66.70 66.39 1h2r h VAL 279 Cb 0.57 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1h2r h VAL 279 CO 0.03 0.40 -0.12 0.58 0.02 0.00 0.00 177.57 178.49 1h2r h VAL 280 N 0.64 1.28 -0.63 2.57 2.07 -1.09 -2.61 116.25 118.48 1h2r h VAL 280 Ca 0.11 -1.20 -0.05 0.00 0.82 0.00 0.00 66.70 66.38 1h2r h VAL 280 Cb 0.61 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1h2r h VAL 280 CO 0.04 0.39 0.21 0.00 0.02 0.00 0.00 177.57 178.24 1h2r h ALA 281 N 0.81 1.18 -0.45 1.67 0.00 -0.98 -1.16 119.26 120.34 1h2r h ALA 281 Ca 0.09 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1h2r h ALA 281 Cb 0.63 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1h2r h ALA 281 CO 0.04 0.58 -0.06 0.00 0.00 0.00 0.00 179.25 179.80 1h2r h ALA 282 N 1.31 1.05 0.00 0.00 0.00 -1.25 -2.00 119.26 118.37 1h2r h ALA 282 Ca 0.21 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1h2r h ALA 282 Cb 0.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1h2r h ALA 282 CO -0.01 0.58 -0.36 0.00 0.00 0.00 0.00 179.25 179.46 1h2r h ALA 283 N 1.22 0.89 -0.62 0.00 0.00 -1.06 -3.25 119.26 116.43 1h2r h ALA 283 Ca 0.13 -0.33 -0.41 0.00 0.00 0.00 0.00 54.91 54.30 1h2r h ALA 283 Cb 0.53 -0.06 -0.26 0.00 0.00 0.00 0.00 17.79 18.00 1h2r h ALA 283 CO 0.03 0.45 -0.16 0.66 0.00 0.00 0.00 179.25 180.23 1h2r n TYR 284 N -3.36 2.11 -0.07 0.00 4.02 -0.48 -4.81 117.16 114.57 1h2r n TYR 284 Ca 0.01 -2.12 0.25 0.00 -0.01 0.00 0.00 57.90 56.04 1h2r n TYR 284 Cb 0.56 -0.63 0.70 0.00 -0.02 0.00 0.00 39.34 39.95 1h2r n TYR 284 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1h2r h LYS 285 N 1.62 0.00 0.00 -0.72 1.63 -1.41 0.50 116.57 118.19 1h2r h LYS 285 Ca 0.35 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.15 1h2r h LYS 285 Cb 1.45 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.08 1h2r h LYS 285 CO 0.76 0.00 0.00 0.38 -3.45 0.00 0.00 179.45 177.14 1h2r h ASP 286 N 0.00 0.00 0.00 4.20 -0.00 -1.88 -2.86 116.42 115.89 1h2r h ASP 286 Ca 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.37 1h2r h ASP 286 Cb 1.64 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.97 1h2r h ASP 286 CO -0.00 0.00 0.00 0.79 -0.00 0.00 0.00 179.24 180.03 1h2r n TRP 287 N -2.75 0.00 0.96 4.15 7.02 0.17 -2.20 117.44 124.78 1h2r n TRP 287 Ca -0.00 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.61 1h2r n TRP 287 Cb 0.20 0.00 0.46 0.00 -2.42 0.00 0.00 31.31 29.55 1h2r n TRP 287 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 1h2r n THR 288 N -0.53 0.05 1.12 -0.99 -1.04 -1.08 -2.41 114.28 109.41 1h2r n THR 288 Ca 0.01 -0.03 0.12 0.00 -2.04 0.00 0.00 64.05 62.11 1h2r n THR 288 Cb 0.00 -0.24 0.19 0.00 -1.82 0.00 0.00 70.33 68.47 1h2r n THR 288 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1h2r n GLN 289 N -1.58 1.99 -4.23 -2.82 1.13 -0.93 -4.68 117.38 106.27 1h2r n GLN 289 Ca 0.06 -1.55 -0.13 0.00 -1.94 0.00 0.00 57.00 53.44 1h2r n GLN 289 Cb 0.35 -1.47 -0.10 0.00 0.11 0.00 0.00 30.24 29.13 1h2r n GLN 289 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 1h2r s TYR 290 N -2.08 1.15 -0.39 1.08 2.02 -1.25 -4.90 117.35 112.97 1h2r s TYR 290 Ca 0.29 -0.87 0.00 0.00 -0.37 0.00 0.00 57.07 56.12 1h2r s TYR 290 Cb 0.20 -0.63 0.00 0.00 -0.40 0.00 0.00 41.96 41.13 1h2r s TYR 290 CO 0.35 -0.06 0.00 0.41 -1.57 0.00 0.00 175.55 174.68 1h2r n GLY 291 N -0.17 0.55 3.89 0.71 0.00 -1.23 -0.71 105.19 108.23 1h2r n GLY 291 Ca -0.10 -0.85 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 1h2r n GLY 291 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h2r s GLY 292 N -2.92 1.59 0.20 -0.02 0.00 -1.25 -3.81 107.32 101.11 1h2r s GLY 292 Ca 0.00 -0.28 0.01 0.00 0.00 0.00 0.00 44.72 44.45 1h2r s GLY 292 CO 0.00 -0.06 0.06 -0.51 0.00 0.00 0.00 173.10 172.60 1h2r s THR 293 N -2.97 0.45 -0.26 0.90 -4.23 -1.26 -4.28 115.64 103.98 1h2r s THR 293 Ca 0.51 -1.98 -0.11 0.00 -1.18 0.00 0.00 61.69 58.94 1h2r s THR 293 Cb -0.11 -2.36 -0.15 0.00 1.34 0.00 0.00 72.50 71.22 1h2r s THR 293 CO 0.49 -0.22 -0.23 0.47 -0.54 0.00 0.00 174.62 174.60 1h2r n ASP 294 N -0.31 1.96 -4.62 3.99 10.43 -1.26 -4.84 116.55 121.90 1h2r n ASP 294 Ca -0.03 0.22 -0.30 0.00 2.57 0.00 0.00 54.79 57.26 1h2r n ASP 294 Cb 0.65 -0.74 -0.09 0.00 1.84 0.00 0.00 41.12 42.78 1h2r n ASP 294 CO 0.00 0.00 0.00 0.20 -1.07 0.00 0.00 177.20 176.33 1h2r s ASN 295 N -7.17 4.64 0.01 -2.24 0.01 -1.26 -0.91 114.94 108.02 1h2r s ASN 295 Ca -0.36 -0.29 0.02 0.00 -0.71 0.00 0.00 52.86 51.52 1h2r s ASN 295 Cb 0.12 -0.99 -0.01 0.00 0.41 0.00 0.00 41.25 40.78 1h2r s ASN 295 CO 0.54 0.19 -0.06 -0.36 -1.51 0.00 0.00 177.10 175.90 1h2r s PHE 296 N -1.22 0.54 0.01 2.20 0.40 0.09 -0.75 117.98 119.25 1h2r s PHE 296 Ca 0.22 -0.26 0.01 0.00 -0.60 0.00 0.00 56.93 56.31 1h2r s PHE 296 Cb -0.11 -0.34 -0.01 0.00 0.51 0.00 0.00 43.02 43.07 1h2r s PHE 296 CO 0.15 -0.04 -0.04 0.96 0.70 0.00 0.00 175.22 176.95 1h2r s ILE 297 N -0.63 0.26 -0.09 0.64 -4.36 -0.51 -0.97 121.20 115.54 1h2r s ILE 297 Ca -0.03 -0.37 -0.17 0.00 -0.26 0.00 0.00 60.65 59.82 1h2r s ILE 297 Cb -0.05 -0.27 0.04 0.00 1.25 0.00 0.00 42.46 43.42 1h2r s ILE 297 CO 0.00 -0.07 0.41 0.28 0.24 0.00 0.00 174.94 175.80 1h2r s THR 298 N -0.45 0.02 -0.87 8.37 -1.32 -0.82 -4.37 115.64 116.21 1h2r s THR 298 Ca -0.03 -0.19 0.22 0.00 -1.21 0.00 0.00 61.69 60.48 1h2r s THR 298 Cb -0.04 -0.65 -0.22 0.00 -1.51 0.00 0.00 72.50 70.09 1h2r s THR 298 CO -0.00 -0.10 0.90 0.49 -2.21 0.00 0.00 174.62 173.70 1h2r n PHE 299 N 2.00 0.02 0.00 9.09 0.99 -1.26 -1.67 117.46 126.63 1h2r n PHE 299 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.28 1h2r n PHE 299 Cb 0.57 -0.10 0.00 0.00 -1.00 0.00 0.00 39.48 38.94 1h2r n PHE 299 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1h2r n GLY 300 N 1.47 -1.08 3.38 1.37 0.00 -1.26 -4.00 105.19 105.06 1h2r n GLY 300 Ca 0.03 -1.52 -0.13 0.00 0.00 0.00 0.00 46.02 44.40 1h2r n GLY 300 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h2r s GLU 301 N -3.50 1.08 -0.14 1.61 2.56 -0.42 -3.75 118.70 116.14 1h2r s GLU 301 Ca 0.00 -0.39 -0.00 0.00 0.00 0.00 0.00 54.97 54.58 1h2r s GLU 301 Cb 0.00 0.49 -0.00 0.00 2.00 0.00 0.00 34.13 36.62 1h2r s GLU 301 CO 0.00 -0.41 0.13 1.19 -0.56 0.00 0.00 175.26 175.61 1h2r n PHE 302 N 0.13 -0.55 -2.01 5.30 3.01 -1.26 -1.70 117.46 120.39 1h2r n PHE 302 Ca -0.18 0.21 -0.32 0.00 1.01 0.00 0.00 57.45 58.17 1h2r n PHE 302 Cb 0.62 -1.99 0.01 0.00 -0.01 0.00 0.00 39.48 38.11 1h2r n PHE 302 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1h2r s PRO 303 N -3.00 3.39 -0.16 -1.08 0.04 -1.26 -1.72 135.00 131.20 1h2r s PRO 303 Ca 0.00 1.08 0.13 0.00 0.04 0.00 0.00 61.00 62.24 1h2r s PRO 303 Cb -0.00 -2.05 -0.19 0.00 0.04 0.00 0.00 34.50 32.30 1h2r s PRO 303 CO 0.14 -0.74 0.03 1.63 0.04 0.00 0.00 177.00 178.09 1h2r n LYS 304 N -2.20 1.29 -3.95 4.56 4.76 -1.16 -4.89 118.16 116.57 1h2r n LYS 304 Ca 0.08 0.01 -0.29 0.00 -2.87 0.00 0.00 58.31 55.23 1h2r n LYS 304 Cb 0.53 -1.41 -0.16 0.00 -1.84 0.00 0.00 35.03 32.15 1h2r n LYS 304 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1h2r s ASP 305 N -5.08 2.96 0.57 4.39 3.68 -1.26 -5.02 116.67 116.90 1h2r s ASP 305 Ca -0.10 -0.68 0.38 0.00 2.13 0.00 0.00 52.55 54.28 1h2r s ASP 305 Cb 0.05 -1.07 2.06 0.00 -1.45 0.00 0.00 42.92 42.51 1h2r s ASP 305 CO 0.63 -0.14 2.17 -0.33 0.13 0.00 0.00 175.17 177.63 1h2r h GLU 306 N 8.06 0.00 -0.39 4.34 4.39 -1.96 -2.04 114.58 126.98 1h2r h GLU 306 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 1h2r h GLU 306 Cb 1.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1h2r h GLU 306 CO 0.45 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.96 1h2r n TYR 307 N -2.86 0.51 -3.76 4.33 4.02 -1.26 -4.86 117.16 113.28 1h2r n TYR 307 Ca -0.02 -0.34 -0.29 0.00 -0.01 0.00 0.00 57.90 57.24 1h2r n TYR 307 Cb 0.07 -0.01 -0.15 0.00 -0.02 0.00 0.00 39.34 39.23 1h2r n TYR 307 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1h2r s ASP 308 N -1.17 3.71 0.53 7.72 3.68 -0.77 -5.00 116.67 125.38 1h2r s ASP 308 Ca 0.32 -1.37 0.19 0.00 2.13 0.00 0.00 52.55 53.82 1h2r s ASP 308 Cb 0.18 -0.83 1.37 0.00 -1.45 0.00 0.00 42.92 42.20 1h2r s ASP 308 CO 0.25 -0.37 2.17 -0.07 0.13 0.00 0.00 175.17 177.28 1h2r h LEU 309 N 8.12 0.00 0.00 -1.34 3.38 -1.89 -1.49 115.31 122.09 1h2r h LEU 309 Ca -0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1h2r h LEU 309 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1h2r h LEU 309 CO 0.43 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.55 1h2r n ASN 310 N -4.41 0.00 -0.64 -0.43 4.13 -1.26 -2.54 115.26 110.11 1h2r n ASN 310 Ca -0.03 -1.04 0.13 0.00 1.68 0.00 0.00 54.58 55.33 1h2r n ASN 310 Cb 0.09 0.00 0.39 0.00 -1.54 0.00 0.00 39.78 38.72 1h2r n ASN 310 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1h2r n SER 311 N -0.94 1.99 -4.82 6.41 3.41 -0.56 -4.94 113.62 114.17 1h2r n SER 311 Ca 0.20 -1.67 -0.34 0.00 -0.26 0.00 0.00 58.87 56.80 1h2r n SER 311 Cb 0.09 -0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 63.96 1h2r n SER 311 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1h2r s ARG 312 N -1.97 4.24 0.27 4.33 0.52 -1.05 -2.97 118.95 122.32 1h2r s ARG 312 Ca 0.35 1.01 0.00 0.00 -0.52 0.00 0.00 55.73 56.57 1h2r s ARG 312 Cb 0.21 -2.45 0.53 0.00 0.52 0.00 0.00 34.95 33.76 1h2r s ARG 312 CO 0.32 0.13 1.82 0.35 0.02 0.00 0.00 175.30 177.94 1h2r h PHE 313 N 2.42 1.06 -3.33 -0.53 3.57 -0.45 -3.36 116.94 116.33 1h2r h PHE 313 Ca -0.48 0.03 -0.64 0.00 3.53 0.00 0.00 57.97 60.41 1h2r h PHE 313 Cb 1.18 -0.33 -0.21 0.00 2.79 0.00 0.00 35.95 39.38 1h2r h PHE 313 CO 0.62 0.40 -0.67 -0.06 -2.23 0.00 0.00 178.31 176.38 1h2r s PHE 314 N -5.97 3.02 0.10 0.41 0.08 -0.95 -4.99 117.98 109.69 1h2r s PHE 314 Ca -0.12 -0.26 -0.01 0.00 0.12 0.00 0.00 56.93 56.66 1h2r s PHE 314 Cb 0.22 -1.93 -0.04 0.00 -0.57 0.00 0.00 43.02 40.69 1h2r s PHE 314 CO 0.80 0.01 0.28 0.15 -0.10 0.00 0.00 175.22 176.35 1h2r s LYS 315 N 0.23 3.49 0.91 0.44 1.02 -1.26 -1.30 119.74 123.27 1h2r s LYS 315 Ca -0.03 -0.36 -0.12 0.00 0.02 0.00 0.00 55.97 55.49 1h2r s LYS 315 Cb -0.14 -2.97 0.14 0.00 -0.52 0.00 0.00 37.83 34.34 1h2r s LYS 315 CO 0.03 0.55 1.09 -1.25 -0.92 0.00 0.00 175.35 174.85 1h2r s PRO 316 N -2.69 1.16 0.00 -1.68 0.04 -1.26 -4.23 135.00 126.35 1h2r s PRO 316 Ca 0.37 0.83 0.00 0.00 0.04 0.00 0.00 61.00 62.24 1h2r s PRO 316 Cb -0.12 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.62 1h2r s PRO 316 CO 0.27 -2.31 0.00 0.41 0.04 0.00 0.00 177.00 175.41 1h2r n GLY 317 N -1.04 2.19 3.13 0.56 0.00 -0.67 -4.84 105.19 104.52 1h2r n GLY 317 Ca 0.07 -0.64 -0.21 0.00 0.00 0.00 0.00 46.02 45.23 1h2r n GLY 317 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1h2r s VAL 318 N -2.00 1.13 -0.03 1.61 -7.23 -0.42 -1.93 120.40 111.53 1h2r s VAL 318 Ca 0.00 -0.78 0.01 0.00 -1.81 0.00 0.00 61.98 59.40 1h2r s VAL 318 Cb 0.00 -0.97 0.01 0.00 0.56 0.00 0.00 36.38 35.98 1h2r s VAL 318 CO 0.00 0.18 -0.05 -0.69 -0.31 0.00 0.00 175.10 174.23 1h2r s VAL 319 N -0.55 0.52 -0.07 1.32 1.01 -0.14 -0.94 120.40 121.54 1h2r s VAL 319 Ca 0.04 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.86 1h2r s VAL 319 Cb -0.06 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 1h2r s VAL 319 CO 0.00 0.20 -0.08 -0.36 0.00 0.00 0.00 175.10 174.86 1h2r s PHE 320 N 0.56 2.91 -1.59 5.22 0.08 -1.26 -0.73 117.98 123.16 1h2r s PHE 320 Ca -0.07 -0.03 -0.12 0.00 0.12 0.00 0.00 56.93 56.82 1h2r s PHE 320 Cb -0.11 -1.71 0.10 0.00 -0.57 0.00 0.00 43.02 40.73 1h2r s PHE 320 CO 0.00 0.28 0.71 1.63 -0.10 0.00 0.00 175.22 177.74 1h2r n LYS 321 N 2.33 -3.60 -1.16 0.44 5.02 -0.85 -1.33 118.16 119.00 1h2r n LYS 321 Ca -0.18 0.42 -0.09 0.00 -2.02 0.00 0.00 58.31 56.45 1h2r n LYS 321 Cb 0.53 -5.00 -0.04 0.00 -0.02 0.00 0.00 35.03 30.50 1h2r n LYS 321 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1h2r n ARG 322 N -4.44 -1.68 -2.21 1.97 1.74 -0.09 -4.86 116.66 107.09 1h2r n ARG 322 Ca -0.05 0.71 -0.39 0.00 -0.77 0.00 0.00 57.85 57.35 1h2r n ARG 322 Cb 0.55 -4.93 -0.02 0.00 -1.02 0.00 0.00 32.46 27.05 1h2r n ARG 322 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1h2r n ASP 323 N -0.59 4.14 0.00 0.55 4.64 -0.44 -4.74 116.55 120.11 1h2r n ASP 323 Ca -0.09 -2.84 0.09 0.00 -1.38 0.00 0.00 54.79 50.57 1h2r n ASP 323 Cb 0.48 -1.68 0.41 0.00 -1.04 0.00 0.00 41.12 39.29 1h2r n ASP 323 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 1h2r n PHE 324 N 9.39 0.00 0.73 -0.67 3.72 -1.26 -1.93 117.46 127.44 1h2r n PHE 324 Ca 0.49 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 58.01 1h2r n PHE 324 Cb 0.45 -0.41 0.35 0.00 -0.94 0.00 0.00 39.48 38.92 1h2r n PHE 324 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1h2r n LYS 325 N -1.41 0.19 -3.16 -1.08 5.02 -1.26 -4.20 118.16 112.25 1h2r n LYS 325 Ca 0.06 0.10 -0.25 0.00 -2.02 0.00 0.00 58.31 56.20 1h2r n LYS 325 Cb 0.18 -1.67 -0.05 0.00 -0.02 0.00 0.00 35.03 33.47 1h2r n LYS 325 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1h2r n ASN 326 N -1.96 3.13 -4.69 4.39 5.03 -0.81 -5.07 115.26 115.27 1h2r n ASN 326 Ca 0.05 -3.38 -0.42 0.00 0.87 0.00 0.00 54.58 51.70 1h2r n ASN 326 Cb 0.40 -0.61 -0.03 0.00 -1.02 0.00 0.00 39.78 38.52 1h2r n ASN 326 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1h2r s ILE 327 N -3.10 3.49 0.17 2.41 1.01 -1.26 -4.84 121.20 119.09 1h2r s ILE 327 Ca 0.43 0.89 -0.03 0.00 0.00 0.00 0.00 60.65 61.93 1h2r s ILE 327 Cb 0.24 -3.57 -0.05 0.00 0.01 0.00 0.00 42.46 39.08 1h2r s ILE 327 CO -0.09 -0.00 0.40 -0.54 0.00 0.00 0.00 174.94 174.71 1h2r s LYS 328 N 2.52 3.59 0.64 2.79 1.02 -0.12 -4.92 119.74 125.25 1h2r s LYS 328 Ca 0.67 -0.16 -0.16 0.00 0.02 0.00 0.00 55.97 56.34 1h2r s LYS 328 Cb -0.34 -2.83 -0.01 0.00 -0.52 0.00 0.00 37.83 34.13 1h2r s LYS 328 CO 0.28 0.42 1.12 -1.25 -0.92 0.00 0.00 175.35 175.01 1h2r s PRO 329 N -2.95 2.88 -0.25 -1.68 0.04 -1.26 -1.30 135.00 130.48 1h2r s PRO 329 Ca 0.40 1.48 -0.22 0.00 0.04 0.00 0.00 61.00 62.70 1h2r s PRO 329 Cb -0.12 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.46 1h2r s PRO 329 CO 0.27 -1.20 0.73 0.12 0.04 0.00 0.00 177.00 176.95 1h2r s PHE 330 N -2.16 3.29 -0.32 0.56 5.36 -1.26 -4.62 117.98 118.83 1h2r s PHE 330 Ca 0.69 0.97 -0.04 0.00 -0.96 0.00 0.00 56.93 57.59 1h2r s PHE 330 Cb -0.22 -2.95 0.05 0.00 -0.34 0.00 0.00 43.02 39.55 1h2r s PHE 330 CO 0.38 -0.37 0.05 0.34 -1.46 0.00 0.00 175.22 174.16 1h2r s ASP 331 N 1.41 5.08 0.65 6.13 3.68 -1.26 -5.00 116.67 127.36 1h2r s ASP 331 Ca 0.30 -1.22 0.43 0.00 2.13 0.00 0.00 52.55 54.19 1h2r s ASP 331 Cb -0.15 -1.78 2.31 0.00 -1.45 0.00 0.00 42.92 41.84 1h2r s ASP 331 CO 0.08 -0.29 2.34 0.07 0.13 0.00 0.00 175.17 177.50 1h2r h LYS 332 N 8.09 0.00 -0.00 4.34 2.10 -2.01 -1.50 116.57 127.59 1h2r h LYS 332 Ca -0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 1h2r h LYS 332 Cb 1.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.40 1h2r h LYS 332 CO 0.56 0.00 -0.05 -1.33 -2.00 0.00 0.00 179.45 176.64 1h2r n MET 333 N -3.16 0.35 -0.15 0.07 2.81 -1.26 -3.53 117.12 112.25 1h2r n MET 333 Ca -0.03 -0.04 0.07 0.00 -1.81 0.00 0.00 57.70 55.89 1h2r n MET 333 Cb 0.09 -1.50 0.21 0.00 -0.71 0.00 0.00 33.22 31.31 1h2r n MET 333 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1h2r n GLN 334 N -1.29 1.78 -3.73 0.03 1.13 -0.56 -4.86 117.38 109.88 1h2r n GLN 334 Ca 0.12 -1.21 -0.36 0.00 -1.94 0.00 0.00 57.00 53.61 1h2r n GLN 334 Cb 0.28 -1.30 -0.07 0.00 0.11 0.00 0.00 30.24 29.25 1h2r n GLN 334 CO 0.00 0.00 0.00 -1.50 -1.44 0.00 0.00 177.06 174.12 1h2r s ILE 335 N -1.59 5.41 -0.01 5.09 2.07 -1.23 -3.90 121.20 127.04 1h2r s ILE 335 Ca 0.25 0.26 0.01 0.00 -1.41 0.00 0.00 60.65 59.76 1h2r s ILE 335 Cb 0.13 -3.48 0.00 0.00 0.13 0.00 0.00 42.46 39.24 1h2r s ILE 335 CO 0.18 0.48 -0.02 -1.61 -1.91 0.00 0.00 174.94 172.06 1h2r s GLU 336 N 0.02 0.25 -0.24 3.50 2.02 -0.89 -4.28 118.70 119.07 1h2r s GLU 336 Ca 0.11 -0.07 -0.07 0.00 0.02 0.00 0.00 54.97 54.96 1h2r s GLU 336 Cb -0.12 -0.27 -0.03 0.00 0.10 0.00 0.00 34.13 33.81 1h2r s GLU 336 CO 0.01 0.02 0.07 -1.21 0.02 0.00 0.00 175.26 174.17 1h2r s GLU 337 N 0.14 3.71 0.41 1.61 2.02 -0.20 -1.07 118.70 125.33 1h2r s GLU 337 Ca -0.01 -0.45 -0.09 0.00 0.02 0.00 0.00 54.97 54.44 1h2r s GLU 337 Cb -0.04 -3.32 -0.06 0.00 0.10 0.00 0.00 34.13 30.81 1h2r s GLU 337 CO -0.00 -0.12 0.75 -1.01 0.02 0.00 0.00 175.26 174.89 1h2r s HIS 338 N 1.45 3.49 0.00 1.61 3.76 0.04 -1.79 115.29 123.84 1h2r s HIS 338 Ca 0.06 0.95 0.00 0.00 -0.15 0.00 0.00 55.06 55.92 1h2r s HIS 338 Cb -0.15 -2.38 0.00 0.00 1.11 0.00 0.00 32.58 31.17 1h2r s HIS 338 CO 0.04 -0.11 0.19 1.33 -0.85 0.00 0.00 174.74 175.34 1h2r n VAL 339 N -1.45 0.00 -0.31 -0.90 0.24 -1.26 -1.24 118.33 113.41 1h2r n VAL 339 Ca 0.02 -0.24 0.12 0.00 -2.04 0.00 0.00 64.34 62.20 1h2r n VAL 339 Cb 0.54 1.41 0.30 0.00 -1.47 0.00 0.00 33.84 34.62 1h2r n VAL 339 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1h2r h ARG 340 N 0.00 0.49 -0.41 7.34 9.65 -1.77 -0.56 114.38 129.13 1h2r h ARG 340 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1h2r h ARG 340 Cb 0.21 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.68 1h2r h ARG 340 CO 0.00 0.32 0.00 0.72 2.80 0.00 0.00 179.97 183.81 1h2r n HIS 341 N -4.96 1.33 -4.35 2.20 8.25 -1.26 -4.61 115.22 111.82 1h2r n HIS 341 Ca 0.21 -0.78 -0.24 0.00 -0.26 0.00 0.00 57.72 56.66 1h2r n HIS 341 Cb 0.60 -0.35 -0.08 0.00 1.12 0.00 0.00 29.99 31.28 1h2r n HIS 341 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1h2r s SER 342 N -1.40 4.19 -1.41 0.41 0.01 -0.22 -1.22 113.70 114.05 1h2r s SER 342 Ca 0.46 -0.84 -0.09 0.00 1.31 0.00 0.00 55.95 56.79 1h2r s SER 342 Cb 0.35 -0.61 -0.08 0.00 0.21 0.00 0.00 66.02 65.88 1h2r s SER 342 CO 0.13 -0.05 2.96 0.79 0.41 0.00 0.00 173.24 177.49 1h2r n TRP 343 N -0.83 2.19 -4.27 2.43 8.01 -0.48 -4.83 117.44 119.66 1h2r n TRP 343 Ca -0.05 -2.89 -0.15 0.00 -1.31 0.00 0.00 57.50 53.10 1h2r n TRP 343 Cb 0.60 -2.31 -0.10 0.00 -2.01 0.00 0.00 31.31 27.49 1h2r n TRP 343 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 1h2r s TYR 344 N 1.59 1.32 0.22 -5.99 1.51 -1.23 -1.17 117.35 113.60 1h2r s TYR 344 Ca 0.68 -0.87 -0.30 0.00 -1.01 0.00 0.00 57.07 55.57 1h2r s TYR 344 Cb 0.20 -0.72 -0.09 0.00 -0.11 0.00 0.00 41.96 41.24 1h2r s TYR 344 CO -0.06 -0.03 1.26 -2.00 -1.11 0.00 0.00 175.55 173.61 1h2r s GLU 345 N -3.82 4.43 2.51 -0.62 2.56 -0.00 -4.67 118.70 119.08 1h2r s GLU 345 Ca 0.21 2.02 0.00 0.00 0.00 0.00 0.00 54.97 57.20 1h2r s GLU 345 Cb 0.04 -3.18 0.00 0.00 2.00 0.00 0.00 34.13 32.99 1h2r s GLU 345 CO 0.03 -0.16 0.00 0.41 -0.56 0.00 0.00 175.26 174.98 1h2r n GLY 346 N 1.96 -0.84 0.06 -1.50 0.00 -1.26 -4.69 105.19 98.92 1h2r n GLY 346 Ca 0.04 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1h2r n GLY 