#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xml s ARG 41 N 0.00 1.30 0.59 5.55 0.52 -1.26 -5.14 118.95 120.50 1xml s ARG 41 Ca 0.00 -1.53 -0.17 0.00 -0.52 0.00 0.00 55.73 53.51 1xml s ARG 41 Cb 0.00 -1.14 -0.04 0.00 0.52 0.00 0.00 34.95 34.29 1xml s ARG 41 CO 0.00 0.20 1.09 -0.51 0.02 0.00 0.00 175.30 176.10 1xml s LEU 42 N -3.13 3.57 0.20 2.53 1.02 -1.26 -4.94 118.68 116.67 1xml s LEU 42 Ca 0.20 1.99 0.17 0.00 0.02 0.00 0.00 54.13 56.52 1xml s LEU 42 Cb -0.02 -4.56 0.82 0.00 0.02 0.00 0.00 46.19 42.46 1xml s LEU 42 CO 0.06 -1.29 1.53 -0.81 0.02 0.00 0.00 176.35 175.87 1xml n PRO 43 N -1.82 0.11 -4.51 1.29 -0.04 -1.26 -4.69 135.00 124.08 1xml n PRO 43 Ca 0.10 0.48 -0.25 0.00 -0.04 0.00 0.00 63.50 63.80 1xml n PRO 43 Cb 0.52 -1.78 -0.10 0.00 -0.04 0.00 0.00 33.50 32.09 1xml n PRO 43 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1xml s PHE 44 N -3.29 2.28 -0.19 0.54 -0.12 -1.26 -5.13 117.98 110.81 1xml s PHE 44 Ca 0.02 -0.53 -0.01 0.00 -0.05 0.00 0.00 56.93 56.36 1xml s PHE 44 Cb 0.07 -1.28 0.01 0.00 -0.63 0.00 0.00 43.02 41.18 1xml s PHE 44 CO 0.24 0.52 -0.15 -1.12 -0.05 0.00 0.00 175.22 174.66 1xml s SER 45 N -3.56 3.56 0.00 1.98 0.01 -1.26 -5.00 113.70 109.42 1xml s SER 45 Ca 0.31 -0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.03 1xml s SER 45 Cb 0.02 -1.57 0.00 0.00 0.21 0.00 0.00 66.02 64.68 1xml s SER 45 CO 0.15 0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.42 1xml n GLY 46 N 4.60 1.73 3.32 3.44 0.00 -1.26 -2.78 105.19 114.23 1xml n GLY 46 Ca -0.20 -1.74 0.02 0.00 0.00 0.00 0.00 46.02 44.10 1xml n GLY 46 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xml s PHE 47 N -2.40 -1.48 -0.19 1.61 5.36 -1.26 -4.31 117.98 115.31 1xml s PHE 47 Ca 0.00 1.91 0.01 0.00 -0.96 0.00 0.00 56.93 57.89 1xml s PHE 47 Cb 0.00 0.63 0.03 0.00 -0.34 0.00 0.00 43.02 43.35 1xml s PHE 47 CO 0.00 -0.79 -0.14 0.50 -1.46 0.00 0.00 175.22 173.32 1xml s ARG 48 N 2.86 2.42 -0.27 10.12 3.52 -1.03 -4.95 118.95 131.63 1xml s ARG 48 Ca 0.11 -0.87 -0.29 0.00 -0.13 0.00 0.00 55.73 54.56 1xml s ARG 48 Cb -0.14 -2.48 -0.03 0.00 -1.56 0.00 0.00 34.95 30.74 1xml s ARG 48 CO -0.20 -0.34 1.76 -1.17 -0.81 0.00 0.00 175.30 174.53 1xml s LEU 49 N 1.33 3.69 -0.11 -0.88 2.96 -1.26 -1.37 118.68 123.04 1xml s LEU 49 Ca 0.01 1.51 -0.16 0.00 -0.22 0.00 0.00 54.13 55.27 1xml s LEU 49 Cb -0.15 -3.53 -0.26 0.00 0.50 0.00 0.00 46.19 42.75 1xml s LEU 49 CO -0.10 -1.52 0.52 -0.61 -1.32 0.00 0.00 176.35 173.33 1xml h GLN 50 N 12.05 0.22 -2.85 1.98 -0.00 -1.67 -3.49 115.11 121.35 1xml h GLN 50 Ca -0.35 -0.38 -0.11 0.00 -0.00 0.00 0.00 58.65 57.81 1xml h GLN 50 Cb 1.17 0.14 -0.20 0.00 0.00 0.00 0.00 27.48 28.59 1xml h GLN 50 CO 1.01 1.18 -0.20 0.21 0.00 0.00 0.00 178.83 181.04 1xml s LYS 51 N -2.47 0.72 -0.53 1.69 2.20 -1.11 -5.05 119.74 115.19 1xml s LYS 51 Ca -0.21 -0.08 -0.19 0.00 -0.36 0.00 0.00 55.97 55.14 1xml s LYS 51 Cb 0.05 0.33 0.07 0.00 -1.51 0.00 0.00 37.83 36.76 1xml s LYS 51 CO 0.75 -0.20 0.64 0.08 -0.36 0.00 0.00 175.35 176.26 1xml s VAL 52 N -1.22 4.87 0.06 4.02 1.01 -1.26 -1.45 120.40 126.43 1xml s VAL 52 Ca -0.12 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 60.99 1xml s VAL 52 Cb -0.04 -4.35 -0.11 0.00 0.00 0.00 0.00 36.38 31.88 1xml s VAL 52 CO 0.05 -0.89 1.44 -0.07 0.00 0.00 0.00 175.10 175.63 1xml h LEU 53 N 9.75 0.41 -6.97 3.92 3.38 -1.48 -3.46 115.31 120.85 1xml h LEU 53 Ca -0.28 -0.38 0.07 0.00 0.09 0.00 0.00 57.88 57.38 1xml h LEU 53 Cb 1.09 -0.11 -0.24 0.00 0.09 0.00 0.00 40.66 41.49 1xml h LEU 53 CO 1.00 0.70 0.18 -0.60 0.09 0.00 0.00 178.44 179.81 1xml s ARG 54 N -4.69 0.54 0.03 1.13 3.52 -1.14 -1.60 118.95 116.74 1xml s ARG 54 Ca -0.14 0.97 0.07 0.00 -0.13 0.00 0.00 55.73 56.50 1xml s ARG 54 Cb 0.06 0.17 -0.02 0.00 -1.56 0.00 0.00 34.95 33.61 1xml s ARG 54 CO 0.75 -0.12 -0.22 -2.00 -0.81 0.00 0.00 175.30 172.90 1xml s GLU 55 N 1.63 1.57 -0.15 5.12 2.12 -1.26 -0.90 118.70 126.82 1xml s GLU 55 Ca -0.09 -0.92 -0.02 0.00 0.36 0.00 0.00 54.97 54.30 1xml s GLU 55 Cb -0.05 -1.64 0.05 0.00 0.26 0.00 0.00 34.13 32.75 1xml s GLU 55 CO -0.18 0.43 0.03 0.45 -0.54 0.00 0.00 175.26 175.45 1xml s SER 56 N -0.98 2.45 0.19 -1.70 0.15 -0.84 -5.02 113.70 107.93 1xml s SER 56 Ca 0.08 -0.57 -0.06 0.00 0.70 0.00 0.00 55.95 56.10 1xml s SER 56 Cb -0.09 -0.52 0.10 0.00 -1.71 0.00 0.00 66.02 63.79 1xml s SER 56 CO 0.01 -0.27 1.55 0.00 1.20 0.00 0.00 173.24 175.73 1xml h ALA 57 N 8.28 0.73 -0.43 5.45 0.00 -1.98 -1.92 119.26 129.39 1xml h ALA 57 Ca -0.17 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.17 1xml h ALA 57 Cb 1.12 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1xml h ALA 57 CO 0.31 0.66 -0.23 0.00 0.00 0.00 0.00 179.25 179.99 1xml h ARG 58 N 0.64 0.91 -0.01 0.00 3.08 -1.96 -3.15 114.38 113.89 1xml h ARG 58 Ca 0.06 -0.41 0.00 0.00 0.07 0.00 0.00 59.98 59.70 1xml h ARG 58 Cb 0.91 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.94 1xml h ARG 58 CO 0.08 1.07 -0.24 -0.25 -1.07 0.00 0.00 179.97 179.56 1xml n ASP 59 N -4.16 0.79 -3.67 7.04 8.00 -1.23 -4.96 116.55 118.35 1xml n ASP 59 Ca -0.01 -0.69 -0.22 0.00 0.71 0.00 0.00 54.79 54.58 1xml n ASP 59 Cb 0.46 0.08 0.05 0.00 -0.02 0.00 0.00 41.12 41.68 1xml n ASP 59 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1xml n LYS 60 N -0.86 -5.52 -4.21 -1.24 4.76 -0.75 -4.74 118.16 105.60 1xml n LYS 60 Ca 0.12 0.67 -0.19 0.00 -2.87 0.00 0.00 58.31 56.04 1xml n LYS 60 Cb 0.33 -5.40 -0.12 0.00 -1.84 0.00 0.00 35.03 28.00 1xml n LYS 60 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1xml s ILE 61 N -3.54 1.28 -0.07 -0.18 1.01 -1.04 -1.85 121.20 116.81 1xml s ILE 61 Ca 0.13 -1.49 -0.07 0.00 0.00 0.00 0.00 60.65 59.23 1xml s ILE 61 Cb -0.06 -1.31 0.02 0.00 0.01 0.00 0.00 42.46 41.12 1xml s ILE 61 CO 0.79 -0.27 0.19 -0.63 0.00 0.00 0.00 174.94 175.03 1xml s ILE 62 N -1.57 -0.00 -0.15 2.92 1.01 -0.54 -1.99 121.20 120.88 1xml s ILE 62 Ca 0.03 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.69 1xml s ILE 62 Cb -0.08 -0.28 -0.01 0.00 0.01 0.00 0.00 42.46 42.11 1xml s ILE 62 CO 0.03 0.00 -0.15 -0.36 0.00 0.00 0.00 174.94 174.47 1xml s PHE 63 N 0.16 2.79 -0.09 3.97 0.40 -0.08 -1.75 117.98 123.38 1xml s PHE 63 Ca -0.00 -0.92 -0.00 0.00 -0.60 0.00 0.00 56.93 55.41 1xml s PHE 63 Cb -0.02 -1.88 0.02 0.00 0.51 0.00 0.00 43.02 41.66 1xml s PHE 63 CO -0.00 -0.40 -0.05 -0.51 0.70 0.00 0.00 175.22 174.96 1xml s LEU 64 N 0.68 1.07 -0.21 -0.37 1.43 -0.69 -1.20 118.68 119.39 1xml s LEU 64 Ca -0.07 -0.22 -0.28 0.00 -1.03 0.00 0.00 54.13 52.53 1xml s LEU 64 Cb -0.16 -0.68 0.00 0.00 0.03 0.00 0.00 46.19 45.39 1xml s LEU 64 CO 0.02 -0.12 0.99 -2.28 0.23 0.00 0.00 176.35 175.19 1xml s HIS 65 N 1.60 3.36 0.27 0.29 5.65 -0.53 -1.60 115.29 124.33 1xml s HIS 65 Ca 0.01 1.42 0.10 0.00 0.25 0.00 0.00 55.06 56.84 1xml s HIS 65 Cb -0.13 -3.21 -0.05 0.00 -1.18 0.00 0.00 32.58 28.01 1xml s HIS 65 CO -0.05 -0.42 -0.16 0.20 -0.65 0.00 0.00 174.74 173.65 1xml s GLY 66 N 1.21 1.82 -0.20 1.59 0.00 0.53 -1.72 107.32 110.55 1xml s GLY 66 Ca 0.43 -1.86 -0.03 0.00 0.00 0.00 0.00 44.72 43.25 1xml s GLY 66 CO 0.08 -1.92 -0.06 0.54 0.00 0.00 0.00 173.10 171.74 1xml s LYS 67 N -3.58 3.40 0.22 2.90 -0.14 -0.47 -1.55 119.74 120.53 1xml s LYS 67 Ca 0.29 -0.63 0.12 0.00 -1.36 0.00 0.00 55.97 54.38 1xml s LYS 67 Cb -0.02 -2.93 -0.05 0.00 -1.68 0.00 0.00 37.83 33.15 1xml s LYS 67 CO 0.13 -0.09 -0.23 0.14 -0.76 0.00 0.00 175.35 174.55 1xml s VAL 68 N 1.18 2.41 0.00 3.17 -7.23 -1.26 -2.45 120.40 116.22 1xml s VAL 68 Ca 0.02 -2.13 0.00 0.00 -1.81 0.00 0.00 61.98 58.06 1xml s VAL 68 Cb -0.14 -2.18 0.00 0.00 0.56 0.00 0.00 36.38 34.61 1xml s VAL 68 CO -0.01 -0.19 0.00 0.59 -0.31 0.00 0.00 175.10 175.17 1xml n ASN 69 N 0.02 0.00 0.00 4.85 3.02 -1.12 -4.66 115.26 117.37 1xml n ASN 69 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 1xml n ASN 69 Cb 0.57 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.74 1xml n ASN 69 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xml n GLU 78 N 0.00 0.00 -4.42 3.52 4.71 -1.26 -5.07 120.64 118.12 1xml n GLU 78 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.16 56.90 1xml n GLU 78 Cb 0.00 -0.25 -0.11 0.00 -1.01 0.00 0.00 31.44 30.07 1xml n GLU 78 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1xml s ASP 79 N -3.96 3.33 -0.24 1.62 1.01 -1.26 -4.41 116.67 112.76 1xml s ASP 79 Ca 0.00 -0.93 -0.26 0.00 0.71 0.00 0.00 52.55 52.07 1xml s ASP 79 Cb 0.00 -0.25 0.09 0.00 1.01 0.00 0.00 42.92 43.77 1xml s ASP 79 CO 0.00 0.06 0.82 0.00 0.21 0.00 0.00 175.17 176.26 1xml s ALA 80 N -2.06 -1.84 -0.22 5.23 0.00 -0.59 -2.30 121.76 119.98 1xml s ALA 80 Ca 0.23 1.88 -0.02 0.00 0.00 0.00 0.00 51.96 54.05 1xml s ALA 80 Cb -0.06 -1.09 0.01 0.00 0.00 0.00 0.00 23.12 21.97 1xml s ALA 80 CO 0.11 -0.31 -0.08 0.08 0.00 0.00 0.00 175.76 175.55 1xml s VAL 81 N 0.07 2.92 -0.13 0.00 1.01 -0.93 -0.34 120.40 123.00 1xml s VAL 81 Ca -0.00 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.21 1xml s VAL 81 Cb -0.04 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1xml s VAL 81 CO -0.00 0.38 -0.12 -0.69 0.00 0.00 0.00 175.10 174.67 1xml s VAL 82 N 1.39 3.14 -0.22 2.92 1.01 -0.63 -1.07 120.40 126.93 1xml s VAL 82 Ca 0.04 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 1xml s VAL 82 Cb -0.15 -2.32 0.02 0.00 0.00 0.00 0.00 36.38 33.94 1xml s VAL 82 CO -0.06 0.52 -0.11 -0.63 0.00 0.00 0.00 175.10 174.83 1xml s ILE 83 N 0.31 2.61 -0.13 2.22 1.01 0.55 -1.70 121.20 126.07 1xml s ILE 83 Ca -0.10 -0.98 -0.03 0.00 0.00 0.00 0.00 60.65 59.54 1xml s ILE 83 Cb -0.16 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 40.02 1xml s ILE 83 CO 0.05 0.32 -0.01 -0.76 0.00 0.00 0.00 174.94 174.54 1xml s LEU 84 N 1.31 3.44 -0.07 2.97 2.01 -0.72 -1.00 118.68 126.63 1xml s LEU 84 Ca 0.02 -0.00 -0.03 0.00 0.01 0.00 0.00 54.13 54.13 