#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmm n PRO 39 N 0.00 1.62 -4.37 0.00 -0.04 -1.26 -5.03 135.00 125.92 1xmm n PRO 39 Ca 0.00 0.57 -0.30 0.00 -0.04 0.00 0.00 63.50 63.73 1xmm n PRO 39 Cb 0.00 -2.03 -0.04 0.00 -0.04 0.00 0.00 33.50 31.39 1xmm n PRO 39 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1xmm s VAL 40 N -0.91 1.33 0.40 0.52 -7.23 -1.26 -5.17 120.40 108.09 1xmm s VAL 40 Ca 0.60 -1.77 0.08 0.00 -1.81 0.00 0.00 61.98 59.08 1xmm s VAL 40 Cb -0.67 -2.10 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 1xmm s VAL 40 CO 0.59 0.00 0.20 -0.60 -0.31 0.00 0.00 175.10 174.98 1xmm s ARG 41 N -4.08 2.30 0.70 4.82 3.52 -1.26 -5.13 118.95 119.83 1xmm s ARG 41 Ca 0.17 -1.74 -0.15 0.00 -0.13 0.00 0.00 55.73 53.88 1xmm s ARG 41 Cb -0.01 -2.08 0.02 0.00 -1.56 0.00 0.00 34.95 31.33 1xmm s ARG 41 CO 0.11 -0.09 1.17 -0.51 -0.81 0.00 0.00 175.30 175.17 1xmm s LEU 42 N -3.93 3.35 0.00 -0.88 1.43 -1.26 -4.91 118.68 112.48 1xmm s LEU 42 Ca 0.42 2.22 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 1xmm s LEU 42 Cb 0.02 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.66 1xmm s LEU 42 CO 0.23 -2.01 0.72 -0.81 0.23 0.00 0.00 176.35 174.71 1xmm n PRO 43 N -2.59 0.97 -1.05 1.29 -0.04 -1.26 -4.80 135.00 127.53 1xmm n PRO 43 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1xmm n PRO 43 Cb 0.51 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 1xmm n PRO 43 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1xmm n PHE 44 N 0.26 -0.95 -4.23 0.54 1.16 -1.26 -5.08 117.46 107.89 1xmm n PHE 44 Ca 0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.45 1xmm n PHE 44 Cb 0.36 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.13 1xmm n PHE 44 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 1xmm s SER 45 N -0.99 0.99 -1.14 5.98 1.04 -1.26 -4.99 113.70 113.33 1xmm s SER 45 Ca 0.00 -1.22 -0.02 0.00 0.48 0.00 0.00 55.95 55.18 1xmm s SER 45 Cb 0.00 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1xmm s SER 45 CO 0.00 -0.64 0.96 0.61 0.98 0.00 0.00 173.24 175.16 1xmm n GLY 46 N -0.25 -0.33 3.67 7.32 0.00 -1.26 -1.84 105.19 112.50 1xmm n GLY 46 Ca -0.05 0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1xmm n GLY 46 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1xmm n PHE 47 N -4.14 2.56 -3.96 1.61 7.35 -1.26 -4.41 117.46 115.21 1xmm n PHE 47 Ca -0.18 -0.31 -0.30 0.00 -0.76 0.00 0.00 57.45 55.90 1xmm n PHE 47 Cb 0.62 -2.78 -0.16 0.00 0.35 0.00 0.00 39.48 37.51 1xmm n PHE 47 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1xmm s ARG 48 N 3.85 1.80 0.19 -4.13 3.52 -0.55 -4.97 118.95 118.66 1xmm s ARG 48 Ca 0.86 -0.91 -0.32 0.00 -0.13 0.00 0.00 55.73 55.24 1xmm s ARG 48 Cb -0.45 -2.48 -0.12 0.00 -1.56 0.00 0.00 34.95 30.34 1xmm s ARG 48 CO 0.40 -0.51 1.74 -0.11 -0.81 0.00 0.00 175.30 176.01 1xmm n LEU 49 N 4.68 3.96 -0.04 -0.88 7.94 -1.26 -1.37 117.00 130.03 1xmm n LEU 49 Ca -0.13 1.05 -0.07 0.00 -1.11 0.00 0.00 56.01 55.74 1xmm n LEU 49 Cb 0.45 -1.56 -0.02 0.00 0.53 0.00 0.00 43.42 42.82 1xmm n LEU 49 CO 0.19 0.16 -0.51 0.00 -1.11 0.00 0.00 177.39 176.12 1xmm n GLN 50 N 4.31 0.31 -3.80 1.96 1.13 -0.19 -4.91 117.38 116.19 1xmm n GLN 50 Ca 0.17 0.13 -0.13 0.00 -1.94 0.00 0.00 57.00 55.22 1xmm n GLN 50 Cb 0.35 -1.04 -0.13 0.00 0.11 0.00 0.00 30.24 29.53 1xmm n GLN 50 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1xmm s LYS 51 N -2.48 0.15 -0.72 -1.09 2.20 -1.10 -5.04 119.74 111.66 1xmm s LYS 51 Ca -0.18 0.25 -0.27 0.00 -0.36 0.00 0.00 55.97 55.42 1xmm s LYS 51 Cb 0.03 0.01 0.02 0.00 -1.51 0.00 0.00 37.83 36.39 1xmm s LYS 51 CO 0.25 -0.06 1.38 0.08 -0.36 0.00 0.00 175.35 176.65 1xmm s VAL 52 N 0.39 3.66 0.09 4.02 1.01 -1.26 -1.90 120.40 126.40 1xmm s VAL 52 Ca -0.03 0.37 -0.29 0.00 0.00 0.00 0.00 61.98 62.04 1xmm s VAL 52 Cb -0.04 -4.75 -0.14 0.00 0.00 0.00 0.00 36.38 31.45 1xmm s VAL 52 CO -0.02 -1.70 1.65 -0.07 0.00 0.00 0.00 175.10 174.97 1xmm h LEU 53 N 13.62 -0.60 -7.81 3.92 3.38 -1.71 -3.45 115.31 122.67 1xmm h LEU 53 Ca -0.27 0.04 -0.16 0.00 0.09 0.00 0.00 57.88 57.58 1xmm h LEU 53 Cb 1.07 0.19 -0.22 0.00 0.09 0.00 0.00 40.66 41.79 1xmm h LEU 53 CO 1.27 -0.36 -0.58 -0.60 0.09 0.00 0.00 178.44 178.26 1xmm s ARG 54 N -6.09 0.37 -0.20 1.13 3.52 -1.20 -1.17 118.95 115.31 1xmm s ARG 54 Ca -0.16 -0.39 -0.09 0.00 -0.13 0.00 0.00 55.73 54.96 1xmm s ARG 54 Cb 0.06 0.15 0.08 0.00 -1.56 0.00 0.00 34.95 33.67 1xmm s ARG 54 CO 0.64 -0.08 0.47 -2.00 -0.81 0.00 0.00 175.30 173.52 1xmm s GLU 55 N -1.18 0.43 -0.10 5.12 2.12 -1.26 -1.28 118.70 122.54 1xmm s GLU 55 Ca -0.13 0.98 -0.01 0.00 0.36 0.00 0.00 54.97 56.17 1xmm s GLU 55 Cb -0.07 0.19 0.03 0.00 0.26 0.00 0.00 34.13 34.54 1xmm s GLU 55 CO 0.00 -0.19 -0.01 0.45 -0.54 0.00 0.00 175.26 174.97 1xmm s SER 56 N 1.96 1.93 0.22 -1.70 0.15 -0.68 -4.99 113.70 110.59 1xmm s SER 56 Ca -0.07 -0.25 -0.03 0.00 0.70 0.00 0.00 55.95 56.31 1xmm s SER 56 Cb -0.09 -0.56 0.22 0.00 -1.71 0.00 0.00 66.02 63.87 1xmm s SER 56 CO -0.14 -0.19 1.63 0.00 1.20 0.00 0.00 173.24 175.74 1xmm h ALA 57 N 8.28 0.90 -0.50 5.45 0.00 -1.98 -1.21 119.26 130.20 1xmm h ALA 57 Ca -0.21 -0.38 0.10 0.00 0.00 0.00 0.00 54.91 54.41 1xmm h ALA 57 Cb 1.12 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 1xmm h ALA 57 CO 0.31 0.62 -0.04 -0.09 0.00 0.00 0.00 179.25 180.05 1xmm h ARG 58 N 0.60 0.07 0.00 0.00 2.43 -1.97 -3.08 114.38 112.43 1xmm h ARG 58 Ca 0.08 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1xmm h ARG 58 Cb 0.76 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1xmm h ARG 58 CO 0.06 0.05 -0.11 -0.40 -1.51 0.00 0.00 179.97 178.06 1xmm n ASP 59 N -5.28 2.03 -3.55 -3.80 3.85 -1.24 -5.03 116.55 103.53 1xmm n ASP 59 Ca 0.05 -3.04 -0.21 0.00 -0.71 0.00 0.00 54.79 50.88 1xmm n ASP 59 Cb 0.28 -0.41 0.05 0.00 -1.35 0.00 0.00 41.12 39.68 1xmm n ASP 59 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1xmm n LYS 60 N -1.24 -3.66 -3.99 0.11 4.01 -0.48 -4.72 118.16 108.18 1xmm n LYS 60 Ca 0.14 0.67 -0.10 0.00 -0.51 0.00 0.00 58.31 58.52 1xmm n LYS 60 Cb 0.66 -5.20 -0.11 0.00 -0.51 0.00 0.00 35.03 29.87 1xmm n LYS 60 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 1xmm s ILE 61 N -3.52 0.19 -0.11 -0.18 2.07 -1.04 -1.59 121.20 117.03 1xmm s ILE 61 Ca 0.22 -0.90 -0.07 0.00 -1.41 0.00 0.00 60.65 58.48 1xmm s ILE 61 Cb -0.05 -0.32 0.04 0.00 0.13 0.00 0.00 42.46 42.26 1xmm s ILE 61 CO 0.79 -0.45 0.27 -0.51 -1.91 0.00 0.00 174.94 173.14 1xmm s ILE 62 N -1.37 -0.02 -0.14 2.00 2.07 -0.33 -1.69 121.20 121.71 1xmm s ILE 62 Ca -0.14 0.09 -0.01 0.00 -1.41 0.00 0.00 60.65 59.17 1xmm s ILE 62 Cb -0.10 -0.41 -0.02 0.00 0.13 0.00 0.00 42.46 42.07 1xmm s ILE 62 CO -0.01 0.04 -0.10 -0.36 -1.91 0.00 0.00 174.94 172.60 1xmm s PHE 63 N 0.85 2.89 -0.06 3.50 0.40 -0.40 -1.16 117.98 124.00 1xmm s PHE 63 Ca -0.06 -0.52 0.04 0.00 -0.60 0.00 0.00 56.93 55.79 1xmm s PHE 63 Cb -0.07 -1.88 0.00 0.00 0.51 0.00 0.00 43.02 41.58 1xmm s PHE 63 CO -0.06 -0.15 -0.16 -0.51 0.70 0.00 0.00 175.22 175.04 1xmm s LEU 64 N 0.35 1.85 -0.27 -0.37 1.43 -0.32 -1.88 118.68 119.47 1xmm s LEU 64 Ca -0.09 -0.36 -0.10 0.00 -1.03 0.00 0.00 54.13 52.55 1xmm s LEU 64 Cb -0.15 -0.98 -0.04 0.00 0.03 0.00 0.00 46.19 45.05 1xmm s LEU 64 CO 0.05 0.12 0.16 -2.28 0.23 0.00 0.00 176.35 174.62 1xmm s HIS 65 N 0.27 3.19 0.19 0.29 5.65 -0.80 -1.25 115.29 122.83 1xmm s HIS 65 Ca -0.09 -0.02 0.06 0.00 0.25 0.00 0.00 55.06 55.26 1xmm s HIS 65 Cb -0.14 -2.35 -0.05 0.00 -1.18 0.00 0.00 32.58 28.87 1xmm s HIS 65 CO 0.04 -0.21 -0.11 0.20 -0.65 0.00 0.00 174.74 174.00 1xmm s GLY 66 N 1.72 1.32 0.14 1.59 0.00 -0.46 -1.03 107.32 110.61 1xmm s GLY 66 Ca 0.07 -1.62 -0.12 0.00 0.00 0.00 0.00 44.72 43.05 1xmm s GLY 66 CO 0.09 -1.69 0.50 0.54 0.00 0.00 0.00 173.10 172.54 1xmm s LYS 67 N -3.70 3.88 0.17 2.90 -0.14 -0.47 -1.49 119.74 120.88 1xmm s LYS 67 Ca 0.21 0.35 0.01 0.00 -1.36 0.00 0.00 55.97 55.18 1xmm s LYS 67 Cb 0.01 -2.90 -0.04 0.00 -1.68 0.00 0.00 37.83 33.22 1xmm s LYS 67 CO 0.05 0.47 0.03 0.14 -0.76 0.00 0.00 175.35 175.28 1xmm s VAL 68 N -1.51 0.49 -1.65 3.17 -7.23 -0.74 -1.48 120.40 111.45 1xmm s VAL 68 Ca 0.38 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 1xmm s VAL 68 Cb -0.14 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.66 1xmm s VAL 68 CO 0.19 -0.43 0.00 0.59 -0.31 0.00 0.00 175.10 175.14 1xmm n ASN 69 N -0.22 -4.74 -4.74 4.85 3.02 -0.77 -1.83 115.26 110.84 1xmm n ASN 69 Ca -0.06 0.27 -0.41 0.00 -0.03 0.00 0.00 54.58 54.35 1xmm n ASN 69 Cb 0.64 -4.13 -0.03 0.00 -0.61 0.00 0.00 39.78 35.65 1xmm n ASN 69 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1xmm s GLU 70 N -4.17 4.32 0.00 3.52 2.02 -1.26 -4.49 118.70 118.64 1xmm s GLU 70 Ca 0.00 2.18 0.00 0.00 0.02 0.00 0.00 54.97 57.17 1xmm s GLU 70 Cb 0.00 -3.16 0.00 0.00 0.10 0.00 0.00 34.13 31.07 1xmm s GLU 70 CO 0.00 -0.36 0.00 0.41 0.02 0.00 0.00 175.26 175.33 1xmm n GLY 75 N 2.48 -0.07 0.19 -1.39 0.00 -1.26 -4.92 105.19 100.23 1xmm n GLY 75 Ca 0.07 0.02 0.05 0.00 0.00 0.00 0.00 46.02 46.17 1xmm n GLY 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xmm h ASP 76 N 0.00 0.00 -3.89 1.61 3.45 -1.96 -3.49 116.42 112.13 1xmm h ASP 76 Ca 0.00 0.00 0.10 0.00 0.43 0.00 0.00 57.03 57.56 1xmm h ASP 76 Cb 0.00 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 38.72 1xmm h ASP 76 CO 0.00 0.37 -0.32 0.61 -1.57 0.00 0.00 179.24 178.33 1xmm n GLY 77 N -0.08 -2.64 3.83 2.75 0.00 -1.26 -4.97 105.19 102.82 1xmm n GLY 77 Ca -0.01 -1.35 -0.22 0.00 0.00 0.00 0.00 46.02 44.44 1xmm n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xmm s GLU 78 N -3.07 2.48 0.22 1.61 2.02 -0.76 -4.90 118.70 116.29 1xmm s GLU 78 Ca 0.00 -1.58 -0.12 0.00 0.02 0.00 0.00 54.97 53.29 1xmm s GLU 78 Cb 0.00 -2.29 -0.08 0.00 0.10 0.00 0.00 34.13 31.86 1xmm s GLU 78 CO 0.00 -0.12 0.59 -0.51 0.02 0.00 0.00 175.26 175.24 1xmm s ASP 79 N -4.05 6.73 0.00 -0.19 1.01 -1.26 -1.80 116.67 117.11 1xmm s ASP 79 Ca 0.45 1.05 -0.15 0.00 0.71 0.00 0.00 52.55 54.62 1xmm s ASP 79 Cb -0.02 -2.28 0.02 0.00 1.01 0.00 0.00 42.92 41.65 1xmm s ASP 79 CO 0.26 -0.05 0.31 0.00 0.21 0.00 0.00 175.17 175.91 1xmm s ALA 80 N -1.74 -0.76 -0.16 5.23 