346 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2r n ALA 347 N 3.18 1.13 -2.65 4.61 0.00 -1.26 -4.35 120.51 121.16 1h2r n ALA 347 Ca 0.00 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.58 1h2r n ALA 347 Cb 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 19.45 19.37 1h2r n ALA 347 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1h2r s GLU 348 N 0.00 4.23 0.40 0.00 2.12 -1.26 -4.39 118.70 119.80 1h2r s GLU 348 Ca 0.00 1.15 -0.24 0.00 0.36 0.00 0.00 54.97 56.24 1h2r s GLU 348 Cb 0.00 -3.64 -0.09 0.00 0.26 0.00 0.00 34.13 30.66 1h2r s GLU 348 CO 0.00 -0.56 1.03 0.00 -0.54 0.00 0.00 175.26 175.19 1h2r s ALA 349 N 2.99 3.08 0.01 6.30 0.00 -1.26 -4.51 121.76 128.36 1h2r s ALA 349 Ca 0.39 0.66 0.01 0.00 0.00 0.00 0.00 51.96 53.03 1h2r s ALA 349 Cb -0.15 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.70 1h2r s ALA 349 CO 0.07 -0.17 -0.05 1.03 0.00 0.00 0.00 175.76 176.64 1h2r s ARG 350 N -2.56 0.37 0.37 0.00 1.81 -0.74 -4.88 118.95 113.32 1h2r s ARG 350 Ca 0.58 -0.35 -0.25 0.00 -1.72 0.00 0.00 55.73 53.99 1h2r s ARG 350 Cb -0.21 -0.26 -0.09 0.00 -0.45 0.00 0.00 34.95 33.94 1h2r s ARG 350 CO 0.26 0.06 1.07 -1.58 -0.68 0.00 0.00 175.30 174.42 1h2r s HIS 351 N -0.57 3.34 0.48 -0.53 5.65 -1.26 -1.03 115.29 121.37 1h2r s HIS 351 Ca -0.03 1.66 0.29 0.00 0.25 0.00 0.00 55.06 57.23 1h2r s HIS 351 Cb -0.05 -3.18 1.37 0.00 -1.18 0.00 0.00 32.58 29.55 1h2r s HIS 351 CO -0.00 -0.63 1.79 -1.35 -0.65 0.00 0.00 174.74 173.90 1h2r h PRO 352 N 2.83 0.15 0.00 2.88 0.11 -1.96 0.16 132.00 136.17 1h2r h PRO 352 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1h2r h PRO 352 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1h2r h PRO 352 CO 0.63 0.10 0.00 0.91 -0.21 0.00 0.00 178.00 179.43 1h2r n TRP 353 N -4.37 0.00 -2.24 0.65 8.01 -1.26 -2.48 117.44 115.74 1h2r n TRP 353 Ca 0.25 0.00 0.03 0.00 -1.31 0.00 0.00 57.50 56.47 1h2r n TRP 353 Cb 1.10 -0.30 0.08 0.00 -2.01 0.00 0.00 31.31 30.17 1h2r n TRP 353 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1h2r n LYS 354 N -1.30 0.82 -1.62 -0.99 5.02 0.52 -4.96 118.16 115.65 1h2r n LYS 354 Ca 0.11 -2.64 -0.32 0.00 -2.02 0.00 0.00 58.31 53.44 1h2r n LYS 354 Cb 0.19 -0.75 0.06 0.00 -0.02 0.00 0.00 35.03 34.51 1h2r n LYS 354 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1h2r s GLY 355 N -2.62 1.92 -0.01 0.72 0.00 -0.90 -4.61 107.32 101.81 1h2r s GLY 355 Ca 0.35 0.35 0.01 0.00 0.00 0.00 0.00 44.72 45.44 1h2r s GLY 355 CO -0.12 0.69 -0.04 1.20 0.00 0.00 0.00 173.10 174.84 1h2r s GLN 356 N -4.51 0.35 -0.47 2.90 -0.21 -1.26 -5.03 119.66 111.44 1h2r s GLN 356 Ca 0.63 -0.12 0.03 0.00 0.02 0.00 0.00 55.36 55.92 1h2r s GLN 356 Cb -0.18 -0.36 0.16 0.00 1.00 0.00 0.00 33.01 33.63 1h2r s GLN 356 CO 0.48 0.06 0.32 0.99 -2.12 0.00 0.00 175.29 175.02 1h2r s THR 357 N 0.07 1.14 -0.55 -0.19 2.01 -1.26 -5.04 115.64 111.81 1h2r s THR 357 Ca -0.00 -2.82 0.03 0.00 0.31 0.00 0.00 61.69 59.21 1h2r s THR 357 Cb -0.03 -1.79 0.14 0.00 0.01 0.00 0.00 72.50 70.83 1h2r s THR 357 CO -0.00 -1.05 0.31 -1.10 -0.69 0.00 0.00 174.62 172.09 1h2r s GLN 358 N -0.01 2.13 0.51 4.92 -0.21 -1.26 -4.89 119.66 120.85 1h2r s GLN 358 Ca 0.25 -2.66 -0.23 0.00 0.02 0.00 0.00 55.36 52.74 1h2r s GLN 358 Cb -0.10 -3.41 -0.06 0.00 1.00 0.00 0.00 33.01 30.44 1h2r s GLN 358 CO -0.10 -1.13 1.37 -1.25 -2.12 0.00 0.00 175.29 172.05 1h2r s PRO 359 N -0.33 3.36 -0.30 2.91 0.04 -1.26 -0.82 135.00 138.60 1h2r s PRO 359 Ca 0.18 2.27 0.03 0.00 0.04 0.00 0.00 61.00 63.51 1h2r s PRO 359 Cb -0.24 -2.40 0.20 0.00 0.04 0.00 0.00 34.50 32.10 1h2r s PRO 359 CO -0.02 -1.02 0.69 0.21 0.04 0.00 0.00 177.00 176.90 1h2r s LYS 360 N -2.74 0.48 0.17 4.56 2.20 -0.31 -4.65 119.74 119.46 1h2r s LYS 360 Ca 0.67 0.43 -0.29 0.00 -0.36 0.00 0.00 55.97 56.42 1h2r s LYS 360 Cb -0.41 0.20 -0.08 0.00 -1.51 0.00 0.00 37.83 36.04 1h2r s LYS 360 CO 0.50 -0.89 0.92 -0.47 -0.36 0.00 0.00 175.35 175.04 1h2r s TYR 361 N 2.80 3.90 0.00 4.03 5.04 -1.26 -3.55 117.35 128.31 1h2r s TYR 361 Ca 0.14 1.82 0.00 0.00 -2.44 0.00 0.00 57.07 56.59 1h2r s TYR 361 Cb -0.08 -2.97 0.00 0.00 0.35 0.00 0.00 41.96 39.26 1h2r s TYR 361 CO -0.24 0.37 0.56 0.25 -1.34 0.00 0.00 175.55 175.14 1h2r n THR 362 N 2.04 0.31 -0.28 4.34 -2.24 -1.26 -5.10 114.28 112.09 1h2r n THR 362 Ca -0.01 -0.47 0.03 0.00 -2.27 0.00 0.00 64.05 61.34 1h2r n THR 362 Cb 0.48 1.03 -0.02 0.00 -2.10 0.00 0.00 70.33 69.73 1h2r n THR 362 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1h2r n ASP 363 N -0.16 -1.60 -4.45 3.42 4.64 -1.26 -3.61 116.55 113.53 1h2r n ASP 363 Ca 0.00 0.23 -0.48 0.00 -1.38 0.00 0.00 54.79 53.15 1h2r n ASP 363 Cb 0.22 -0.91 -0.08 0.00 -1.04 0.00 0.00 41.12 39.31 1h2r n ASP 363 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1h2r n LEU 364 N -2.70 1.93 -0.04 -2.67 4.32 -1.26 -0.79 117.00 115.79 1h2r n LEU 364 Ca -0.01 0.30 -0.01 0.00 -0.02 0.00 0.00 56.01 56.27 1h2r n LEU 364 Cb 0.13 -1.25 -0.00 0.00 -1.62 0.00 0.00 43.42 40.67 1h2r n LEU 364 CO 0.01 -0.82 -0.01 1.41 -1.22 0.00 0.00 177.39 176.76 1h2r n HIS 365 N 10.51 0.00 -2.10 -1.77 8.25 0.74 -4.98 115.22 125.88 1h2r n HIS 365 Ca 0.44 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.47 1h2r n HIS 365 Cb 0.24 -0.66 -0.03 0.00 1.12 0.00 0.00 29.99 30.66 1h2r n HIS 365 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1h2r s GLY 366 N -2.08 1.53 -1.57 -1.41 0.00 0.03 -1.54 107.32 102.29 1h2r s GLY 366 Ca 0.00 0.80 -0.04 0.00 0.00 0.00 0.00 44.72 45.48 1h2r s GLY 366 CO 0.00 2.92 0.49 1.34 0.00 0.00 0.00 173.10 177.86 1h2r n ASP 367 N 7.14 -5.87 -1.70 1.64 4.64 -1.26 -2.29 116.55 118.85 1h2r n ASP 367 Ca 0.17 -0.24 -0.16 0.00 -1.38 0.00 0.00 54.79 53.18 1h2r n ASP 367 Cb 0.43 -4.78 -0.02 0.00 -1.04 0.00 0.00 41.12 35.72 1h2r n ASP 367 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 1h2r n ASP 368 N -2.41 -4.83 -4.42 1.67 4.64 -0.59 -4.95 116.55 105.66 1h2r n ASP 368 Ca -0.13 0.08 -0.33 0.00 -1.38 0.00 0.00 54.79 53.03 1h2r n ASP 368 Cb 0.63 -3.90 -0.14 0.00 -1.04 0.00 0.00 41.12 36.67 1h2r n ASP 368 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1h2r s ARG 369 N -4.48 2.87 0.00 -0.67 0.52 -0.97 -4.40 118.95 111.82 1h2r s ARG 369 Ca 0.00 -0.70 0.01 0.00 -0.52 0.00 0.00 55.73 54.52 1h2r s ARG 369 Cb 0.00 -2.47 0.01 0.00 0.52 0.00 0.00 34.95 33.01 1h2r s ARG 369 CO 0.00 0.44 0.88 2.48 0.02 0.00 0.00 175.30 179.12 1h2r n TYR 370 N 2.84 0.00 -3.50 -0.53 4.11 -0.36 -0.18 117.16 119.54 1h2r n TYR 370 Ca -0.18 -0.02 -0.15 0.00 -0.00 0.00 0.00 57.90 57.56 1h2r n TYR 370 Cb 0.52 0.03 -0.04 0.00 -0.00 0.00 0.00 39.34 39.85 1h2r n TYR 370 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1h2r s SER 371 N -0.77 -0.56 0.00 9.48 0.15 -1.24 -4.30 113.70 116.46 1h2r s SER 371 Ca 0.01 0.30 0.26 0.00 0.70 0.00 0.00 55.95 57.22 1h2r s SER 371 Cb 0.01 0.55 0.74 0.00 -1.71 0.00 0.00 66.02 65.61 1h2r s SER 371 CO -0.01 -0.77 1.56 0.79 1.20 0.00 0.00 173.24 176.02 1h2r n TRP 372 N 0.30 0.00 -2.93 3.44 7.02 -0.97 -1.38 117.44 122.92 1h2r n TRP 372 Ca -0.18 0.00 -0.39 0.00 -1.02 0.00 0.00 57.50 55.91 1h2r n TRP 372 Cb 0.61 -0.18 -0.06 0.00 -2.42 0.00 0.00 31.31 29.25 1h2r n TRP 372 CO 0.00 0.00 0.00 -1.64 -2.02 0.00 0.00 177.69 174.03 1h2r s MET 373 N -2.68 4.58 0.75 -0.99 -1.94 -1.26 -4.82 119.30 112.93 1h2r s MET 373 Ca 0.20 1.20 -0.11 0.00 -1.71 0.00 0.00 55.69 55.27 1h2r s MET 373 Cb 0.19 -3.16 0.04 0.00 2.01 0.00 0.00 34.83 33.91 1h2r s MET 373 CO 0.57 0.50 1.12 0.15 -0.01 0.00 0.00 175.02 177.36 1h2r s LYS 374 N -1.38 2.46 -0.47 2.03 1.02 -1.26 -4.47 119.74 117.67 1h2r s LYS 374 Ca 0.39 0.28 -0.00 0.00 0.02 0.00 0.00 55.97 56.66 1h2r s LYS 374 Cb -0.22 -2.00 0.13 0.00 -0.52 0.00 0.00 37.83 35.21 1h2r s LYS 374 CO 0.26 -1.27 0.24 0.00 -0.92 0.00 0.00 175.35 173.66 1h2r s ALA 375 N -3.44 3.24 0.24 5.17 0.00 -0.37 -4.32 121.76 122.28 1h2r s ALA 375 Ca 0.60 -2.87 -0.30 0.00 0.00 0.00 0.00 51.96 49.39 1h2r s ALA 375 Cb -0.11 -2.34 -0.09 0.00 0.00 0.00 0.00 23.12 20.58 1h2r s ALA 375 CO 0.50 -1.90 1.24 -2.14 0.00 0.00 0.00 175.76 173.47 1h2r s PRO 376 N 0.50 4.45 -0.01 0.00 0.02 -1.26 -0.78 135.00 137.92 1h2r s PRO 376 Ca 0.13 2.01 0.02 0.00 0.02 0.00 0.00 61.00 63.18 1h2r s PRO 376 Cb -0.22 -3.17 -0.00 0.00 0.02 0.00 0.00 34.50 31.12 1h2r s PRO 376 CO -0.04 -0.11 -0.07 1.03 -0.33 0.00 0.00 177.00 177.47 1h2r s ARG 377 N -0.78 0.63 0.00 5.54 1.81 -0.23 -4.67 118.95 121.24 1h2r s ARG 377 Ca 0.52 -0.25 0.00 0.00 -1.72 0.00 0.00 55.73 54.27 1h2r s ARG 377 Cb -0.36 -0.61 0.00 0.00 -0.45 0.00 0.00 34.95 33.54 1h2r s ARG 377 CO 0.42 0.14 0.00 0.98 -0.68 0.00 0.00 175.30 176.16 1h2r n TYR 378 N 3.00 0.00 -2.12 -0.53 4.19 -0.42 -2.09 117.16 119.18 1h2r n TYR 378 Ca -0.14 0.00 -0.38 0.00 3.31 0.00 0.00 57.90 60.69 1h2r n TYR 378 Cb 0.57 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.40 1h2r n TYR 378 CO 0.00 0.00 0.00 -1.33 0.91 0.00 0.00 176.86 176.44 1h2r n MET 379 N 0.00 4.25 -0.97 2.98 2.81 -1.25 -4.28 117.12 120.65 1h2r n MET 379 Ca 0.00 -3.70 0.00 0.00 -1.81 0.00 0.00 57.70 52.19 1h2r n MET 379 Cb 0.00 -2.44 0.00 0.00 -0.71 0.00 0.00 33.22 30.07 1h2r n MET 379 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1h2r n GLY 380 N 0.61 0.84 3.76 3.03 0.00 -1.26 -5.04 105.19 107.14 1h2r n GLY 380 Ca 0.54 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.23 1h2r n GLY 380 