1xml s LEU 84 Cb -0.15 -1.81 0.04 0.00 0.01 0.00 0.00 46.19 44.27 1xml s LEU 84 CO -0.07 0.25 0.07 -0.70 1.01 0.00 0.00 176.35 176.91 1xml s GLU 85 N -0.13 -0.04 0.54 1.70 2.12 -0.29 -1.47 118.70 121.13 1xml s GLU 85 Ca 0.04 0.27 -0.22 0.00 0.36 0.00 0.00 54.97 55.43 1xml s GLU 85 Cb -0.13 -0.81 -0.05 0.00 0.26 0.00 0.00 34.13 33.41 1xml s GLU 85 CO 0.02 -0.40 1.33 0.15 -0.54 0.00 0.00 175.26 175.81 1xml s LYS 86 N 2.16 3.16 0.26 4.30 -0.14 -0.77 -1.25 119.74 127.47 1xml s LYS 86 Ca 0.04 2.16 -0.02 0.00 -1.36 0.00 0.00 55.97 56.79 1xml s LYS 86 Cb -0.13 -2.24 -0.04 0.00 -1.68 0.00 0.00 37.83 33.74 1xml s LYS 86 CO -0.04 -1.15 0.48 0.95 -0.76 0.00 0.00 175.35 174.83 1xml s THR 87 N -1.35 5.12 0.61 2.17 -4.23 -1.24 -4.86 115.64 111.86 1xml s THR 87 Ca 0.72 -0.23 -0.18 0.00 -1.18 0.00 0.00 61.69 60.81 1xml s THR 87 Cb -0.39 -3.76 -0.03 0.00 1.34 0.00 0.00 72.50 69.67 1xml s THR 87 CO 0.45 -0.30 1.19 -2.84 -0.54 0.00 0.00 174.62 172.58 1xml s PRO 88 N -3.60 2.91 0.45 3.99 0.02 -1.26 -5.00 135.00 132.51 1xml s PRO 88 Ca 0.41 1.75 -0.23 0.00 0.02 0.00 0.00 61.00 62.95 1xml s PRO 88 Cb -0.11 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.41 1xml s PRO 88 CO 0.31 -1.23 1.14 -0.06 -0.33 0.00 0.00 177.00 176.83 1xml s PHE 89 N -1.73 2.95 -0.18 6.54 0.40 -1.26 -5.05 117.98 119.66 1xml s PHE 89 Ca 0.75 1.56 -0.08 0.00 -0.60 0.00 0.00 56.93 58.56 1xml s PHE 89 Cb -0.28 -3.33 -0.04 0.00 0.51 0.00 0.00 43.02 39.87 1xml s PHE 89 CO 0.34 -1.34 0.08 -0.65 0.70 0.00 0.00 175.22 174.35 1xml s GLN 90 N -2.65 3.96 0.24 0.44 -1.52 -1.26 -5.02 119.66 113.84 1xml s GLN 90 Ca 0.62 -0.31 -0.07 0.00 -1.95 0.00 0.00 55.36 53.66 1xml s GLN 90 Cb -0.27 -3.24 0.26 0.00 -0.22 0.00 0.00 33.01 29.54 1xml s GLN 90 CO 0.33 0.32 1.89 0.28 -0.25 0.00 0.00 175.29 177.87 1xml h VAL 91 N 4.76 1.17 -0.30 1.09 2.07 -2.00 -2.84 116.25 120.20 1xml h VAL 91 Ca -0.39 -0.39 -0.09 0.00 0.82 0.00 0.00 66.70 66.65 1xml h VAL 91 Cb 1.17 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1xml h VAL 91 CO 0.70 0.21 -0.16 -0.08 0.02 0.00 0.00 177.57 178.27 1xml h GLU 92 N 1.15 0.64 -0.82 1.57 4.57 -1.99 -1.89 114.58 117.81 1xml h GLU 92 Ca 0.35 -0.28 -0.04 0.00 -1.18 0.00 0.00 59.36 58.21 1xml h GLU 92 Cb -0.03 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.51 1xml h GLU 92 CO -0.11 0.87 0.37 1.96 -1.18 0.00 0.00 179.01 180.92 1xml h GLN 93 N 0.40 1.19 -0.14 1.92 4.20 -1.97 -2.67 115.11 118.04 1xml h GLN 93 Ca 0.07 -0.19 -0.15 0.00 0.06 0.00 0.00 58.65 58.43 1xml h GLN 93 Cb 0.68 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1xml h GLN 93 CO 0.05 0.93 -0.56 0.28 -0.67 0.00 0.00 178.83 178.86 1xml h VAL 94 N 1.17 1.34 0.10 -0.54 2.07 -1.47 -2.62 116.25 116.31 1xml h VAL 94 Ca 0.28 -1.85 -0.01 0.00 0.82 0.00 0.00 66.70 65.94 1xml h VAL 94 Cb 0.16 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 1xml h VAL 94 CO -0.03 0.56 -0.05 0.00 0.02 0.00 0.00 177.57 178.07 1xml h ALA 95 N 1.07 -0.14 0.00 1.67 0.00 -1.01 -2.37 119.26 118.48 1xml h ALA 95 Ca 0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1xml h ALA 95 Cb 1.08 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1xml h ALA 95 CO 0.10 -0.56 -0.46 -0.56 0.00 0.00 0.00 179.25 177.77 1xml h GLN 96 N -0.18 0.00 -0.67 0.00 3.07 -1.55 -3.09 115.11 112.69 1xml h GLN 96 Ca -0.01 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.67 1xml h GLN 96 Cb 0.14 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.67 1xml h GLN 96 CO 0.02 0.46 0.19 1.25 0.09 0.00 0.00 178.83 180.84 1xml h LEU 97 N 0.00 0.98 -0.37 0.06 5.85 -1.17 -2.86 115.31 117.80 1xml h LEU 97 Ca -0.00 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.47 1xml h LEU 97 Cb 0.82 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1xml h LEU 97 CO 0.06 0.93 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.76 1xml h LEU 98 N 1.00 0.00 -0.40 2.25 3.38 -1.36 -3.15 115.31 117.04 1xml h LEU 98 Ca 0.22 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.00 1xml h LEU 98 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1xml h LEU 98 CO -0.00 0.26 -0.78 0.71 0.09 0.00 0.00 178.44 178.71 1xml h THR 99 N 0.00 1.45 -3.67 0.22 1.35 -1.44 -3.43 112.91 107.39 1xml h THR 99 Ca -0.00 -2.37 -0.69 0.00 -0.55 0.00 0.00 66.41 62.79 1xml h THR 99 Cb 1.06 2.29 -0.31 0.00 -1.73 0.00 0.00 68.15 69.46 1xml h THR 99 CO 0.03 0.70 -0.62 -0.83 -0.25 0.00 0.00 175.52 174.55 1xml s GLY 100 N -4.43 1.84 0.00 5.82 0.00 -1.10 -4.98 107.32 104.47 1xml s GLY 100 Ca -0.04 -1.89 0.00 0.00 0.00 0.00 0.00 44.72 42.79 1xml s GLY 100 CO 0.82 0.79 0.00 -1.14 0.00 0.00 0.00 173.10 173.58 1xml n SER 101 N 4.72 0.00 -4.80 1.64 3.41 -1.26 -4.83 113.62 112.49 1xml n SER 101 Ca -0.11 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.17 1xml n SER 101 Cb 0.44 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.39 1xml n SER 101 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1xml s PRO 102 N 0.00 3.35 -0.79 4.33 0.04 -1.26 -5.00 135.00 135.67 1xml s PRO 102 Ca 0.00 1.22 -0.23 0.00 0.04 0.00 0.00 61.00 62.03 1xml s PRO 102 Cb 0.00 -2.04 0.07 0.00 0.04 0.00 0.00 34.50 32.57 1xml s PRO 102 CO 0.00 -0.79 1.16 -1.21 0.04 0.00 0.00 177.00 176.21 1xml s GLU 103 N -4.00 3.31 0.25 4.56 2.02 -1.26 -5.01 118.70 118.56 1xml s GLU 103 Ca 0.64 -0.90 0.09 0.00 0.02 0.00 0.00 54.97 54.82 1xml s GLU 103 Cb -0.16 -4.55 -0.04 0.00 0.10 0.00 0.00 34.13 29.48 1xml s GLU 103 CO 0.36 -1.97 0.00 -0.51 0.02 0.00 0.00 175.26 173.16 1xml s LEU 104 N 4.41 3.22 -0.28 1.80 1.43 -1.26 -2.16 118.68 125.85 1xml s LEU 104 Ca 0.32 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 1xml s LEU 104 Cb -0.09 -1.76 0.15 0.00 0.03 0.00 0.00 46.19 44.52 1xml s LEU 104 CO 0.04 0.01 0.39 -1.58 0.23 0.00 0.00 176.35 175.45 1xml s GLN 105 N -3.59 0.39 0.31 1.70 0.74 -0.77 -4.98 119.66 113.46 1xml s GLN 105 Ca 0.31 0.25 -0.29 0.00 0.05 0.00 0.00 55.36 55.68 1xml s GLN 105 Cb -0.07 -0.38 -0.13 0.00 1.10 0.00 0.00 33.01 33.54 1xml s GLN 105 CO 0.20 -0.91 1.28 -0.11 -0.55 0.00 0.00 175.29 175.20 1xml n LEU 106 N 5.35 3.23 -0.03 3.68 7.94 -1.26 -1.30 117.00 134.61 1xml n LEU 106 Ca -0.01 1.19 -0.07 0.00 -1.11 0.00 0.00 56.01 56.01 1xml n LEU 106 Cb 0.49 -1.45 -0.02 0.00 0.53 0.00 0.00 43.42 42.97 1xml n LEU 106 CO 0.01 -0.61 -0.52 1.67 -1.11 0.00 0.00 177.39 176.83 1xml n GLN 107 N 0.87 0.25 -4.10 1.96 -0.06 -0.93 -4.83 117.38 110.54 1xml n GLN 107 Ca 0.07 0.10 -0.12 0.00 -2.00 0.00 0.00 57.00 55.05 1xml n GLN 107 Cb 0.35 -0.94 -0.11 0.00 -4.06 0.00 0.00 30.24 25.48 1xml n GLN 107 CO 0.00 0.00 0.00 0.12 -0.20 0.00 0.00 177.06 176.98 1xml s PHE 108 N -2.36 0.76 -0.14 3.69 5.36 -1.18 -5.02 117.98 119.08 1xml s PHE 108 Ca -0.15 -0.65 -0.15 0.00 -0.96 0.00 0.00 56.93 55.02 1xml s PHE 108 Cb 0.03 -0.45 0.04 0.00 -0.34 0.00 0.00 43.02 42.31 1xml s PHE 108 CO 0.21 -0.11 0.42 -1.54 -1.46 0.00 0.00 175.22 172.74 1xml s SER 109 N -2.11 -0.42 -0.29 6.13 1.04 -1.26 -1.67 113.70 115.11 1xml s SER 109 Ca -0.02 0.78 -0.00 0.00 0.48 0.00 0.00 55.95 57.19 1xml s SER 109 Cb -0.04 0.81 0.19 0.00 0.10 0.00 0.00 66.02 67.07 1xml s SER 109 CO -0.01 -0.18 0.74 0.21 0.98 0.00 0.00 173.24 174.97 1xml s ASN 110 N 0.05 -1.22 0.45 7.02 3.84 -0.60 -5.01 114.94 119.47 1xml s ASN 110 Ca -0.01 0.21 0.00 0.00 0.21 0.00 0.00 52.86 53.27 1xml s ASN 110 Cb -0.03 1.80 0.00 0.00 -0.55 0.00 0.00 41.25 42.47 1xml s ASN 110 CO 0.01 -0.22 0.00 -0.67 -2.79 0.00 0.00 177.10 173.43 1xml n ASP 111 N 5.34 0.00 -0.11 -4.21 4.64 -1.26 -2.76 116.55 118.19 1xml n ASP 111 Ca 0.05 0.00 -0.12 0.00 -1.38 0.00 0.00 54.79 53.34 1xml n ASP 111 Cb 0.55 0.00 -0.15 0.00 -1.04 0.00 0.00 41.12 40.48 1xml n ASP 111 CO 0.00 0.00 0.00 -0.38 -0.82 0.00 0.00 177.20 176.00 1xml n ILE 112 N 0.00 1.42 -3.10 5.18 5.41 -1.26 -4.94 119.36 122.07 1xml n ILE 112 Ca 0.00 -0.77 -0.39 0.00 1.00 0.00 0.00 62.75 62.59 1xml n ILE 112 Cb 0.00 -0.76 -0.06 0.00 -0.71 0.00 0.00 39.64 38.11 1xml n ILE 112 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 1xml s TYR 113 N -2.50 3.85 -0.30 1.39 5.04 -1.11 -5.07 117.35 118.65 1xml s TYR 113 Ca -0.18 1.48 -0.12 0.00 -2.44 0.00 0.00 57.07 55.81 1xml s TYR 113 Cb 0.07 -2.65 0.14 0.00 0.35 0.00 0.00 41.96 39.87 1xml s TYR 113 CO 0.76 0.53 0.80 -1.54 -1.34 0.00 0.00 175.55 174.75 1xml s SER 114 N -1.18 -0.89 0.16 4.32 1.04 -1.26 -1.56 113.70 114.33 1xml s SER 114 Ca 0.34 1.24 -0.06 0.00 0.48 0.00 0.00 55.95 57.96 1xml s SER 114 Cb -0.21 1.96 -0.06 0.00 0.10 0.00 0.00 66.02 67.81 1xml s SER 114 CO 0.23 -0.18 0.41 -0.89 0.98 0.00 0.00 173.24 173.80 1xml s THR 115 N 2.59 5.12 0.14 2.02 2.01 -0.67 -4.99 115.64 121.85 1xml s THR 115 Ca -0.05 0.11 0.01 0.00 0.31 0.00 0.00 61.69 62.07 1xml s THR 115 Cb -0.09 -3.