0.00 -0.56 -2.10 121.76 121.67 1xmm s ALA 80 Ca 0.46 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.67 1xmm s ALA 80 Cb -0.12 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.16 1xmm s ALA 80 CO 0.20 -0.30 -0.19 0.08 0.00 0.00 0.00 175.76 175.55 1xmm s VAL 81 N -1.68 1.90 -0.21 0.00 1.01 -0.50 -1.36 120.40 119.57 1xmm s VAL 81 Ca -0.11 -0.85 -0.03 0.00 0.00 0.00 0.00 61.98 60.98 1xmm s VAL 81 Cb -0.04 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 1xmm s VAL 81 CO 0.02 0.52 -0.06 -0.69 0.00 0.00 0.00 175.10 174.89 1xmm s VAL 82 N 1.21 3.29 -0.14 2.92 1.01 -0.38 -0.81 120.40 127.50 1xmm s VAL 82 Ca 0.02 -0.53 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 1xmm s VAL 82 Cb -0.14 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1xmm s VAL 82 CO -0.09 0.44 0.04 -0.63 0.00 0.00 0.00 175.10 174.85 1xmm s ILE 83 N 1.37 4.61 -0.08 2.22 -1.09 0.66 -1.17 121.20 127.72 1xmm s ILE 83 Ca 0.05 -0.11 0.03 0.00 -2.23 0.00 0.00 60.65 58.38 1xmm s ILE 83 Cb -0.14 -3.02 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 1xmm s ILE 83 CO -0.03 0.52 -0.18 -0.76 -1.23 0.00 0.00 174.94 173.26 1xmm s LEU 84 N -0.15 1.88 -0.04 2.97 1.02 -0.31 -0.91 118.68 123.15 1xmm s LEU 84 Ca 0.06 -0.42 0.01 0.00 0.02 0.00 0.00 54.13 53.80 1xmm s LEU 84 Cb -0.12 -1.11 0.02 0.00 0.02 0.00 0.00 46.19 45.00 1xmm s LEU 84 CO 0.02 0.11 -0.03 -0.70 0.02 0.00 0.00 176.35 175.77 1xmm s GLU 85 N 0.43 0.63 0.75 1.70 2.12 0.12 -1.19 118.70 123.26 1xmm s GLU 85 Ca -0.15 -0.04 -0.15 0.00 0.36 0.00 0.00 54.97 55.00 1xmm s GLU 85 Cb -0.16 -0.70 0.05 0.00 0.26 0.00 0.00 34.13 33.57 1xmm s GLU 85 CO 0.06 -0.10 1.21 0.15 -0.54 0.00 0.00 175.26 176.03 1xmm s LYS 86 N 0.96 2.03 0.18 4.30 -0.14 -0.62 -1.26 119.74 125.19 1xmm s LYS 86 Ca -0.11 1.76 0.07 0.00 -1.36 0.00 0.00 55.97 56.33 1xmm s LYS 86 Cb -0.14 -1.82 -0.04 0.00 -1.68 0.00 0.00 37.83 34.15 1xmm s LYS 86 CO -0.01 -1.92 0.06 0.95 -0.76 0.00 0.00 175.35 173.68 1xmm s THR 87 N -2.02 4.03 1.05 2.17 -4.23 -1.24 -4.79 115.64 110.61 1xmm s THR 87 Ca 0.74 -1.34 -0.11 0.00 -1.18 0.00 0.00 61.69 59.79 1xmm s THR 87 Cb -0.29 -3.06 0.22 0.00 1.34 0.00 0.00 72.50 70.71 1xmm s THR 87 CO 0.47 -0.15 1.08 -2.84 -0.54 0.00 0.00 174.62 172.64 1xmm s PRO 88 N -3.13 -0.09 0.11 3.99 0.02 -1.26 -4.98 135.00 129.66 1xmm s PRO 88 Ca 0.29 1.22 -0.25 0.00 0.02 0.00 0.00 61.00 62.29 1xmm s PRO 88 Cb -0.09 -1.62 -0.07 0.00 0.02 0.00 0.00 34.50 32.74 1xmm s PRO 88 CO 0.21 -3.28 0.75 -0.06 -0.33 0.00 0.00 177.00 174.29 1xmm s PHE 89 N -2.52 3.83 -0.32 6.54 0.40 -1.26 -5.03 117.98 119.61 1xmm s PHE 89 Ca 0.68 1.54 -0.20 0.00 -0.60 0.00 0.00 56.93 58.35 1xmm s PHE 89 Cb -0.24 -2.77 -0.01 0.00 0.51 0.00 0.00 43.02 40.51 1xmm s PHE 89 CO 0.62 0.42 0.62 -0.65 0.70 0.00 0.00 175.22 176.93 1xmm s GLN 90 N -0.69 3.82 0.29 0.44 1.11 -1.26 -4.96 119.66 118.40 1xmm s GLN 90 Ca 0.36 0.19 0.03 0.00 0.01 0.00 0.00 55.36 55.95 1xmm s GLN 90 Cb -0.22 -3.76 0.63 0.00 -1.01 0.00 0.00 33.01 28.65 1xmm s GLN 90 CO 0.24 -0.63 1.80 0.28 0.01 0.00 0.00 175.29 176.99 1xmm h VAL 91 N 5.59 0.79 -0.24 1.09 2.07 -2.00 -2.27 116.25 121.29 1xmm h VAL 91 Ca -0.27 -0.28 -0.15 0.00 0.82 0.00 0.00 66.70 66.82 1xmm h VAL 91 Cb 1.12 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1xmm h VAL 91 CO 0.81 0.15 -0.48 -0.33 0.02 0.00 0.00 177.57 177.74 1xmm h GLU 92 N 0.83 0.64 -0.17 1.57 3.07 -2.00 -2.45 114.58 116.06 1xmm h GLU 92 Ca 0.53 -0.37 -0.19 0.00 -0.50 0.00 0.00 59.36 58.83 1xmm h GLU 92 Cb 0.70 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.63 1xmm h GLU 92 CO -0.33 0.98 -0.66 1.96 -1.40 0.00 0.00 179.01 179.56 1xmm h GLN 93 N 0.51 0.65 -0.16 2.33 4.20 -1.85 -2.90 115.11 117.88 1xmm h GLN 93 Ca 0.03 -0.47 -0.15 0.00 0.06 0.00 0.00 58.65 58.12 1xmm h GLN 93 Cb 1.02 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 1xmm h GLN 93 CO 0.10 1.09 -0.54 0.28 -0.67 0.00 0.00 178.83 179.08 1xmm h VAL 94 N 0.47 1.33 -0.36 -0.54 2.07 -1.36 -2.16 116.25 115.71 1xmm h VAL 94 Ca -0.02 -1.80 -0.13 0.00 0.82 0.00 0.00 66.70 65.57 1xmm h VAL 94 Cb 1.24 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.81 1xmm h VAL 94 CO 0.13 0.55 -0.30 0.00 0.02 0.00 0.00 177.57 177.97 1xmm h ALA 95 N 1.05 0.52 -0.44 1.67 0.00 -1.48 -2.86 119.26 117.72 1xmm h ALA 95 Ca 0.01 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 1xmm h ALA 95 Cb 1.06 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1xmm h ALA 95 CO 0.10 0.55 -0.04 0.37 0.00 0.00 0.00 179.25 180.23 1xmm h GLN 96 N 0.63 0.75 -0.34 0.00 4.15 -1.45 -2.94 115.11 115.90 1xmm h GLN 96 Ca 0.06 -0.21 -0.04 0.00 0.77 0.00 0.00 58.65 59.23 1xmm h GLN 96 Cb 0.88 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.47 1xmm h GLN 96 CO 0.08 0.79 0.03 1.25 -1.93 0.00 0.00 178.83 179.04 1xmm h LEU 97 N 0.69 0.48 -8.33 -2.39 5.85 -1.25 -3.52 115.31 106.84 1xmm h LEU 97 Ca 0.13 -0.08 -0.72 0.00 0.84 0.00 0.00 57.88 58.05 1xmm h LEU 97 Cb 0.49 -0.12 -0.21 0.00 0.37 0.00 0.00 40.66 41.18 1xmm h LEU 97 CO 0.02 0.53 -0.22 -0.76 -0.34 0.00 0.00 178.44 177.68 1xmm s LEU 98 N -9.10 5.42 0.00 2.25 1.43 -1.09 -4.98 118.68 112.60 1xmm s LEU 98 Ca -0.08 -1.19 0.00 0.00 -1.03 0.00 0.00 54.13 51.83 1xmm s LEU 98 Cb 0.16 -2.26 0.00 0.00 0.03 0.00 0.00 46.19 44.11 1xmm s LEU 98 CO 0.76 -0.72 0.00 -2.65 0.23 0.00 0.00 176.35 173.97 1xmm n PRO 102 N 5.50 0.00 -3.34 1.29 -0.02 -1.26 -5.09 135.00 132.08 1xmm n PRO 102 Ca -0.11 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 60.98 1xmm n PRO 102 Cb 0.44 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.84 1xmm n PRO 102 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1xmm s GLU 103 N -3.19 4.05 0.04 -0.52 -1.05 -1.26 -5.07 118.70 111.70 1xmm s GLU 103 Ca 0.00 0.15 0.02 0.00 -0.15 0.00 0.00 54.97 54.99 1xmm s GLU 103 Cb 0.00 -3.64 -0.02 0.00 -0.44 0.00 0.00 34.13 30.03 1xmm s GLU 103 CO 0.00 -0.27 -0.08 -0.51 0.95 0.00 0.00 175.26 175.35 1xmm s LEU 104 N 2.06 2.24 -0.27 1.83 1.43 -1.26 -4.38 118.68 120.34 1xmm s LEU 104 Ca 0.17 -0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1xmm s LEU 104 Cb -0.16 -0.17 0.04 0.00 0.03 0.00 0.00 46.19 45.93 1xmm s LEU 104 CO 0.09 -0.19 -0.05 -1.10 0.23 0.00 0.00 176.35 175.34 1xmm s GLN 105 N -1.50 2.59 0.56 1.70 -0.21 -0.41 -4.93 119.66 117.46 1xmm s GLN 105 Ca -0.09 -1.14 -0.20 0.00 0.02 0.00 0.00 55.36 53.95 1xmm s GLN 105 Cb -0.10 -3.04 -0.05 0.00 1.00 0.00 0.00 33.01 30.82 1xmm s GLN 105 CO 0.00 -0.51 1.20 -1.17 -2.12 0.00 0.00 175.29 172.69 1xmm s LEU 106 N 1.27 3.74 0.17 2.90 2.96 -1.26 -0.24 118.68 128.22 1xmm s LEU 106 Ca -0.03 2.37 0.00 0.00 -0.22 0.00 0.00 54.13 56.25 1xmm s LEU 106 Cb -0.18 -4.53 0.00 0.00 0.50 0.00 0.00 46.19 41.98 1xmm s LEU 106 CO -0.03 -1.44 0.00 1.67 -1.32 0.00 0.00 176.35 175.23 1xmm n GLN 107 N -1.35 0.00 -4.42 1.98 7.27 -0.75 -4.84 117.38 115.27 1xmm n GLN 107 Ca 0.12 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.98 1xmm n GLN 107 Cb 0.49 -0.11 -0.10 0.00 2.41 0.00 0.00 30.24 32.93 1xmm n GLN 107 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1xmm s PHE 108 N -1.73 1.92 0.37 3.69 2.99 -1.11 -5.02 117.98 119.09 1xmm s PHE 108 Ca 0.00 -0.67 -0.16 0.00 0.00 0.00 0.00 56.93 56.09 1xmm s PHE 108 Cb 0.00 -1.06 0.06 0.00 0.00 0.00 0.00 43.02 42.01 1xmm s PHE 108 CO 0.00 0.30 0.81 -1.54 -0.00 0.00 0.00 175.22 174.79 1xmm s SER 109 N -3.43 0.00 0.00 1.36 1.04 -1.26 -2.13 113.70 109.28 1xmm s SER 109 Ca 0.28 -1.10 0.00 0.00 0.48 0.00 0.00 55.95 55.62 1xmm s SER 109 Cb 0.03 0.82 0.00 0.00 0.10 0.00 0.00 66.02 66.97 1xmm s SER 109 CO 0.11 -1.63 0.00 -0.67 0.98 0.00 0.00 173.24 172.03 1xmm n ASP 111 N -1.38 0.00 0.02 7.02 2.03 -1.26 -4.72 116.55 118.26 1xmm n ASP 111 Ca -0.08 0.26 -0.12 0.00 0.52 0.00 0.00 54.79 55.37 1xmm n ASP 111 Cb 0.60 -0.45 -0.14 0.00 -0.72 0.00 0.00 41.12 40.41 1xmm n ASP 111 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1xmm h ILE 112 N 0.00 1.08 -3.30 5.18 1.08 -2.10 -3.47 117.51 115.98 1xmm h ILE 112 Ca 0.00 -2.83 -0.56 0.00 -0.39 0.00 0.00 64.86 61.08 1xmm h ILE 112 Cb 0.00 2.61 -0.04 0.00 -3.07 0.00 0.00 36.82 36.32 1xmm h ILE 112 CO 0.00 0.72 -0.14 -0.31 -0.69 0.00 0.00 178.15 177.73 1xmm s TYR 113 N -2.62 3.54 -0.30 1.37 1.51 -1.26 -5.09 117.35 114.49 1xmm s TYR 113 Ca -0.07 0.91 -0.09 0.00 -1.01 0.00 0.00 57.07 56.81 1xmm s TYR 113 Cb 0.08 -2.27 0.14 0.00 -0.11 0.00 0.00 41.96 39.81 1xmm s TYR 113 CO 0.83 0.40 0.70 -1.54 -1.11 0.00 0.00 175.55 174.82 1xmm s SER 114 N -1.96 -1.10 -0.08 2.29 1.04 -1.26 -4.47 113.70 108.16 1xmm s SER 114 Ca 0.40 1.34 -0.01 0.00 0.48 0.00 0.00 55.95 58.16 1xmm s SER 114 Cb -0.13 2.18 -0.03 0.00 0.10 0.00 0.00 66.02 68.14 1xmm s SER 114 CO 0.20 -0.21 -0.03 -0.89 0.98 0.00 0.00 173.24 173.29 1xmm s THR 115 N 2.84 4.06 0.37 2.02 2.01 -0.91 -5.01 115.64 121.02 1xmm s THR 115 Ca -0.01 -0.34 0.04 0.00 0.31 0.00 0.00 61.69 61.68 1xmm s THR 115 Cb -0.12 -2.69 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 1xmm s THR 115 CO -0.19 0.60 0.12 -0.31 -0.69 0.00 0.00 174.62 174.15 1xmm s TYR 116 N -0.85 1.78 -0.17 4.92 1.51 -1.26 -1.82 117.35 121.46 1xmm s TYR 116 Ca 0.13 -1.24 -0.06 0.00 -1.01 0.00 0.00 57.07 54.89 1xmm s TYR 116 Cb -0.11 -1.11 -0.04 0.00 -0.11 0.00 0.00 41.96 40.59 1xmm s TYR 116 CO 0.02 -0.29 0.03 -1.01 -1.11 0.00 0.00 175.55 173.19 1xmm s HIS 117 N -3.32 3.17 -0.19 2.71 3.76 0.67 -4.91 115.29 117.18 1xmm s HIS 117 Ca 0.29 -0.06 0.01 0.00 -0.15 0.00 0.00 55.06 55.16 1xmm s HIS 117 Cb 0.04 -2.03 0.03 0.00 1.11 0.00 0.00 32.58 31.73 1xmm s HIS 117 CO 0.15 0.10 -0.17 -1.17 -0.85 0.00 0.00 174.74 172.80 1xmm s LEU 118 N 0.34 2.31 -0.50 0.89 2.96 -1.26 -1.29 118.68 122.12 1xmm s LEU 118 Ca 0.01 -0.78 -0.14 0.00 -0.22 0.00 0.00 54.13 53.00 1xmm s LEU 118 Cb -0.13 -1.43 0.11 0.00 0.50 0.00 0.00 46.19 45.25 1xmm s LEU 118 CO 0.01 -0.05 0.42 -0.36 -1.32 0.00 0.00 176.35 175.05 1xmm s PHE 119 N 1.29 3.30 0.57 5.38 0.40 -1.26 -5.08 117.98 122.58 1xmm s PHE 119 Ca 0.02 -1.41 -0.05 0.00 -0.60 0.00 0.00 56.93 54.89 1xmm s PHE 119 Cb -0.14 -3.56 0.00 0.00 0.51 0.00 0.00 43.02 39.83 1xmm s PHE 119 CO -0.11 -0.97 0.87 -1.25 0.70 0.00 0.00 175.22 174.47 