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h2r s GLU 381 N -0.03 2.97 0.05 1.61 0.41 -1.26 -4.96 118.70 117.50 1h2r s GLU 381 Ca 0.00 -0.56 -0.29 0.00 -0.41 0.00 0.00 54.97 53.71 1h2r s GLU 381 Cb 0.00 -2.79 -0.05 0.00 -1.78 0.00 0.00 34.13 29.51 1h2r s GLU 381 CO 0.00 0.62 0.94 -1.25 -0.49 0.00 0.00 175.26 175.08 1h2r s PRO 382 N -1.86 4.61 -0.05 0.39 0.04 -1.26 -1.30 135.00 135.58 1h2r s PRO 382 Ca 0.24 1.38 0.05 0.00 0.04 0.00 0.00 61.00 62.71 1h2r s PRO 382 Cb -0.12 -3.41 -0.01 0.00 0.04 0.00 0.00 34.50 31.00 1h2r s PRO 382 CO 0.15 0.10 -0.21 -1.64 0.04 0.00 0.00 177.00 175.45 1h2r s MET 383 N 0.44 2.09 0.19 4.56 -1.94 -1.26 -4.51 119.30 118.88 1h2r s MET 383 Ca 0.48 -0.75 -0.22 0.00 -1.71 0.00 0.00 55.69 53.48 1h2r s MET 383 Cb -0.22 -1.82 -0.08 0.00 2.01 0.00 0.00 34.83 34.72 1h2r s MET 383 CO 0.28 0.33 0.75 -2.00 -0.01 0.00 0.00 175.02 174.37 1h2r s GLU 384 N -0.12 4.40 0.16 2.03 2.12 0.07 -4.24 118.70 123.13 1h2r s GLU 384 Ca -0.02 1.01 0.03 0.00 0.36 0.00 0.00 54.97 56.35 1h2r s GLU 384 Cb -0.12 -3.06 -0.05 0.00 0.26 0.00 0.00 34.13 31.16 1h2r s GLU 384 CO 0.02 0.48 -0.03 -0.08 -0.54 0.00 0.00 175.26 175.11 1h2r s THR 385 N -1.34 0.83 -0.69 -1.70 -1.32 -1.26 -1.42 115.64 108.73 1h2r s THR 385 Ca 0.39 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.88 1h2r s THR 385 Cb -0.20 -2.02 0.00 0.00 -1.51 0.00 0.00 72.50 68.78 1h2r s THR 385 CO 0.23 -0.58 0.00 0.61 -2.21 0.00 0.00 174.62 172.67 1h2r n GLY 386 N -0.22 0.45 0.25 6.08 0.00 -1.12 -4.67 105.19 105.96 1h2r n GLY 386 Ca -0.08 -2.25 0.03 0.00 0.00 0.00 0.00 46.02 43.72 1h2r n GLY 386 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1h2r h PRO 387 N 4.93 0.20 -0.80 1.61 0.11 -1.83 -1.20 132.00 135.00 1h2r h PRO 387 Ca 0.00 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 1h2r h PRO 387 Cb 0.00 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.03 1h2r h PRO 387 CO 0.00 0.13 0.42 1.25 -0.21 0.00 0.00 178.00 179.59 1h2r h LEU 388 N 0.20 1.02 -0.38 2.35 6.46 -1.87 -0.66 115.31 122.44 1h2r h LEU 388 Ca 0.36 -0.12 -0.16 0.00 -0.12 0.00 0.00 57.88 57.85 1h2r h LEU 388 Cb 0.60 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 40.26 1h2r h LEU 388 CO -0.51 0.85 -0.40 0.00 -0.62 0.00 0.00 178.44 177.77 1h2r h ALA 389 N 1.22 0.56 -0.29 1.25 0.00 -1.68 -0.93 119.26 119.39 1h2r h ALA 389 Ca 0.28 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1h2r h ALA 389 Cb 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1h2r h ALA 389 CO -0.04 0.67 0.04 0.37 0.00 0.00 0.00 179.25 180.29 1h2r h GLN 390 N 0.76 0.48 0.20 0.00 4.15 -0.98 -1.91 115.11 117.80 1h2r h GLN 390 Ca 0.06 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 1h2r h GLN 390 Cb 0.99 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.63 1h2r h GLN 390 CO 0.10 0.60 -0.10 0.28 -1.93 0.00 0.00 178.83 177.78 1h2r h VAL 391 N 0.29 0.89 -0.70 2.39 2.07 -1.12 -1.04 116.25 119.04 1h2r h VAL 391 Ca 0.09 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 1h2r h VAL 391 Cb 0.36 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1h2r h VAL 391 CO 0.01 0.12 0.42 -0.07 0.02 0.00 0.00 177.57 178.06 1h2r h LEU 392 N -0.54 0.84 -0.23 2.57 3.38 -1.21 0.45 115.31 120.57 1h2r h LEU 392 Ca -0.03 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1h2r h LEU 392 Cb 0.40 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1h2r h LEU 392 CO 0.04 0.66 0.02 0.40 0.09 0.00 0.00 178.44 179.66 1h2r h ILE 393 N 0.95 1.24 -0.77 1.22 2.04 -1.36 -1.44 117.51 119.39 1h2r h ILE 393 Ca 0.25 -0.83 -0.05 0.00 1.00 0.00 0.00 64.86 65.23 1h2r h ILE 393 Cb -0.02 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1h2r h ILE 393 CO -0.05 0.26 0.28 0.00 0.00 0.00 0.00 178.15 178.64 1h2r h ALA 394 N 0.82 1.03 -0.40 1.87 0.00 -0.94 -0.77 119.26 120.87 1h2r h ALA 394 Ca 0.07 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1h2r h ALA 394 Cb 0.37 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1h2r h ALA 394 CO 0.01 0.67 0.22 -0.92 0.00 0.00 0.00 179.25 179.23 1h2r h TYR 395 N 1.13 0.42 0.00 0.00 3.20 -0.75 -0.99 116.97 119.98 1h2r h TYR 395 Ca 0.25 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.10 1h2r h TYR 395 Cb 0.26 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 1h2r h TYR 395 CO 0.02 0.24 -0.17 0.77 -1.64 0.00 0.00 178.16 177.38 1h2r h SER 396 N 0.46 0.00 -0.05 -2.11 0.02 -0.79 -0.79 113.55 110.29 1h2r h SER 396 Ca 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1h2r h SER 396 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 1h2r h SER 396 CO -0.09 0.17 0.00 0.00 -1.14 0.00 0.00 176.83 175.77 1h2r n GLN 397 N -3.76 1.35 -1.06 3.45 6.02 -0.34 -4.92 117.38 118.13 1h2r n GLN 397 Ca -0.02 -0.52 0.00 0.00 -0.01 0.00 0.00 57.00 56.46 1h2r n GLN 397 Cb 0.28 -1.40 0.00 0.00 1.02 0.00 0.00 30.24 30.14 1h2r n GLN 397 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1h2r n GLY 398 N 1.01 0.45 3.64 1.08 0.00 -0.30 -5.00 105.19 106.07 1h2r n GLY 398 Ca 0.18 -0.96 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 1h2r n GLY 398 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1h2r s HIS 399 N -2.00 1.31 0.13 1.61 5.04 -0.44 -4.89 115.29 116.05 1h2r s HIS 399 Ca 0.00 -0.05 -0.23 0.00 -1.54 0.00 0.00 55.06 53.24 1h2r s HIS 399 Cb 0.00 -4.12 -0.04 0.00 0.04 0.00 0.00 32.58 28.47 1h2r s HIS 399 CO 0.00 -4.88 1.67 -1.35 -2.34 0.00 0.00 174.74 167.84 1h2r h PRO 400 N 12.03 -0.21 -0.49 2.88 0.11 -1.94 -0.69 132.00 143.69 1h2r h PRO 400 Ca -0.45 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.59 1h2r h PRO 400 Cb 1.23 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 1h2r h PRO 400 CO 0.95 -0.14 -0.00 0.87 -0.21 0.00 0.00 178.00 179.47 1h2r h LYS 401 N -0.22 0.87 -0.43 1.05 1.57 -2.00 -1.37 116.57 116.04 1h2r h LYS 401 Ca 0.08 -0.28 -0.06 0.00 -1.87 0.00 0.00 60.65 58.52 1h2r h LYS 401 Cb 0.33 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1h2r h LYS 401 CO -0.21 0.90 0.04 0.28 -0.57 0.00 0.00 179.45 179.89 1h2r h VAL 402 N 0.73 1.25 -0.33 0.50 2.07 -1.92 -2.49 116.25 116.06 1h2r h VAL 402 Ca 0.14 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.70 1h2r h VAL 402 Cb 0.51 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1h2r h VAL 402 CO 0.03 0.33 0.22 0.50 0.02 0.00 0.00 177.57 178.66 1h2r h LYS 403 N 0.58 0.44 0.16 1.57 3.64 -1.03 -0.83 116.57 121.10 1h2r h LYS 403 Ca 0.13 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1h2r h LYS 403 Cb 0.43 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1h2r h LYS 403 CO 0.01 0.30 -0.19 0.00 -2.27 0.00 0.00 179.45 177.30 1h2r h ALA 404 N 1.11 -0.37 -0.47 5.00 0.00 -1.14 -0.86 119.26 122.53 1h2r h ALA 404 Ca 0.12 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 1h2r h ALA 404 Cb -0.04 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1h2r h ALA 404 CO -0.03 -0.74 -0.22 -0.24 0.00 0.00 0.00 179.25 178.03 1h2r h VAL 405 N -0.40 1.27 -0.42 0.00 3.04 -1.38 -2.25 116.25 116.11 1h2r h VAL 405 Ca 0.01 -1.38 -0.04 0.00 -1.01 0.00 0.00 66.70 64.28 1h2r h VAL 405 Cb 0.39 1.14 -0.02 0.00 -2.01 0.00 0.00 31.29 30.79 1h2r h VAL 405 CO -0.07 0.48 0.13 0.71 -1.01 0.00 0.00 177.57 177.80 1h2r h THR 406 N 0.83 1.22 -0.97 3.17 1.35 -1.00 -1.11 112.91 116.40 1h2r h THR 406 Ca 0.11 -0.74 0.02 0.00 -0.55 0.00 0.00 66.41 65.25 1h2r h THR 406 Cb 0.79 0.91 -0.05 0.00 -1.73 0.00 0.00 68.15 68.07 1h2r h THR 406 CO 0.07 0.26 0.64 0.44 -0.25 0.00 0.00 175.52 176.68 1h2r h ASP 407 N 0.54 1.09 -0.58 5.36 3.32 -1.12 0.48 116.42 125.50 1h2r h ASP 407 Ca 0.13 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 1h2r h ASP 407 Cb 0.27 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1h2r h ASP 407 CO -0.00 0.77 0.15 0.00 -1.72 0.00 0.00 179.24 178.44 1h2r h ALA 408 N 1.37 0.76 -0.58 3.45 0.00 -1.04 -0.15 119.26 123.07 1h2r h ALA 408 Ca 0.37 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1h2r h ALA 408 Cb -0.09 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1h2r h ALA 408 CO -0.10 0.46 0.15 0.28 0.00 0.00 0.00 179.25 180.04 1h2r h VAL 409 N 0.83 1.25 -0.50 0.00 2.07 -0.38 -0.37 116.25 119.15 1h2r h VAL 409 Ca 0.18 -0.89 -0.09 0.00 0.82 0.00 0.00 66.70 66.72 1h2r h VAL 409 Cb 0.33 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1h2r h VAL 409 CO -0.00 0.33 -0.05 -0.07 0.02 0.00 0.00 177.57 177.80 1h2r h LEU 410 N 0.84 0.86 -0.49 2.57 4.07 -0.70 -1.79 115.31 120.68 1h2r h LEU 410 Ca 0.18 -0.24 -0.15 0.00 0.08 0.00 0.00 57.88 57.75 1h2r h LEU 410 Cb 0.34 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1h2r h LEU 410 CO 0.00 0.95 -0.36 0.00 -1.08 0.00 0.00 178.44 177.96 1h2r h ALA 411 N 1.13 0.67 -0.50 1.53 0.00 -0.84 0.19 119.26 121.44 1h2r h ALA 411 Ca 0.14 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1h2r h ALA 411 Cb 0.55 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1h2r h ALA 411 CO 0.03 0.67 0.23 -0.22 0.00 0.00 0.00 179.25 179.96 1h2r h LYS 412 N 0.70 0.73 0.00 0.00 1.63 -0.86 -2.65 116.57 116.12 1h2r h LYS 412 Ca 0.06 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 1h2r h LYS 412 Cb 0.93 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.43 1h2r h LYS 412 CO 0.09 0.62 0.00 1.28 -3.45 0.00 0.00 179.45 177.99 1h2r n LEU 413 N -4.59 0.70 -3.16 5.20 4.77 -0.69 -4.94 117.00 114.29 1h2r n LEU 413 Ca 0.02 0.57 -0.17 0.00 -0.03 0.00 0.00 56.01 56.40 1h2r n LEU 413 Cb 0.13 -0.36 0.07 0.00 -2.33 0.00 0.00 43.42 40.93 1h2r n LEU 413 CO 0.37 -0.19 0.15 0.61 -1.33 0.00 0.00 177.39 177.00 1h2r n GLY 414 N 1.21 -0.30 3.26 -0.72 0.00 0.01 -5.02 105.19 103.63 1h2r n GLY 414 Ca 0.05 0.08 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 1h2r n GLY 414 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1h2r s VAL 415 N -3.30 1.11 0.54 1.61 -7.23 -0.96 -5.06 120.40 107.12 1h2r s VAL 415 Ca 0.22 -2.05 -0.05 0.00 -1.81 0.00 0.00 61.98 58.29 1h2r s VAL 415 Cb -0.10 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 34.88 1h2r s VAL 415 CO 0.64 -0.65 0.83 -0.83 -0.31 0.00 0.00 175.10 174.78 1h2r s GLY 416 N -3.19 1.57 0.61 2.32 0.00 -1.26 -4.71 107.32 102.65 1h2r s GLY 416 Ca 0.19 -0.69 0.30 0.00 0.00 0.00 0.00 44.72 44.52 1h2r s GLY 416 CO 0.02 -0.46 2.09 -0.56 0.00 0.00 0.00 173.10 174.19 1h2r h PRO 417 N 0.02 0.00 0.00 2.90 0.13 -2.02 -0.06 132.00 132.97 1h2r h PRO 417 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1h2r h PRO 417 Cb 1.