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 1xml s THR 115 CO -0.18 0.01 0.01 -0.31 -0.69 0.00 0.00 174.62 173.46 1xml s TYR 116 N -1.70 0.98 -0.26 4.92 1.51 -1.26 -2.20 117.35 119.34 1xml s TYR 116 Ca 0.42 -1.09 -0.10 0.00 -1.01 0.00 0.00 57.07 55.29 1xml s TYR 116 Cb -0.12 -0.57 -0.05 0.00 -0.11 0.00 0.00 41.96 41.12 1xml s TYR 116 CO 0.24 -0.33 0.16 -1.01 -1.11 0.00 0.00 175.55 173.50 1xml s HIS 117 N -3.82 3.23 -0.09 2.71 3.76 -0.42 -4.87 115.29 115.79 1xml s HIS 117 Ca 0.21 0.08 -0.02 0.00 -0.15 0.00 0.00 55.06 55.17 1xml s HIS 117 Cb 0.07 -2.32 -0.03 0.00 1.11 0.00 0.00 32.58 31.41 1xml s HIS 117 CO 0.01 -0.10 0.02 -1.17 -0.85 0.00 0.00 174.74 172.64 1xml s LEU 118 N 1.47 3.67 -0.48 0.89 2.96 -1.26 -1.84 118.68 124.09 1xml s LEU 118 Ca 0.07 0.18 0.03 0.00 -0.22 0.00 0.00 54.13 54.19 1xml s LEU 118 Cb -0.15 -1.85 0.13 0.00 0.50 0.00 0.00 46.19 44.82 1xml s LEU 118 CO 0.08 0.38 0.23 -0.36 -1.32 0.00 0.00 176.35 175.36 1xml s PHE 119 N -0.88 2.84 0.78 5.38 0.40 -0.92 -5.05 117.98 120.53 1xml s PHE 119 Ca 0.13 -2.91 -0.11 0.00 -0.60 0.00 0.00 56.93 53.45 1xml s PHE 119 Cb -0.11 -2.53 0.06 0.00 0.51 0.00 0.00 43.02 40.95 1xml s PHE 119 CO 0.02 -0.77 1.08 -2.14 0.70 0.00 0.00 175.22 174.12 1xml s PRO 120 N 0.04 2.18 0.94 0.24 0.02 -1.26 -4.48 135.00 132.68 1xml s PRO 120 Ca 0.16 0.97 -0.12 0.00 0.02 0.00 0.00 61.00 62.04 1xml s PRO 120 Cb -0.25 -1.90 0.08 0.00 0.02 0.00 0.00 34.50 32.45 1xml s PRO 120 CO -0.01 -1.64 0.70 -2.30 -0.33 0.00 0.00 177.00 173.42 1xml n PRO 121 N -3.50 -0.39 -0.46 5.54 -0.02 -1.26 -4.86 135.00 130.06 1xml n PRO 121 Ca 0.08 -0.06 0.42 0.00 -2.02 0.00 0.00 63.50 61.91 1xml n PRO 121 Cb 0.54 -2.06 0.73 0.00 -0.02 0.00 0.00 33.50 32.69 1xml n PRO 121 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1xml h ARG 122 N -1.71 0.00 0.00 -0.52 2.43 -2.00 -2.71 114.38 109.87 1xml h ARG 122 Ca -0.43 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.68 1xml h ARG 122 Cb 1.28 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1xml h ARG 122 CO 0.37 0.00 -0.27 1.96 -1.51 0.00 0.00 179.97 180.52 1xml h GLN 123 N 0.00 0.00 -0.03 0.20 7.50 -2.03 -2.85 115.11 117.90 1xml h GLN 123 Ca 0.71 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.86 1xml h GLN 123 Cb 3.02 0.00 0.00 0.00 0.05 0.00 0.00 27.48 30.55 1xml h GLN 123 CO -0.01 0.27 0.00 1.28 -1.50 0.00 0.00 178.83 178.88 1xml n LEU 124 N -3.20 2.05 -0.55 1.46 4.32 -1.02 -4.44 117.00 115.62 1xml n LEU 124 Ca 0.02 -0.69 0.09 0.00 -0.02 0.00 0.00 56.01 55.41 1xml n LEU 124 Cb 0.61 -0.01 0.04 0.00 -1.62 0.00 0.00 43.42 42.44 1xml n LEU 124 CO 0.37 0.35 0.40 0.59 -1.22 0.00 0.00 177.39 177.87 1xml n ASN 125 N 0.60 2.09 -4.77 -1.43 3.02 -1.08 -4.93 115.26 108.76 1xml n ASN 125 Ca 0.17 -1.54 -0.40 0.00 -0.03 0.00 0.00 54.58 52.78 1xml n ASN 125 Cb 0.44 0.24 0.01 0.00 -0.61 0.00 0.00 39.78 39.85 1xml n ASN 125 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 1xml s ASP 126 N -1.73 6.14 -0.10 6.41 -4.77 -1.25 -4.95 116.67 116.41 1xml s ASP 126 Ca 0.17 2.96 0.02 0.00 -3.30 0.00 0.00 52.55 52.40 1xml s ASP 126 Cb 0.14 -2.66 0.02 0.00 -1.09 0.00 0.00 42.92 39.33 1xml s ASP 126 CO 0.33 -1.00 -0.13 -0.69 0.70 0.00 0.00 175.17 174.37 1xml s VAL 127 N -1.17 1.33 -0.15 2.11 1.01 -1.26 -3.68 120.40 118.60 1xml s VAL 127 Ca 0.57 -0.55 -0.29 0.00 0.00 0.00 0.00 61.98 61.70 1xml s VAL 127 Cb -0.45 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 1xml s VAL 127 CO 0.59 0.41 1.56 -0.75 0.00 0.00 0.00 175.10 176.90 1xml s LYS 128 N 1.00 4.03 -0.27 2.72 2.20 -0.38 -4.84 119.74 124.19 1xml s LYS 128 Ca -0.07 1.86 0.02 0.00 -0.36 0.00 0.00 55.97 57.41 1xml s LYS 128 Cb -0.15 -3.96 0.07 0.00 -1.51 0.00 0.00 37.83 32.28 1xml s LYS 128 CO -0.01 -1.01 -0.03 0.99 -0.36 0.00 0.00 175.35 174.93 1xml s THR 129 N 4.41 1.82 -0.15 3.43 2.01 -1.26 -1.14 115.64 124.76 1xml s THR 129 Ca 0.69 -1.60 -0.08 0.00 0.31 0.00 0.00 61.69 61.00 1xml s THR 129 Cb -0.27 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 1xml s THR 129 CO 0.26 -0.24 0.14 -0.89 -0.69 0.00 0.00 174.62 173.20 1xml s THR 130 N 1.22 5.46 -0.03 -0.82 2.01 -0.17 -4.94 115.64 118.38 1xml s THR 130 Ca -0.02 0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.24 1xml s THR 130 Cb -0.19 -3.44 -0.01 0.00 0.01 0.00 0.00 72.50 68.88 1xml s THR 130 CO -0.08 0.54 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.56 1xml s VAL 131 N -0.46 1.21 -0.19 3.82 1.01 -1.26 -0.33 120.40 124.20 1xml s VAL 131 Ca 0.12 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1xml s VAL 131 Cb -0.12 -1.03 0.04 0.00 0.00 0.00 0.00 36.38 35.27 1xml s VAL 131 CO 0.02 0.35 -0.12 -0.69 0.00 0.00 0.00 175.10 174.66 1xml s VAL 132 N -0.11 1.69 -0.23 2.92 1.01 -0.24 -5.00 120.40 120.45 1xml s VAL 132 Ca 0.01 -0.98 -0.10 0.00 0.00 0.00 0.00 61.98 60.91 1xml s VAL 132 Cb -0.08 -1.72 0.09 0.00 0.00 0.00 0.00 36.38 34.66 1xml s VAL 132 CO 0.01 0.23 0.53 -0.47 0.00 0.00 0.00 175.10 175.39 1xml s TYR 133 N 1.38 -0.95 0.41 5.22 5.04 -1.26 -2.20 117.35 125.00 1xml s TYR 133 Ca -0.00 1.80 -0.24 0.00 -2.44 0.00 0.00 57.07 56.18 1xml s TYR 133 Cb -0.16 0.49 -0.08 0.00 0.35 0.00 0.00 41.96 42.56 1xml s TYR 133 CO -0.09 -0.51 1.14 -2.14 -1.34 0.00 0.00 175.55 172.61 1xml s PRO 134 N 2.27 4.00 -0.05 4.97 0.02 -1.26 -5.14 135.00 139.81 1xml s PRO 134 Ca -0.06 1.75 -0.14 0.00 0.02 0.00 0.00 61.00 62.57 1xml s PRO 134 Cb -0.10 -2.58 -0.05 0.00 0.02 0.00 0.00 34.50 31.79 1xml s PRO 134 CO -0.16 -0.34 0.38 0.00 -0.33 0.00 0.00 177.00 176.55 1xml s ALA 135 N -1.50 3.67 0.59 -1.55 0.00 -0.97 -4.98 121.76 117.02 1xml s ALA 135 Ca 0.59 -0.28 0.09 0.00 0.00 0.00 0.00 51.96 52.36 1xml s ALA 135 Cb -0.28 -2.38 0.09 0.00 0.00 0.00 0.00 23.12 20.55 1xml s ALA 135 CO 0.35 0.38 0.78 0.25 0.00 0.00 0.00 175.76 177.52 1xml n THR 136 N 2.31 0.00 0.11 0.00 -2.24 -1.26 -4.59 114.28 108.61 1xml n THR 136 Ca -0.13 -1.99 0.02 0.00 -2.27 0.00 0.00 64.05 59.68 1xml n THR 136 Cb 0.52 -0.46 0.38 0.00 -2.10 0.00 0.00 70.33 68.67 1xml n THR 136 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1xml h GLU 137 N 0.00 0.27 -0.05 -0.78 4.57 -2.00 -2.81 114.58 113.78 1xml h GLU 137 Ca -0.28 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 57.76 1xml h GLU 137 Cb 1.27 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.81 1xml h GLU 137 CO 0.41 0.39 -0.33 0.87 -1.18 0.00 0.00 179.01 179.17 1xml h LYS 138 N 0.25 0.09 0.00 1.92 6.56 -2.00 -2.30 116.57 121.10 1xml h LYS 138 Ca 0.05 -0.03 -0.15 0.00 -1.06 0.00 0.00 60.65 59.46 1xml h LYS 138 Cb 0.37 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.00 1xml h LYS 138 CO 0.02 0.41 -0.73 0.45 -2.06 0.00 0.00 179.45 177.54 1xml h HIS 139 N 0.08 0.00 -0.27 -1.35 3.86 -1.89 -2.59 115.15 112.99 1xml h HIS 139 Ca 0.01 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.03 1xml h HIS 139 Cb 0.62 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 1xml h HIS 139 CO 0.00 0.73 -0.58 -0.07 0.86 0.00 0.00 177.93 178.87 1xml h LEU 140 N 0.00 0.98 -0.52 2.43 3.38 -1.27 -2.92 115.31 117.38 1xml h LEU 140 Ca -0.01 -0.54 -0.14 0.00 0.09 0.00 0.00 57.88 57.29 1xml h LEU 140 Cb 1.43 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 1xml h LEU 140 CO 0.10 1.34 -0.64 1.56 0.09 0.00 0.00 178.44 180.88 1xml h GLN 141 N 0.66 0.00 -0.37 1.13 1.08 -1.48 -2.50 115.11 113.62 1xml h GLN 141 Ca 0.00 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.08 1xml h GLN 141 Cb 1.20 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.62 1xml h GLN 141 CO 0.13 0.64 -0.27 -0.22 -0.95 0.00 0.00 178.83 178.16 1xml h LYS 142 N 0.00 0.78 -0.01 1.46 3.64 -1.45 -3.22 116.57 117.77 1xml h LYS 142 Ca -0.01 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1xml h LYS 142 Cb 1.25 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1xml h LYS 142 CO 0.08 0.96 -0.48 0.66 -2.27 0.00 0.00 179.45 178.40 1xml n TYR 143 N -4.09 0.00 -1.89 1.91 0.53 -1.11 -4.92 117.16 107.59 1xml n TYR 143 Ca -0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.90 56.46 1xml n TYR 143 Cb 0.46 -0.03 -0.02 0.00 -1.03 0.00 0.00 39.34 38.72 1xml n TYR 143 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 1xml s LEU 144 N -2.54 4.37 0.29 7.72 2.96 -0.94 -4.08 118.68 126.45 1xml s LEU 144 Ca 0.19 2.76 -0.30 0.00 -0.22 0.00 0.00 54.13 56.56 1xml s LEU 144 Cb 0.18 -3.62 -0.13 0.00 0.50 0.00 0.00 46.19 43.13 1xml s LEU 144 CO 0.59 -0.83 1.40 -1.14 -1.32 0.00 0.00 176.35 175.05 1xml n ARG 145 N 2.96 2.19 -2.30 1.98 3.00 -0.62 -4.87 116.66 118.99 1xml n ARG 145 Ca 0.10 0.78 -0.43 0.00 -0.00 0.00 0.00 57.85 58.30 1xml n ARG 145 Cb 0.38 -2.43 -0.02 0.00 0.00 0.00 0.00 32.46 30.39 1xml n ARG 145 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 1xml s GLN 146 N -1.00 4.00 -0.67 -0.14 -2.07 -1.26 -4.94 119.66 113.58 1xml s GLN 146 Ca 0.62 1.56 -0.24 0.00 -1.82 0.00 0.00 55.36 55.49 1xml s GLN 146 Cb -0.59 -3.90 0.06 0.00 -1.09 0.00 0.00 33.01 27.49 1xml s GLN 146 CO 0.54 -1.02 1.05 0.34 -1.32 0.00 0.00 175.29 174.88 1xml s ASP 147 N 3.00 6.19 0.25 12.60 -1.08 -1.26 -5.02 116.67 131.35 1xml s ASP 147 Ca 0.61 -0.75 -0.08 0.00 -0.52 0.00 0.00 52.55 51.82 1xml s ASP 147 Cb -0.22 -2.46 -0.06 0.00 -1.46 0.00 0.00 42.92 38.72 1xml s ASP 147 CO 0.23 -1.53 0.55 -0.76 0.52 0.00 0.00 175.17 174.18 1xml s LEU 148 N 4.53 4.12 -0.02 -1.34 1.43 -1.26 -0.25 118.68 125.89 1xml s LEU 148 Ca 0.27 0.85 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 1xml s LEU 148 Cb -0.14 -3.64 0.01 0.00 0.03 0.00 0.00 46.19 42.46 1xml s LEU 148 CO 0.13 -0.12 -0.03 -0.13 0.23 0.00 0.00 176.35 176.43 1xml s ARG 149 N -3.09 0.42 0.33 1.70 1.81 -0.03 -4.84 118.95 115.24 1xml s ARG 149 Ca 0.46 -0.06 -0.26 0.00 -1.72 0.00 0.00 55.73 54.15 1xml s ARG 149 Cb -0.11 -0.49 -0.10 0.00 -0.45 0.00 0.00 34.95 33.81 1xml s ARG 149 CO 0.25 -0.03 0.97 -1.17 -0.68 0.00 0.00 175.30 174.64 1xml s LEU 150 N 0.52 4.34 0.01 2.53 2.96 -1.26 -1.08 118.68 126.70 1xml s LEU 150 Ca -0.06 1.90 -0.01 0.00 -0.22 0.00 0.00 54.13 55.74 1xml s LEU 150 Cb -0.09 -3.99 -0.01 0.00 0.50 0.00 0.00 46.19 42.60 1xml s LEU 150 CO -0.01 -0.12 0.00 -0.51 -1.32 0.00 0.00 176.35 174.40 1xml s ILE 151 N -1.57 0.08 -0.26 6.68 2.07 -0.10 -4.95 121.20 123.16 1xml s ILE 151 Ca 0.50 -0.63 -0.00 0.00 -1.41 0.00 0.00 60.65 59.11 1xml s ILE 151 Cb -0.20 -0.22 0.04 0.00 0.13 0.00 0.00 42.46 42.21 1xml s ILE 151 CO 0.26 -0.35 -0.07 -0.13 -1.91 0.00 0.00 174.94 172.74 1xml s ARG 152 N -1.04 2.63 -0.36 3.50 0.52 -1.26 -1.88 118.95 121.06 1xml s ARG 152 Ca -0.11 -1.11 -0.12 0.00 -0.52 0.00 0.00 55.73 53.87 1xml s ARG 152 Cb -0.07 -2.97 0.01 0.00 0.52 0.00 0.00 34.95 32.44 1xml s ARG 152 CO -0.00 -0.47 0.23 -2.00 0.02 0.00 0.00 175.30 173.08 1xml s GLU 153 N 1.26 3.11 0.89 3.54 2.12 0.17 -4.94 118.70 124.86 1xml s GLU 153 Ca -0.03 -0.90 -0.12 0.00 0.36 0.00 0.00 54.97 54.29 1xml s GLU 153 Cb -0.18 -3.78 0.13 0.00 0.26 0.00 0.00 34.13 30.56 1xml s GLU 153 CO -0.05 -0.60 1.09 0.95 -0.54 0.00 