1xmm s PRO 120 N 1.53 2.99 0.76 0.24 0.05 -1.26 -4.97 135.00 134.34 1xmm s PRO 120 Ca 0.04 -0.03 -0.11 0.00 0.05 0.00 0.00 61.00 60.95 1xmm s PRO 120 Cb -0.28 -2.30 0.05 0.00 0.05 0.00 0.00 34.50 32.02 1xmm s PRO 120 CO 0.03 -0.62 1.09 -1.25 0.05 0.00 0.00 177.00 176.30 1xmm s PRO 121 N -4.93 2.33 0.05 0.56 0.04 -1.26 -4.89 135.00 126.89 1xmm s PRO 121 Ca 0.53 1.17 -0.03 0.00 0.04 0.00 0.00 61.00 62.70 1xmm s PRO 121 Cb -0.10 -1.90 0.05 0.00 0.04 0.00 0.00 34.50 32.58 1xmm s PRO 121 CO 0.45 -1.59 0.31 0.54 0.04 0.00 0.00 177.00 176.75 1xmm n ARG 122 N -3.44 -0.04 -0.19 4.56 1.74 -1.26 -2.24 116.66 115.80 1xmm n ARG 122 Ca 0.09 0.31 0.11 0.00 -0.77 0.00 0.00 57.85 57.59 1xmm n ARG 122 Cb 0.53 -0.46 0.42 0.00 -1.02 0.00 0.00 32.46 31.93 1xmm n ARG 122 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 1xmm h GLN 123 N 0.00 0.57 -0.34 5.56 5.75 -2.04 -1.54 115.11 123.08 1xmm h GLN 123 Ca 0.07 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1xmm h GLN 123 Cb 0.12 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.54 1xmm h GLN 123 CO -0.20 0.38 0.00 1.28 -2.65 0.00 0.00 178.83 177.64 1xmm n LEU 124 N -4.50 2.21 -0.65 -2.39 4.32 -0.95 -4.23 117.00 110.82 1xmm n LEU 124 Ca 0.13 -1.03 0.07 0.00 -0.02 0.00 0.00 56.01 55.16 1xmm n LEU 124 Cb 0.40 -0.22 0.12 0.00 -1.62 0.00 0.00 43.42 42.09 1xmm n LEU 124 CO 0.32 0.52 0.56 0.59 -1.22 0.00 0.00 177.39 178.16 1xmm n ASN 125 N 0.69 2.60 -4.58 -1.43 3.02 -0.58 -4.98 115.26 110.01 1xmm n ASN 125 Ca 0.16 -1.78 -0.54 0.00 -0.03 0.00 0.00 54.58 52.39 1xmm n ASN 125 Cb 0.38 -0.14 -0.06 0.00 -0.61 0.00 0.00 39.78 39.35 1xmm n ASN 125 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1xmm n ASP 126 N 0.73 1.35 -4.06 6.41 2.03 -1.26 -4.97 116.55 116.78 1xmm n ASP 126 Ca 0.11 1.13 -0.32 0.00 0.52 0.00 0.00 54.79 56.22 1xmm n ASP 126 Cb 0.40 -1.14 -0.15 0.00 -0.72 0.00 0.00 41.12 39.51 1xmm n ASP 126 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1xmm s VAL 127 N 0.47 2.09 -0.02 5.18 1.01 -1.26 -3.71 120.40 124.16 1xmm s VAL 127 Ca 0.86 -1.52 -0.33 0.00 0.00 0.00 0.00 61.98 60.99 1xmm s VAL 127 Cb -1.02 -2.18 -0.11 0.00 0.00 0.00 0.00 36.38 33.06 1xmm s VAL 127 CO 0.49 0.02 1.88 1.17 0.00 0.00 0.00 175.10 178.67 1xmm n LYS 128 N 4.47 2.40 -3.95 2.72 4.81 -0.39 -4.82 118.16 123.41 1xmm n LYS 128 Ca -0.15 0.88 -0.30 0.00 -0.87 0.00 0.00 58.31 57.87 1xmm n LYS 128 Cb 0.43 -2.75 -0.16 0.00 0.02 0.00 0.00 35.03 32.57 1xmm n LYS 128 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1xmm s THR 129 N 3.88 1.52 -0.21 3.15 2.01 -1.26 -0.70 115.64 124.03 1xmm s THR 129 Ca 0.90 -1.14 -0.04 0.00 0.31 0.00 0.00 61.69 61.73 1xmm s THR 129 Cb -0.61 -1.74 -0.01 0.00 0.01 0.00 0.00 72.50 70.14 1xmm s THR 129 CO 0.47 -0.03 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.44 1xmm s THR 130 N 1.41 3.47 -0.11 -0.82 2.01 -0.09 -4.96 115.64 116.56 1xmm s THR 130 Ca -0.05 -0.47 -0.03 0.00 0.31 0.00 0.00 61.69 61.46 1xmm s THR 130 Cb -0.18 -2.56 -0.03 0.00 0.01 0.00 0.00 72.50 69.73 1xmm s THR 130 CO -0.07 0.44 0.00 -0.69 -0.69 0.00 0.00 174.62 173.61 1xmm s VAL 131 N 1.24 4.32 -0.24 3.82 1.01 -1.26 -0.24 120.40 129.05 1xmm s VAL 131 Ca 0.03 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.79 1xmm s VAL 131 Cb -0.14 -2.84 0.06 0.00 0.00 0.00 0.00 36.38 33.45 1xmm s VAL 131 CO -0.01 0.58 -0.07 -0.69 0.00 0.00 0.00 175.10 174.90 1xmm s VAL 132 N -0.58 1.72 -0.21 2.92 1.01 0.01 -5.01 120.40 120.26 1xmm s VAL 132 Ca 0.10 -1.32 -0.11 0.00 0.00 0.00 0.00 61.98 60.65 1xmm s VAL 132 Cb -0.12 -1.92 0.07 0.00 0.00 0.00 0.00 36.38 34.41 1xmm s VAL 132 CO 0.02 -0.06 0.49 -0.47 0.00 0.00 0.00 175.10 175.09 1xmm s TYR 133 N 1.31 -0.77 0.16 5.22 5.04 -1.26 -1.41 117.35 125.64 1xmm s TYR 133 Ca -0.06 1.56 -0.30 0.00 -2.44 0.00 0.00 57.07 55.83 1xmm s TYR 133 Cb -0.19 0.38 -0.08 0.00 0.35 0.00 0.00 41.96 42.43 1xmm s TYR 133 CO -0.06 -0.42 1.26 -2.14 -1.34 0.00 0.00 175.55 172.85 1xmm s PRO 134 N 1.65 4.42 -0.01 4.97 0.02 -1.26 -5.12 135.00 139.68 1xmm s PRO 134 Ca -0.09 1.94 -0.28 0.00 0.02 0.00 0.00 61.00 62.59 1xmm s PRO 134 Cb -0.08 -3.25 -0.03 0.00 0.02 0.00 0.00 34.50 31.16 1xmm s PRO 134 CO -0.15 -0.22 0.90 0.00 -0.33 0.00 0.00 177.00 177.20 1xmm s ALA 135 N 0.36 3.22 0.87 -1.55 0.00 -0.89 -5.01 121.76 118.76 1xmm s ALA 135 Ca 0.57 0.43 -0.13 0.00 0.00 0.00 0.00 51.96 52.82 1xmm s ALA 135 Cb -0.34 -3.22 0.12 0.00 0.00 0.00 0.00 23.12 19.68 1xmm s ALA 135 CO 0.35 -0.17 1.20 0.95 0.00 0.00 0.00 175.76 178.09 1xmm s THR 136 N 0.83 1.99 0.40 0.00 -4.23 -1.26 -4.60 115.64 108.77 1xmm s THR 136 Ca 0.47 0.00 0.07 0.00 -1.18 0.00 0.00 61.69 61.06 1xmm s THR 136 Cb -0.20 -2.95 0.23 0.00 1.34 0.00 0.00 72.50 70.92 1xmm s THR 136 CO 0.25 0.00 2.01 -0.08 -0.54 0.00 0.00 174.62 176.27 1xmm h GLU 137 N -1.29 0.46 0.00 3.99 4.57 -2.00 -2.20 114.58 118.11 1xmm h GLU 137 Ca -0.46 -0.05 -0.07 0.00 -1.18 0.00 0.00 59.36 57.59 1xmm h GLU 137 Cb 1.31 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 1xmm h GLU 137 CO 0.58 0.37 -0.35 0.87 -1.18 0.00 0.00 179.01 179.31 1xmm h LYS 138 N 0.47 0.00 -0.30 1.92 1.57 -1.99 -2.24 116.57 115.99 1xmm h LYS 138 Ca 0.12 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.79 1xmm h LYS 138 Cb 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1xmm h LYS 138 CO -0.02 0.35 -0.24 0.45 -0.57 0.00 0.00 179.45 179.42 1xmm h HIS 139 N 0.00 0.82 -0.56 -1.35 3.86 -1.76 -2.39 115.15 113.78 1xmm h HIS 139 Ca -0.00 -0.23 -0.01 0.00 -1.16 0.00 0.00 60.37 58.96 1xmm h HIS 139 Cb 0.70 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 28.97 1xmm h HIS 139 CO 0.00 0.96 0.30 -0.07 0.86 0.00 0.00 177.93 179.98 1xmm h LEU 140 N 0.45 0.68 -0.06 2.43 3.38 -1.27 -2.79 115.31 118.14 1xmm h LEU 140 Ca 0.06 -0.05 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1xmm h LEU 140 Cb 0.80 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.39 1xmm h LEU 140 CO 0.06 0.56 -0.72 1.56 0.09 0.00 0.00 178.44 179.99 1xmm h GLN 141 N 0.78 0.59 -0.00 1.13 4.20 -1.37 -3.10 115.11 117.34 1xmm h GLN 141 Ca 0.20 -0.56 -0.12 0.00 0.06 0.00 0.00 58.65 58.23 1xmm h GLN 141 Cb 0.03 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 1xmm h GLN 141 CO -0.03 1.18 -0.55 1.57 -0.67 0.00 0.00 178.83 180.33 1xmm h LYS 142 N 0.21 0.01 0.00 1.46 2.10 -1.27 -3.01 116.57 116.08 1xmm h LYS 142 Ca -0.07 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 1xmm h LYS 142 Cb 1.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.71 1xmm h LYS 142 CO 0.14 0.56 -0.60 0.66 -2.00 0.00 0.00 179.45 178.21 1xmm n TYR 143 N -3.89 0.56 -1.99 0.07 0.53 -1.07 -4.90 117.16 106.48 1xmm n TYR 143 Ca -0.01 0.16 -0.42 0.00 -1.02 0.00 0.00 57.90 56.61 1xmm n TYR 143 Cb 0.56 -0.66 -0.03 0.00 -1.03 0.00 0.00 39.34 38.18 1xmm n TYR 143 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 1xmm s LEU 144 N -4.22 4.37 0.04 7.72 0.20 -1.14 -3.96 118.68 121.70 1xmm s LEU 144 Ca 0.06 2.60 -0.30 0.00 0.69 0.00 0.00 54.13 57.18 1xmm s LEU 144 Cb 0.13 -3.60 -0.05 0.00 -0.43 0.00 0.00 46.19 42.24 1xmm s LEU 144 CO 0.72 -0.76 1.15 -0.60 -0.29 0.00 0.00 176.35 176.56 1xmm s ARG 145 N 0.61 4.46 0.07 1.98 3.52 -0.32 -4.94 118.95 124.33 1xmm s ARG 145 Ca 0.66 1.69 -0.27 0.00 -0.13 0.00 0.00 55.73 57.68 1xmm s ARG 145 Cb -0.42 -3.38 0.09 0.00 -1.56 0.00 0.00 34.95 29.67 1xmm s ARG 145 CO 0.35 -0.22 0.94 1.14 -0.81 0.00 0.00 175.30 176.70 1xmm s GLN 146 N 1.09 0.97 0.13 5.12 -2.07 -1.26 -4.97 119.66 118.67 1xmm s GLN 146 Ca 0.57 -0.46 -0.34 0.00 -1.82 0.00 0.00 55.36 53.31 1xmm s GLN 146 Cb -0.28 0.38 -0.16 0.00 -1.09 0.00 0.00 33.01 31.86 1xmm s GLN 146 CO 0.29 -0.44 1.21 -3.47 -1.32 0.00 0.00 175.29 171.56 1xmm n ASP 147 N -0.36 1.33 -4.30 12.60 2.03 -1.26 -4.87 116.55 121.72 1xmm n ASP 147 Ca -0.07 1.13 -0.31 0.00 0.52 0.00 0.00 54.79 56.06 1xmm n ASP 147 Cb 0.61 -1.19 -0.16 0.00 -0.72 0.00 0.00 41.12 39.67 1xmm n ASP 147 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1xmm s LEU 148 N 0.61 2.10 0.10 -2.67 1.43 -1.26 -1.71 118.68 117.28 1xmm s LEU 148 Ca 0.78 -0.47 0.09 0.00 -1.03 0.00 0.00 54.13 53.50 1xmm s LEU 148 Cb -0.91 -1.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 1xmm s LEU 148 CO 0.51 0.29 -0.24 -0.13 0.23 0.00 0.00 176.35 177.01 1xmm s ARG 149 N -0.45 1.30 0.08 1.70 1.81 -0.60 -4.97 118.95 117.82 1xmm s ARG 149 Ca 0.05 -1.20 -0.14 0.00 -1.72 0.00 0.00 55.73 52.71 1xmm s ARG 149 Cb -0.11 -1.63 -0.06 0.00 -0.45 0.00 0.00 34.95 32.69 1xmm s ARG 149 CO 0.01 0.39 0.49 -1.17 -0.68 0.00 0.00 175.30 174.33 1xmm s LEU 150 N -1.84 4.41 -0.04 2.53 2.96 -1.26 -1.24 118.68 124.20 1xmm s LEU 150 Ca 0.10 1.03 0.01 0.00 -0.22 0.00 0.00 54.13 55.05 1xmm s LEU 150 Cb -0.10 -2.96 0.02 0.00 0.50 0.00 0.00 46.19 43.65 1xmm s LEU 150 CO 0.04 0.21 -0.05 -0.51 -1.32 0.00 0.00 176.35 174.73 1xmm s ILE 151 N -1.28 0.53 -0.51 6.68 1.10 -0.33 -4.97 121.20 122.42 1xmm s ILE 151 Ca 0.31 -0.14 -0.18 0.00 -0.51 0.00 0.00 60.65 60.13 1xmm s ILE 151 Cb -0.16 -0.54 0.07 0.00 0.15 0.00 0.00 42.46 41.98 1xmm s ILE 151 CO 0.17 0.21 0.54 -0.13 -2.11 0.00 0.00 174.94 173.63 1xmm s ARG 152 N 0.76 3.05 -0.37 3.50 0.52 -1.26 -2.36 118.95 122.79 1xmm s ARG 152 Ca -0.10 -1.17 -0.21 0.00 -0.52 0.00 0.00 55.73 53.72 1xmm s ARG 152 Cb -0.13 -4.15 0.01 0.00 0.52 0.00 0.00 34.95 31.20 1xmm s ARG 152 CO 0.00 -1.20 0.67 -2.00 0.02 0.00 0.00 175.30 172.79 1xmm s GLU 153 N 2.21 3.64 0.79 3.54 2.12 -0.15 -4.92 118.70 125.93 1xmm s GLU 153 Ca 0.10 0.05 -0.12 0.00 0.36 0.00 0.00 54.97 55.36 1xmm s GLU 153 Cb -0.22 -3.83 0.07 0.00 0.26 0.00 0.00 34.13 30.41 1xmm s GLU 153 CO 0.09 -0.80 1.10 0.95 -0.54 0.00 0.00 175.26 176.06 1xmm s THR 154 N 2.81 3.04 0.24 -1.70 -4.23 -1.26 -1.79 115.64 112.75 1xmm s THR 154 Ca 0.26 0.34 -0.05 0.00 -1.18 0.00 0.00 61.69 61.05 1xmm s THR 154 Cb -0.14 -3.11 0.20 0.00 1.34 0.00 0.00 72.50 70.79 1xmm s THR 154 CO 0.16 -0.44 1.80 1.23 -0.54 0.00 0.00 174.62 176.83 1xmm h GLY 155 N -1.06 1.22 1.01 3.99 0.00 -1.71 -0.24 103.07 106.28 1xmm h GLY 155 Ca -0.47 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 46.49 1xmm h GLY 155 CO 0.60 0.12 -0.01 -0.55 0.00 0.00 0.00 176.54 176.70 1xmm h ASP 156 N 0.75 0.86 -0.94 0.19 3.32 -1.89 -2.07 116.42 116.65 1xmm h ASP 156 Ca 0.38 -0.31 0.13 0.00 0.02 0.00 0.00 57.03 57.24 1xmm h ASP 156 Cb 0.35 -0.23 -0.09 0.00 0.22 0.00 0.00 39.33 39.58 1xmm h ASP 156 CO -0.25 0.96 0.56 0.44 -1.72 0.00 0.00 179.24 179.24 1xmm h ASP 157 N 0.73 0.79 -0.49 6.45 3.32 -1.67 0.53 116.42 126.08 1xmm h ASP 157 Ca 0.14 0.06 -0.13 0.00 0.02 0.00 0.00 57.03 57.12 1xmm h ASP 157 Cb 0.53 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1xmm h ASP 157 CO 0.03 0.40 -0.21 0.22 -1.72 0.00 0.00 179.24 177.96 1xmm h TYR 158 N 0.86 1.16 -0.13 4.55 3.20 -0.65 -1.01 116.97 124.96 1xmm h TYR 158 Ca 0.48 -0.28 -0.15 0.00 3.14 0.00 0.00 58.73 61.92 1xmm h TYR 158 Cb 0.53 -0.27 0.01 0.00 1.54 0.00 0.00 36.73 38.53 1xmm h TYR 158 CO -0.03 1.11 -0.51 0.00 -1.64 0.00 0.00 178.16 177.09 1xmm h ARG 159 N 0.87 0.58 0.00 1.82 3.08 -0.82 -0.61 114.38 119.30 1xmm h ARG 159 Ca 0.11 -0.44 -0.17 0.00 0.07 0.00 0.00 59.98 59.55 1xmm h ARG 159 Cb 0.79 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.90 1xmm h ARG 159 CO 0.07 1.07 -0.80 -0.91 -1.07 0.00 0.00 179.97 178.32 1xmm h ASN 160 N 0.21 0.00 0.00 7.04 2.35 -0.93 -3.40 115.58 120.85 1xmm h ASN 160 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1xmm h ASN 160 Cb 1.