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1h2r h PRO 417 CO 0.60 0.00 -0.06 0.93 -0.23 0.00 0.00 178.00 179.25 1h2r h GLU 418 N 0.00 0.00 0.00 0.86 3.07 -2.01 -1.96 114.58 114.54 1h2r h GLU 418 Ca 0.08 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1h2r h GLU 418 Cb 0.50 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1h2r h GLU 418 CO -0.00 0.06 -0.02 0.00 -1.40 0.00 0.00 179.01 177.65 1h2r h ALA 419 N 1.94 1.45 0.00 3.43 0.00 -1.35 -2.81 119.26 121.93 1h2r h ALA 419 Ca -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1h2r h ALA 419 Cb 0.19 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1h2r h ALA 419 CO 0.01 0.02 -0.19 -0.07 0.00 0.00 0.00 179.25 179.02 1h2r h LEU 420 N 0.00 0.00 -5.86 0.00 3.38 -1.55 -3.34 115.31 107.94 1h2r h LEU 420 Ca -0.00 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.26 1h2r h LEU 420 Cb 0.04 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 1h2r h LEU 420 CO 0.00 0.19 3.16 0.49 0.09 0.00 0.00 178.44 182.38 1h2r n PHE 421 N -4.06 3.29 -3.78 1.13 3.72 -1.06 -3.93 117.46 112.78 1h2r n PHE 421 Ca -0.02 -2.98 -0.02 0.00 -0.05 0.00 0.00 57.45 54.37 1h2r n PHE 421 Cb 0.27 -2.49 -0.00 0.00 -0.94 0.00 0.00 39.48 36.31 1h2r n PHE 421 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1h2r s SER 422 N 2.80 -0.10 0.21 4.37 1.04 -1.26 -3.91 113.70 116.85 1h2r s SER 422 Ca 0.50 -0.43 -0.10 0.00 0.48 0.00 0.00 55.95 56.40 1h2r s SER 422 Cb 0.14 0.43 0.18 0.00 0.10 0.00 0.00 66.02 66.87 1h2r s SER 422 CO -0.08 -0.81 1.86 0.74 0.98 0.00 0.00 173.24 175.94 1h2r h THR 423 N 2.00 1.14 -0.55 2.02 2.02 -1.02 0.74 112.91 119.27 1h2r h THR 423 Ca -0.26 -0.32 -0.07 0.00 0.77 0.00 0.00 66.41 66.52 1h2r h THR 423 Cb 1.22 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1h2r h THR 423 CO 0.29 0.17 0.06 0.25 0.37 0.00 0.00 175.52 176.66 1h2r h LEU 424 N 0.94 0.90 -0.87 2.58 6.46 -1.72 -1.91 115.31 121.69 1h2r h LEU 424 Ca 0.28 -0.28 -0.04 0.00 -0.12 0.00 0.00 57.88 57.73 1h2r h LEU 424 Cb -0.04 -0.24 -0.04 0.00 -0.73 0.00 0.00 40.66 39.61 1h2r h LEU 424 CO -0.09 0.95 0.37 1.23 -0.62 0.00 0.00 178.44 180.28 1h2r h GLY 425 N 0.81 1.28 1.07 3.75 0.00 -1.46 -0.69 103.07 107.83 1h2r h GLY 425 Ca 0.16 -0.65 -0.09 0.00 0.00 0.00 0.00 47.33 46.75 1h2r h GLY 425 CO 0.02 0.62 0.06 -0.09 0.00 0.00 0.00 176.54 177.15 1h2r h ARG 426 N 1.17 1.08 -0.53 4.80 2.43 -0.67 0.43 114.38 123.09 1h2r h ARG 426 Ca 0.28 -0.31 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 1h2r h ARG 426 Cb 0.15 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1h2r h ARG 426 CO -0.03 1.02 -0.02 1.15 -1.51 0.00 0.00 179.97 180.58 1h2r h THR 427 N 1.00 1.27 -0.52 0.20 2.02 -1.00 -2.22 112.91 113.65 1h2r h THR 427 Ca 0.19 -1.14 -0.10 0.00 0.77 0.00 0.00 66.41 66.13 1h2r h THR 427 Cb 0.49 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 1h2r h THR 427 CO 0.02 0.40 -0.07 0.00 0.37 0.00 0.00 175.52 176.25 1h2r h ALA 428 N 0.94 0.71 -0.40 6.16 0.00 -0.83 -2.85 119.26 123.00 1h2r h ALA 428 Ca 0.15 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1h2r h ALA 428 Cb 0.56 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1h2r h ALA 428 CO 0.03 0.59 0.07 0.00 0.00 0.00 0.00 179.25 179.94 1h2r h ALA 429 N 0.92 1.38 -0.88 0.00 0.00 -0.78 0.37 119.26 120.27 1h2r h ALA 429 Ca 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1h2r h ALA 429 Cb 0.62 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1h2r h ALA 429 CO 0.04 0.44 0.50 -0.09 0.00 0.00 0.00 179.25 180.15 1h2r h ARG 430 N 0.59 1.22 -0.07 0.00 2.43 -1.18 -0.91 114.38 116.45 1h2r h ARG 430 Ca 0.13 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1h2r h ARG 430 Cb 0.27 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1h2r h ARG 430 CO 0.00 0.87 0.00 0.78 -1.51 0.00 0.00 179.97 180.12 1h2r h GLY 431 N 1.22 0.13 0.50 2.80 0.00 -1.08 -2.24 103.07 104.40 1h2r h GLY 431 Ca 0.31 -0.10 0.07 0.00 0.00 0.00 0.00 47.33 47.62 1h2r h GLY 431 CO -0.05 0.09 0.20 -2.22 0.00 0.00 0.00 176.54 174.55 1h2r h ILE 432 N -0.16 0.82 -0.82 2.60 2.04 -0.72 -1.62 117.51 119.65 1h2r h ILE 432 Ca 0.02 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 65.78 1h2r h ILE 432 Cb 0.34 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 1h2r h ILE 432 CO 0.00 0.07 0.53 -0.08 0.00 0.00 0.00 178.15 178.68 1h2r h GLU 433 N 0.38 1.02 -0.62 2.37 4.81 -1.12 -1.11 114.58 120.31 1h2r h GLU 433 Ca 0.26 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 1h2r h GLU 433 Cb 0.28 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1h2r h GLU 433 CO -0.26 0.67 0.22 1.15 -0.73 0.00 0.00 179.01 180.07 1h2r h THR 434 N 1.05 1.24 -0.29 0.32 2.02 -0.75 -1.10 112.91 115.40 1h2r h THR 434 Ca 0.32 -0.78 -0.04 0.00 0.77 0.00 0.00 66.41 66.69 1h2r h THR 434 Cb -0.02 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1h2r h THR 434 CO -0.10 0.30 0.03 0.00 0.37 0.00 0.00 175.52 176.12 1h2r h ALA 435 N 1.08 0.38 -0.46 6.16 0.00 -0.78 -0.80 119.26 124.84 1h2r h ALA 435 Ca 0.20 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1h2r h ALA 435 Cb 0.25 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1h2r h ALA 435 CO -0.01 0.09 0.00 -0.39 0.00 0.00 0.00 179.25 178.94 1h2r h VAL 436 N 0.29 1.26 -0.54 0.00 -1.51 -1.14 -2.72 116.25 111.88 1h2r h VAL 436 Ca 0.09 -1.05 -0.10 0.00 -1.23 0.00 0.00 66.70 64.41 1h2r h VAL 436 Cb 0.37 1.03 -0.02 0.00 -2.13 0.00 0.00 31.29 30.53 1h2r h VAL 436 CO 0.01 0.36 -0.06 0.40 -1.23 0.00 0.00 177.57 177.05 1h2r h ILE 437 N 0.66 1.26 -0.88 7.19 2.04 -1.15 -1.01 117.51 125.63 1h2r h ILE 437 Ca 0.13 -1.19 0.06 0.00 1.00 0.00 0.00 64.86 64.86 1h2r h ILE 437 Cb 0.50 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.42 1h2r h ILE 437 CO 0.02 0.42 0.55 0.00 0.00 0.00 0.00 178.15 179.15 1h2r h ALA 438 N 1.04 1.19 -0.26 1.87 0.00 -1.04 0.23 119.26 122.28 1h2r h ALA 438 Ca 0.15 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.86 1h2r h ALA 438 Cb 0.60 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1h2r h ALA 438 CO 0.04 0.32 -0.56 1.49 0.00 0.00 0.00 179.25 180.54 1h2r h GLU 439 N 1.02 0.81 -0.18 0.00 4.81 -1.15 -3.21 114.58 116.68 1h2r h GLU 439 Ca 0.37 -0.52 -0.06 0.00 -0.13 0.00 0.00 59.36 59.02 1h2r h GLU 439 Cb 0.13 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1h2r h GLU 439 CO -0.16 1.15 -0.17 -0.92 -0.73 0.00 0.00 179.01 178.18 1h2r h TYR 440 N 0.62 0.33 -0.67 0.92 3.20 -0.03 -2.04 116.97 119.29 1h2r h TYR 440 Ca 0.01 -0.05 0.07 0.00 3.14 0.00 0.00 58.73 61.91 1h2r h TYR 440 Cb 1.16 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 39.29 1h2r h TYR 440 CO 0.07 0.47 0.45 0.28 -1.64 0.00 0.00 178.16 177.78 1h2r h VAL 441 N 0.28 0.98 -0.71 1.81 2.07 -1.00 -0.24 116.25 119.46 1h2r h VAL 441 Ca 0.05 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 1h2r h VAL 441 Cb 0.47 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1h2r h VAL 441 CO 0.03 0.12 0.22 1.23 0.02 0.00 0.00 177.57 179.19 1h2r h GLY 442 N 0.64 1.17 0.71 2.17 0.00 -1.47 0.24 103.07 106.52 1h2r h GLY 442 Ca 0.30 -0.68 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 1h2r h GLY 442 CO -0.10 0.63 -0.09 -2.08 0.00 0.00 0.00 176.54 174.90 1h2r h VAL 443 N 1.05 1.34 -0.95 4.60 2.07 -1.23 -2.34 116.25 120.79 1h2r h VAL 443 Ca 0.23 -1.20 0.05 0.00 0.82 0.00 0.00 66.70 66.60 1h2r h VAL 443 Cb 0.29 1.