0.00 175.26 176.12 1xml s THR 154 N 1.64 2.64 0.43 -1.70 -4.23 -1.26 -1.16 115.64 112.00 1xml s THR 154 Ca 0.04 0.21 0.13 0.00 -1.18 0.00 0.00 61.69 60.89 1xml s THR 154 Cb -0.18 -2.74 0.32 0.00 1.34 0.00 0.00 72.50 71.23 1xml s THR 154 CO 0.08 -0.27 2.00 1.23 -0.54 0.00 0.00 174.62 177.12 1xml h GLY 155 N -1.51 0.55 0.89 3.99 0.00 -1.70 -0.97 103.07 104.32 1xml h GLY 155 Ca -0.50 -0.17 -0.17 0.00 0.00 0.00 0.00 47.33 46.50 1xml h GLY 155 CO 0.56 0.12 -0.62 -0.55 0.00 0.00 0.00 176.54 176.05 1xml h ASP 156 N 0.42 0.63 -1.01 0.19 3.32 -1.89 -2.54 116.42 115.54 1xml h ASP 156 Ca 0.24 -0.70 0.14 0.00 0.02 0.00 0.00 57.03 56.73 1xml h ASP 156 Cb 0.42 -0.19 -0.09 0.00 0.22 0.00 0.00 39.33 39.69 1xml h ASP 156 CO -0.07 1.24 0.63 0.44 -1.72 0.00 0.00 179.24 179.77 1xml h ASP 157 N 0.07 0.89 0.08 6.45 3.32 -1.83 0.88 116.42 126.29 1xml h ASP 157 Ca -0.06 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1xml h ASP 157 Cb 1.29 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1xml h ASP 157 CO 0.12 0.43 -0.04 0.22 -1.72 0.00 0.00 179.24 178.26 1xml h TYR 158 N 0.94 -0.10 -0.40 4.55 3.20 -1.05 0.56 116.97 124.66 1xml h TYR 158 Ca 0.52 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 62.30 1xml h TYR 158 Cb 0.60 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 1xml h TYR 158 CO -0.00 0.05 -0.11 0.00 -1.64 0.00 0.00 178.16 176.46 1xml h ARG 159 N -0.24 0.71 0.00 1.82 3.08 -1.02 -0.68 114.38 118.04 1xml h ARG 159 Ca -0.01 -0.23 -0.21 0.00 0.07 0.00 0.00 59.98 59.60 1xml h ARG 159 Cb 0.20 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 1xml h ARG 159 CO 0.02 0.80 -1.77 0.09 -1.07 0.00 0.00 179.97 178.04 1xml n ASN 160 N -4.17 0.53 0.03 7.04 3.02 0.27 -4.44 115.26 117.54 1xml n ASN 160 Ca 0.01 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.80 1xml n ASN 160 Cb 0.35 0.59 0.00 0.00 -0.61 0.00 0.00 39.78 40.11 1xml n ASN 160 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1xml n ILE 161 N -2.79 0.71 0.06 2.41 5.41 0.14 -4.75 119.36 120.56 1xml n ILE 161 Ca -0.15 0.24 -0.13 0.00 1.00 0.00 0.00 62.75 63.70 1xml n ILE 161 Cb 0.91 -1.50 -0.09 0.00 -0.71 0.00 0.00 39.64 38.25 1xml n ILE 161 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1xml h THR 162 N 0.00 1.06 -0.05 1.39 2.02 -1.29 -2.28 112.91 113.77 1xml h THR 162 Ca 0.00 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 1xml h THR 162 Cb 0.37 1.57 -0.00 0.00 -1.74 0.00 0.00 68.15 68.35 1xml h THR 162 CO 0.00 0.19 -0.00 0.25 0.37 0.00 0.00 175.52 176.33 1xml h LEU 163 N -0.55 0.09 -1.09 2.58 5.85 -1.38 0.37 115.31 121.19 1xml h LEU 163 Ca -0.02 -0.33 0.16 0.00 0.84 0.00 0.00 57.88 58.53 1xml h LEU 163 Cb 0.44 -0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.35 1xml h LEU 163 CO 0.03 0.40 0.61 -0.65 -0.34 0.00 0.00 178.44 178.49 1xml h PRO 164 N -0.21 0.79 -0.37 5.25 0.11 -1.78 -0.17 132.00 135.62 1xml h PRO 164 Ca 0.01 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 1xml h PRO 164 Cb 0.35 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 1xml h PRO 164 CO 0.00 0.52 -0.02 1.25 -0.21 0.00 0.00 178.00 179.55 1xml h HIS 165 N 0.82 0.73 -0.60 0.65 -0.00 -0.93 -0.99 115.15 114.83 1xml h HIS 165 Ca 0.52 -0.13 0.01 0.00 -0.00 0.00 0.00 60.37 60.77 1xml h HIS 165 Cb 0.74 -0.19 -0.03 0.00 -0.00 0.00 0.00 27.41 27.93 1xml h HIS 165 CO -0.00 0.77 0.38 1.25 -0.00 0.00 0.00 177.93 180.33 1xml h LEU 166 N 0.48 0.65 -0.87 0.26 5.85 -0.29 -2.22 115.31 119.17 1xml h LEU 166 Ca 0.10 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.70 1xml h LEU 166 Cb 0.49 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1xml h LEU 166 CO 0.02 0.47 -0.39 -0.33 -0.34 0.00 0.00 178.44 177.87 1xml h GLU 167 N 0.78 0.35 -0.17 1.25 5.08 -0.87 -2.90 114.58 118.09 1xml h GLU 167 Ca 0.23 -0.16 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 1xml h GLU 167 Cb -0.05 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1xml h GLU 167 CO -0.07 0.69 -0.38 0.66 -1.00 0.00 0.00 179.01 178.92 1xml h SER 168 N 0.29 0.39 -3.97 1.42 4.64 -0.85 -3.39 113.55 112.09 1xml h SER 168 Ca 0.03 -0.16 -0.48 0.00 -0.47 0.00 0.00 61.79 60.71 1xml h SER 168 Cb 0.82 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1xml h SER 168 CO 0.07 0.73 0.40 -1.10 -0.87 0.00 0.00 176.83 176.06 1xml s GLN 169 N -4.24 4.19 -0.70 4.77 -0.21 -0.87 -4.98 119.66 117.62 1xml s GLN 169 Ca -0.06 1.46 0.03 0.00 0.02 0.00 0.00 55.36 56.82 1xml s GLN 169 Cb 0.13 -2.52 0.32 0.00 1.00 0.00 0.00 33.01 31.95 1xml s GLN 169 CO 0.79 -0.11 1.14 0.43 -2.12 0.00 0.00 175.29 175.42 1xml n SER 170 N -0.09 5.12 -4.68 5.90 7.64 -1.26 -4.85 113.62 121.39 1xml n SER 170 Ca 0.05 -3.65 -0.42 0.00 1.01 0.00 0.00 58.87 55.86 1xml n SER 170 Cb 0.50 -0.73 -0.03 0.00 -1.01 0.00 0.00 64.21 62.94 1xml n SER 170 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1xml s LEU 171 N -3.53 4.30 0.04 -3.43 1.43 -1.26 -4.98 118.68 111.25 1xml s LEU 171 Ca 0.45 2.08 -0.27 0.00 -1.03 0.00 0.00 54.13 55.35 1xml s LEU 171 Cb 0.24 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.85 1xml s LEU 171 CO -0.11 -0.75 0.85 -0.55 0.23 0.00 0.00 176.35 176.02 1xml s SER 172 N 2.08 7.29 -0.20 2.29 0.15 -1.26 -4.93 113.70 119.12 1xml s SER 172 Ca 0.64 1.55 0.13 0.00 0.70 0.00 0.00 55.95 58.97 1xml s SER 172 Cb -0.30 -2.51 0.40 0.00 -1.71 0.00 0.00 66.02 61.89 1xml s SER 172 CO 0.25 -0.08 1.25 2.30 1.20 0.00 0.00 173.24 178.16 1xml n ILE 173 N 3.17 2.17 -0.27 6.45 -5.35 -1.26 -4.73 119.36 119.54 1xml n ILE 173 Ca 0.01 -2.79 0.17 0.00 -0.27 0.00 0.00 62.75 59.86 1xml n ILE 173 Cb 0.50 -0.25 0.45 0.00 -1.74 0.00 0.00 39.64 38.60 1xml n ILE 173 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1xml h GLN 174 N 0.76 0.51 -0.41 6.28 5.75 -2.00 -1.12 115.11 124.87 1xml h GLN 174 Ca 0.03 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1xml h GLN 174 Cb 1.13 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 29.54 1xml h GLN 174 CO 0.07 0.34 0.15 0.11 -2.65 0.00 0.00 178.83 176.86 1xml h TRP 175 N 0.53 0.59 -0.25 3.99 5.08 -2.00 0.18 115.95 124.06 1xml h TRP 175 Ca 0.49 -0.02 -0.03 0.00 1.08 0.00 0.00 58.89 60.40 1xml h TRP 175 Cb 1.04 -0.18 -0.01 0.00 -3.00 0.00 0.00 29.16 27.00 1xml h TRP 175 CO -0.00 0.47 0.03 0.28 -1.28 0.00 0.00 178.44 177.94 1xml h VAL 176 N 0.59 1.23 -0.45 0.12 2.07 -1.58 -2.79 116.25 115.43 1xml h VAL 176 Ca 0.14 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1xml h VAL 176 Cb 0.14 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1xml h VAL 176 CO -0.01 0.25 0.22 1.88 0.02 0.00 0.00 177.57 179.93 1xml h TYR 177 N 0.22 0.61 -0.22 1.57 0.99 -1.01 -1.57 116.97 117.57 1xml h TYR 177 Ca 0.08 -0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.73 1xml h TYR 177 Cb 0.34 -0.20 -0.01 0.00 1.00 0.00 0.00 36.73 37.86 1xml h TYR 177 CO 0.02 0.45 -0.14 -0.91 -0.00 0.00 0.00 178.16 177.58 1xml h ASN 178 N 0.63 0.35 -0.18 3.88 2.35 -0.88 -0.41 115.58 121.32 1xml h ASN 178 Ca 0.16 -0.08 -0.10 0.00 -0.55 0.00 0.00 56.30 55.73 1xml h ASN 178 Cb 0.06 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 1xml h ASN 178 CO -0.02 0.52 -0.28 0.40 -1.65 0.00 0.00 177.43 176.39 1xml h ILE 179 N 0.34 1.34 -0.26 2.81 2.04 -1.05 0.14 117.51 122.87 1xml h ILE 179 Ca 0.06 -1.50 -0.04 0.00 1.00 0.00 0.00 64.86 64.38 1xml h ILE 179 Cb 0.46 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 1xml h ILE 179 CO 0.03 0.46 -0.02 -0.07 0.00 0.00 0.00 178.15 178.54 1xml h LEU 180 N 0.15 0.36 -0.72 1.44 3.38 -1.07 -1.82 115.31 117.04 1xml h LEU 180 Ca 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1xml h LEU 180 Cb 0.86 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1xml h LEU 180 CO 0.06 0.45 0.00 0.47 0.09 0.00 0.00 178.44 179.51 1xml n ASP 181 N -4.31 1.09 -0.70 -0.43 10.43 -0.19 -4.92 116.55 117.52 1xml n ASP 181 Ca 0.01 -1.54 -0.09 0.00 2.57 0.00 0.00 54.79 55.73 1xml n ASP 181 Cb 0.23 -0.05 -0.04 0.00 1.84 0.00 0.00 41.12 43.10 1xml n ASP 181 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1xml n LYS 182 N -0.09 -0.95 0.17 -1.24 4.76 -0.68 -4.89 118.16 115.24 1xml n LYS 182 Ca 0.17 0.76 0.05 0.00 -2.87 0.00 0.00 58.31 56.42 1xml n LYS 182 Cb 0.25 -4.75 0.21 0.00 -1.84 0.00 0.00 35.03 28.89 1xml n LYS 182 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 1xml h LYS 183 N 0.11 0.00 -4.07 1.97 1.57 -0.98 -3.42 116.57 111.75 1xml h LYS 183 Ca -0.19 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.32 1xml h LYS 183 Cb 0.75 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.79 1xml h LYS 183 CO 0.27 0.42 -0.73 0.00 -0.57 0.00 0.00 179.45 178.83 1xml s ALA 184 N -3.30 0.24 -0.00 3.86 0.00 -0.90 -4.90 121.76 116.76 1xml s ALA 184 Ca 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1xml s ALA 184 Cb 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.18 1xml s ALA 184 CO 0.71 0.03 0.00 0.39 0.00 0.00 0.00 175.76 176.89 1xml n GLU 185 N 2.78 -1.06 -0.13 0.00 -0.58 -1.26 -4.21 120.64 116.18 1xml n GLU 185 Ca -0.14 0.27 0.01 0.00 -0.42 0.00 0.00 57.16 56.87 1xml n GLU 185 Cb 0.58 -4.06 0.29 0.00 -0.57 0.00 0.00 31.44 27.68 1xml n GLU 185 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xml h ALA 186 N 0.00 1.48 -0.24 0.62 0.00 -1.88 -1.57 119.26 117.66 1xml h ALA 186 Ca -0.00 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.90 1xml h ALA 186 Cb 0.53 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1xml h ALA 186 CO 0.00 0.44 0.21 0.22 0.00 0.00 0.00 179.25 180.12 1xml h ASP 187 N 0.82 0.00 0.87 0.00 3.58 -1.94 -2.56 116.42 117.18 1xml h ASP 187 Ca 0.21 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.66 1xml h ASP 187 Cb -0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1xml h ASP 187 CO -0.04 0.00 -0.47 0.54 -2.88 0.00 0.00 179.24 176.39 1xml n ARG 188 N -4.14 0.20 -1.70 0.28 1.74 -0.59 -4.94 116.66 107.51 1xml n ARG 188 