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.51 1xmm h ASN 160 CO 0.11 0.79 -0.19 -0.38 -1.65 0.00 0.00 177.43 176.11 1xmm n ILE 161 N -3.29 0.67 0.03 2.81 2.08 -0.41 -4.79 119.36 116.46 1xmm n ILE 161 Ca 0.01 0.22 -0.13 0.00 0.56 0.00 0.00 62.75 63.41 1xmm n ILE 161 Cb 0.85 -1.28 -0.09 0.00 -0.75 0.00 0.00 39.64 38.38 1xmm n ILE 161 CO 0.00 0.00 0.00 0.74 0.56 0.00 0.00 176.55 177.85 1xmm h THR 162 N 0.00 1.18 0.38 1.39 2.02 -1.43 -2.85 112.91 113.60 1xmm h THR 162 Ca 0.00 -1.02 -0.02 0.00 0.77 0.00 0.00 66.41 66.14 1xmm h THR 162 Cb 0.19 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 1xmm h THR 162 CO 0.00 0.25 -0.20 0.25 0.37 0.00 0.00 175.52 176.18 1xmm h LEU 163 N -0.58 -0.49 -1.16 2.58 6.46 -1.36 0.11 115.31 120.87 1xmm h LEU 163 Ca -0.01 0.02 0.09 0.00 -0.12 0.00 0.00 57.88 57.86 1xmm h LEU 163 Cb 0.49 0.14 -0.07 0.00 -0.73 0.00 0.00 40.66 40.49 1xmm h LEU 163 CO 0.02 -0.34 0.59 -0.65 -0.62 0.00 0.00 178.44 177.44 1xmm h PRO 164 N -0.54 0.91 -0.60 5.25 0.11 -1.78 -0.27 132.00 135.09 1xmm h PRO 164 Ca -0.05 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.98 1xmm h PRO 164 Cb 0.43 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.31 1xmm h PRO 164 CO 0.07 0.61 0.27 1.25 -0.21 0.00 0.00 178.00 179.98 1xmm h HIS 165 N 0.94 0.87 -0.87 0.65 -0.00 -1.25 -2.93 115.15 112.56 1xmm h HIS 165 Ca 0.42 -0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.74 1xmm h HIS 165 Cb 0.35 -0.27 -0.04 0.00 -0.00 0.00 0.00 27.41 27.45 1xmm h HIS 165 CO -0.00 0.67 0.56 1.25 -0.00 0.00 0.00 177.93 180.41 1xmm h LEU 166 N 0.82 1.02 -0.64 0.26 6.46 0.79 -2.80 115.31 121.21 1xmm h LEU 166 Ca 0.20 -0.04 -0.07 0.00 -0.12 0.00 0.00 57.88 57.85 1xmm h LEU 166 Cb 0.14 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.81 1xmm h LEU 166 CO -0.02 0.76 -0.34 -0.33 -0.62 0.00 0.00 178.44 177.89 1xmm h GLU 167 N 1.19 0.00 0.13 1.25 5.08 -1.06 -3.18 114.58 117.98 1xmm h GLU 167 Ca 0.32 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 1xmm h GLU 167 Cb -0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1xmm h GLU 167 CO -0.06 0.34 -0.06 0.77 -1.00 0.00 0.00 179.01 178.99 1xmm h SER 168 N 0.00 -0.15 -3.78 1.42 0.02 -1.31 -3.47 113.55 106.29 1xmm h SER 168 Ca -0.00 -0.13 0.05 0.00 -0.84 0.00 0.00 61.79 60.86 1xmm h SER 168 Cb 1.01 0.04 -0.24 0.00 0.14 0.00 0.00 62.40 63.35 1xmm h SER 168 CO 0.04 0.04 0.44 -1.58 -1.14 0.00 0.00 176.83 174.64 1xmm s GLN 169 N -5.50 0.62 0.15 3.45 2.00 -1.20 -5.14 119.66 114.04 1xmm s GLN 169 Ca -0.14 0.43 -0.13 0.00 -2.00 0.00 0.00 55.36 53.52 1xmm s GLN 169 Cb 0.04 0.30 0.01 0.00 0.80 0.00 0.00 33.01 34.16 1xmm s GLN 169 CO 0.64 -0.14 0.36 -1.54 -0.50 0.00 0.00 175.29 174.11 1xmm s SER 170 N -0.39 -0.08 0.12 6.67 1.04 -1.26 -4.70 113.70 115.10 1xmm s SER 170 Ca -0.00 -0.62 -0.32 0.00 0.48 0.00 0.00 55.95 55.48 1xmm s SER 170 Cb -0.03 0.47 -0.12 0.00 0.10 0.00 0.00 66.02 66.44 1xmm s SER 170 CO -0.01 -0.90 1.78 0.18 0.98 0.00 0.00 173.24 175.26 1xmm n LEU 171 N -0.23 3.78 -4.49 2.42 4.77 -1.26 -4.88 117.00 117.11 1xmm n LEU 171 Ca -0.11 1.01 -0.48 0.00 -0.03 0.00 0.00 56.01 56.40 1xmm n LEU 171 Cb 0.63 -1.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.18 1xmm n LEU 171 CO 0.21 0.06 0.33 -0.24 -1.33 0.00 0.00 177.39 176.42 1xmm n SER 172 N 5.07 0.01 -1.93 -1.43 2.88 -1.26 -4.72 113.62 112.25 1xmm n SER 172 Ca 0.18 1.15 -0.23 0.00 -1.33 0.00 0.00 58.87 58.64 1xmm n SER 172 Cb 0.34 -1.08 0.09 0.00 -0.75 0.00 0.00 64.21 62.81 1xmm n SER 172 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1xmm n ILE 173 N 0.48 2.95 0.11 2.46 -5.35 -1.26 -4.71 119.36 114.03 1xmm n ILE 173 Ca 0.15 -3.29 0.02 0.00 -0.27 0.00 0.00 62.75 59.37 1xmm n ILE 173 Cb 0.25 -0.90 0.39 0.00 -1.74 0.00 0.00 39.64 37.64 1xmm n ILE 173 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1xmm h GLN 174 N 1.76 0.28 -0.24 6.28 5.75 -2.00 -2.31 115.11 124.62 1xmm h GLN 174 Ca 0.43 -0.06 -0.09 0.00 -0.15 0.00 0.00 58.65 58.78 1xmm h GLN 174 Cb 1.41 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.91 1xmm h GLN 174 CO 0.97 0.38 -0.25 0.11 -2.65 0.00 0.00 178.83 177.39 1xmm h TRP 175 N 0.27 0.50 -0.38 3.99 5.08 -1.99 -0.79 115.95 122.62 1xmm h TRP 175 Ca 0.06 -0.10 -0.12 0.00 1.08 0.00 0.00 58.89 59.80 1xmm h TRP 175 Cb 0.32 -0.12 -0.01 0.00 -3.00 0.00 0.00 29.16 26.35 1xmm h TRP 175 CO 0.01 0.66 -0.23 0.28 -1.28 0.00 0.00 178.44 177.87 1xmm h VAL 176 N 0.40 1.28 -0.46 0.12 2.07 -1.80 -1.99 116.25 115.87 1xmm h VAL 176 Ca 0.06 -1.38 -0.08 0.00 0.82 0.00 0.00 66.70 66.12 1xmm h VAL 176 Cb 0.65 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 1xmm h VAL 176 CO 0.05 0.46 -0.06 1.88 0.02 0.00 0.00 177.57 179.92 1xmm h TYR 177 N 0.64 0.86 -0.35 1.57 0.99 -1.24 -2.34 116.97 117.10 1xmm h TYR 177 Ca 0.08 -0.14 -0.09 0.00 2.00 0.00 0.00 58.73 60.59 1xmm h TYR 177 Cb 0.80 -0.23 -0.02 0.00 1.00 0.00 0.00 36.73 38.28 1xmm h TYR 177 CO 0.06 0.82 -0.14 -0.91 -0.00 0.00 0.00 178.16 177.99 1xmm h ASN 178 N 0.73 0.61 -0.25 3.88 2.35 -0.98 -0.73 115.58 121.20 1xmm h ASN 178 Ca 0.13 -0.18 -0.04 0.00 -0.55 0.00 0.00 56.30 55.66 1xmm h ASN 178 Cb 0.52 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 1xmm h ASN 178 CO 0.03 0.78 -0.00 0.40 -1.65 0.00 0.00 177.43 176.99 1xmm h ILE 179 N 0.57 1.26 0.00 2.81 2.04 -1.18 -0.39 117.51 122.62 1xmm h ILE 179 Ca 0.10 -0.90 -0.08 0.00 1.00 0.00 0.00 64.86 64.97 1xmm h ILE 179 Cb 0.57 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 1xmm h ILE 179 CO 0.04 0.28 -0.40 -0.07 0.00 0.00 0.00 178.15 178.00 1xmm h LEU 180 N 0.21 0.00 -2.48 1.44 3.38 -0.96 -2.62 115.31 114.28 1xmm h LEU 180 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1xmm h LEU 180 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1xmm h LEU 180 CO 0.01 0.40 0.00 0.47 0.09 0.00 0.00 178.44 179.41 1xmm n ASP 181 N -3.62 3.64 -1.89 -0.43 8.00 -0.32 -4.97 116.55 116.96 1xmm n ASP 181 Ca -0.01 -2.00 -0.18 0.00 0.71 0.00 0.00 54.79 53.32 1xmm n ASP 181 Cb 0.50 -0.33 -0.03 0.00 -0.02 0.00 0.00 41.12 41.25 1xmm n ASP 181 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1xmm n LYS 182 N 1.55 -1.41 0.00 -1.24 4.76 -0.99 -4.88 118.16 115.96 1xmm n LYS 182 Ca 0.21 0.96 0.11 0.00 -2.87 0.00 0.00 58.31 56.72 1xmm n LYS 182 Cb 0.61 -5.41 0.06 0.00 -1.84 0.00 0.00 35.03 28.46 1xmm n LYS 182 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1xmm n LYS 183 N -2.68 0.05 -3.77 1.97 5.02 -0.22 -4.73 118.16 113.81 1xmm n LYS 183 Ca -0.21 -0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 55.95 1xmm n LYS 183 Cb 0.65 -1.52 -0.09 0.00 -0.02 0.00 0.00 35.03 34.05 1xmm n LYS 183 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xmm s ALA 184 N -3.04 -0.75 -1.76 7.82 0.00 -0.82 -4.96 121.76 118.25 1xmm s ALA 184 Ca 0.08 0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1xmm s ALA 184 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.26 1xmm s ALA 184 CO 0.79 -0.24 0.00 0.39 0.00 0.00 0.00 175.76 176.70 1xmm n GLU 185 N 1.56 -1.36 0.00 0.00 1.02 -1.26 -4.11 120.64 116.50 1xmm n GLU 185 Ca -0.20 1.02 -0.04 0.00 -0.02 0.00 0.00 57.16 57.92 1xmm n GLU 185 Cb 0.56 -5.41 0.18 0.00 -0.02 0.00 0.00 31.44 26.76 1xmm n GLU 185 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xmm h ALA 186 N 0.41 1.06 0.00 0.62 0.00 -1.91 -2.07 119.26 117.37 1xmm h ALA 186 Ca -0.40 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1xmm h ALA 186 Cb 1.25 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1xmm h ALA 186 CO 0.53 0.57 0.00 -0.40 0.00 0.00 0.00 179.25 179.95 1xmm n ASP 187 N -4.11 0.00 -0.00 0.00 5.68 -1.26 -3.03 116.55 113.83 1xmm n ASP 187 Ca -0.00 -1.41 0.07 0.00 -0.50 0.00 0.00 54.79 52.95 1xmm n ASP 187 Cb 0.41 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.31 1xmm n ASP 187 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1xmm n ARG 188 N -0.73 2.20 -1.67 0.11 1.74 -0.78 -4.99 116.66 112.54 1xmm n ARG 188 Ca 0.10 -0.02 -0.49 0.00 -0.77 0.00 0.00 57.85 56.67 1xmm n ARG 188 Cb 0.05 -1.17 -0.05 0.00 -1.02 0.00 0.00 32.46 30.26 1xmm n ARG 188 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1xmm n ILE 189 N -1.41 0.26 0.00 0.55 2.08 -1.17 -4.31 119.36 115.37 1xmm n ILE 189 Ca 0.02 -0.05 -0.13 0.00 0.56 0.00 0.00 62.75 63.15 1xmm n ILE 189 Cb 0.23 -1.54 -0.14 0.00 -0.75 0.00 0.00 39.64 37.44 1xmm n ILE 189 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 1xmm h VAL 190 N 4.49 0.87 -1.91 1.39 2.07 -1.29 -3.48 116.25 118.39 1xmm h VAL 190 Ca -0.47 -2.65 0.01 0.00 0.82 0.00 0.00 66.70 64.41 1xmm h VAL 190 Cb 1.28 2.51 -0.22 0.00 -1.52 0.00 0.00 31.29 33.34 1xmm h VAL 190 CO 0.91 0.67 0.15 0.12 0.02 0.00 0.00 177.57 179.43 1xmm s PHE 191 N -2.60 -0.85 -0.08 1.57 5.36 -1.18 -5.02 117.98 115.18 1xmm s PHE 191 Ca -0.10 1.85 0.04 0.00 -0.96 0.00 0.00 56.93 57.76 1xmm s PHE 191 Cb 0.08 0.44 0.00 