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.87 1h2r h VAL 443 CO -0.01 0.35 0.61 0.24 0.02 0.00 0.00 177.57 178.78 1h2r h MET 444 N -0.10 1.11 -0.30 1.57 2.86 -0.86 -1.45 114.93 117.76 1h2r h MET 444 Ca 0.02 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1h2r h MET 444 Cb 0.59 -0.25 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1h2r h MET 444 CO 0.02 0.73 0.20 1.25 1.06 0.00 0.00 176.91 180.18 1h2r h LEU 445 N 1.14 0.34 -0.64 1.22 6.46 -0.90 0.41 115.31 123.34 1h2r h LEU 445 Ca 0.40 -0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 58.14 1h2r h LEU 445 Cb 0.10 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 39.91 1h2r h LEU 445 CO -0.15 0.25 0.37 -0.61 -0.62 0.00 0.00 178.44 177.68 1h2r h GLN 446 N 0.40 0.87 -0.86 1.25 5.75 -0.84 0.39 115.11 122.08 1h2r h GLN 446 Ca 0.11 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1h2r h GLN 446 Cb -0.04 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.29 1h2r h GLN 446 CO -0.03 0.64 0.51 0.93 -2.65 0.00 0.00 178.83 178.23 1h2r h GLU 447 N 0.87 1.18 -0.10 1.69 5.08 -0.86 0.13 114.58 122.57 1h2r h GLU 447 Ca 0.23 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1h2r h GLU 447 Cb 0.00 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.00 1h2r h GLU 447 CO -0.04 0.84 0.04 -0.92 -1.00 0.00 0.00 179.01 177.93 1h2r h TYR 448 N 1.19 0.14 -0.62 4.33 -0.00 -0.47 -1.56 116.97 119.99 1h2r h TYR 448 Ca 0.31 -0.01 0.07 0.00 -0.00 0.00 0.00 58.73 59.10 1h2r h TYR 448 Cb -0.03 -0.04 -0.06 0.00 -0.00 0.00 0.00 36.73 36.60 1h2r h TYR 448 CO 0.00 0.24 0.31 0.87 -0.00 0.00 0.00 178.16 179.58 1h2r h LYS 449 N 0.01 0.55 -0.54 1.82 1.57 -0.23 -1.72 116.57 118.03 1h2r h LYS 449 Ca 0.03 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 1h2r h LYS 449 Cb 0.15 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1h2r h LYS 449 CO -0.00 0.37 0.07 -0.44 -0.57 0.00 0.00 179.45 178.87 1h2r h ASP 450 N 0.57 0.82 -0.49 0.86 3.45 -0.59 -1.48 116.42 119.57 1h2r h ASP 450 Ca 0.29 -0.18 -0.10 0.00 0.43 0.00 0.00 57.03 57.47 1h2r h ASP 450 Cb 0.24 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.78 1h2r h ASP 450 CO -0.22 0.85 -0.09 -1.13 -1.57 0.00 0.00 179.24 177.08 1h2r h ASN 451 N 0.82 0.94 -0.74 6.45 -0.00 -0.62 -2.36 115.58 120.07 1h2r h ASN 451 Ca 0.17 -0.35 -0.06 0.00 -0.00 0.00 0.00 56.30 56.06 1h2r h ASN 451 Cb 0.40 -0.25 -0.03 0.00 -0.00 0.00 0.00 38.32 38.43 1h2r h ASN 451 CO 0.01 1.07 0.23 0.40 -0.00 0.00 0.00 177.43 179.14 1h2r h ILE 452 N 0.79 1.26 -0.22 2.57 2.04 -1.16 -2.55 117.51 120.24 1h2r h ILE 452 Ca 0.13 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 65.10 1h2r h ILE 452 Cb 0.64 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1h2r h ILE 452 CO 0.04 0.36 0.15 0.00 0.00 0.00 0.00 178.15 178.70 1h2r h ALA 453 N 1.14 1.93 0.00 1.87 0.00 -0.89 -0.41 119.26 122.90 1h2r h ALA 453 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1h2r h ALA 453 Cb 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1h2r h ALA 453 CO -0.01 0.05 0.00 0.87 0.00 0.00 0.00 179.25 180.16 1h2r h LYS 454 N 0.23 0.00 0.00 0.00 1.57 -1.01 -3.46 116.57 113.90 1h2r h LYS 454 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1h2r h LYS 454 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1h2r h LYS 454 CO -0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.27 1h2r n GLY 455 N 0.29 1.26 3.52 3.86 0.00 -0.16 -5.07 105.19 108.88 1h2r n GLY 455 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 1h2r n GLY 455 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1h2r s ASP 456 N -2.00 6.34 -0.17 1.61 2.15 -1.15 -4.89 116.67 118.57 1h2r s ASP 456 Ca 0.00 -0.29 0.16 0.00 0.43 0.00 0.00 52.55 52.85 1h2r s ASP 456 Cb 0.00 -2.33 0.35 0.00 -0.30 0.00 0.00 42.92 40.64 1h2r s ASP 456 CO 0.00 -0.80 1.18 -0.46 -0.17 0.00 0.00 175.17 174.93 1h2r n ASN 457 N 6.33 2.10 -4.80 -0.34 2.04 -1.26 -4.34 115.26 114.99 1h2r n ASN 457 Ca -0.01 -3.44 -0.37 0.00 -0.44 0.00 0.00 54.58 50.32 1h2r n ASN 457 Cb 0.48 -0.47 -0.06 0.00 -2.53 0.00 0.00 39.78 37.19 1h2r n ASN 457 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1h2r s VAL 458 N -3.03 5.18 0.00 3.53 1.01 -1.26 -4.98 120.40 120.84 1h2r s VAL 458 Ca 0.35 0.70 0.00 0.00 0.00 0.00 0.00 61.98 63.03 1h2r s VAL 458 Cb 0.32 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 33.03 1h2r s VAL 458 CO -0.01 0.51 0.14 2.30 0.00 0.00 0.00 175.10 178.04 1h2r n ILE 459 N 2.51 0.00 -3.77 2.22 -5.35 -1.26 -4.12 119.36 109.58 1h2r n ILE 459 Ca -0.13 -0.29 -0.13 0.00 -0.27 0.00 0.00 62.75 61.93 1h2r n ILE 459 Cb 0.52 1.20 -0.11 0.00 -1.74 0.00 0.00 39.64 39.52 1h2r n ILE 459 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1h2r s ALA 461 N -0.03 2.66 0.57 0.00 0.00 0.07 -4.91 121.76 120.11 1h2r s ALA 461 Ca -0.02 -1.29 -0.18 0.00 0.00 0.00 0.00 51.96 50.47 1h2r s ALA 461 Cb -0.03 -0.69 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 1h2r s ALA 461 CO 0.01 0.59 1.09 -1.25 0.00 0.00 0.00 175.76 176.19 1h2r s PRO 462 N -1.89 3.33 0.33 0.00 0.04 -1.26 -4.57 135.00 130.98 1h2r s PRO 462 Ca 0.17 1.40 -0.11 0.00 0.04 0.00 0.00 61.00 62.50 1h2r s PRO 462 Cb -0.11 -2.02 0.02 0.00 0.04 0.00 0.00 34.50 32.43 1h2r s PRO 462 CO 0.08 -0.83 0.60 1.67 0.04 0.00 0.00 177.00 178.57 1h2r s TRP 463 N -2.12 0.48 -0.04 0.56 1.48 -1.26 -4.97 118.94 113.08 1h2r s TRP 463 Ca 0.68 -0.91 -0.02 0.00 -1.06 0.00 0.00 56.10 54.79 1h2r s TRP 463 Cb -0.19 0.35 0.02 0.00 -1.16 0.00 0.00 33.47 32.48 1h2r s TRP 463 CO 0.31 -1.25 0.09 -1.21 -4.06 0.00 0.00 176.95 170.83 1h2r s GLU 464 N -3.13 0.08 -0.30 3.25 2.02 -1.26 -5.13 118.70 114.22 1h2r s GLU 464 Ca 0.22 0.17 -0.29 0.00 0.02 0.00 0.00 54.97 55.09 1h2r s GLU 464 Cb -0.02 -0.03 0.01 0.00 0.10 0.00 0.00 34.13 34.19 1h2r s GLU 464 CO 0.14 -0.06 1.18 1.41 0.02 0.00 0.00 175.26 177.95 1h2r s MET 465 N 0.36 4.02 0.72 1.61 -2.45 -1.26 -4.90 119.30 117.39 1h2r s MET 465 Ca -0.03 1.18 -0.11 0.00 -1.25 0.00 0.00 55.69 55.48 1h2r s MET 465 Cb -0.04 -3.80 0.02 0.00 1.25 0.00 0.00 34.83 32.26 1h2r s MET 465 CO -0.01 -0.98 1.07 -1.25 1.05 0.00 0.00 175.02 174.89 1h2r s PRO 466 N 3.85 2.77 0.05 4.11 0.04 -1.26 -4.98 135.00 139.58 1h2r s PRO 466 Ca 0.50 0.90 -0.10 0.00 0.04 0.00 0.00 61.00 62.35 1h2r s PRO 466 Cb -0.15 -1.97 -0.32 0.00 0.04 0.00 0.00 34.50 32.10 1h2r s PRO 466 CO 0.19 -1.21 1.06 -0.22 0.04 0.00 0.00 177.00 176.86 1h2r h LYS 467 N -0.80 0.41 -3.89 4.56 1.63 -1.94 -3.37 116.57 113.17 1h2r h LYS 467 Ca -0.44 -0.70 -0.37 0.00 -0.85 0.00 0.00 60.65 58.29 1h2r h LYS 467 Cb 1.22 0.26 -0.33 0.00 -0.60 0.00 0.00 32.23 32.78 1h2r h LYS 467 CO 0.57 1.33 -0.76 -1.14 -3.45 0.00 0.00 179.45 176.01 1h2r s GLN 468 N -2.63 0.55 0.09 1.90 0.74 -1.26 -0.18 119.66 118.87 1h2r s GLN 468 Ca -0.07 -0.03 -0.26 0.00 0.05 0.00 0.00 55.36 55.05 1h2r s GLN 468 Cb 0.06 -0.63 0.09 0.00 1.10 0.00 0.00 33.01 33.62 1h2r s GLN 468 CO 0.92 -0.09 1.11 0.00 -0.55 0.00 0.00 175.29 176.68 1h2r s ALA 469 N 0.88 -1.90 0.02 1.58 0.00 -0.80 -4.98 121.76 116.56 1h2r s ALA 469 Ca -0.10 0.20 0.01 0.00 0.00 0.00 0.00 51.96 52.07 1h2r s ALA 469 Cb -0.13 0.60 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 1h2r s ALA 469 CO -0.01 -1.06 -0.05 -1.83 0.00 0.00 0.00 175.76 172.81 1h2r s GLU 470 N -2.67 0.39 0.22 0.00 -1.05 -1.26 -0.55 118.70 113.77 1h2r s GLU 470 Ca 0.16 -0.55 -0.20 0.00 -0.15 0.00 0.00 54.97 54.23 1h2r s GLU 470 Cb 0.00 -0.15 0.04 0.00 -0.44 0.00 0.00 34.13 33.58 1h2r s GLU 470 CO 0.01 0.02 0.62 0.20 0.95 0.00 0.00 175.26 177.06 1h2r s GLY 471 N -1.17 -0.24 -0.10 -3.83 0.00 -0.92 -4.31 107.32 96.75 1h2r s GLY 471 Ca -0.09 -0.05 -0.16 0.00 0.00 0.00 0.00 44.72 44.41 1h2r s GLY 471 CO -0.00 -0.08 0.41 0.54 0.00 0.00 0.00 173.10 173.97 1h2r s VAL 472 N -3.86 0.02 -0.03 1.40 0.11 -1.25 -1.73 120.40 115.06 1h2r s VAL 472 Ca 0.08 -0.16 0.06 0.00 -2.93 0.00 0.00 61.98 59.03 1h2r s VAL 472 Cb -0.03 -0.64 -0.01 0.00 -1.53 0.00 0.00 36.38 34.17 1h2r s VAL 472 CO -0.02 -0.09 -0.21 -0.83 -3.33 0.00 0.00 175.10 170.62 1h2r s GLY 473 N -0.42 1.06 -0.09 6.54 0.00 -0.64 -4.27 107.32 109.50 1h2r s GLY 473 Ca -0.05 -0.89 0.04 0.00 0.00 0.00 0.00 44.72 43.81 1h2r s GLY 473 CO 0.03 -0.66 -0.21 -1.36 0.00 0.00 0.00 173.10 170.90 1h2r s PHE 474 N -0.33 2.26 -0.02 1.90 0.40 -1.26 -2.02 117.98 118.92 1h2r s PHE 474 Ca 0.04 -0.90 0.01 0.00 -0.60 0.00 0.00 56.93 55.48 1h2r s PHE 474 Cb -0.10 -1.53 0.01 0.00 0.51 0.00 0.00 43.02 41.91 1h2r s PHE 474 CO 0.01 -0.37 -0.03 0.08 0.70 0.00 0.00 175.22 175.61 1h2r s VAL 475 N 0.40 0.28 -0.55 -0.44 1.01 -0.11 -4.97 120.40 116.01 1h2r s VAL 475 Ca -0.17 -0.07 -0.14 0.00 0.00 0.00 0.00 61.98 61.60 1h2r s VAL 475 Cb -0.17 -0.29 0.14 0.00 0.00 0.00 0.00 36.38 36.06 1h2r s VAL 475 CO 0.07 0.12 0.48 0.21 0.00 0.00 0.00 175.10 175.98 1h2r s ASN 476 N 0.37 6.10 0.90 3.32 3.84 -1.25 0.06 114.94 128.28 1h2r s ASN 476 Ca -0.04 -1.92 -0.14 0.00 0.21 0.00 0.00 52.86 50.97 1h2r s ASN 476 Cb -0.07 -2.15 0.14 0.00 -0.55 0.00 0.00 41.25 38.63 1h2r s ASN 476 CO -0.01 -0.78 1.24 0.00 -2.79 0.00 0.00 177.10 174.76 1h2r s ALA 477 N 1.38 2.36 0.66 1.71 0.00 0.47 -4.87 121.76 123.47 1h2r s ALA 477 Ca 0.05 -0.91 0.38 0.00 0.00 0.00 0.00 51.96 51.48 1h2r s ALA 477 Cb -0.27 -2.88 2.07 0.00 0.00 0.00 0.00 23.12 22.04 1h2r s ALA 477 CO 0.01 -2.12 2.18 -1.35 0.00 0.00 0.00 175.76 174.48 1h2r h PRO 478 N -1.40 0.00 -0.02 0.00 0.11 -1.96 -0.76 132.00 127.97 1h2r h PRO 478 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1h2r h PRO 478 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1h2r h PRO 478 CO 0.52 0.00 -0.10 0.54 -0.21 0.00 0.00 178.00 178.75 1h2r n ARG 479 N -3.08 1.61 0.00 1.05 1.74 -1.26 -4.28 116.66 112.44 1h2r n ARG 479 Ca -0.02 -1.42 0.00 0.00 -0.77 0.00 0.00 57.85 55.64 1h2r n ARG 479 Cb 0.21 -1.35 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 1h2r n ARG 479 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h2r n GLY 480 N 1.11 0.80 3.62 -0.13 0.00 -0.29 -2.80 105.19 107.49 1h2r n GLY 480 Ca 0.10 -2.05 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 1h2r n GLY 480 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h2r s GLY 481 N 0.00 1.11 -0.08 -0.02 0.00 -1.26 -0.40 107.32 106.66 1h2r s GLY 481 Ca 0.00 0.27 0.01 0.00 0.00 0.00 0.00 44.72 45.00 1h2r s GLY 481 CO 0.00 2.99 -0.08 -2.27 0.00 0.00 0.00 173.10 173.74 