Ca 0.03 0.07 -0.43 0.00 -0.77 0.00 0.00 57.85 56.76 1xml n ARG 188 Cb 0.35 -1.64 -0.03 0.00 -1.02 0.00 0.00 32.46 30.12 1xml n ARG 188 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1xml n ILE 189 N -1.94 0.21 0.08 0.55 5.41 -0.97 -4.35 119.36 118.35 1xml n ILE 189 Ca 0.04 -0.04 -0.23 0.00 1.00 0.00 0.00 62.75 63.53 1xml n ILE 189 Cb 0.41 -2.02 -0.15 0.00 -0.71 0.00 0.00 39.64 37.17 1xml n ILE 189 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1xml h VAL 190 N 4.28 0.99 -2.34 1.39 2.07 -1.41 -3.49 116.25 117.75 1xml h VAL 190 Ca -0.45 -2.55 -0.08 0.00 0.82 0.00 0.00 66.70 64.44 1xml h VAL 190 Cb 1.22 2.80 -0.21 0.00 -1.52 0.00 0.00 31.29 33.58 1xml h VAL 190 CO 0.95 0.85 -0.01 0.12 0.02 0.00 0.00 177.57 179.50 1xml s PHE 191 N -2.58 -0.58 -0.04 1.57 5.36 -1.21 -5.02 117.98 115.47 1xml s PHE 191 Ca -0.15 1.29 -0.01 0.00 -0.96 0.00 0.00 56.93 57.10 1xml s PHE 191 Cb 0.05 0.25 0.03 0.00 -0.34 0.00 0.00 43.02 43.01 1xml s PHE 191 CO 0.87 -0.39 0.08 -2.00 -1.46 0.00 0.00 175.22 172.31 1xml s GLU 192 N -0.26 0.00 -0.44 10.12 2.12 -1.26 -0.90 118.70 128.08 1xml s GLU 192 Ca -0.04 0.29 -0.16 0.00 0.36 0.00 0.00 54.97 55.41 1xml s GLU 192 Cb -0.03 -0.25 0.04 0.00 0.26 0.00 0.00 34.13 34.14 1xml s GLU 192 CO 0.03 -0.19 0.41 1.21 -0.54 0.00 0.00 175.26 176.18 1xml s ASN 193 N 1.27 6.16 0.00 -1.70 3.84 -0.50 -4.99 114.94 119.03 1xml s ASN 193 Ca -0.07 -0.90 0.24 0.00 0.21 0.00 0.00 52.86 52.33 1xml s ASN 193 Cb -0.12 -2.20 1.41 0.00 -0.55 0.00 0.00 41.25 39.78 1xml s ASN 193 CO -0.04 -0.59 1.79 -0.81 -2.79 0.00 0.00 177.10 174.66 1xml n PRO 194 N 5.44 0.77 -1.68 0.43 -0.04 -1.26 -1.26 135.00 137.41 1xml n PRO 194 Ca -0.09 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.94 1xml n PRO 194 Cb 0.46 -1.48 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 1xml n PRO 194 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1xml n ASP 195 N -0.98 4.01 0.21 3.54 -0.08 -1.26 -4.86 116.55 117.13 1xml n ASP 195 Ca 0.18 0.97 0.15 0.00 -1.51 0.00 0.00 54.79 54.57 1xml n ASP 195 Cb 0.08 -1.52 0.67 0.00 2.34 0.00 0.00 41.12 42.68 1xml n ASP 195 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1xml h PRO 196 N 9.06 0.00 0.00 -0.67 0.11 -1.93 -0.05 132.00 138.52 1xml h PRO 196 Ca -0.47 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.20 1xml h PRO 196 Cb 1.23 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.27 1xml h PRO 196 CO 0.94 0.00 -2.47 0.45 -0.21 0.00 0.00 178.00 176.71 1xml n SER 197 N -2.62 1.97 -0.52 -2.05 2.88 -1.26 -2.91 113.62 109.10 1xml n SER 197 Ca 0.00 0.18 0.05 0.00 -1.33 0.00 0.00 58.87 57.77 1xml n SER 197 Cb 0.20 -0.69 0.13 0.00 -0.75 0.00 0.00 64.21 63.10 1xml n SER 197 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1xml n ASP 198 N -3.91 2.80 -5.02 -3.46 8.00 -1.23 -4.50 116.55 109.24 1xml n ASP 198 Ca -0.51 -2.09 -0.19 0.00 0.71 0.00 0.00 54.79 52.72 1xml n ASP 198 Cb 0.92 -0.21 0.04 0.00 -0.02 0.00 0.00 41.12 41.85 1xml n ASP 198 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1xml s GLY 199 N -1.10 1.82 0.10 0.44 0.00 -0.03 -4.48 107.32 104.07 1xml s GLY 199 Ca 0.20 -1.93 -0.26 0.00 0.00 0.00 0.00 44.72 42.73 1xml s GLY 199 CO 0.12 -1.58 0.89 -0.11 0.00 0.00 0.00 173.10 172.42 1xml s PHE 200 N -2.55 -0.25 -0.03 1.90 -0.12 -0.39 -1.55 117.98 115.00 1xml s PHE 200 Ca 0.59 -0.00 0.06 0.00 -0.05 0.00 0.00 56.93 57.53 1xml s PHE 200 Cb -0.08 0.60 -0.02 0.00 -0.63 0.00 0.00 43.02 42.89 1xml s PHE 200 CO 0.37 -0.75 -0.21 0.08 -0.05 0.00 0.00 175.22 174.65 1xml s VAL 201 N -3.30 2.46 -0.18 -2.49 1.01 -0.35 -1.41 120.40 116.14 1xml s VAL 201 Ca 0.09 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 61.10 1xml s VAL 201 Cb -0.01 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 1xml s VAL 201 CO -0.03 0.58 -0.10 -0.22 0.00 0.00 0.00 175.10 175.34 1xml s LEU 202 N -0.64 2.72 -0.04 3.92 2.96 -0.07 -1.27 118.68 126.26 1xml s LEU 202 Ca 0.10 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 1xml s LEU 202 Cb -0.10 -1.65 0.02 0.00 0.50 0.00 0.00 46.19 44.95 1xml s LEU 202 CO -0.00 0.05 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.42 1xml s ILE 203 N 1.02 0.41 0.45 6.68 1.01 -0.01 -0.96 121.20 129.79 1xml s ILE 203 Ca -0.01 -0.06 -0.23 0.00 0.00 0.00 0.00 60.65 60.35 1xml s ILE 203 Cb -0.15 -0.46 -0.08 0.00 0.01 0.00 0.00 42.46 41.79 1xml s ILE 203 CO -0.01 0.19 1.17 -2.84 0.00 0.00 0.00 174.94 173.45 1xml s PRO 204 N 0.91 3.83 0.49 2.79 0.02 -1.26 -1.08 135.00 140.69 1xml s PRO 204 Ca -0.11 1.80 -0.24 0.00 0.02 0.00 0.00 61.00 62.47 1xml s PRO 204 Cb -0.14 -2.47 -0.07 0.00 0.02 0.00 0.00 34.50 31.84 1xml s PRO 204 CO -0.00 -0.50 1.41 0.34 -0.33 0.00 0.00 177.00 177.92 1xml s ASP 205 N -1.30 5.60 0.38 2.53 -1.08 -0.17 -4.86 116.67 117.76 1xml s ASP 205 Ca 0.62 2.89 0.05 0.00 -0.52 0.00 0.00 52.55 55.59 1xml s ASP 205 Cb -0.29 -2.65 0.74 0.00 -1.46 0.00 0.00 42.92 39.26 1xml s ASP 205 CO 0.36 -1.36 2.03 0.24 0.52 0.00 0.00 175.17 176.96 1xml h MET 206 N 1.97 0.67 0.00 4.34 2.86 -1.93 -2.21 114.93 120.63 1xml h MET 206 Ca -0.51 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.07 1xml h MET 206 Cb 1.28 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 32.79 1xml h MET 206 CO 0.59 0.46 -0.04 -0.22 1.06 0.00 0.00 176.91 178.76 1xml h LYS 207 N 0.69 0.00 -5.67 1.72 3.64 -1.97 -3.42 116.57 111.55 1xml h LYS 207 Ca 0.18 0.00 -0.61 0.00 -1.27 0.00 0.00 60.65 58.95 1xml h LYS 207 Cb -0.05 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 31.66 1xml h LYS 207 CO -0.04 0.04 0.30 -0.46 -2.27 0.00 0.00 179.45 177.03 1xml s TRP 208 N -3.60 3.19 -1.02 1.91 -0.00 -0.83 -4.94 118.94 113.65 1xml s TRP 208 Ca 0.02 0.69 0.24 0.00 -0.00 0.00 0.00 56.10 57.04 1xml s TRP 208 Cb 0.09 -3.16 1.02 0.00 -0.00 0.00 0.00 33.47 31.41 1xml s TRP 208 CO 0.58 -0.56 1.76 0.27 -0.00 0.00 0.00 176.95 179.00 1xml n ASN 209 N 6.11 0.00 -0.79 5.86 0.23 -1.26 -4.79 115.26 120.62 1xml n ASN 209 Ca 0.02 0.47 -0.10 0.00 -0.53 0.00 0.00 54.58 54.44 1xml n ASN 209 Cb 0.48 -0.49 -0.04 0.00 -2.08 0.00 0.00 39.78 37.66 1xml n ASN 209 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xml n GLN 210 N -1.49 -0.69 -0.00 -3.83 6.02 -1.26 -4.89 117.38 111.23 1xml n GLN 210 Ca 0.06 0.80 0.09 0.00 -0.01 0.00 0.00 57.00 57.94 1xml n GLN 210 Cb 0.27 -4.73 -0.12 0.00 1.02 0.00 0.00 30.24 26.69 1xml n GLN 210 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1xml n GLN 211 N -2.62 0.77 -3.78 -1.09 1.13 -1.26 -4.95 117.38 105.58 1xml n GLN 211 Ca -0.10 -0.05 -0.13 0.00 -1.94 0.00 0.00 57.00 54.78 1xml n GLN 211 Cb 0.35 -1.40 -0.10 0.00 0.11 0.00 0.00 30.24 29.20 1xml n GLN 211 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 1xml s GLN 212 N -2.92 0.49 0.01 -1.09 0.00 -1.26 -5.05 119.66 109.84 1xml s GLN 212 Ca 0.03 0.06 0.28 0.00 -0.00 0.00 0.00 55.36 55.74 1xml s GLN 212 Cb 0.14 0.22 1.14 0.00 0.00 0.00 0.00 33.01 34.51 1xml s GLN 212 CO 0.77 -0.11 1.87 1.28 0.00 0.00 0.00 175.29 179.11 1xml n LEU 213 N 2.08 0.09 0.20 2.60 4.77 -1.26 -3.80 117.00 121.68 1xml n LEU 213 Ca -0.18 0.45 0.04 0.00 -0.03 0.00 0.00 56.01 56.29 1xml n LEU 213 Cb 0.57 -0.47 0.40 0.00 -2.33 0.00 0.00 43.42 41.60 1xml n LEU 213 CO 0.19 0.01 0.77 0.44 -1.33 0.00 0.00 177.39 177.47 1xml h ASP 214 N 0.00 0.00 -0.24 -1.43 3.32 -2.00 -2.63 116.42 113.44 1xml h ASP 214 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 1xml h ASP 214 Cb 0.51 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.02 1xml h ASP 214 CO 0.00 0.32 -0.05 -0.90 -1.72 0.00 0.00 179.24 176.89 1xml n ASP 215 N -4.08 3.02 -4.67 6.45 5.75 -1.25 -3.56 116.55 118.20 1xml n ASP 215 Ca -0.02 -3.36 -0.46 0.00 -0.01 0.00 0.00 54.79 50.95 1xml n ASP 215 Cb 0.37 -0.56 -0.04 0.00 -1.03 0.00 0.00 41.12 39.86 1xml n ASP 215 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1xml n LEU 216 N -0.92 3.14 -3.24 -2.12 0.00 -0.99 -4.88 117.00 107.99 1xml n LEU 216 Ca 0.25 1.08 0.01 0.00 0.00 0.00 0.00 56.01 57.35 1xml n LEU 216 Cb 0.90 -1.43 -0.03 0.00 0.00 0.00 0.00 43.42 42.86 1xml n LEU 216 CO 0.14 -0.27 0.12 -0.47 0.00 0.00 0.00 177.39 176.91 1xml s TYR 217 N 0.89 -1.41 0.16 1.96 6.04 -1.25 -1.77 117.35 121.97 1xml s TYR 217 Ca 0.78 1.59 0.06 0.00 0.04 0.00 0.00 57.07 59.54 1xml s TYR 217 Cb -0.67 0.47 -0.04 0.00 -1.04 0.00 0.00 41.96 40.68 1xml s TYR 217 CO 0.38 -0.82 -0.12 -0.51 -1.54 0.00 0.00 175.55 172.94 1xml s LEU 218 N 2.79 2.51 -0.04 6.97 1.02 -0.23 -1.00 118.68 130.70 1xml s LEU 218 Ca 0.17 -0.97 0.05 0.00 0.02 0.00 0.00 54.13 53.39 1xml s LEU 218 Cb -0.15 -0.49 -0.01 0.00 0.02 0.00 0.00 46.19 45.57 1xml s LEU 218 CO -0.20 -0.25 -0.20 -0.51 0.02 0.00 0.00 176.35 175.22 1xml s ILE 219 N -2.98 1.62 -0.23 -0.59 2.07 -0.24 -1.08 121.20 119.77 1xml s ILE 219 Ca 0.17 -0.83 -0.10 0.00 -1.41 0.00 0.00 60.65 58.48 1xml s ILE 219 Cb 0.00 -1.38 -0.05 0.00 0.13 0.00 0.00 42.46 41.16 1xml s ILE 219 CO 0.03 0.46 0.14 0.00 -1.91 0.00 0.00 174.94 173.66 1xml s ALA 220 N -0.08 3.56 -0.18 1.50 0.00 0.17 -0.83 121.76 125.91 1xml s ALA 220 Ca -0.02 -0.89 -0.03 0.00 0.00 0.00 0.00 51.96 51.02 1xml s ALA 220 Cb -0.12 -2.26 -0.02 0.00 0.00 0.00 0.00 23.12 20.72 1xml s ALA 220 CO 0.02 -0.17 -0.05 0.42 0.00 0.00 0.00 175.76 175.98 1xml s ILE 221 N 1.01 3.55 0.42 0.00 1.01 -0.40 -0.67 121.20 126.11 1xml s ILE 221 Ca 0.07 -0.46 -0.24 0.00 0.00 0.00 0.00 60.65 60.02 1xml s ILE 221 Cb -0.13 -2.57 -0.08 0.00 0.01 0.00 0.00 42.46 39.68 1xml s ILE 221 CO 0.04 0.47 1.10 0.00 0.00 0.00 0.00 174.94 176.54 1xml h HIS 223 N 2.39 0.37 -3.31 0.00 3.86 -1.57 -3.45 115.15 113.44 1xml h HIS 223 Ca -0.49 -0.11 -0.53 0.00 -1.16 0.00 0.00 60.37 58.09 1xml h HIS 223 Cb 1.23 -0.08 0.05 0.00 1.06 0.00 0.00 27.41 29.67 1xml h HIS 223 CO 0.56 0.70 0.77 0.50 0.86 0.00 0.00 177.93 181.32 1xml s ARG 224 N -4.12 4.27 0.22 2.45 3.52 -1.15 -4.93 118.95 119.22 