0.00 -0.34 0.00 0.00 43.02 43.20 1xmm s PHE 191 CO 0.81 -0.42 -0.21 -2.00 -1.46 0.00 0.00 175.22 171.95 1xmm s GLU 192 N 1.00 2.59 -0.41 10.12 2.12 -1.26 -1.63 118.70 131.22 1xmm s GLU 192 Ca -0.05 -0.75 -0.12 0.00 0.36 0.00 0.00 54.97 54.41 1xmm s GLU 192 Cb -0.05 -2.02 0.05 0.00 0.26 0.00 0.00 34.13 32.37 1xmm s GLU 192 CO -0.10 0.17 0.27 1.21 -0.54 0.00 0.00 175.26 176.27 1xmm s ASN 193 N 0.33 5.82 0.00 -1.70 3.84 -0.79 -4.98 114.94 117.46 1xmm s ASN 193 Ca -0.15 -1.21 0.19 0.00 0.21 0.00 0.00 52.86 51.91 1xmm s ASN 193 Cb -0.17 -2.06 1.16 0.00 -0.55 0.00 0.00 41.25 39.63 1xmm s ASN 193 CO 0.07 -0.49 1.74 -0.81 -2.79 0.00 0.00 177.10 174.82 1xmm n PRO 194 N 5.03 1.00 -1.68 0.43 -0.04 -1.26 -0.89 135.00 137.59 1xmm n PRO 194 Ca -0.11 0.00 -0.47 0.00 -0.04 0.00 0.00 63.50 62.88 1xmm n PRO 194 Cb 0.45 -1.30 -0.04 0.00 -0.04 0.00 0.00 33.50 32.56 1xmm n PRO 194 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1xmm n ASP 195 N -0.80 3.51 -0.34 3.54 -0.08 -1.26 -4.87 116.55 116.25 1xmm n ASP 195 Ca 0.15 0.98 0.14 0.00 -1.51 0.00 0.00 54.79 54.54 1xmm n ASP 195 Cb 0.07 -1.40 0.35 0.00 2.34 0.00 0.00 41.12 42.47 1xmm n ASP 195 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1xmm h PRO 196 N 8.94 0.70 0.05 -0.67 0.11 -1.92 -1.12 132.00 138.08 1xmm h PRO 196 Ca -0.48 -0.04 -0.35 0.00 0.11 0.00 0.00 66.00 65.24 1xmm h PRO 196 Cb 1.26 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 1xmm h PRO 196 CO 0.94 0.46 -1.95 0.45 -0.21 0.00 0.00 178.00 177.69 1xmm n SER 197 N -4.72 2.01 -0.42 -2.05 2.88 -1.26 -1.68 113.62 108.37 1xmm n SER 197 Ca 0.23 0.22 0.04 0.00 -1.33 0.00 0.00 58.87 58.03 1xmm n SER 197 Cb 0.59 -0.81 0.09 0.00 -0.75 0.00 0.00 64.21 63.33 1xmm n SER 197 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1xmm n ASP 198 N -3.80 2.45 -4.98 -3.46 8.00 -1.23 -4.56 116.55 108.97 1xmm n ASP 198 Ca -0.37 -1.87 -0.20 0.00 0.71 0.00 0.00 54.79 53.06 1xmm n ASP 198 Cb 0.92 -0.13 0.02 0.00 -0.02 0.00 0.00 41.12 41.91 1xmm n ASP 198 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1xmm s GLY 199 N -0.93 1.95 0.34 0.44 0.00 -0.42 -4.48 107.32 104.21 1xmm s GLY 199 Ca 0.15 -1.84 -0.18 0.00 0.00 0.00 0.00 44.72 42.85 1xmm s GLY 199 CO 0.11 -1.69 0.81 -0.11 0.00 0.00 0.00 173.10 172.22 1xmm s PHE 200 N -2.58 0.05 -0.11 1.90 -0.12 -0.07 -2.14 117.98 114.90 1xmm s PHE 200 Ca 0.53 -0.64 0.01 0.00 -0.05 0.00 0.00 56.93 56.78 1xmm s PHE 200 Cb -0.06 0.80 0.02 0.00 -0.63 0.00 0.00 43.02 43.15 1xmm s PHE 200 CO 0.33 -1.42 -0.11 0.08 -0.05 0.00 0.00 175.22 174.05 1xmm s VAL 201 N -2.63 1.25 -0.33 -2.49 1.01 0.39 -1.89 120.40 115.71 1xmm s VAL 201 Ca 0.15 -0.46 -0.13 0.00 0.00 0.00 0.00 61.98 61.54 1xmm s VAL 201 Cb -0.05 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.11 1xmm s VAL 201 CO 0.10 0.40 0.24 -0.22 0.00 0.00 0.00 175.10 175.61 1xmm s LEU 202 N 1.36 4.44 0.20 3.92 2.96 -0.64 -0.76 118.68 130.15 1xmm s LEU 202 Ca -0.00 -0.35 0.09 0.00 -0.22 0.00 0.00 54.13 53.65 1xmm s LEU 202 Cb -0.14 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.37 1xmm s LEU 202 CO -0.06 -0.21 -0.17 0.27 -1.32 0.00 0.00 176.35 174.87 1xmm s ILE 203 N 1.74 1.88 0.19 6.68 -0.00 -0.58 -0.70 121.20 130.41 1xmm s ILE 203 Ca 0.06 -2.11 -0.33 0.00 -0.00 0.00 0.00 60.65 58.27 1xmm s ILE 203 Cb -0.17 -1.99 -0.14 0.00 -0.00 0.00 0.00 42.46 40.16 1xmm s ILE 203 CO 0.11 -0.45 1.49 -2.65 -0.00 0.00 0.00 174.94 173.44 1xmm n PRO 204 N -0.12 2.04 -1.67 0.37 -0.02 -1.26 -1.12 135.00 133.22 1xmm n PRO 204 Ca -0.10 0.73 -0.35 0.00 -2.02 0.00 0.00 63.50 61.77 1xmm n PRO 204 Cb 0.59 -2.45 0.07 0.00 -0.02 0.00 0.00 33.50 31.69 1xmm n PRO 204 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1xmm s ASP 205 N 0.62 4.67 0.44 2.55 -1.08 0.11 -4.73 116.67 119.25 1xmm s ASP 205 Ca 0.75 2.30 0.13 0.00 -0.52 0.00 0.00 52.55 55.20 1xmm s ASP 205 Cb -0.68 -2.58 1.02 0.00 -1.46 0.00 0.00 42.92 39.21 1xmm s ASP 205 CO 0.43 -1.94 2.02 0.25 0.52 0.00 0.00 175.17 176.45 1xmm h LEU 206 N 0.12 0.35 -1.56 -1.34 6.46 -1.92 -2.73 115.31 114.67 1xmm h LEU 206 Ca -0.48 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.28 1xmm h LEU 206 Cb 1.29 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 41.14 1xmm h LEU 206 CO 0.52 0.22 0.00 0.11 -0.62 0.00 0.00 178.44 178.68 1xmm h LYS 207 N 0.39 0.00 -5.42 1.25 1.57 -1.92 -3.44 116.57 109.01 1xmm h LYS 207 Ca 0.22 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.39 1xmm h LYS 207 Cb 0.35 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.54 1xmm h LYS 207 CO -0.05 0.00 -0.20 -0.46 -0.57 0.00 0.00 179.45 178.17 1xmm s TRP 208 N -3.70 3.37 -2.14 -1.35 -0.00 -1.03 -4.96 118.94 109.13 1xmm s TRP 208 Ca 0.01 0.61 0.17 0.00 -0.00 0.00 0.00 56.10 56.89 1xmm s TRP 208 Cb 0.09 -2.53 0.76 0.00 -0.00 0.00 0.00 33.47 31.79 1xmm s TRP 208 CO 0.53 -0.02 1.53 0.27 -0.00 0.00 0.00 176.95 179.26 1xmm n ASN 209 N 4.50 1.02 -0.68 5.86 6.94 -1.26 -4.87 115.26 126.77 1xmm n ASN 209 Ca -0.08 -1.67 -0.09 0.00 -0.02 0.00 0.00 54.58 52.72 1xmm n ASN 209 Cb 0.51 -0.08 -0.04 0.00 -2.36 0.00 0.00 39.78 37.81 1xmm n ASN 209 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1xmm n GLN 210 N -0.08 -1.32 0.06 -3.83 6.02 -1.26 -4.86 117.38 112.12 1xmm n GLN 210 Ca 0.14 0.76 0.11 0.00 -0.01 0.00 0.00 57.00 58.01 1xmm n GLN 210 Cb 0.22 -4.94 0.03 0.00 1.02 0.00 0.00 30.24 26.56 1xmm n GLN 210 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1xmm n GLN 211 N -1.33 0.46 -3.54 -1.09 1.13 -1.26 -4.96 117.38 106.79 1xmm n GLN 211 Ca -0.09 0.05 -0.11 0.00 -1.94 0.00 0.00 57.00 54.91 1xmm n GLN 211 Cb 0.47 -1.71 -0.04 0.00 0.11 0.00 0.00 30.24 29.07 1xmm n GLN 211 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 1xmm s GLN 212 N -3.29 1.15 0.00 -1.09 0.00 -1.26 -5.06 119.66 110.12 1xmm s GLN 212 Ca 0.01 -0.59 0.26 0.00 -0.00 0.00 0.00 55.36 55.04 1xmm s GLN 212 Cb 0.12 0.52 0.61 0.00 0.00 0.00 0.00 33.01 34.26 1xmm s GLN 212 CO 0.79 -0.47 1.49 1.28 0.00 0.00 0.00 175.29 178.38 1xmm n LEU 213 N -0.26 0.43 0.08 2.60 4.77 -1.26 -4.16 117.00 119.20 1xmm n LEU 213 Ca -0.17 0.08 0.03 0.00 -0.03 0.00 0.00 56.01 55.93 1xmm n LEU 213 Cb 0.64 -0.29 0.40 0.00 -2.33 0.00 0.00 43.42 41.85 1xmm n LEU 213 CO 0.15 0.10 0.99 0.44 -1.33 0.00 0.00 177.39 177.74 1xmm h ASP 214 N 0.00 0.32 -0.55 -1.43 3.32 -1.98 -2.58 116.42 113.53 1xmm h ASP 214 Ca 0.00 -0.04 -0.39 0.00 0.02 0.00 0.00 57.03 56.61 1xmm h ASP 214 Cb 0.51 -0.08 -0.29 0.00 0.22 0.00 0.00 39.33 39.68 1xmm h ASP 214 CO 0.00 0.37 -0.58 -0.90 -1.72 0.00 0.00 179.24 176.41 1xmm n ASP 215 N -4.35 4.10 -4.63 6.45 3.85 -1.26 -4.06 116.55 116.64 1xmm n ASP 215 Ca 0.00 -3.80 -0.53 0.00 -0.71 0.00 0.00 54.79 49.76 1xmm n ASP 215 Cb 0.19 -0.45 -0.06 0.00 -1.35 0.00 0.00 41.12 39.45 1xmm n ASP 215 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 1xmm n LEU 216 N -0.86 2.06 -3.55 -2.12 0.00 -0.97 -4.78 117.00 106.78 1xmm n LEU 216 Ca 0.38 1.10 -0.20 0.00 0.00 0.00 0.00 56.01 57.29 1xmm n LEU 216 Cb 0.89 -1.21 -0.14 0.00 0.00 0.00 0.00 43.42 42.96 1xmm n LEU 216 CO 0.30 -0.77 -0.24 -0.47 0.00 0.00 0.00 177.39 176.21 1xmm s TYR 217 N 1.51 -0.15 0.19 1.96 6.04 -1.25 -0.99 117.35 124.65 1xmm s TYR 217 Ca 0.88 0.17 0.09 0.00 0.04 0.00 0.00 57.07 58.24 1xmm s TYR 217 Cb -0.95 -0.42 -0.04 0.00 -1.04 0.00 0.00 41.96 39.51 1xmm s TYR 217 CO 0.51 -0.52 -0.17 -0.51 -1.54 0.00 0.00 175.55 173.32 1xmm s LEU 218 N 2.28 2.50 -0.01 6.97 1.02 0.36 -0.71 118.68 131.09 1xmm s LEU 218 Ca 0.05 -0.93 0.06 0.00 0.02 0.00 0.00 54.13 53.32 1xmm s LEU 218 Cb -0.15 -0.81 -0.02 0.00 0.02 0.00 0.00 46.19 45.24 1xmm s LEU 218 CO -0.10 -0.07 -0.18 -0.51 0.02 0.00 0.00 176.35 175.50 1xmm s ILE 219 N -2.41 1.43 -0.24 -0.59 1.10 -0.28 -0.32 121.20 119.88 1xmm s ILE 219 Ca 0.20 -0.82 -0.06 0.00 -0.51 0.00 0.00 60.65 59.45 1xmm s ILE 219 Cb -0.04 -1.20 -0.02 0.00 0.15 0.00 0.00 42.46 41.35 1xmm s ILE 219 CO 0.08 0.37 0.04 0.00 -2.11 0.00 0.00 174.94 173.31 1xmm s ALA 220 N -0.48 3.06 -0.25 1.50 0.00 -0.01 -1.53 121.76 124.06 1xmm s ALA 220 Ca 0.07 -1.15 -0.06 0.00 0.00 0.00 0.00 51.96 50.81 1xmm s ALA 220 Cb -0.07 -1.98 -0.02 0.00 0.00 0.00 0.00 23.12 21.05 1xmm s ALA 220 CO -0.00 -0.49 0.04 0.42 0.00 0.00 0.00 175.76 175.73 1xmm s ILE 221 N 1.57 4.04 0.56 0.00 -1.09 0.06 -0.74 121.20 125.60 1xmm s ILE 221 Ca 0.06 -0.31 -0.20 0.00 -2.23 0.00 0.00 60.65 57.97 1xmm s ILE 221 Cb -0.15 -2.90 -0.05 0.00 -1.58 0.00 0.00 42.46 37.78 1xmm s ILE 221 CO 0.02 0.33 1.19 0.00 -1.23 0.00 0.00 174.94 175.24 1xmm h HIS 223 N 1.19 1.03 -2.71 0.00 3.86 -1.67 -3.45 115.15 113.40 1xmm h HIS 223 Ca -0.50 -0.48 -0.52 0.00 -1.16 0.00 0.00 60.37 57.71 1xmm h HIS 223 Cb 1.28 -0.15 0.06 0.00 1.06 0.00 0.00 27.41 29.66 1xmm h HIS 223 CO 0.49 1.31 1.01 -2.13 0.86 0.00 0.00 177.93 179.46 1xmm n ARG 224 N -3.91 2.79 -3.26 2.45 0.63 -0.68 -4.99 116.66 109.69 1xmm n ARG 224 Ca -0.08 1.00 -0.28 0.00 -0.92 0.00 0.00 57.85 57.58 1xmm n ARG 224 Cb 0.77 -2.85 -0.03 0.00 0.45 0.00 0.00 32.46 30.81 1xmm n ARG 224 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1xmm s ARG 225 N 1.02 3.61 0.00 -0.14 0.52 -1.26 -4.53 118.95 118.17 1xmm s ARG 225 Ca 0.74 -0.01 0.00 0.00 -0.52 0.00 0.00 55.73 55.94 1xmm s ARG 225 Cb -0.50 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.36 1xmm s ARG 225 CO 0.34 0.15 0.00 0.41 0.02 0.00 0.00 175.30 176.22 1xmm n GLY 226 N -1.20 0.81 3.37 -3.53 0.00 -1.26 -5.02 105.19 98.37 1xmm n GLY 226 Ca -0.02 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.55 1xmm n GLY 226 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xmm s ILE 227 N -2.13 5.38 0.16 -0.61 1.01 -1.26 -4.91 121.20 118.83 1xmm s ILE 227 Ca 0.00 -2.37 -0.12 0.00 0.00 0.00 0.00 60.65 58.16 1xmm s ILE 227 Cb 0.00 -4.61 0.05 0.00 0.01 0.00 0.00 42.46 37.91 1xmm s ILE 227 CO 0.00 -1.23 1.67 0.03 0.00 0.00 0.00 174.94 175.42 1xmm h ARG 228 N 7.87 0.89 0.00 2.79 3.08 -1.95 0.12 114.38 127.18 1xmm h ARG 228 Ca 0.15 -0.21 0.08 0.00 0.07 0.00 0.00 59.98 60.07 1xmm h ARG 228 Cb 1.00 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 1xmm h ARG 228 CO 0.92 0.83 0.40 -1.13 -1.07 0.00 0.00 179.97 179.92 1xmm n SER 