1h2r s LEU 482 N 5.59 3.05 -0.06 0.66 2.96 0.11 -3.29 118.68 127.69 1h2r s LEU 482 Ca 0.70 -0.10 -0.04 0.00 -0.22 0.00 0.00 54.13 54.47 1h2r s LEU 482 Cb -0.21 -1.67 0.03 0.00 0.50 0.00 0.00 46.19 44.83 1h2r s LEU 482 CO 0.30 0.31 0.15 -0.94 -1.32 0.00 0.00 176.35 174.86 1h2r s SER 483 N -0.49 -0.14 -0.08 3.68 1.04 -0.76 -0.94 113.70 116.00 1h2r s SER 483 Ca 0.07 0.32 0.03 0.00 0.48 0.00 0.00 55.95 56.84 1h2r s SER 483 Cb -0.12 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.24 1h2r s SER 483 CO 0.02 -0.11 -0.16 -1.00 0.98 0.00 0.00 173.24 172.98 1h2r s HIS 484 N 0.70 2.70 -0.08 5.02 3.76 -0.86 -1.51 115.29 125.02 1h2r s HIS 484 Ca -0.05 -0.46 0.02 0.00 -0.15 0.00 0.00 55.06 54.42 1h2r s HIS 484 Cb -0.07 -1.71 0.01 0.00 1.11 0.00 0.00 32.58 31.92 1h2r s HIS 484 CO -0.03 -0.05 -0.15 -1.58 -0.85 0.00 0.00 174.74 172.08 1h2r s TRP 485 N -0.19 1.76 0.04 1.40 0.52 0.13 -1.62 118.94 120.99 1h2r s TRP 485 Ca -0.00 -0.73 0.07 0.00 0.02 0.00 0.00 56.10 55.46 1h2r s TRP 485 Cb -0.13 -1.27 -0.02 0.00 -1.15 0.00 0.00 33.47 30.89 1h2r s TRP 485 CO 0.03 -0.36 -0.20 -1.50 0.02 0.00 0.00 176.95 174.94 1h2r s ILE 486 N 0.75 1.61 -0.25 2.03 2.07 -0.71 -1.02 121.20 125.68 1h2r s ILE 486 Ca -0.12 -1.18 0.02 0.00 -1.41 0.00 0.00 60.65 57.95 1h2r s ILE 486 Cb -0.16 -1.40 0.06 0.00 0.13 0.00 0.00 42.46 41.09 1h2r s ILE 486 CO 0.03 0.18 -0.07 -0.60 -1.91 0.00 0.00 174.94 172.56 1h2r s ARG 487 N -1.19 1.84 -0.16 3.50 3.52 -0.03 -2.16 118.95 124.27 1h2r s ARG 487 Ca 0.07 -1.17 -0.16 0.00 -0.13 0.00 0.00 55.73 54.34 1h2r s ARG 487 Cb -0.09 -2.72 -0.04 0.00 -1.56 0.00 0.00 34.95 30.54 1h2r s ARG 487 CO 0.02 -0.61 0.39 0.42 -0.81 0.00 0.00 175.30 174.72 1h2r s ILE 488 N 1.26 5.23 -0.06 4.11 1.01 0.28 -0.08 121.20 132.95 1h2r s ILE 488 Ca -0.06 0.74 -0.00 0.00 0.00 0.00 0.00 60.65 61.33 1h2r s ILE 488 Cb -0.19 -3.73 0.02 0.00 0.01 0.00 0.00 42.46 38.57 1h2r s ILE 488 CO -0.06 0.31 -0.03 -0.70 0.00 0.00 0.00 174.94 174.47 1h2r s GLU 489 N 0.85 0.77 -1.50 2.79 2.56 -0.37 -1.91 118.70 121.89 1h2r s GLU 489 Ca 0.21 -0.02 -0.06 0.00 0.00 0.00 0.00 54.97 55.10 1h2r s GLU 489 Cb -0.14 -0.94 0.02 0.00 2.00 0.00 0.00 34.13 35.07 1h2r s GLU 489 CO 0.07 -0.19 0.61 -3.47 -0.56 0.00 0.00 175.26 171.72 1h2r n ASP 490 N 4.59 -5.68 0.00 -1.70 4.64 0.23 -1.34 116.55 117.29 1h2r n ASP 490 Ca -0.16 -0.32 0.00 0.00 -1.38 0.00 0.00 54.79 52.93 1h2r n ASP 490 Cb 0.50 -4.60 0.00 0.00 -1.04 0.00 0.00 41.12 35.99 1h2r n ASP 490 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1h2r n GLY 491 N -1.48 0.52 3.70 0.27 0.00 0.74 -4.99 105.19 103.96 1h2r n GLY 491 Ca -0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.67 1h2r n GLY 491 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h2r s LYS 492 N -0.50 2.14 -0.53 1.61 1.02 -0.45 -4.54 119.74 118.49 1h2r s LYS 492 Ca 0.00 -1.95 -0.28 0.00 0.02 0.00 0.00 55.97 53.77 1h2r s LYS 492 Cb 0.00 -1.86 -0.00 0.00 -0.52 0.00 0.00 37.83 35.45 1h2r s LYS 492 CO 0.00 -0.11 1.64 0.42 -0.92 0.00 0.00 175.35 176.38 1h2r s ILE 493 N -2.64 3.59 -0.04 2.17 1.01 -0.09 -1.23 121.20 123.96 1h2r s ILE 493 Ca 0.38 0.48 -0.22 0.00 0.00 0.00 0.00 60.65 61.30 1h2r s ILE 493 Cb 0.06 -4.11 -0.27 0.00 0.01 0.00 0.00 42.46 38.15 1h2r s ILE 493 CO 0.21 -0.93 0.98 1.23 0.00 0.00 0.00 174.94 176.43 1h2r h GLY 494 N 14.26 0.33 -5.04 6.18 0.00 -0.76 0.22 103.07 118.26 1h2r h GLY 494 Ca -0.28 -0.68 -0.11 0.00 0.00 0.00 0.00 47.33 46.26 1h2r h GLY 494 CO 1.16 0.60 -0.17 0.21 0.00 0.00 0.00 176.54 178.34 1h2r s ASN 495 N -6.71 -0.45 -0.06 0.19 3.84 -0.83 -4.79 114.94 106.13 1h2r s ASN 495 Ca -0.14 0.81 -0.03 0.00 0.21 0.00 0.00 52.86 53.71 1h2r s ASN 495 Cb 0.01 0.84 0.04 0.00 -0.55 0.00 0.00 41.25 41.59 1h2r s ASN 495 CO 0.80 -0.22 0.12 0.12 -2.79 0.00 0.00 177.10 175.13 1h2r s PHE 496 N -0.04 -0.09 -0.03 0.43 2.19 -1.26 -0.85 117.98 118.33 1h2r s PHE 496 Ca -0.02 0.45 0.03 0.00 0.33 0.00 0.00 56.93 57.72 1h2r s PHE 496 Cb -0.03 -0.30 0.00 0.00 -1.31 0.00 0.00 43.02 41.37 1h2r s PHE 496 CO 0.02 -0.22 -0.12 -0.65 1.83 0.00 0.00 175.22 176.08 1h2r s GLN 497 N 2.03 1.26 -0.12 10.12 -1.52 -0.19 -4.70 119.66 126.54 1h2r s GLN 497 Ca 0.01 -0.41 -0.02 0.00 -1.95 0.00 0.00 55.36 52.99 1h2r s GLN 497 Cb -0.12 -1.13 -0.03 0.00 -0.22 0.00 0.00 33.01 31.51 1h2r s GLN 497 CO -0.05 0.16 -0.04 -0.51 -0.25 0.00 0.00 175.29 174.60 1h2r s LEU 498 N 0.15 3.29 -0.26 2.90 1.02 -1.26 -0.69 118.68 123.84 1h2r s LEU 498 Ca -0.04 -0.04 0.01 0.00 0.02 0.00 0.00 54.13 54.08 1h2r s LEU 498 Cb -0.10 -1.76 0.07 0.00 0.02 0.00 0.00 46.19 44.42 1h2r s LEU 498 CO 0.01 0.27 0.00 -0.69 0.02 0.00 0.00 176.35 175.96 1h2r s VAL 499 N -0.24 1.41 0.23 -1.59 1.01 -0.57 -5.04 120.40 115.61 1h2r s VAL 499 Ca 0.04 -1.36 0.07 0.00 0.00 0.00 0.00 61.98 60.74 1h2r s VAL 499 Cb -0.13 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1h2r s VAL 499 CO 0.02 -0.30 0.11 0.68 0.00 0.00 0.00 175.10 175.61 1h2r s VAL 500 N 1.41 4.09 0.19 2.92 -7.23 -1.26 -1.83 120.40 118.69 1h2r s VAL 500 Ca 0.00 -1.49 -0.23 0.00 -1.81 0.00 0.00 61.98 58.45 1h2r s VAL 500 Cb -0.18 -3.16 0.10 0.00 0.56 0.00 0.00 36.38 33.70 1h2r s VAL 500 CO -0.10 -0.28 1.55 -0.65 -0.31 0.00 0.00 175.10 175.31 1h2r h PRO 501 N 1.92 -0.07 0.00 4.82 0.11 -1.84 -0.09 132.00 136.85 1h2r h PRO 501 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1h2r h PRO 501 Cb 1.23 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1h2r h PRO 501 CO 0.61 -0.05 -0.08 0.77 -0.21 0.00 0.00 178.00 179.04 1h2r h SER 502 N -0.07 0.00 -0.40 -2.05 0.02 -1.85 -1.53 113.55 107.67 1h2r h SER 502 Ca 0.25 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.16 1h2r h SER 502 Cb 0.54 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1h2r h SER 502 CO -0.88 0.08 0.10 0.74 -1.14 0.00 0.00 176.83 175.73 1h2r h THR 503 N 0.00 1.23 0.12 -2.27 2.02 -1.25 0.37 112.91 113.13 1h2r h THR 503 Ca -0.00 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.41 1h2r h THR 503 Cb 0.18 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 1h2r h THR 503 CO 0.01 0.27 -0.12 -0.50 0.37 0.00 0.00 175.52 175.55 1h2r h TRP 504 N 0.50 -0.30 0.09 3.16 4.06 -1.04 -0.61 115.95 121.81 1h2r h TRP 504 Ca 0.12 0.00 -0.28 0.00 2.06 0.00 0.00 58.89 60.80 1h2r h TRP 504 Cb 0.31 0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 28.57 1h2r h TRP 504 CO 0.02 -0.18 -1.37 1.79 -3.56 0.00 0.00 178.44 175.13 1h2r h THR 505 N -0.26 1.32 -0.01 1.49 1.35 -1.36 -3.38 112.91 112.05 1h2r h THR 505 Ca 0.00 -2.97 0.00 0.00 -0.55 0.00 0.00 66.41 62.89 1h2r h THR 505 Cb 0.25 2.80 0.00 0.00 -1.73 0.00 0.00 68.15 69.47 1h2r h THR 505 CO -0.03 0.84 -0.01 0.18 -0.25 0.00 0.00 175.52 176.26 1h2r n LEU 506 N -3.43 1.92 -4.51 3.87 7.99 0.13 -1.86 117.00 121.10 1h2r n LEU 506 Ca -0.11 -0.99 -0.28 0.00 -0.01 0.00 0.00 56.01 54.61 1h2r n LEU 506 Cb 1.02 0.00 0.24 0.00 -0.11 0.00 0.00 43.42 44.58 1h2r n LEU 506 CO 0.50 0.36 0.53 -0.83 -1.51 0.00 0.00 177.39 176.45 1h2r s GLY 507 N -0.97 1.54 0.00 -0.72 0.00 -0.24 -4.82 107.32 102.11 1h2r s GLY 507 Ca 0.13 -0.20 0.00 0.00 0.00 0.00 0.00 44.72 44.65 1h2r s GLY 507 CO 0.15 0.52 0.00 -1.55 0.00 0.00 0.00 173.10 172.22 1h2r n PRO 508 N -4.84 0.27 -1.51 2.90 -0.04 -1.26 -4.53 135.00 125.99 1h2r n PRO 508 Ca 0.03 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.17 1h2r n PRO 508 Cb 0.55 0.00 0.07 0.00 -0.04 0.00 0.00 33.50 34.08 1h2r n PRO 508 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1h2r s ARG 509 N -2.51 2.57 0.03 0.54 0.52 -1.26 -4.39 118.95 114.45 1h2r s ARG 509 Ca 0.00 1.24 0.00 0.00 -0.52 0.00 0.00 55.73 56.45 1h2r s ARG 509 Cb 0.00 -1.93 0.01 0.00 0.52 0.00 0.00 34.95 33.55 1h2r s ARG 509 CO 0.00 -1.41 0.05 0.00 0.02 0.00 0.00 175.30 173.96 1h2r n ASP 511 N -2.98 0.00 -0.59 0.00 3.85 -1.26 -1.20 116.55 114.37 1h2r n ASP 511 Ca 0.01 -0.65 0.05 0.00 -0.71 0.00 0.00 54.79 53.49 1h2r n ASP 511 Cb 0.03 -0.01 0.13 0.00 -1.35 0.00 0.00 41.12 39.92 1h2r n ASP 511 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1h2r n LYS 512 N -1.01 2.52 -2.16 0.11 5.02 -1.26 -4.99 118.16 116.40 1h2r n LYS 512 Ca 0.16 -1.90 -0.19 0.00 -2.02 0.00 0.00 58.31 54.36 1h2r n LYS 512 Cb 0.08 -1.25 -0.03 0.00 -0.02 0.00 0.00 35.03 33.81 1h2r n LYS 512 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1h2r n ASN 513 N 0.49 -5.54 -4.71 4.39 3.02 -0.34 -4.97 115.26 107.61 1h2r n ASN 513 Ca 0.10 0.11 -0.42 0.00 -0.03 0.00 0.00 54.58 54.35 1h2r n ASN 513 Cb 0.40 -4.62 -0.03 0.00 -0.61 0.00 0.00 39.78 34.92 1h2r n ASN 513 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1h2r s ASN 514 N -2.30 7.31 0.46 6.41 0.01 -1.26 -4.82 114.94 120.76 1h2r s ASN 514 Ca 0.00 1.73 -0.22 0.00 -0.71 0.00 0.00 52.86 53.66 1h2r s ASN 514 Cb 0.00 -2.57 -0.08 0.00 0.41 0.00 0.00 41.25 39.01 1h2r s ASN 514 CO 0.00 -0.31 1.09 0.68 -1.51 0.00 0.00 177.10 177.05 1h2r s VAL 515 N 1.04 3.50 0.92 1.60 -7.23 -1.26 -3.19 120.40 115.77 1h2r s VAL 515 Ca 0.53 1.04 -0.12 0.00 -1.81 0.00 0.00 61.98 61.63 1h2r s VAL 515 Cb -0.23 -3.49 0.14 0.00 0.56 0.00 0.00 36.38 33.37 1h2r s VAL 515 CO 0.28 -0.10 1.11 -0.94 -0.31 0.00 0.00 175.10 175.14 1h2r s SER 516 N -1.67 3.40 0.23 4.85 1.04 -1.26 -4.71 113.70 115.58 1h2r s SER 516 Ca 0.64 1.18 -0.06 0.00 0.48 0.00 0.00 55.95 58.19 1h2r s SER 516 Cb -0.22 -1.83 0.39 0.00 0.10 0.00 0.00 66.02 64.45 1h2r s SER 516 CO 0.27 -2.64 1.74 -0.65 0.98 0.00 0.00 173.24 172.93 1h2r h PRO 517 N -1.56 0.44 -0.35 4.02 0.11 -1.79 0.31 132.00 133.17 1h2r h PRO 517 Ca -0.51 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.42 1h2r h PRO 517 Cb 1.31 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1h2r h PRO 517 CO 0.59 0.29 -0.38 0.28 -0.21 0.00 0.00 178.00 178.57 1h2r h VAL 518 N 0.45 1.28 -0.33 3.15 2.07 -1.73 -0.88 116.25 120.27 1h2r h VAL 518 Ca 0.37 -1.