1xml s ARG 224 Ca -0.05 2.29 0.00 0.00 -0.13 0.00 0.00 55.73 57.84 1xml s ARG 224 Cb 0.13 -3.12 -0.04 0.00 -1.56 0.00 0.00 34.95 30.36 1xml s ARG 224 CO 0.79 -0.44 0.40 1.03 -0.81 0.00 0.00 175.30 176.28 1xml s ARG 225 N -0.16 3.50 0.00 5.12 3.00 -1.26 -4.53 118.95 124.62 1xml s ARG 225 Ca 0.61 -0.39 0.00 0.00 0.00 0.00 0.00 55.73 55.94 1xml s ARG 225 Cb -0.42 -2.83 0.00 0.00 0.00 0.00 0.00 34.95 31.71 1xml s ARG 225 CO 0.41 0.37 0.00 0.41 0.00 0.00 0.00 175.30 176.50 1xml n GLY 226 N -0.88 0.71 3.40 -3.53 0.00 -1.26 -5.02 105.19 98.61 1xml n GLY 226 Ca -0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.52 1xml n GLY 226 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xml s ILE 227 N -2.47 4.81 0.17 -0.61 1.01 -1.26 -4.92 121.20 117.93 1xml s ILE 227 Ca 0.00 -1.16 -0.09 0.00 0.00 0.00 0.00 60.65 59.40 1xml s ILE 227 Cb 0.00 -4.57 0.00 0.00 0.01 0.00 0.00 42.46 37.90 1xml s ILE 227 CO 0.00 -1.24 1.56 0.03 0.00 0.00 0.00 174.94 175.29 1xml h ARG 228 N 9.04 0.95 0.00 2.79 3.08 -1.95 0.63 114.38 128.92 1xml h ARG 228 Ca -0.17 -0.41 0.16 0.00 0.07 0.00 0.00 59.98 59.62 1xml h ARG 228 Cb 1.07 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 31.06 1xml h ARG 228 CO 1.08 1.08 0.44 -1.13 -1.07 0.00 0.00 179.97 180.37 1xml n SER 229 N -4.10 -0.79 -0.39 7.04 3.41 -1.26 -2.75 113.62 114.78 1xml n SER 229 Ca -0.00 -1.28 0.31 0.00 -0.26 0.00 0.00 58.87 57.64 1xml n SER 229 Cb 0.47 1.25 0.58 0.00 -0.26 0.00 0.00 64.21 66.24 1xml n SER 229 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1xml h LEU 230 N 0.00 0.35 -2.60 1.04 5.85 -1.93 -1.43 115.31 116.58 1xml h LEU 230 Ca -0.13 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1xml h LEU 230 Cb 0.67 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 1xml h LEU 230 CO 0.19 -0.12 -0.01 0.03 -0.34 0.00 0.00 178.44 178.18 1xml h ARG 231 N 0.20 0.00 -0.02 1.25 2.47 -1.96 -2.38 114.38 113.95 1xml h ARG 231 Ca 0.75 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.47 1xml h ARG 231 Cb 2.13 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.45 1xml h ARG 231 CO -0.44 0.01 -0.13 -0.25 0.56 0.00 0.00 179.97 179.72 1xml n ASP 232 N -3.25 1.91 -4.71 7.04 8.00 -0.54 -4.39 116.55 120.61 1xml n ASP 232 Ca -0.02 -1.52 -0.42 0.00 0.71 0.00 0.00 54.79 53.54 1xml n ASP 232 Cb 0.12 0.11 -0.03 0.00 -0.02 0.00 0.00 41.12 41.30 1xml n ASP 232 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xml s LEU 233 N -2.18 4.38 0.28 0.64 1.43 -0.90 -4.99 118.68 117.34 1xml s LEU 233 Ca 0.29 1.84 0.02 0.00 -1.03 0.00 0.00 54.13 55.25 1xml s LEU 233 Cb 0.20 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.80 1xml s LEU 233 CO 0.40 -0.34 0.11 0.42 0.23 0.00 0.00 176.35 177.17 1xml s THR 234 N 0.93 0.53 0.59 5.49 -4.23 -1.26 -4.62 115.64 113.07 1xml s THR 234 Ca 0.55 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.34 1xml s THR 234 Cb -0.25 -2.60 0.37 0.00 1.34 0.00 0.00 72.50 71.36 1xml s THR 234 CO 0.29 0.00 2.01 -0.65 -0.54 0.00 0.00 174.62 175.73 1xml h PRO 235 N 2.30 0.00 -0.48 3.99 0.11 -1.86 -0.12 132.00 135.94 1xml h PRO 235 Ca -0.37 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.88 1xml h PRO 235 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 1xml h PRO 235 CO 0.59 0.00 0.39 1.49 -0.21 0.00 0.00 178.00 180.26 1xml h GLU 236 N 0.00 0.00 -0.01 1.05 4.81 -1.97 -1.55 114.58 116.91 1xml h GLU 236 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1xml h GLU 236 Cb 0.79 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.17 1xml h GLU 236 CO -0.00 0.00 -0.08 0.72 -0.73 0.00 0.00 179.01 178.92 1xml n HIS 237 N -4.11 0.00 -0.18 0.92 8.25 -0.06 -4.43 115.22 115.62 1xml n HIS 237 Ca 0.09 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.51 1xml n HIS 237 Cb 0.60 -0.04 0.06 0.00 1.12 0.00 0.00 29.99 31.73 1xml n HIS 237 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1xml h LEU 238 N 1.99 0.38 -0.85 2.41 3.38 -1.39 -0.81 115.31 120.42 1xml h LEU 238 Ca 0.00 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.06 1xml h LEU 238 Cb 0.50 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 1xml h LEU 238 CO 0.00 0.26 0.52 -0.65 0.09 0.00 0.00 178.44 178.66 1xml h PRO 239 N 0.51 0.94 -0.36 1.13 0.11 -1.81 -0.31 132.00 132.21 1xml h PRO 239 Ca 0.24 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.28 1xml h PRO 239 Cb 0.15 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 1xml h PRO 239 CO -0.17 0.62 0.20 1.25 -0.21 0.00 0.00 178.00 179.69 1xml h LEU 240 N 0.96 0.45 -0.37 2.35 5.85 -1.63 -1.30 115.31 121.62 1xml h LEU 240 Ca 0.37 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 1xml h LEU 240 Cb 0.16 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1xml h LEU 240 CO -0.17 0.40 0.06 -0.07 -0.34 0.00 0.00 178.44 178.33 1xml h LEU 241 N 0.46 0.58 -0.75 2.25 3.38 -0.85 -1.00 115.31 119.38 1xml h LEU 241 Ca 0.13 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1xml h LEU 241 Cb 0.05 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1xml h LEU 241 CO -0.02 0.69 0.41 0.03 0.09 0.00 0.00 178.44 179.64 1xml h ARG 242 N 0.45 1.05 -0.21 1.13 3.08 -1.04 -1.68 114.38 117.17 1xml h ARG 242 Ca 0.11 -0.12 0.01 0.00 0.07 0.00 0.00 59.98 60.05 1xml h ARG 242 Cb 0.35 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1xml h ARG 242 CO 0.01 0.78 0.12 -0.91 -1.07 0.00 0.00 179.97 178.90 1xml h ASN 243 N 1.04 0.19 -0.48 7.04 2.35 -0.95 0.01 115.58 124.78 1xml h ASN 243 Ca 0.27 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 56.05 1xml h ASN 243 Cb 0.04 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 1xml h ASN 243 CO -0.04 0.14 0.25 0.40 -1.65 0.00 0.00 177.43 176.53 1xml h ILE 244 N 0.25 0.98 0.28 2.81 2.04 -0.97 0.14 117.51 123.03 1xml h ILE 244 Ca 0.08 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1xml h ILE 244 Cb -0.01 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1xml h ILE 244 CO -0.04 0.09 -0.13 0.25 0.00 0.00 0.00 178.15 178.32 1xml h LEU 245 N 0.50 -0.31 0.04 1.44 6.46 -1.02 -1.84 115.31 120.57 1xml h LEU 245 Ca 0.21 -0.17 -0.06 0.00 -0.12 0.00 0.00 57.88 57.75 1xml h LEU 245 Cb 0.10 0.08 0.01 0.00 -0.73 0.00 0.00 40.66 40.12 1xml h LEU 245 CO -0.14 0.01 -0.25 0.45 -0.62 0.00 0.00 178.44 177.89 1xml h HIS 246 N -0.66 0.15 -0.52 1.25 -0.00 -0.95 -2.71 115.15 111.71 1xml h HIS 246 Ca -0.04 -0.11 -0.11 0.00 -0.00 0.00 0.00 60.37 60.11 1xml h HIS 246 Cb 0.46 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 27.85 1xml h HIS 246 CO 0.01 1.10 -0.12 1.96 -0.00 0.00 0.00 177.93 180.88 1xml h GLN 247 N -0.82 0.99 -0.42 2.45 4.20 -0.88 -2.24 115.11 118.39 1xml h GLN 247 Ca -0.05 -0.37 0.05 0.00 0.06 0.00 0.00 58.65 58.34 1xml h GLN 247 Cb 1.19 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.86 1xml h GLN 247 CO 0.04 1.05 0.16 0.78 -0.67 0.00 0.00 178.83 180.18 1xml h GLY 248 N 0.94 0.55 1.29 3.46 0.00 -1.34 0.15 103.07 108.12 1xml h GLY 248 Ca 0.13 -0.09 -0.11 0.00 0.00 0.00 0.00 47.33 47.26 1xml h GLY 248 CO 0.05 0.04 -0.18 1.46 0.00 0.00 0.00 176.54 177.91 1xml h GLN 249 N 0.33 0.82 -0.16 4.80 4.20 -1.39 -1.81 115.11 121.90 1xml h GLN 249 Ca 0.19 -0.32 -0.13 0.00 0.06 0.00 0.00 58.65 58.46 1xml h GLN 249 Cb 0.17 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1xml h GLN 249 CO -0.19 0.94 -0.45 1.49 -0.67 0.00 0.00 178.83 179.96 1xml h GLU 250 N 0.73 0.40 -0.60 1.46 4.57 -1.14 0.30 114.58 120.31 1xml h GLU 250 Ca 0.11 -0.21 -0.10 0.00 -1.18 0.00 0.00 59.36 57.98 1xml h GLU 250 Cb 0.70 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.27 1xml h GLU 250 CO 0.05 0.77 -0.01 0.00 -1.18 0.00 0.00 179.01 178.65 1xml h ALA 251 N 1.20 0.81 -0.28 2.92 0.00 -0.79 -2.07 119.26 121.05 1xml h ALA 251 Ca 0.02 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 54.45 1xml h ALA 251 Cb 0.92 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1xml h ALA 251 CO 0.08 0.66 -0.51 0.82 0.00 0.00 0.00 179.25 180.29 1xml h ILE 252 N 0.96 1.29 -0.11 0.00 2.04 -1.08 -0.28 117.51 120.32 1xml h ILE 252 Ca 0.17 -1.71 -0.00 0.00 1.00 0.00 0.00 64.86 64.32 1xml h ILE 252 Cb 0.57 1.61 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 1xml h ILE 252 CO 0.03 0.55 0.06 0.25 0.00 0.00 0.00 178.15 179.04 1xml h LEU 253 N 0.62 0.13 -0.30 1.44 6.46 -0.87 -0.94 115.31 121.85 1xml h LEU 253 Ca 0.02 -0.07 -0.03 0.00 -0.12 0.00 0.00 57.88 57.68 1xml h LEU 253 Cb 1.09 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.98 1xml h LEU 253 CO 0.11 0.17 0.07 -0.61 -0.62 0.00 0.00 178.44 177.55 1xml h GLN 254 N 0.09 0.48 -0.01 1.25 4.15 -1.30 0.23 115.11 120.00 1xml h GLN 254 Ca 0.04 -0.12 -0.19 0.00 0.77 0.00 0.00 58.65 59.15 1xml h GLN 254 Cb 0.06 -0.06 0.01 0.00 0.21 0.00 0.00 27.48 27.70 1xml h GLN 254 CO -0.01 0.56 -0.72 -0.09 -1.93 0.00 0.00 178.83 176.64 1xml h ARG 255 N 0.31 0.50 -0.00 1.69 9.65 -1.01 -3.37 114.38 122.15 1xml h ARG 255 Ca 0.09 -0.53 0.00 0.00 -1.10 0.00 0.00 59.98 58.44 1xml h ARG 255 Cb 0.30 0.15 0.00 0.00 -1.39 0.00 0.00 29.97 29.03 1xml h ARG 255 CO 0.00 1.17 -0.03 0.66 2.80 0.00 0.00 179.97 184.57 1xml n TYR 256 N -4.12 0.00 -2.43 2.20 4.02 -0.37 -5.02 117.16 111.45 1xml n TYR 256 Ca -0.10 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.58 1xml n TYR 256 Cb 0.73 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.04 1xml n TYR 256 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1xml n ARG 257 N -0.01 -1.85 -3.70 -0.72 5.12 0.07 -4.99 116.66 110.58 1xml n ARG 257 Ca 0.02 0.99 -0.37 0.00 -1.93 0.00 0.00 57.85 56.56 1xml n ARG 257 Cb 0.09 -5.65 -0.12 0.00 -1.16 0.00 0.00 32.46 25.61 1xml n ARG 257 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 1xml s MET 258 N -5.07 3.58 0.66 5.56 1.75 -1.24 -4.98 119.30 119.56 1xml s MET 258 Ca 0.02 -0.54 -0.16 0.00 -1.25 0.00 0.00 55.69 53.76 1xml s MET 258 Cb -0.01 -3.45 0.00 0.00 2.84 0.00 0.00 34.83 