229 N -4.40 -1.51 -0.18 7.04 3.41 -1.26 -3.54 113.62 113.17 1xmm n SER 229 Ca 0.02 -1.88 0.07 0.00 -0.26 0.00 0.00 58.87 56.82 1xmm n SER 229 Cb 0.23 2.48 0.13 0.00 -0.26 0.00 0.00 64.21 66.80 1xmm n SER 229 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1xmm n LEU 230 N 0.00 -0.09 0.29 1.04 7.94 -1.26 -1.62 117.00 123.30 1xmm n LEU 230 Ca -0.03 0.88 0.18 0.00 -1.11 0.00 0.00 56.01 55.93 1xmm n LEU 230 Cb 0.47 -0.31 0.82 0.00 0.53 0.00 0.00 43.42 44.93 1xmm n LEU 230 CO 0.18 -0.88 1.04 0.03 -1.11 0.00 0.00 177.39 176.65 1xmm h ARG 231 N 0.00 0.00 -0.00 1.96 3.08 -1.96 -1.17 114.38 116.29 1xmm h ARG 231 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1xmm h ARG 231 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1xmm h ARG 231 CO -0.50 0.02 -0.06 -0.25 -1.07 0.00 0.00 179.97 178.11 1xmm n ASP 232 N -3.15 0.22 -4.71 7.04 8.00 -0.64 -4.45 116.55 118.85 1xmm n ASP 232 Ca -0.01 -0.32 -0.42 0.00 0.71 0.00 0.00 54.79 54.76 1xmm n ASP 232 Cb 0.24 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.13 1xmm n ASP 232 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xmm s LEU 233 N -2.55 4.36 0.39 0.64 1.43 -0.44 -5.03 118.68 117.47 1xmm s LEU 233 Ca 0.28 1.68 0.04 0.00 -1.03 0.00 0.00 54.13 55.10 1xmm s LEU 233 Cb 0.20 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.82 1xmm s LEU 233 CO 0.48 -0.30 0.14 0.42 0.23 0.00 0.00 176.35 177.32 1xmm s THR 234 N 1.11 0.57 0.59 5.49 -4.23 -1.26 -4.60 115.64 113.31 1xmm s THR 234 Ca 0.52 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 59.33 1xmm s THR 234 Cb -0.22 -2.40 0.35 0.00 1.34 0.00 0.00 72.50 71.58 1xmm s THR 234 CO 0.27 0.00 2.23 -0.65 -0.54 0.00 0.00 174.62 175.93 1xmm h PRO 235 N 1.86 0.00 0.00 3.99 0.11 -1.86 -2.12 132.00 133.98 1xmm h PRO 235 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1xmm h PRO 235 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1xmm h PRO 235 CO 0.56 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.40 1xmm h GLU 236 N 0.00 0.00 -0.01 1.05 4.11 -1.97 -2.23 114.58 115.53 1xmm h GLU 236 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1xmm h GLU 236 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1xmm h GLU 236 CO -0.00 0.00 0.00 0.72 0.07 0.00 0.00 179.01 179.80 1xmm n HIS 237 N -2.56 0.01 -0.07 2.06 8.25 -0.80 -4.38 115.22 117.72 1xmm n HIS 237 Ca 0.02 -0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.36 1xmm n HIS 237 Cb 0.28 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.34 1xmm n HIS 237 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1xmm h LEU 238 N 0.99 0.41 -0.73 2.41 3.38 -1.53 -1.59 115.31 118.65 1xmm h LEU 238 Ca 0.00 -0.35 0.09 0.00 0.09 0.00 0.00 57.88 57.71 1xmm h LEU 238 Cb 0.21 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 1xmm h LEU 238 CO 0.00 0.66 0.38 -0.65 0.09 0.00 0.00 178.44 178.92 1xmm h PRO 239 N 0.15 0.63 -0.21 1.13 0.11 -1.81 -1.21 132.00 130.80 1xmm h PRO 239 Ca 0.06 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.15 1xmm h PRO 239 Cb 0.47 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 1xmm h PRO 239 CO 0.02 0.42 0.09 1.25 -0.21 0.00 0.00 178.00 179.57 1xmm h LEU 240 N 0.65 0.12 -1.23 2.35 5.85 -1.75 -2.41 115.31 118.90 1xmm h LEU 240 Ca 0.35 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 59.01 1xmm h LEU 240 Cb 0.34 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1xmm h LEU 240 CO -0.25 0.10 -0.38 -0.07 -0.34 0.00 0.00 178.44 177.50 1xmm h LEU 241 N 0.20 0.00 -0.05 2.25 3.38 -0.75 -1.57 115.31 118.78 1xmm h LEU 241 Ca 0.09 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.84 1xmm h LEU 241 Cb 0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.80 1xmm h LEU 241 CO -0.07 0.38 -0.80 0.03 0.09 0.00 0.00 178.44 178.07 1xmm h ARG 242 N 0.00 0.62 -0.33 1.13 3.08 -1.19 -1.74 114.38 115.96 1xmm h ARG 242 Ca -0.00 -0.61 0.05 0.00 0.07 0.00 0.00 59.98 59.49 1xmm h ARG 242 Cb 0.70 0.16 -0.05 0.00 0.08 0.00 0.00 29.97 30.86 1xmm h ARG 242 CO 0.05 1.22 0.03 -0.91 -1.07 0.00 0.00 179.97 179.29 1xmm h ASN 243 N 0.26 -0.06 -0.24 7.04 2.35 -1.06 0.35 115.58 124.23 1xmm h ASN 243 Ca -0.09 0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1xmm h ASN 243 Cb 1.46 0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.92 1xmm h ASN 243 CO 0.16 0.01 0.15 0.40 -1.65 0.00 0.00 177.43 176.49 1xmm h ILE 244 N 0.14 1.08 0.55 2.81 2.04 -1.24 0.19 117.51 123.08 1xmm h ILE 244 Ca 0.16 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 1xmm h ILE 244 Cb 0.19 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1xmm h ILE 244 CO -0.23 0.08 -0.46 0.25 0.00 0.00 0.00 178.15 177.79 1xmm h LEU 245 N 0.30 -1.21 0.02 1.44 5.85 -1.00 -1.46 115.31 119.25 1xmm h LEU 245 Ca 0.09 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1xmm h LEU 245 Cb 0.00 0.39 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1xmm h LEU 245 CO -0.02 -0.65 -0.01 0.45 -0.34 0.00 0.00 178.44 177.88 1xmm h HIS 246 N -0.99 -0.03 -0.93 1.25 3.86 -0.20 -2.51 115.15 115.60 1xmm h HIS 246 Ca -0.07 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.13 1xmm h HIS 246 Cb 0.84 0.01 -0.04 0.00 1.06 0.00 0.00 27.41 29.28 1xmm h HIS 246 CO -0.19 0.39 0.54 1.96 0.86 0.00 0.00 177.93 181.49 1xmm h GLN 247 N -0.99 1.28 -0.09 2.45 4.20 -1.13 -1.47 115.11 119.36 1xmm h GLN 247 Ca -0.00 -0.13 0.03 0.00 0.06 0.00 0.00 58.65 58.61 1xmm h GLN 247 Cb 0.43 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 1xmm h GLN 247 CO 0.01 0.91 -0.09 0.78 -0.67 0.00 0.00 178.83 179.76 1xmm h GLY 248 N 1.30 -0.03 0.81 3.46 0.00 -1.15 -0.23 103.07 107.22 1xmm h GLY 248 Ca 0.33 0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.77 1xmm h GLY 248 CO -0.06 -0.10 -0.01 1.46 0.00 0.00 0.00 176.54 177.83 1xmm h GLN 249 N -0.12 -0.02 -0.17 4.80 4.20 -1.20 -2.44 115.11 120.16 1xmm h GLN 249 Ca 0.07 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.80 1xmm h GLN 249 Cb 0.21 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1xmm h GLN 249 CO -0.16 0.17 0.11 0.93 -0.67 0.00 0.00 178.83 179.22 1xmm h GLU 250 N -0.21 0.14 -0.32 1.46 3.07 -1.19 0.34 114.58 117.87 1xmm h GLU 250 Ca -0.00 -0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 58.75 1xmm h GLU 250 Cb 0.20 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.07 1xmm h GLU 250 CO 0.00 0.09 -0.20 0.00 -1.40 0.00 0.00 179.01 177.50 1xmm h ALA 251 N 1.91 0.45 0.00 3.43 0.00 -0.84 -0.97 119.26 123.24 1xmm h ALA 251 Ca 0.07 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 1xmm h ALA 251 Cb 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1xmm h ALA 251 CO -0.01 0.40 -0.33 0.82 0.00 0.00 0.00 179.25 180.13 1xmm h ILE 252 N 0.46 1.06 -0.38 0.00 2.04 -0.80 -0.10 117.51 119.79 1xmm h ILE 252 Ca 0.07 -1.19 -0.16 0.00 1.00 0.00 0.00 64.86 64.58 1xmm h ILE 252 Cb 0.75 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 1xmm h ILE 252 CO 0.06 0.32 -0.38 0.25 0.00 0.00 0.00 178.15 178.40 1xmm h LEU 253 N 0.00 0.99 0.22 1.44 5.85 -0.73 -2.02 115.31 121.06 1xmm h LEU 253 Ca -0.00 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 1xmm h LEU 253 Cb 0.65 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.40 1xmm h LEU 253 CO 0.04 1.25 -0.10 -0.61 -0.34 0.00 0.00 178.44 178.68 1xmm h GLN 254 N 0.75 -0.28 -0.07 1.25 5.75 -0.78 -2.10 115.11 119.63 1xmm h GLN 254 Ca 0.06 0.02 -0.18 0.00 -0.15 0.00 0.00 58.65 58.40 1xmm h GLN 254 Cb 0.97 0.06 0.01 0.00 1.07 0.00 0.00 27.48 29.60 1xmm h GLN 254 CO 0.09 0.04 -0.66 -0.09 -2.65 0.00 0.00 178.83 175.55 1xmm h ARG 255 N -0.62 0.57 -0.01 1.69 9.65 -1.06 -3.36 114.38 121.24 1xmm h ARG 255 Ca -0.03 -0.52 0.00 0.00 -1.10 0.00 0.00 59.98 58.33 1xmm h ARG 255 Cb 0.45 0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 1xmm h ARG 255 CO 0.05 1.15 -0.02 0.66 2.80 0.00 0.00 179.97 184.61 1xmm n TYR 256 N -4.12 0.00 -2.51 2.20 4.02 -0.77 -5.00 117.16 110.98 1xmm n TYR 256 Ca -0.09 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.59 1xmm n TYR 256 Cb 0.69 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 40.01 1xmm n TYR 256 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1xmm n ARG 257 N 0.15 -2.27 -4.23 -0.72 1.74 -0.79 -4.98 116.66 105.55 1xmm n ARG 257 Ca 0.03 0.98 -0.34 0.00 -0.77 0.00 0.00 57.85 57.74 1xmm n ARG 257 Cb 0.11 -5.66 -0.12 0.00 -1.02 0.00 0.00 32.46 25.78 1xmm n ARG 257 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1xmm s MET 258 N -5.15 3.72 0.67 5.56 1.75 -1.22 -4.99 119.30 119.64 1xmm s MET 258 Ca 0.06 -0.48 -0.11 0.00 -1.25 0.00 0.00 55.69 53.90 1xmm s MET 258 Cb -0.03 -3.02 -0.01 0.00 2.84 0.00 0.00 34.83 34.61 1xmm s MET 258 CO 0.07 0.19 1.06 0.15 -0.65 0.00 0.00 175.02 175.85 1xmm s LYS 259 N 0.53 3.20 0.47 4.11 1.02 -1.26 -3.51 119.74 124.30 1xmm s LYS 259 Ca -0.01 0.62 0.14 0.00 0.02 0.00 0.00 55.97 56.74 1xmm s LYS 259 Cb -0.14 -2.05 1.10 0.00 -0.52 0.00 0.00 37.83 36.23 1xmm s LYS 259 CO 0.02 -0.83 2.06 0.78 -0.92 0.00 0.00 175.35 176.46 1xmm h GLY 260 N -0.51 0.04 0.59 -3.33 0.00 -1.96 -0.86 103.07 97.04 1xmm h GLY 260 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1xmm h GLY 260 CO 0.63 0.02 0.00 2.09 0.00 0.00 0.00 176.54 179.28 1xmm n ASP 261 N -4.43 0.09 -1.39 0.19 5.75 -1.26 -2.12 116.55 113.37 1xmm n ASP 261 Ca -0.02 -1.35 0.10 0.00 -0.01 0.00 0.00 54.79 53.51 1xmm n ASP 261 Cb 0.17 -0.00 0.32 0.00 -1.03 0.00 0.00 41.12 40.58 1xmm n ASP 261 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1xmm n HIS 262 N -0.77 1.13 -4.88 2.11 8.25 -0.33 -4.96 115.22 115.77 1xmm n HIS 262 Ca 0.16 -0.51 -0.26 0.00 -0.26 0.00 0.00 57.72 56.85 1xmm n HIS 262 Cb 0.09 -0.09 -0.16 0.00 1.12 0.00 0.00 29.99 30.95 1xmm n HIS 262 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1xmm s LEU 263 N -1.30 1.96 -0.36 2.41 1.43 -0.90 -0.67 118.68 121.25 1xmm s LEU 263 Ca 0.48 -0.36 -0.12 0.00 -1.03 0.00 0.00 54.13 53.09 1xmm s LEU 263 Cb 0.27 -1.00 0.00 0.00 0.03 0.00 0.00 46.19 45.49 1xmm s LEU 263 CO 0.29 0.18 0.23 -0.60 0.23 0.00 0.00 176.35 176.68 1xmm s ARG 264 N -0.09 3.23 -0.20 1.70 3.52 -0.45 -4.81 118.95 121.85 1xmm s ARG 264 Ca -0.01 -0.82 -0.02 0.00 -0.13 0.00 0.00 55.73 54.75 1xmm s ARG 