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.33 1h2r h VAL 518 Cb 0.52 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1h2r h VAL 518 CO -0.36 0.51 0.14 -0.33 0.02 0.00 0.00 177.57 177.55 1h2r h GLU 519 N 0.69 0.48 -0.49 1.57 5.08 -1.62 -2.73 114.58 117.57 1h2r h GLU 519 Ca 0.06 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 1h2r h GLU 519 Cb 0.95 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1h2r h GLU 519 CO 0.09 0.47 0.03 0.00 -1.00 0.00 0.00 179.01 178.60 1h2r h ALA 520 N 0.99 0.65 0.00 3.43 0.00 -0.89 -3.02 119.26 120.42 1h2r h ALA 520 Ca 0.11 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1h2r h ALA 520 Cb 0.16 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1h2r h ALA 520 CO -0.01 0.43 -0.10 0.66 0.00 0.00 0.00 179.25 180.23 1h2r h SER 521 N 0.70 0.00 1.47 0.00 4.64 -1.03 -2.68 113.55 116.64 1h2r h SER 521 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1h2r h SER 521 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1h2r h SER 521 CO 0.02 0.10 0.00 -0.07 -0.87 0.00 0.00 176.83 176.00 1h2r h LEU 522 N 0.00 0.00 -9.42 5.97 -0.00 -1.35 -3.26 115.31 107.25 1h2r h LEU 522 Ca -0.00 0.00 -0.54 0.00 -0.00 0.00 0.00 57.88 57.34 1h2r h LEU 522 Cb 0.36 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.03 1h2r h LEU 522 CO 0.01 0.00 0.84 -0.63 -0.00 0.00 0.00 178.44 178.67 1h2r s ILE 523 N -3.35 3.49 0.00 1.22 1.01 -1.01 -2.33 121.20 120.23 1h2r s ILE 523 Ca 0.05 0.94 0.00 0.00 0.00 0.00 0.00 60.65 61.64 1h2r s ILE 523 Cb 0.08 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.95 1h2r s ILE 523 CO 0.59 0.01 0.00 0.61 0.00 0.00 0.00 174.94 176.15 1h2r n GLY 524 N 3.68 0.60 3.69 6.18 0.00 0.34 -4.84 105.19 114.84 1h2r n GLY 524 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1h2r n GLY 524 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h2r s THR 525 N -2.15 3.62 0.33 2.61 2.01 -0.98 -4.67 115.64 116.40 1h2r s THR 525 Ca 0.00 1.03 -0.27 0.00 0.31 0.00 0.00 61.69 62.76 1h2r s THR 525 Cb 0.00 -3.66 -0.09 0.00 0.01 0.00 0.00 72.50 68.75 1h2r s THR 525 CO 0.00 0.01 1.02 -2.16 -0.69 0.00 0.00 174.62 172.79 1h2r s PRO 526 N 2.28 4.50 -0.42 4.92 0.04 -1.26 -1.44 135.00 143.62 1h2r s PRO 526 Ca 0.65 1.53 0.02 0.00 0.04 0.00 0.00 61.00 63.23 1h2r s PRO 526 Cb -0.33 -2.88 0.13 0.00 0.04 0.00 0.00 34.50 31.47 1h2r s PRO 526 CO 0.27 0.16 0.21 0.54 0.04 0.00 0.00 177.00 178.22 1h2r s VAL 527 N -1.46 1.36 0.14 -0.36 0.11 0.50 -4.69 120.40 116.00 1h2r s VAL 527 Ca 0.50 -2.38 -0.24 0.00 -2.93 0.00 0.00 61.98 56.93 1h2r s VAL 527 Cb -0.24 -1.97 0.01 0.00 -1.53 0.00 0.00 36.38 32.65 1h2r s VAL 527 CO 0.30 -0.85 1.63 0.00 -3.33 0.00 0.00 175.10 172.85 1h2r h ALA 528 N 6.95 -0.21 -2.06 1.54 0.00 -1.94 -3.42 119.26 120.12 1h2r h ALA 528 Ca -0.03 0.05 -0.56 0.00 0.00 0.00 0.00 54.91 54.37 1h2r h ALA 528 Cb 0.94 0.52 -0.09 0.00 0.00 0.00 0.00 17.79 19.16 1h2r h ALA 528 CO 0.48 -0.71 -0.62 0.34 0.00 0.00 0.00 179.25 178.75 1h2r s ASP 529 N -4.99 4.45 -0.01 0.00 3.68 -1.26 -4.97 116.67 113.57 1h2r s ASP 529 Ca -0.15 -0.77 0.07 0.00 2.13 0.00 0.00 52.55 53.83 1h2r s ASP 529 Cb 0.11 -0.72 -0.11 0.00 -1.45 0.00 0.00 42.92 40.76 1h2r s ASP 529 CO 0.67 -0.13 0.19 0.00 0.13 0.00 0.00 175.17 176.04 1h2r n ALA 530 N -0.96 2.41 0.30 3.66 0.00 -1.26 -4.36 120.51 120.30 1h2r n ALA 530 Ca -0.05 -0.18 0.12 0.00 0.00 0.00 0.00 53.44 53.33 1h2r n ALA 530 Cb 0.60 -0.25 0.17 0.00 0.00 0.00 0.00 19.45 19.97 1h2r n ALA 530 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1h2r h LYS 531 N 0.00 0.00 -2.09 0.00 1.57 -1.98 -3.36 116.57 110.70 1h2r h LYS 531 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1h2r h LYS 531 Cb 0.30 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.21 1h2r h LYS 531 CO 0.00 0.00 -0.99 0.54 -0.57 0.00 0.00 179.45 178.43 1h2r n ARG 532 N -2.74 1.63 -0.42 3.15 1.74 -1.26 -5.05 116.66 113.71 1h2r n ARG 532 Ca 0.03 -3.84 -0.13 0.00 -0.77 0.00 0.00 57.85 53.14 1h2r n ARG 532 Cb 0.51 -1.80 -0.01 0.00 -1.02 0.00 0.00 32.46 30.14 1h2r n ARG 532 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1h2r n PRO 533 N 0.41 1.17 0.19 5.56 -0.04 -1.26 -4.69 135.00 136.34 1h2r n PRO 533 Ca 0.26 -1.05 0.15 0.00 -0.04 0.00 0.00 63.50 62.82 1h2r n PRO 533 Cb 0.55 -2.26 0.75 0.00 -0.04 0.00 0.00 33.50 32.50 1h2r n PRO 533 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1h2r h VAL 534 N 3.70 0.70 -0.74 0.52 3.04 -1.96 -1.94 116.25 119.57 1h2r h VAL 534 Ca 0.28 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.92 1h2r h VAL 534 Cb 0.10 0.88 -0.03 0.00 -2.01 0.00 0.00 31.29 30.23 1h2r h VAL 534 CO 1.26 0.00 0.27 -0.33 -1.01 0.00 0.00 177.57 177.76 1h2r h GLU 535 N 0.00 1.12 -0.60 4.17 3.07 -1.84 0.66 114.58 121.16 1h2r h GLU 535 Ca 0.09 -0.22 -0.07 0.00 -0.50 0.00 0.00 59.36 58.66 1h2r h GLU 535 Cb 0.40 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.11 1h2r h GLU 535 CO -0.00 0.93 0.10 0.82 -1.40 0.00 0.00 179.01 179.46 1h2r h ILE 536 N 1.09 1.26 -0.57 3.13 2.04 -1.65 -2.66 117.51 120.15 1h2r h ILE 536 Ca 0.24 -0.99 -0.06 0.00 1.00 0.00 0.00 64.86 65.06 1h2r h ILE 536 Cb 0.25 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1h2r h ILE 536 CO -0.01 0.36 0.10 -0.07 0.00 0.00 0.00 178.15 178.53 1h2r h LEU 537 N 0.90 0.86 -0.28 1.44 -0.00 -1.35 -1.01 115.31 115.86 1h2r h LEU 537 Ca 0.18 -0.18 0.02 0.00 -0.00 0.00 0.00 57.88 57.90 1h2r h LEU 537 Cb 0.41 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.83 1h2r h LEU 537 CO 0.01 0.86 0.15 0.03 -0.00 0.00 0.00 178.44 179.49 1h2r h ARG 538 N 0.86 0.30 -0.06 1.13 3.08 -0.54 0.14 114.38 119.27 1h2r h ARG 538 Ca 0.18 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.16 1h2r h ARG 538 Cb 0.37 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1h2r h ARG 538 CO 0.01 0.20 -0.14 1.15 -1.07 0.00 0.00 179.97 180.11 1h2r h THR 539 N 0.31 1.42 -0.40 2.04 2.02 -1.36 -2.41 112.91 114.53 1h2r h THR 539 Ca 0.12 -1.47 0.04 0.00 0.77 0.00 0.00 66.41 65.86 1h2r h THR 539 Cb 0.03 2.23 -0.04 0.00 -1.74 0.00 0.00 68.15 68.64 1h2r h THR 539 CO -0.08 0.41 0.18 0.58 0.37 0.00 0.00 175.52 176.98 1h2r h VAL 540 N -0.29 0.94 0.00 3.16 2.07 -1.08 -1.89 116.25 119.17 1h2r h VAL 540 Ca 0.00 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 1h2r h VAL 540 Cb 0.74 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1h2r h VAL 540 CO 0.03 0.07 -0.22 0.45 0.02 0.00 0.00 177.57 177.92 1h2r h HIS 541 N 0.37 0.00 0.00 1.57 -0.00 -0.79 -2.48 115.15 113.82 1h2r h HIS 541 Ca 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.53 1h2r h HIS 541 Cb 0.11 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.51 1h2r h HIS 541 CO -0.12 0.22 -0.07 0.66 -0.00 0.00 0.00 177.93 178.62 1h2r h SER 542 N 0.00 0.00 1.28 2.45 4.64 -0.80 -0.78 113.55 120.33 1h2r h SER 542 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h2r h SER 542 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1h2r h SER 542 CO 0.03 0.07 -0.02 0.49 -0.87 0.00 0.00 176.83 176.53 1h2r n PHE 543 N -3.87 0.57 -3.29 4.77 3.72 -0.93 -4.70 117.46 113.73 1h2r n PHE 543 Ca -0.02 0.17 -0.16 0.00 -0.05 0.00 0.00 57.45 57.38 1h2r n PHE 543 Cb 0.16 -0.77 0.06 0.00 -0.94 0.00 0.00 39.48 38.00 1h2r n PHE 543 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1h2r n ASP 544 N -1.97 -6.58 -4.74 4.37 4.64 -0.30 -4.91 116.55 107.06 1h2r n ASP 544 Ca 0.06 -0.70 -0.40 0.00 -1.38 0.00 0.00 54.79 52.37 1h2r n ASP 544 Cb 0.40 -4.98 0.02 0.00 -1.04 0.00 0.00 41.12 35.51 1h2r n ASP 544 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 1h2r n PRO 545 N -3.23 2.14 -3.51 -0.67 -0.02 -1.26 -4.96 135.00 123.48 1h2r n PRO 545 Ca -0.07 0.76 -0.29 0.00 -2.02 0.00 0.00 63.50 61.88 1h2r n PRO 545 Cb 0.61 -2.54 -0.14 0.00 -0.02 0.00 0.00 33.50 31.41 1h2r n PRO 545 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1h2r h ILE 547 N 5.82 1.41 -0.62 0.00 1.08 -1.23 -0.86 117.51 123.11 1h2r h ILE 547 Ca -0.09 -2.11 -0.06 0.00 -0.39 0.00 0.00 64.86 62.21 1h2r h ILE 547 Cb 0.99 2.10 -0.02 0.00 -3.07 0.00 0.00 36.82 36.82 1h2r h ILE 547 CO 0.37 0.62 0.14 0.00 -0.69 0.00 0.00 178.15 178.59 1h2r h ALA 548 N 1.16 0.81 0.41 1.87 0.00 -1.84 -2.16 119.26 119.52 1h2r h ALA 548 Ca -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1h2r h ALA 548 Cb 1.18 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1h2r h ALA 548 CO 0.10 0.54 -0.19 0.00 0.00 0.00 0.00 179.25 179.69 1h2r h GLY 550 N -0.65 1.46 0.10 0.00 0.00 -0.95 -3.32 103.07 99.71 1h2r h GLY 550 Ca -0.06 -0.40 -0.39 0.00 0.00 0.00 0.00 47.33 46.48 1h2r h GLY 550 CO 0.09 0.19 -2.33 -0.62 0.00 0.00 0.00 176.54 173.87 1h2r n VAL 551 N -4.56 1.55 -0.22 4.60 0.31 -0.83 -4.52 118.33 114.66 1h2r n VAL 551 Ca 0.17 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1h2r n VAL 551 Cb 0.33 -1.64 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 1h2r n VAL 551 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51