34.22 1xml s MET 258 CO 0.02 -0.27 1.15 0.15 -0.65 0.00 0.00 175.02 175.43 1xml s LYS 259 N 1.63 2.68 0.45 4.11 1.02 -1.26 -3.56 119.74 124.81 1xml s LYS 259 Ca 0.06 1.58 0.16 0.00 0.02 0.00 0.00 55.97 57.79 1xml s LYS 259 Cb -0.16 -1.92 1.10 0.00 -0.52 0.00 0.00 37.83 36.33 1xml s LYS 259 CO 0.05 -1.38 1.98 0.78 -0.92 0.00 0.00 175.35 175.86 1xml h GLY 260 N 0.17 0.49 0.85 -3.33 0.00 -1.95 -1.24 103.07 98.07 1xml h GLY 260 Ca -0.48 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 46.71 1xml h GLY 260 CO 0.53 0.07 0.00 2.09 0.00 0.00 0.00 176.54 179.24 1xml n ASP 261 N -4.46 0.00 -0.44 0.19 3.85 -1.26 -2.02 116.55 112.41 1xml n ASP 261 Ca 0.10 -1.15 0.12 0.00 -0.71 0.00 0.00 54.79 53.16 1xml n ASP 261 Cb 0.43 0.00 0.21 0.00 -1.35 0.00 0.00 41.12 40.41 1xml n ASP 261 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 1xml n HIS 262 N -0.93 0.00 -4.83 2.11 8.25 -0.47 -4.99 115.22 114.36 1xml n HIS 262 Ca 0.20 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.36 1xml n HIS 262 Cb 0.09 -0.05 -0.14 0.00 1.12 0.00 0.00 29.99 31.02 1xml n HIS 262 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1xml s LEU 263 N -2.39 2.44 -0.19 2.41 1.43 -0.86 -1.77 118.68 119.75 1xml s LEU 263 Ca 0.24 -0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 52.81 1xml s LEU 263 Cb 0.19 -1.44 -0.04 0.00 0.03 0.00 0.00 46.19 44.93 1xml s LEU 263 CO 0.50 0.28 0.08 -0.13 0.23 0.00 0.00 176.35 177.31 1xml s ARG 264 N -1.20 3.98 -0.19 1.70 0.52 0.96 -4.88 118.95 119.84 1xml s ARG 264 Ca 0.13 -0.33 0.01 0.00 -0.52 0.00 0.00 55.73 55.02 1xml s ARG 264 Cb -0.10 -3.28 0.03 0.00 0.52 0.00 0.00 34.95 32.12 1xml s ARG 264 CO 0.03 0.22 -0.14 0.08 0.02 0.00 0.00 175.30 175.51 1xml s VAL 265 N 0.52 1.82 0.21 3.52 1.01 -1.26 -1.00 120.40 125.23 1xml s VAL 265 Ca 0.04 -0.97 -0.21 0.00 0.00 0.00 0.00 61.98 60.84 1xml s VAL 265 Cb -0.13 -1.77 0.04 0.00 0.00 0.00 0.00 36.38 34.52 1xml s VAL 265 CO 0.01 0.33 0.63 -0.72 0.00 0.00 0.00 175.10 175.35 1xml s TYR 266 N 1.35 -0.33 0.35 5.22 -0.85 -0.58 -0.96 117.35 121.55 1xml s TYR 266 Ca 0.01 -0.00 0.09 0.00 -0.52 0.00 0.00 57.07 56.65 1xml s TYR 266 Cb -0.15 0.59 -0.06 0.00 0.38 0.00 0.00 41.96 42.72 1xml s TYR 266 CO -0.10 -1.01 -0.00 -0.51 -1.52 0.00 0.00 175.55 172.41 1xml s LEU 267 N -2.84 2.93 -0.03 -3.49 1.02 -0.30 0.04 118.68 116.00 1xml s LEU 267 Ca 0.06 -1.06 0.03 0.00 0.02 0.00 0.00 54.13 53.17 1xml s LEU 267 Cb -0.03 -1.25 -0.03 0.00 0.02 0.00 0.00 46.19 44.90 1xml s LEU 267 CO -0.03 -0.26 -0.08 -1.00 0.02 0.00 0.00 176.35 174.99 1xml s HIS 268 N -2.55 2.87 0.03 0.29 3.76 -1.26 -0.73 115.29 117.70 1xml s HIS 268 Ca 0.35 -0.04 0.06 0.00 -0.15 0.00 0.00 55.06 55.27 1xml s HIS 268 Cb 0.01 -1.64 -0.02 0.00 1.11 0.00 0.00 32.58 32.04 1xml s HIS 268 CO 0.19 0.33 -0.17 -0.47 -0.85 0.00 0.00 174.74 173.77 1xml s TYR 269 N -0.88 1.47 0.00 1.40 5.04 -0.23 -3.35 117.35 120.80 1xml s TYR 269 Ca 0.14 -0.34 0.00 0.00 -2.44 0.00 0.00 57.07 54.43 1xml s TYR 269 Cb -0.11 -0.89 0.00 0.00 0.35 0.00 0.00 41.96 41.31 1xml s TYR 269 CO 0.04 0.04 0.00 1.28 -1.34 0.00 0.00 175.55 175.58 1xml n LEU 270 N 2.04 0.00 -4.89 6.97 4.32 -1.26 -4.61 117.00 119.56 1xml n LEU 270 Ca -0.17 0.00 -0.29 0.00 -0.02 0.00 0.00 56.01 55.53 1xml n LEU 270 Cb 0.54 0.00 0.04 0.00 -1.62 0.00 0.00 43.42 42.39 1xml n LEU 270 CO 0.23 0.00 0.69 -2.16 -1.22 0.00 0.00 177.39 174.93 1xml s PRO 271 N 0.00 2.81 0.37 3.23 0.04 -1.21 -4.99 135.00 135.25 1xml s PRO 271 Ca 0.00 0.30 0.24 0.00 0.04 0.00 0.00 61.00 61.59 1xml s PRO 271 Cb 0.00 -2.09 0.54 0.00 0.04 0.00 0.00 34.50 33.00 1xml s PRO 271 CO 0.00 -0.98 1.68 0.66 0.04 0.00 0.00 177.00 178.40 1xml h SER 272 N -0.55 0.00 -5.16 6.66 4.64 -2.00 -3.45 113.55 113.70 1xml h SER 272 Ca -0.45 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.79 1xml h SER 272 Cb 1.26 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.21 1xml h SER 272 CO 0.63 0.00 -0.31 -0.72 -0.87 0.00 0.00 176.83 175.56 1xml s TYR 273 N -3.20 0.12 -0.84 4.77 -0.85 -1.26 -5.10 117.35 110.99 1xml s TYR 273 Ca 0.08 -0.53 0.02 0.00 -0.52 0.00 0.00 57.07 56.12 1xml s TYR 273 Cb 0.08 -0.00 0.33 0.00 0.38 0.00 0.00 41.96 42.74 1xml s TYR 273 CO 0.64 -0.59 1.45 0.66 -1.52 0.00 0.00 175.55 176.18 1xml n TYR 274 N -0.11 3.32 -3.69 -3.49 4.02 -1.26 -4.79 117.16 111.16 1xml n TYR 274 Ca -0.14 -3.18 -0.16 0.00 -0.01 0.00 0.00 57.90 54.40 1xml n TYR 274 Cb 0.63 -0.90 -0.16 0.00 -0.02 0.00 0.00 39.34 38.89 1xml n TYR 274 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1xml s HIS 275 N -3.95 -0.13 0.00 -0.72 2.46 -1.11 -4.32 115.29 107.51 1xml s HIS 275 Ca 0.43 0.51 -0.38 0.00 0.47 0.00 0.00 55.06 56.09 1xml s HIS 275 Cb 0.23 -0.25 -0.17 0.00 -0.13 0.00 0.00 32.58 32.25 1xml s HIS 275 CO -0.13 -0.23 1.38 -0.11 -2.47 0.00 0.00 174.74 173.18 1xml n LEU 276 N 5.03 1.55 -3.76 8.88 7.94 0.21 -4.93 117.00 131.92 1xml n LEU 276 Ca -0.10 1.12 -0.13 0.00 -1.11 0.00 0.00 56.01 55.79 1xml n LEU 276 Cb 0.50 -1.14 -0.10 0.00 0.53 0.00 0.00 43.42 43.21 1xml n LEU 276 CO 0.08 -1.05 0.01 -1.38 -1.11 0.00 0.00 177.39 173.94 1xml s HIS 277 N 0.99 -0.27 -0.06 1.96 -3.43 -1.26 -3.29 115.29 109.93 1xml s HIS 277 Ca 0.88 0.58 0.06 0.00 -0.80 0.00 0.00 55.06 55.79 1xml s HIS 277 Cb -1.03 0.11 -0.01 0.00 -1.43 0.00 0.00 32.58 30.22 1xml s HIS 277 CO 0.52 -0.28 -0.25 0.08 -2.00 0.00 0.00 174.74 172.81 1xml s VAL 278 N -0.56 2.06 0.06 -5.38 1.01 0.15 -4.66 120.40 113.09 1xml s VAL 278 Ca -0.07 -1.07 -0.19 0.00 0.00 0.00 0.00 61.98 60.65 1xml s VAL 278 Cb -0.04 -1.74 -0.07 0.00 0.00 0.00 0.00 36.38 34.54 1xml s VAL 278 CO 0.02 0.57 0.56 -1.00 0.00 0.00 0.00 175.10 175.25 1xml s HIS 279 N -0.19 3.80 -0.19 5.22 3.76 0.11 -0.66 115.29 127.13 1xml s HIS 279 Ca -0.03 1.25 0.01 0.00 -0.15 0.00 0.00 55.06 56.15 1xml s HIS 279 Cb -0.13 -2.49 0.03 0.00 1.11 0.00 0.00 32.58 31.10 1xml s HIS 279 CO 0.03 0.59 -0.17 -0.06 -0.85 0.00 0.00 174.74 174.28 1xml s PHE 280 N -1.08 2.81 -0.01 1.40 0.40 -0.24 -1.52 117.98 119.74 1xml s PHE 280 Ca 0.29 -1.75 0.00 0.00 -0.60 0.00 0.00 56.93 54.87 1xml s PHE 280 Cb -0.19 -1.88 0.01 0.00 0.51 0.00 0.00 43.02 41.47 1xml s PHE 280 CO 0.19 -0.81 -0.01 -0.08 0.70 0.00 0.00 175.22 175.21 1xml s THR 281 N 1.27 0.14 0.36 0.64 -1.32 -0.17 -1.07 115.64 115.49 1xml s THR 281 Ca 0.02 0.01 -0.27 0.00 -1.21 0.00 0.00 61.69 60.23 1xml s THR 281 Cb -0.15 -0.17 -0.12 0.00 -1.51 0.00 0.00 72.50 70.55 1xml s THR 281 CO -0.11 0.08 1.22 0.00 -2.21 0.00 0.00 174.62 173.60 1xml n ALA 282 N 3.52 0.98 -0.28 11.08 0.00 -0.73 -0.03 120.51 135.05 1xml n ALA 282 Ca -0.19 0.33 0.08 0.00 0.00 0.00 0.00 53.44 53.66 1xml n ALA 282 Cb 0.55 -2.21 0.31 0.00 0.00 0.00 0.00 19.45 18.10 1xml n ALA 282 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1xml h LEU 283 N 2.26 0.78 -0.84 0.00 4.07 -1.69 -2.47 115.31 117.42 1xml h LEU 283 Ca -0.45 0.02 -0.10 0.00 0.08 0.00 0.00 57.88 57.43 1xml h LEU 283 Cb 1.30 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.88 1xml h LEU 283 CO 0.61 0.46 -0.20 1.23 -1.08 0.00 0.00 178.44 179.46 1xml h GLY 284 N 0.86 0.70 0.55 0.83 0.00 -1.86 -3.50 103.07 100.64 1xml h GLY 284 Ca 0.41 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1xml h GLY 284 CO -0.17 0.51 -0.14 -2.75 0.00 0.00 0.00 176.54 173.99 1xml h PHE 285 N 0.57 -0.36 -0.13 5.60 -0.00 -1.49 -3.51 116.94 117.63 1xml h PHE 285 Ca 0.09 -0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.05 1xml h PHE 285 Cb 0.66 0.12 0.00 0.00 -0.00 0.00 0.00 35.95 36.73 1xml h PHE 285 CO 0.03 -0.01 0.00 -0.85 -0.00 0.00 0.00 178.31 177.48 1xml n GLU 293 N -5.08 -0.13 0.00 1.11 0.00 -1.26 -5.09 120.64 110.20 1xml n GLU 293 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.07 1xml n GLU 293 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.71 1xml n GLU 293 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1xml n ARG 294 N 0.00 0.00 -3.45 3.44 3.00 -1.26 -3.81 116.66 114.58 1xml n ARG 294 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 57.85 57.49 1xml n ARG 294 Cb 0.00 -0.49 -0.06 0.00 0.00 0.00 0.00 32.46 31.91 1xml n ARG 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xml s ALA 295 N -1.09 3.65 -0.17 5.13 0.00 -1.26 -1.06 121.76 126.95 1xml s ALA 295 Ca 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 51.96 51.70 1xml s ALA 295 Cb 0.00 -2.42 0.07 0.00 0.00 0.00 0.00 23.12 20.77 1xml s ALA 295 CO 0.00 0.49 0.15 -1.01 0.00 0.00 0.00 175.76 175.39 1xml s HIS 296 N -1.37 -0.03 0.24 0.00 3.76 0.09 -4.97 115.29 113.02 1xml s HIS 296 Ca 0.34 -0.02 -0.31 0.00 -0.15 0.00 0.00 55.06 54.92 1xml s HIS 296 Cb -0.15 -0.52 -0.11 0.00 1.11 0.00 0.00 32.58 32.90 1xml s HIS 296 CO 0.18 -0.52 1.60 -0.51 -0.85 0.00 0.00 174.74 174.63 1xml s LEU 297 N 2.23 4.36 0.20 0.89 1.43 -1.26 -1.15 118.68 125.37 1xml s LEU 297 Ca 0.04 2.82 -0.11 0.00 -1.03 0.00 0.00 54.13 55.85 1xml s LEU 297 Cb -0.16 -3.62 0.13 0.00 0.03 0.00 0.00 46.19 42.58 1xml s LEU 297 CO -0.10 -0.88 1.85 0.25 0.23 0.00 0.00 176.35 177.70 1xml h LEU 298 N 5.79 0.82 -1.33 1.79 6.46 -1.39 -1.11 115.31 126.34 1xml h LEU 298 Ca -0.45 -0.05 0.10 0.00 -0.12 0.00 0.00 57.88 57.36 1xml h LEU 298 Cb 1.21 -0.21 -0.06 0.00 -0.73 0.00 0.00 40.66 40.88 1xml h LEU 298 CO 0.86 0.62 0.53 0.00 -0.62 0.00 0.00 178.44 179.83 1xml h ALA 299 N 1.23 1.75 0.07 1.25 0.00 -1.91 -1.34 119.26 120.30 1xml h ALA 299 Ca 0.25 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.90 1xml h ALA 299 Cb -0.06 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.57 1xml h ALA 299 CO -0.05 0.09 -1.10 0.93 0.00 0.00 0.00 179.25 179.11 1xml h GLU 300 N 0.75 0.43 -0.56 0.00 5.08 -1.75 -2.54 114.58 115.99 1xml h GLU 300 Ca 0.37 -0.55 0.05 0.00 -1.00 0.00 0.00 59.36 58.24 1xml h GLU 300 Cb 0.45 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 29.83 1xml h GLU 300 CO -0.15 1.21 0.29 0.28 -1.00 