264 Cb -0.11 -3.78 -0.00 0.00 -1.56 0.00 0.00 34.95 29.50 1xmm s ARG 264 CO 0.02 -0.55 -0.09 0.08 -0.81 0.00 0.00 175.30 173.94 1xmm s VAL 265 N 1.66 2.98 0.13 7.11 1.01 -1.26 -1.51 120.40 130.52 1xmm s VAL 265 Ca 0.05 -0.63 -0.24 0.00 0.00 0.00 0.00 61.98 61.15 1xmm s VAL 265 Cb -0.18 -2.33 0.07 0.00 0.00 0.00 0.00 36.38 33.95 1xmm s VAL 265 CO 0.09 0.46 0.72 -0.72 0.00 0.00 0.00 175.10 175.65 1xmm s TYR 266 N 1.35 -0.42 0.12 5.22 -0.85 -0.30 -1.71 117.35 120.75 1xmm s TYR 266 Ca 0.04 0.20 0.05 0.00 -0.52 0.00 0.00 57.07 56.84 1xmm s TYR 266 Cb -0.14 0.58 -0.04 0.00 0.38 0.00 0.00 41.96 42.74 1xmm s TYR 266 CO -0.05 -0.81 0.07 -0.51 -1.52 0.00 0.00 175.55 172.72 1xmm s LEU 267 N -2.71 3.67 0.03 -3.49 1.43 -0.40 0.32 118.68 117.53 1xmm s LEU 267 Ca 0.04 -0.13 -0.21 0.00 -1.03 0.00 0.00 54.13 52.80 1xmm s LEU 267 Cb -0.02 -2.34 -0.06 0.00 0.03 0.00 0.00 46.19 43.81 1xmm s LEU 267 CO -0.09 0.13 0.62 -1.00 0.23 0.00 0.00 176.35 176.24 1xmm s HIS 268 N -1.51 3.73 -0.08 0.29 3.76 -1.26 -0.93 115.29 119.29 1xmm s HIS 268 Ca 0.29 1.27 0.03 0.00 -0.15 0.00 0.00 55.06 56.50 1xmm s HIS 268 Cb -0.11 -2.62 -0.02 0.00 1.11 0.00 0.00 32.58 30.94 1xmm s HIS 268 CO 0.21 0.41 -0.16 -0.47 -0.85 0.00 0.00 174.74 173.88 1xmm s TYR 269 N -0.44 2.69 -0.35 1.40 5.04 -0.15 -3.74 117.35 121.80 1xmm s TYR 269 Ca 0.32 -0.43 -0.13 0.00 -2.44 0.00 0.00 57.07 54.39 1xmm s TYR 269 Cb -0.19 -1.70 0.02 0.00 0.35 0.00 0.00 41.96 40.44 1xmm s TYR 269 CO 0.19 -0.02 0.36 1.28 -1.34 0.00 0.00 175.55 176.02 1xmm n LEU 270 N 2.84 -6.75 -4.87 6.97 7.99 -1.26 -4.80 117.00 117.13 1xmm n LEU 270 Ca -0.18 0.70 -0.31 0.00 -0.01 0.00 0.00 56.01 56.22 1xmm n LEU 270 Cb 0.52 -2.94 -0.00 0.00 -0.11 0.00 0.00 43.42 40.89 1xmm n LEU 270 CO 0.27 -2.19 0.68 -2.16 -1.51 0.00 0.00 177.39 172.48 1xmm s PRO 271 N -2.12 3.69 0.30 3.23 0.04 -1.25 -5.00 135.00 133.89 1xmm s PRO 271 Ca 0.17 0.75 0.15 0.00 0.04 0.00 0.00 61.00 62.12 1xmm s PRO 271 Cb -0.04 -2.12 0.33 0.00 0.04 0.00 0.00 34.50 32.71 1xmm s PRO 271 CO 0.71 -0.45 1.57 0.77 0.04 0.00 0.00 177.00 179.64 1xmm h SER 272 N 0.08 0.00 -3.67 6.66 0.02 -1.97 -3.44 113.55 111.22 1xmm h SER 272 Ca -0.45 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 59.98 1xmm h SER 272 Cb 1.19 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 63.41 1xmm h SER 272 CO 0.62 0.52 -0.82 -0.31 -1.14 0.00 0.00 176.83 175.70 1xmm s TYR 273 N -3.27 1.51 -0.99 3.45 1.51 -1.26 -4.59 117.35 113.70 1xmm s TYR 273 Ca 0.01 -0.48 -0.02 0.00 -1.01 0.00 0.00 57.07 55.57 1xmm s TYR 273 Cb 0.10 -1.06 0.28 0.00 -0.11 0.00 0.00 41.96 41.17 1xmm s TYR 273 CO 0.73 -0.21 2.02 0.66 -1.11 0.00 0.00 175.55 177.64 1xmm n TYR 274 N 3.45 2.72 -3.67 2.71 4.02 -1.26 -4.78 117.16 120.35 1xmm n TYR 274 Ca -0.20 -2.50 -0.16 0.00 -0.01 0.00 0.00 57.90 55.02 1xmm n TYR 274 Cb 0.53 -1.30 -0.15 0.00 -0.02 0.00 0.00 39.34 38.39 1xmm n TYR 274 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1xmm s HIS 275 N -3.66 -0.19 0.16 -0.72 2.46 -1.23 -4.25 115.29 107.85 1xmm s HIS 275 Ca 0.45 0.63 -0.34 0.00 0.47 0.00 0.00 55.06 56.28 1xmm s HIS 275 Cb 0.26 -0.24 -0.14 0.00 -0.13 0.00 0.00 32.58 32.33 1xmm s HIS 275 CO -0.20 -0.27 1.53 -0.11 -2.47 0.00 0.00 174.74 173.21 1xmm n LEU 276 N 5.28 2.93 -3.68 8.88 7.94 0.43 -4.91 117.00 133.87 1xmm n LEU 276 Ca -0.06 1.10 -0.14 0.00 -1.11 0.00 0.00 56.01 55.80 1xmm n LEU 276 Cb 0.50 -1.40 -0.08 0.00 0.53 0.00 0.00 43.42 42.97 1xmm n LEU 276 CO 0.05 -0.40 0.18 -1.38 -1.11 0.00 0.00 177.39 174.73 1xmm s HIS 277 N 0.72 -0.44 -0.13 1.96 -3.43 -1.26 -2.69 115.29 110.02 1xmm s HIS 277 Ca 0.78 0.91 -0.03 0.00 -0.80 0.00 0.00 55.06 55.92 1xmm s HIS 277 Cb -0.70 0.20 -0.03 0.00 -1.43 0.00 0.00 32.58 30.62 1xmm s HIS 277 CO 0.40 -0.38 -0.01 0.08 -2.00 0.00 0.00 174.74 172.83 1xmm s VAL 278 N -0.62 4.20 -0.03 -5.38 1.01 0.08 -4.67 120.40 115.00 1xmm s VAL 278 Ca -0.07 -0.27 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 1xmm s VAL 278 Cb -0.03 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1xmm s VAL 278 CO 0.04 0.54 0.68 -1.00 0.00 0.00 0.00 175.10 175.36 1xmm s HIS 279 N -0.23 3.63 -0.27 5.22 3.76 0.15 -0.83 115.29 126.73 1xmm s HIS 279 Ca 0.05 1.27 0.02 0.00 -0.15 0.00 0.00 55.06 56.25 1xmm s HIS 279 Cb -0.12 -2.75 0.06 0.00 1.11 0.00 0.00 32.58 30.87 1xmm s HIS 279 CO 0.02 0.19 -0.09 -0.06 -0.85 0.00 0.00 174.74 173.95 1xmm s PHE 280 N 0.39 3.25 0.32 1.40 0.40 0.56 -1.15 117.98 123.15 1xmm s PHE 280 Ca 0.36 -2.21 0.10 0.00 -0.60 0.00 0.00 56.93 54.58 1xmm s PHE 280 Cb -0.18 -1.97 -0.06 0.00 0.51 0.00 0.00 43.02 41.32 1xmm s PHE 280 CO 0.19 -0.86 -0.10 0.95 0.70 0.00 0.00 175.22 176.10 1xmm s THR 281 N 1.14 2.49 0.40 0.64 -4.23 -0.57 -0.48 115.64 115.03 1xmm s THR 281 Ca -0.08 -2.20 -0.26 0.00 -1.18 0.00 0.00 61.69 57.98 1xmm s THR 281 Cb -0.20 -2.59 -0.09 0.00 1.34 0.00 0.00 72.50 70.97 1xmm s THR 281 CO -0.04 -0.28 1.25 0.00 -0.54 0.00 0.00 174.62 175.01 1xmm s ALA 282 N -2.54 3.24 0.21 3.99 0.00 -0.16 -1.34 121.76 125.16 1xmm s ALA 282 Ca 0.32 1.14 0.01 0.00 0.00 0.00 0.00 51.96 53.43 1xmm s ALA 282 Cb -0.01 -3.45 0.17 0.00 0.00 0.00 0.00 23.12 19.84 1xmm s ALA 282 CO 0.17 -0.70 1.52 1.25 0.00 0.00 0.00 175.76 178.00 1xmm h LEU 283 N 2.73 0.41 -0.58 0.00 5.85 -1.21 -2.24 115.31 120.28 1xmm h LEU 283 Ca -0.49 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 57.99 1xmm h LEU 283 Cb 1.24 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1xmm h LEU 283 CO 0.63 0.92 0.00 0.61 -0.34 0.00 0.00 178.44 180.26 1xmm n GLY 284 N 0.32 -1.17 3.51 3.75 0.00 -1.26 -4.57 105.19 105.77 1xmm n GLY 284 Ca -0.03 0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1xmm n GLY 284 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xmm s PHE 285 N -3.26 2.97 -1.21 1.61 5.99 -0.84 -4.97 117.98 118.27 1xmm s PHE 285 Ca 0.04 -0.09 -0.17 0.00 0.00 0.00 0.00 56.93 56.71 1xmm s PHE 285 Cb 0.09 -3.67 0.10 0.00 0.00 0.00 0.00 43.02 39.55 1xmm s PHE 285 CO 0.34 -1.06 1.56 -1.21 -0.00 0.00 0.00 175.22 174.85 1xmm s GLU 286 N 3.20 3.95 0.35 10.12 0.41 -1.26 -4.77 118.70 130.69 1xmm s GLU 286 Ca 0.25 -2.07 -0.23 0.00 -0.41 0.00 0.00 54.97 52.51 1xmm s GLU 286 Cb -0.14 -5.32 -0.10 0.00 -1.78 0.00 0.00 34.13 26.79 1xmm s GLU 286 CO 0.19 -2.06 0.91 0.00 -0.49 0.00 0.00 175.26 173.80 1xmm s ALA 287 N 3.34 3.19 0.30 5.21 0.00 -1.26 -5.00 121.76 127.54 1xmm s ALA 287 Ca 0.48 0.41 -0.29 0.00 0.00 0.00 0.00 51.96 52.56 1xmm s ALA 287 Cb 0.01 -3.10 -0.13 0.00 0.00 0.00 0.00 23.12 19.90 1xmm s ALA 287 CO 0.02 0.19 1.30 -2.30 0.00 0.00 0.00 175.76 174.97 1xmm n PRO 288 N 0.14 2.00 -0.41 0.00 -0.02 -1.26 -1.80 135.00 133.65 1xmm n PRO 288 Ca 0.03 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1xmm n PRO 288 Cb 0.52 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1xmm n PRO 288 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xmm n GLY 289 N 1.32 1.56 0.58 -1.23 0.00 -1.26 -4.89 105.19 101.27 1xmm n GLY 289 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.23 1xmm n GLY 289 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xmm n SER 290 N 0.00 1.80 -4.70 1.61 3.41 -0.74 -3.92 113.62 111.07 1xmm n SER 290 Ca 0.00 -1.60 -0.31 0.00 -0.26 0.00 0.00 58.87 56.70 1xmm n SER 290 Cb 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.09 1xmm n SER 290 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1xmm s GLY 291 N -2.00 1.68 0.39 5.00 0.00 -1.26 -4.67 107.32 106.46 1xmm s GLY 291 Ca 0.36 0.44 0.14 0.00 0.00 0.00 0.00 44.72 45.65 1xmm s GLY 291 CO 0.33 0.84 1.86 -0.24 0.00 0.00 0.00 173.10 175.89 1xmm h VAL 292 N -1.63 1.21 0.00 1.40 3.04 -1.92 0.09 116.25 118.44 1xmm h VAL 292 Ca -0.44 -1.16 0.00 0.00 -1.01 0.00 0.00 66.70 64.09 1xmm h VAL 292 Cb 1.26 1.63 0.00 0.00 -2.01 0.00 0.00 31.29 32.17 1xmm h VAL 292 CO 0.46 0.33 0.00 -1.84 -1.01 0.00 0.00 177.57 175.50 1xmm n GLU 293 N -4.10 0.57 0.00 4.17 0.00 -1.26 -3.99 120.64 116.03 1xmm n GLU 293 Ca -0.02 0.03 0.00 0.00 0.00 0.00 0.00 57.16 57.17 1xmm n GLU 293 Cb 0.38 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.32 1xmm n GLU 293 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1xmm n ARG 294 N -1.08 0.93 -3.77 3.44 0.63 -0.87 -3.89 116.66 112.05 1xmm n ARG 294 Ca 0.14 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.71 1xmm n ARG 294 Cb 0.10 -0.64 -0.06 0.00 0.45 0.00 0.00 32.46 32.31 1xmm n ARG 294 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1xmm s ALA 295 N -1.28 3.84 -0.19 5.13 0.00 -0.04 -0.98 121.76 128.24 1xmm s ALA 295 Ca 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.41 1xmm s ALA 295 Cb 0.00 -2.08 0.05 0.00 0.00 0.00 0.00 23.12 21.10 1xmm s ALA 295 CO 0.00 0.61 -0.02 -1.01 0.00 0.00 0.00 175.76 175.33 1xmm s HIS 296 N -1.13 1.65 -0.04 0.00 3.76 -0.11 -4.77 115.29 114.65 1xmm s HIS 296 Ca 0.21 -1.17 -0.32 0.00 -0.15 0.00 0.00 55.06 53.62 1xmm s HIS 296 Cb -0.13 -1.28 -0.10 0.00 1.11 0.00 0.00 32.58 32.17 1xmm s HIS 296 CO 0.10 -0.65 1.94 1.28 -0.85 0.00 0.00 174.74 176.56 1xmm n LEU 297 N 4.88 3.75 -0.32 0.89 4.77 -1.26 -1.27 117.00 128.44 1xmm n LEU 297 Ca -0.11 0.91 0.10 0.00 -0.03 0.00 0.00 56.01 56.88 1xmm n LEU 297 Cb 0.47 -1.44 0.27 0.00 -2.33 0.00 0.00 43.42 40.38 1xmm n LEU 297 CO 0.16 0.03 1.12 0.25 -1.33 0.00 0.00 177.39 177.62 1xmm h LEU 298 N 10.07 0.59 -0.96 2.23 6.46 -1.66 -0.20 115.31 131.82 1xmm h LEU 298 Ca -0.49 0.10 -0.01 0.00 -0.12 0.00 0.00 57.88 57.37 1xmm h LEU 298 Cb 1.26 0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 41.16 1xmm h LEU 298 CO 0.95 0.20 0.52 0.00 -0.62 0.00 0.00 178.44 179.49 1xmm h ALA 299 N 1.61 1.21 0.00 1.25 0.00 -1.90 -1.59 119.26 119.85 1xmm h ALA 299 Ca 0.52 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 55.19 1xmm h ALA 299 Cb 0.80 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1xmm h ALA 299 CO -0.40 0.65 -0.60 1.49 0.00 0.00 0.00 179.25 180.40 1xmm h GLU 300 N 1.25 0.00 -0.52 0.00 4.81 -1.47 -2.75 114.58 115.91 1xmm h GLU 300 Ca 0.32 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.48 1xmm h GLU 300 Cb -0.01 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 1xmm h GLU 300 CO -0.06 0.60 0.06 0.28 -0.73 0.00 