0.00 0.00 179.01 179.64 1xml h VAL 301 N 0.20 0.96 -0.17 3.13 2.07 -0.75 0.18 116.25 121.86 1xml h VAL 301 Ca -0.12 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 1xml h VAL 301 Cb 1.77 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1xml h VAL 301 CO 0.19 0.10 0.10 0.40 0.02 0.00 0.00 177.57 178.38 1xml h ILE 302 N 0.56 1.10 -0.49 4.57 2.04 -1.24 -1.77 117.51 122.27 1xml h ILE 302 Ca 0.25 -0.28 -0.11 0.00 1.00 0.00 0.00 64.86 65.72 1xml h ILE 302 Cb 0.15 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1xml h ILE 302 CO -0.17 0.10 -0.12 -0.33 0.00 0.00 0.00 178.15 177.62 1xml h GLU 303 N 0.18 0.93 -0.58 2.37 5.08 -1.18 -1.39 114.58 119.99 1xml h GLU 303 Ca 0.06 -0.34 0.09 0.00 -1.00 0.00 0.00 59.36 58.18 1xml h GLU 303 Cb 0.07 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.19 1xml h GLU 303 CO -0.01 1.00 0.19 -0.91 -1.00 0.00 0.00 179.01 178.28 1xml h ASN 304 N 0.83 0.16 -0.12 1.42 2.35 -0.84 -0.09 115.58 119.28 1xml h ASN 304 Ca 0.13 0.08 -0.09 0.00 -0.55 0.00 0.00 56.30 55.87 1xml h ASN 304 Cb 0.66 0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 1xml h ASN 304 CO 0.05 0.10 -0.21 -0.07 -1.65 0.00 0.00 177.43 175.65 1xml h LEU 305 N 0.36 0.55 -0.63 1.61 3.38 -0.83 0.60 115.31 120.34 1xml h LEU 305 Ca 0.29 -0.18 -0.14 0.00 0.09 0.00 0.00 57.88 57.95 1xml h LEU 305 Cb 0.38 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1xml h LEU 305 CO -0.32 0.76 -0.49 -0.33 0.09 0.00 0.00 178.44 178.15 1xml h GLU 306 N 0.49 0.49 0.01 1.13 5.08 -0.83 -3.22 114.58 117.72 1xml h GLU 306 Ca 0.08 -0.28 -0.25 0.00 -1.00 0.00 0.00 59.36 57.91 1xml h GLU 306 Cb 0.64 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.87 1xml h GLU 306 CO 0.05 0.87 -1.29 0.00 -1.00 0.00 0.00 179.01 177.63 1xml s ASP 308 N -6.48 0.22 0.43 0.00 2.15 0.17 -5.05 116.67 108.10 1xml s ASP 308 Ca -0.02 -0.62 0.19 0.00 0.43 0.00 0.00 52.55 52.54 1xml s ASP 308 Cb 0.09 1.15 1.13 0.00 -0.30 0.00 0.00 42.92 44.99 1xml s ASP 308 CO 0.82 -0.31 1.86 -0.65 -0.17 0.00 0.00 175.17 176.72 1xml h PRO 309 N 7.83 0.35 -0.64 4.34 0.11 -1.77 -1.75 132.00 140.46 1xml h PRO 309 Ca -0.04 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1xml h PRO 309 Cb 1.12 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1xml h PRO 309 CO 0.23 0.23 0.00 0.54 -0.21 0.00 0.00 178.00 178.79 1xml n ARG 310 N -4.49 4.08 -0.19 1.05 1.74 -1.26 -4.39 116.66 113.20 1xml n ARG 310 Ca 0.19 -2.96 -0.05 0.00 -0.77 0.00 0.00 57.85 54.26 1xml n ARG 310 Cb 0.73 -2.01 0.01 0.00 -1.02 0.00 0.00 32.46 30.18 1xml n ARG 310 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1xml h HIS 311 N 4.11 -0.84 0.00 -1.55 2.76 -1.62 -1.42 115.15 116.59 1xml h HIS 311 Ca 0.00 0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1xml h HIS 311 Cb 1.61 0.45 0.00 0.00 1.55 0.00 0.00 27.41 31.02 1xml h HIS 311 CO 0.87 -0.37 -0.03 0.66 -1.30 0.00 0.00 177.93 177.77 1xml n TYR 312 N -5.43 0.08 0.02 5.26 4.02 -1.26 -1.18 117.16 118.67 1xml n TYR 312 Ca 0.04 0.02 -0.03 0.00 -0.01 0.00 0.00 57.90 57.93 1xml n TYR 312 Cb 0.35 -0.53 -0.09 0.00 -0.02 0.00 0.00 39.34 39.05 1xml n TYR 312 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1xml h GLN 313 N 0.00 0.00 0.00 -0.72 7.50 -1.54 -3.41 115.11 116.93 1xml h GLN 313 Ca 0.00 0.00 -0.25 0.00 0.50 0.00 0.00 58.65 58.90 1xml h GLN 313 Cb 0.52 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 28.00 1xml h GLN 313 CO 0.00 0.38 -2.01 1.04 -1.50 0.00 0.00 178.83 176.74 1xml n GLN 314 N -2.97 1.38 -2.29 1.46 6.02 -0.62 -4.34 117.38 116.03 1xml n GLN 314 Ca -0.11 -0.02 -0.28 0.00 -0.01 0.00 0.00 57.00 56.57 1xml n GLN 314 Cb 0.90 -1.39 0.02 0.00 1.02 0.00 0.00 30.24 30.78 1xml n GLN 314 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1xml s ARG 315 N -2.46 3.32 -0.02 -1.09 1.81 -0.33 -4.05 118.95 116.13 1xml s ARG 315 Ca -0.07 0.32 -0.22 0.00 -1.72 0.00 0.00 55.73 54.04 1xml s ARG 315 Cb 0.05 -2.23 -0.05 0.00 -0.45 0.00 0.00 34.95 32.27 1xml s ARG 315 CO 0.63 -0.52 0.64 0.99 -0.68 0.00 0.00 175.30 176.37 1xml s THR 316 N -2.99 4.94 -0.04 0.02 2.01 -1.26 -3.55 115.64 114.77 1xml s THR 316 Ca 0.52 1.34 0.00 0.00 0.31 0.00 0.00 61.69 63.86 1xml s THR 316 Cb -0.11 -3.98 -0.03 0.00 0.01 0.00 0.00 72.50 68.39 1xml s THR 316 CO 0.48 0.36 -0.01 -0.04 -0.69 0.00 0.00 174.62 174.72 1xml s MET 317 N 0.17 2.83 -0.09 4.92 -1.94 -0.31 -4.93 119.30 119.97 1xml s MET 317 Ca 0.34 -0.54 0.03 0.00 -1.71 0.00 0.00 55.69 53.80 1xml s MET 317 Cb -0.18 -2.69 -0.02 0.00 2.01 0.00 0.00 34.83 33.95 1xml s MET 317 CO 0.18 0.65 -0.17 0.99 -0.01 0.00 0.00 175.02 176.66 1xml s THR 318 N -0.98 2.77 0.19 2.05 2.01 -1.26 -0.65 115.64 119.76 1xml s THR 318 Ca 0.17 -0.79 -0.20 0.00 0.31 0.00 0.00 61.69 61.17 1xml s THR 318 Cb -0.11 -2.10 0.04 0.00 0.01 0.00 0.00 72.50 70.34 1xml s THR 318 CO 0.06 0.56 0.57 0.72 -0.69 0.00 0.00 174.62 175.84 1xml s PHE 319 N -0.07 -0.29 0.07 4.92 -0.12 -0.79 -4.44 117.98 117.27 1xml s PHE 319 Ca -0.04 -0.03 -0.06 0.00 -0.05 0.00 0.00 56.93 56.76 1xml s PHE 319 Cb -0.14 0.49 -0.05 0.00 -0.63 0.00 0.00 43.02 42.69 1xml s PHE 319 CO 0.04 -0.93 0.32 0.00 -0.05 0.00 0.00 175.22 174.60 1xml s ALA 320 N -3.83 3.82 0.03 1.99 0.00 -1.25 -0.92 121.76 121.60 1xml s ALA 320 Ca 0.06 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.48 1xml s ALA 320 Cb -0.02 -2.10 -0.02 0.00 0.00 0.00 0.00 23.12 20.98 1xml s ALA 320 CO -0.06 0.66 -0.07 -0.51 0.00 0.00 0.00 175.76 175.79 1xml s LEU 321 N -2.16 2.22 0.41 0.00 1.43 -0.24 -4.94 118.68 115.39 1xml s LEU 321 Ca 0.34 -0.47 -0.26 0.00 -1.03 0.00 0.00 54.13 52.71 1xml s LEU 321 Cb -0.13 -0.13 -0.10 0.00 0.03 0.00 0.00 46.19 45.86 1xml s LEU 321 CO 0.20 -0.18 1.28 0.54 0.23 0.00 0.00 176.35 178.42 1xml n ARG 322 N 1.71 1.97 -0.02 1.70 1.74 -1.26 -0.86 116.66 121.65 1xml n ARG 322 Ca -0.21 0.70 0.09 0.00 -0.77 0.00 0.00 57.85 57.65 1xml n ARG 322 Cb 0.55 -2.38 0.48 0.00 -1.02 0.00 0.00 32.46 30.09 1xml n ARG 322 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xml h ALA 323 N 2.16 1.90 -0.01 7.54 0.00 -0.95 -1.49 119.26 128.41 1xml h ALA 323 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1xml h ALA 323 Cb 1.29 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1xml h ALA 323 CO 0.60 0.02 -0.15 -0.40 0.00 0.00 0.00 179.25 179.33 1xml n ASP 324 N -4.48 0.91 -4.69 0.00 5.68 -1.26 -4.84 116.55 107.88 1xml n ASP 324 Ca 0.06 -0.92 -0.43 0.00 -0.50 0.00 0.00 54.79 53.00 1xml n ASP 324 Cb 0.23 0.04 -0.03 0.00 -1.14 0.00 0.00 41.12 40.21 1xml n ASP 324 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1xml n ASP 325 N -0.59 3.96 0.27 -1.12 -0.08 -0.56 -4.88 116.55 113.55 1xml n ASP 325 Ca 0.15 1.00 0.13 0.00 -1.51 0.00 0.00 54.79 54.56 1xml n ASP 325 Cb 0.32 -1.53 0.79 0.00 2.34 0.00 0.00 41.12 43.03 1xml n ASP 325 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1xml h PRO 326 N 8.19 0.00 -0.59 -0.67 0.11 -1.90 -2.34 132.00 134.79 1xml h PRO 326 Ca -0.46 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.57 1xml h PRO 326 Cb 1.22 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 1xml h PRO 326 CO 0.95 0.07 0.07 1.25 -0.21 0.00 0.00 178.00 180.12 1xml h LEU 327 N 0.00 0.94 -0.50 2.35 5.85 -1.95 -2.52 115.31 119.48 1xml h LEU 327 Ca -0.00 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 1xml h LEU 327 Cb 0.17 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1xml h LEU 327 CO 0.01 0.96 0.20 0.25 -0.34 0.00 0.00 178.44 179.52 1xml h LEU 328 N 0.92 0.69 -0.57 2.25 5.85 -1.74 -0.97 115.31 121.75 1xml h LEU 328 Ca 0.18 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.74 1xml h LEU 328 Cb 0.44 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1xml h LEU 328 CO 0.02 0.68 0.37 0.50 -0.34 0.00 0.00 178.44 179.67 1xml h LYS 329 N 0.67 0.74 -0.82 1.25 1.63 -1.53 -1.73 116.57 116.78 1xml h LYS 329 Ca 0.17 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.88 1xml h LYS 329 Cb 0.20 -0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 31.63 1xml h LYS 329 CO -0.01 0.49 0.36 -0.07 -3.45 0.00 0.00 179.45 176.76 1xml h LEU 330 N 0.76 1.10 -0.23 5.20 3.38 -1.02 -1.77 115.31 122.73 1xml h LEU 330 Ca 0.21 -0.15 -0.21 0.00 0.09 0.00 0.00 57.88 57.82 1xml h LEU 330 Cb -0.08 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.40 1xml h LEU 330 CO -0.05 0.95 -0.78 -0.07 0.09 0.00 0.00 178.44 178.58 1xml h LEU 331 N 1.17 0.80 -0.67 1.67 3.38 -1.04 -2.78 115.31 117.85 1xml h LEU 331 Ca 0.28 -0.53 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 1xml h LEU 331 Cb 0.17 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1xml h LEU 331 CO -0.03 1.31 0.25 1.56 0.09 0.00 0.00 178.44 181.62 1xml h GLN 332 N 0.46 1.02 -0.66 1.13 4.20 -1.17 -2.07 115.11 118.01 1xml h GLN 332 Ca -0.05 -0.20 -0.07 0.00 0.06 0.00 0.00 58.65 58.40 1xml h GLN 332 Cb 1.39 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.98 1xml h GLN 332 CO 0.15 0.86 0.15 0.93 -0.67 0.00 0.00 178.83 180.25 1xml h GLU 333 N 0.96 1.06 0.00 1.46 5.08 -1.33 -2.42 114.58 119.40 1xml h GLU 333 Ca 0.22 -0.25 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 1xml h GLU 333 Cb 0.24 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1xml h GLU 333 CO -0.01 0.95 -0.45 0.00 -1.00 0.00 0.00 179.01 178.49 1xml h ALA 334 N 1.15 1.02 0.00 3.43 0.00 -1.35 -3.11 119.26 120.40 1xml h ALA 334 Ca 0.21 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1xml h ALA 334 Cb 0.37 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1xml h ALA 334 CO 0.00 0.56 -0.36 1.96 0.00 0.00 0.00 179.25 181.41 1xml h GLN 335 N 0.00 0.00 0.00 0.00 4.20 -1.03 -3.52 115.11 114.76 1xml h GLN 335 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1xml h GLN 335 Cb 0.94 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.72 1xml h GLN 335 CO 0.06 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.22