0.00 179.01 179.16 1xmm h VAL 301 N 0.00 1.26 -0.34 0.32 2.07 -0.73 -1.65 116.25 117.18 1xmm h VAL 301 Ca -0.01 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.51 1xmm h VAL 301 Cb 1.18 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 1xmm h VAL 301 CO 0.08 0.35 0.14 0.40 0.02 0.00 0.00 177.57 178.56 1xmm h ILE 302 N 0.75 1.18 -0.08 4.57 2.04 -1.23 -2.22 117.51 122.52 1xmm h ILE 302 Ca 0.15 -0.56 -0.10 0.00 1.00 0.00 0.00 64.86 65.36 1xmm h ILE 302 Cb 0.44 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1xmm h ILE 302 CO 0.01 0.20 -0.40 -0.33 0.00 0.00 0.00 178.15 177.63 1xmm h GLU 303 N 0.40 0.17 -0.11 2.37 5.08 -1.47 -2.42 114.58 118.60 1xmm h GLU 303 Ca 0.11 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1xmm h GLU 303 Cb 0.18 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1xmm h GLU 303 CO -0.01 0.55 0.07 -0.91 -1.00 0.00 0.00 179.01 177.72 1xmm h ASN 304 N 0.14 0.13 0.09 1.42 2.35 -1.07 -2.04 115.58 116.60 1xmm h ASN 304 Ca 0.01 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1xmm h ASN 304 Cb 0.78 -0.03 -0.00 0.00 0.05 0.00 0.00 38.32 39.11 1xmm h ASN 304 CO 0.06 0.10 -0.09 -0.07 -1.65 0.00 0.00 177.43 175.78 1xmm h LEU 305 N 0.15 0.02 -0.07 1.61 3.38 -1.07 0.16 115.31 119.49 1xmm h LEU 305 Ca 0.04 -0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.76 1xmm h LEU 305 Cb -0.01 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 40.75 1xmm h LEU 305 CO -0.01 0.12 -0.96 -0.33 0.09 0.00 0.00 178.44 177.35 1xmm h GLU 306 N 0.03 0.68 0.00 1.13 5.08 -1.28 -3.19 114.58 117.02 1xmm h GLU 306 Ca 0.01 -0.68 -0.07 0.00 -1.00 0.00 0.00 59.36 57.62 1xmm h GLU 306 Cb 0.19 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1xmm h GLU 306 CO 0.01 1.27 -0.32 0.00 -1.00 0.00 0.00 179.01 178.98 1xmm s ASP 308 N -6.33 -1.45 0.30 0.00 2.15 0.51 -5.05 116.67 106.80 1xmm s ASP 308 Ca 0.04 -1.36 0.05 0.00 0.43 0.00 0.00 52.55 51.70 1xmm s ASP 308 Cb 0.08 1.90 0.72 0.00 -0.30 0.00 0.00 42.92 45.32 1xmm s ASP 308 CO 0.70 -0.10 1.76 -0.65 -0.17 0.00 0.00 175.17 176.70 1xmm h PRO 309 N 5.83 0.64 -0.72 4.34 0.11 -1.78 -0.01 132.00 140.41 1xmm h PRO 309 Ca 0.06 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.09 1xmm h PRO 309 Cb 1.14 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 1xmm h PRO 309 CO 0.05 0.42 0.05 0.54 -0.21 0.00 0.00 178.00 178.85 1xmm n ARG 310 N -4.84 3.69 0.02 1.05 1.74 -1.26 -4.40 116.66 112.65 1xmm n ARG 310 Ca 0.23 -2.32 -0.16 0.00 -0.77 0.00 0.00 57.85 54.83 1xmm n ARG 310 Cb 0.59 -2.05 -0.10 0.00 -1.02 0.00 0.00 32.46 29.88 1xmm n ARG 310 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1xmm h HIS 311 N 2.72 -1.60 0.00 -1.55 2.76 -1.32 -1.37 115.15 114.79 1xmm h HIS 311 Ca 0.05 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 1xmm h HIS 311 Cb 1.68 0.71 0.00 0.00 1.55 0.00 0.00 27.41 31.35 1xmm h HIS 311 CO 0.85 -0.56 0.00 0.66 -1.30 0.00 0.00 177.93 177.58 1xmm n TYR 312 N -5.44 0.00 -0.04 5.26 4.02 -1.26 -1.36 117.16 118.34 1xmm n TYR 312 Ca -0.07 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 57.85 1xmm n TYR 312 Cb 0.39 0.00 -0.15 0.00 -0.02 0.00 0.00 39.34 39.55 1xmm n TYR 312 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1xmm n GLN 313 N -0.94 0.74 -0.07 -0.72 3.00 -0.93 -4.52 117.38 113.94 1xmm n GLN 313 Ca 0.20 -0.12 -0.05 0.00 -0.01 0.00 0.00 57.00 57.02 1xmm n GLN 313 Cb 0.09 -1.48 -0.13 0.00 0.00 0.00 0.00 30.24 28.72 1xmm n GLN 313 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1xmm n GLN 314 N -2.39 1.19 -2.80 -1.09 6.02 -0.56 -4.39 117.38 113.37 1xmm n GLN 314 Ca -0.14 -0.04 -0.27 0.00 -0.01 0.00 0.00 57.00 56.55 1xmm n GLN 314 Cb 0.75 -1.42 -0.01 0.00 1.02 0.00 0.00 30.24 30.58 1xmm n GLN 314 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1xmm s ARG 315 N -2.54 3.56 -0.21 -1.09 1.81 -0.47 -4.10 118.95 115.91 1xmm s ARG 315 Ca -0.08 0.13 -0.24 0.00 -1.72 0.00 0.00 55.73 53.83 1xmm s ARG 315 Cb 0.06 -2.43 -0.01 0.00 -0.45 0.00 0.00 34.95 32.11 1xmm s ARG 315 CO 0.68 -0.12 0.77 0.99 -0.68 0.00 0.00 175.30 176.95 1xmm s THR 316 N -2.62 4.90 -0.10 0.02 2.01 -1.26 -3.77 115.64 114.83 1xmm s THR 316 Ca 0.46 1.48 -0.05 0.00 0.31 0.00 0.00 61.69 63.90 1xmm s THR 316 Cb -0.10 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.29 1xmm s THR 316 CO 0.42 0.01 0.10 -0.76 -0.69 0.00 0.00 174.62 173.70 1xmm s LEU 317 N 2.37 4.16 -0.16 4.42 1.43 -0.74 -4.89 118.68 125.28 1xmm s LEU 317 Ca 0.34 0.36 -0.02 0.00 -1.03 0.00 0.00 54.13 53.79 1xmm s LEU 317 Cb -0.16 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 1xmm s LEU 317 CO 0.10 0.39 -0.10 -0.89 0.23 0.00 0.00 176.35 176.08 1xmm s THR 318 N -1.02 3.23 0.23 5.49 2.01 -1.26 -0.98 115.64 123.34 1xmm s THR 318 Ca 0.16 -0.58 -0.16 0.00 0.31 0.00 0.00 61.69 61.42 1xmm s THR 318 Cb -0.12 -2.40 0.01 0.00 0.01 0.00 0.00 72.50 70.01 1xmm s THR 318 CO 0.05 0.49 0.53 0.72 -0.69 0.00 0.00 174.62 175.72 1xmm s PHE 319 N 0.67 0.09 -0.07 4.92 -0.12 -0.99 -4.50 117.98 117.98 1xmm s PHE 319 Ca -0.05 -0.47 -0.03 0.00 -0.05 0.00 0.00 56.93 56.33 1xmm s PHE 319 Cb -0.15 0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 42.54 1xmm s PHE 319 CO 0.02 -0.99 0.07 0.00 -0.05 0.00 0.00 175.22 174.27 1xmm s ALA 320 N -3.95 3.56 0.24 1.99 0.00 -1.26 -1.19 121.76 121.16 1xmm s ALA 320 Ca 0.15 -0.78 0.11 0.00 0.00 0.00 0.00 51.96 51.45 1xmm s ALA 320 Cb -0.01 -1.66 -0.05 0.00 0.00 0.00 0.00 23.12 21.40 1xmm s ALA 320 CO 0.04 0.63 -0.21 -0.51 0.00 0.00 0.00 175.76 175.71 1xmm s LEU 321 N -1.20 2.53 0.72 0.00 1.43 -0.37 -4.96 118.68 116.82 1xmm s LEU 321 Ca 0.17 -0.97 -0.11 0.00 -1.03 0.00 0.00 54.13 52.19 1xmm s LEU 321 Cb -0.12 -1.09 0.02 0.00 0.03 0.00 0.00 46.19 45.03 1xmm s LEU 321 CO 0.07 0.05 1.07 -0.13 0.23 0.00 0.00 176.35 177.64 1xmm s ARG 322 N -3.21 2.73 0.28 1.70 0.52 -1.26 -1.56 118.95 118.14 1xmm s ARG 322 Ca 0.26 0.87 0.04 0.00 -0.52 0.00 0.00 55.73 56.38 1xmm s ARG 322 Cb -0.06 -1.97 0.39 0.00 0.52 0.00 0.00 34.95 33.83 1xmm s ARG 322 CO 0.13 -1.22 1.68 0.00 0.02 0.00 0.00 175.30 175.90 1xmm h ALA 323 N -0.81 1.05 -0.34 2.13 0.00 -1.66 -3.00 119.26 116.63 1xmm h ALA 323 Ca -0.45 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1xmm h ALA 323 Cb 1.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1xmm h ALA 323 CO 0.57 0.59 0.00 -0.40 0.00 0.00 0.00 179.25 180.02 1xmm n ASP 324 N -4.05 3.42 -4.60 0.00 5.75 -1.26 -4.82 116.55 110.98 1xmm n ASP 324 Ca -0.01 -2.43 -0.40 0.00 -0.01 0.00 0.00 54.79 51.94 1xmm n ASP 324 Cb 0.47 -0.54 -0.08 0.00 -1.03 0.00 0.00 41.12 39.94 1xmm n ASP 324 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1xmm s ASP 325 N -0.54 6.38 0.47 -1.12 -1.08 -1.13 -4.98 116.67 114.67 1xmm s ASP 325 Ca 0.30 0.34 0.15 0.00 -0.52 0.00 0.00 52.55 52.83 1xmm s ASP 325 Cb 0.22 -2.27 1.14 0.00 -1.46 0.00 0.00 42.92 40.54 1xmm s ASP 325 CO 0.11 -0.34 2.05 -0.65 0.52 0.00 0.00 175.17 176.86 1xmm h PRO 326 N 8.17 0.23 -0.91 4.34 0.11 -1.89 -2.59 132.00 139.45 1xmm h PRO 326 Ca -0.29 -0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.89 1xmm h PRO 326 Cb 1.14 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.13 1xmm h PRO 326 CO 0.73 0.15 0.59 1.25 -0.21 0.00 0.00 178.00 180.51 1xmm h LEU 327 N 0.24 0.88 -0.24 2.35 5.85 -1.95 -2.61 115.31 119.83 1xmm h LEU 327 Ca 0.16 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.93 1xmm h LEU 327 Cb 0.32 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1xmm h LEU 327 CO -0.03 0.54 0.00 0.25 -0.34 0.00 0.00 178.44 178.87 1xmm h LEU 328 N 0.99 -0.08 -0.74 2.25 5.85 -1.76 -1.27 115.31 120.54 1xmm h LEU 328 Ca 0.41 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 59.14 1xmm h LEU 328 Cb 0.29 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 1xmm h LEU 328 CO -0.17 -0.01 0.32 0.50 -0.34 0.00 0.00 178.44 178.74 1xmm h LYS 329 N 0.08 1.09 -0.59 1.25 1.63 -1.62 -1.20 116.57 117.22 1xmm h LYS 329 Ca 0.11 -0.18 -0.06 0.00 -0.85 0.00 0.00 60.65 59.67 1xmm h LYS 329 Cb 0.14 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.56 1xmm h LYS 329 CO -0.19 0.88 0.13 -0.07 -3.45 0.00 0.00 179.45 176.75 1xmm h LEU 330 N 1.05 0.86 -0.05 5.20 3.38 -1.10 -1.49 115.31 123.17 1xmm h LEU 330 Ca 0.25 -0.17 -0.23 0.00 0.09 0.00 0.00 57.88 57.82 1xmm h LEU 330 Cb 0.17 -0.23 0.02 0.00 0.09 0.00 0.00 40.66 40.71 1xmm h LEU 330 CO -0.03 0.85 -0.88 -0.07 0.09 0.00 0.00 178.44 178.41 1xmm h LEU 331 N 0.88 0.86 -0.92 1.67 3.38 -1.11 -2.48 115.31 117.58 1xmm h LEU 331 Ca 0.19 -0.71 -0.01 0.00 0.09 0.00 0.00 57.88 57.44 1xmm h LEU 331 Cb 0.34 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1xmm h LEU 331 CO 0.00 1.44 0.54 1.56 0.09 0.00 0.00 178.44 182.07 1xmm h GLN 332 N 0.35 1.26 -0.46 1.13 4.20 -1.09 -0.85 115.11 119.66 1xmm h GLN 332 Ca -0.10 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.41 1xmm h GLN 332 Cb 1.53 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 29.04 1xmm h GLN 332 CO 0.18 0.89 -0.04 0.93 -0.67 0.00 0.00 178.83 180.12 1xmm h GLU 333 N 1.27 0.79 -0.15 1.46 3.07 -1.30 -2.07 114.58 117.65 1xmm h GLU 333 Ca 0.33 -0.23 -0.11 0.00 -0.50 0.00 0.00 59.36 58.85 1xmm h GLU 333 Cb -0.03 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.79 1xmm h GLU 333 CO -0.06 0.82 -0.40 0.00 -1.40 0.00 0.00 179.01 177.97 1xmm h ALA 334 N 1.23 1.04 -0.00 3.43 0.00 -0.91 -2.87 119.26 121.17 1xmm h ALA 334 Ca 0.14 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1xmm h ALA 334 Cb 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1xmm h ALA 334 CO 0.03 0.60 -0.50 1.04 0.00 0.00 0.00 179.25 180.42 1xmm n GLN 335 N -4.03 0.11 -2.03 0.00 6.02 -0.38 -3.46 117.38 113.61 1xmm n GLN 335 Ca -0.01 -0.06 -0.18 0.00 -0.01 0.00 0.00 57.00 56.73 1xmm n GLN 335 Cb 0.49 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 30.29 1xmm n GLN 335 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xmm n GLN 336 N -1.39 3.13 0.00 -1.09 10.64 -0.80 -5.08 117.38 122.79 1xmm n GLN 336 Ca 0.06 -3.97 0.00 0.00 -1.83 0.00 0.00 57.00 51.26 1xmm n GLN 336 Cb 0.34 -2.10 0.00 0.00 -0.86 0.00 0.00 30.24 27.62 1xmm n GLN 336 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66