#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xe5 s GLU 2 N 0.00 3.64 0.00 0.00 2.12 -1.26 -0.66 118.70 122.54 2xe5 s GLU 2 Ca 0.00 0.88 0.14 0.00 0.36 0.00 0.00 54.97 56.35 2xe5 s GLU 2 Cb 0.00 -3.98 0.11 0.00 0.26 0.00 0.00 34.13 30.52 2xe5 s GLU 2 CO 0.00 -1.48 0.94 0.44 -0.54 0.00 0.00 175.26 174.62 2xe5 n ILE 3 N 6.94 0.00 -3.65 -3.70 -5.35 -0.47 -4.94 119.36 108.19 2xe5 n ILE 3 Ca 0.15 -0.50 -0.07 0.00 -0.27 0.00 0.00 62.75 62.06 2xe5 n ILE 3 Cb 0.48 1.29 -0.08 0.00 -1.74 0.00 0.00 39.64 39.60 2xe5 n ILE 3 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2xe5 s TYR 4 N -1.17 -1.00 -0.28 4.28 5.04 -1.18 -5.00 117.35 118.04 2xe5 s TYR 4 Ca 0.16 2.00 0.00 0.00 -2.44 0.00 0.00 57.07 56.80 2xe5 s TYR 4 Cb 0.12 0.58 0.17 0.00 0.35 0.00 0.00 41.96 43.18 2xe5 s TYR 4 CO 0.18 -0.50 0.50 1.21 -1.34 0.00 0.00 175.55 175.60 2xe5 s ASN 5 N 1.64 -0.66 -0.28 4.32 3.84 -1.26 -0.86 114.94 121.68 2xe5 s ASN 5 Ca -0.10 0.33 -0.24 0.00 0.21 0.00 0.00 52.86 53.07 2xe5 s ASN 5 Cb -0.06 1.66 0.11 0.00 -0.55 0.00 0.00 41.25 42.41 2xe5 s ASN 5 CO -0.19 -0.30 0.93 -0.75 -2.79 0.00 0.00 177.10 174.00 2xe5 s LYS 6 N 2.71 0.59 -1.59 0.43 2.20 -0.38 -5.01 119.74 118.69 2xe5 s LYS 6 Ca 0.14 0.75 -0.05 0.00 -0.36 0.00 0.00 55.97 56.45 2xe5 s LYS 6 Cb -0.14 0.27 0.05 0.00 -1.51 0.00 0.00 37.83 36.49 2xe5 s LYS 6 CO -0.22 -0.08 0.19 -0.25 -0.36 0.00 0.00 175.35 174.63 2xe5 n ASP 7 N 2.60 0.14 0.00 1.43 8.00 -1.26 -0.98 116.55 126.49 2xe5 n ASP 7 Ca -0.14 -1.22 0.00 0.00 0.71 0.00 0.00 54.79 54.14 2xe5 n ASP 7 Cb 0.56 -1.85 0.00 0.00 -0.02 0.00 0.00 41.12 39.81 2xe5 n ASP 7 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2xe5 n GLY 8 N -2.20 1.27 3.31 0.44 0.00 -1.26 -5.03 105.19 101.72 2xe5 n GLY 8 Ca -0.24 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 2xe5 n GLY 8 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2xe5 s ASN 9 N -3.14 3.01 0.08 1.61 2.47 -0.15 -1.15 114.94 117.67 2xe5 s ASN 9 Ca 0.00 -0.52 0.04 0.00 0.42 0.00 0.00 52.86 52.79 2xe5 s ASN 9 Cb 0.00 -0.30 -0.03 0.00 -1.45 0.00 0.00 41.25 39.47 2xe5 s ASN 9 CO 0.00 0.27 -0.10 -1.59 -3.72 0.00 0.00 177.10 171.96 2xe5 s LYS 10 N -0.94 0.78 -0.04 0.43 -2.85 -0.23 -1.25 119.74 115.63 2xe5 s LYS 10 Ca 0.10 -1.03 -0.01 0.00 -1.00 0.00 0.00 55.97 54.03 2xe5 s LYS 10 Cb -0.10 -0.55 0.03 0.00 -2.06 0.00 0.00 37.83 35.16 2xe5 s LYS 10 CO 0.01 0.10 0.07 -1.17 0.10 0.00 0.00 175.35 174.45 2xe5 s LEU 11 N -2.12 0.57 -0.29 2.77 2.96 -0.04 -1.88 118.68 120.65 2xe5 s LEU 11 Ca 0.01 0.11 -0.07 0.00 -0.22 0.00 0.00 54.13 53.96 2xe5 s LEU 11 Cb -0.06 -0.02 0.01 0.00 0.50 0.00 0.00 46.19 46.62 2xe5 s LEU 11 CO 0.01 -0.19 0.07 -0.62 -1.32 0.00 0.00 176.35 174.30 2xe5 s ASP 12 N 1.63 5.07 -0.29 3.68 -1.08 0.48 -1.36 116.67 124.80 2xe5 s ASP 12 Ca -0.02 -0.67 -0.15 0.00 -0.52 0.00 0.00 52.55 51.18 2xe5 s ASP 12 Cb -0.12 -1.87 -0.03 0.00 -1.46 0.00 0.00 42.92 39.43 2xe5 s ASP 12 CO -0.04 -0.17 0.38 -0.22 0.52 0.00 0.00 175.17 175.64 2xe5 s LEU 13 N 1.50 4.13 0.22 -1.34 2.96 0.16 -0.99 118.68 125.32 2xe5 s LEU 13 Ca 0.03 0.17 0.05 0.00 -0.22 0.00 0.00 54.13 54.16 2xe5 s LEU 13 Cb -0.17 -2.42 -0.05 0.00 0.50 0.00 0.00 46.19 44.05 2xe5 s LEU 13 CO 0.02 -0.23 -0.05 -0.72 -1.32 0.00 0.00 176.35 174.04 2xe5 s TYR 14 N 2.08 1.59 0.00 5.38 1.13 0.05 0.11 117.35 127.69 2xe5 s TYR 14 Ca 0.15 -0.80 0.00 0.00 -1.41 0.00 0.00 57.07 55.01 2xe5 s TYR 14 Cb -0.16 -0.88 0.00 0.00 -1.10 0.00 0.00 41.96 39.83 2xe5 s TYR 14 CO 0.11 0.10 0.00 0.41 -2.51 0.00 0.00 175.55 173.66 2xe5 n GLY 15 N -0.40 0.86 3.34 5.49 0.00 -1.00 -0.20 105.19 113.28 2xe5 n GLY 15 Ca -0.07 -0.86 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 2xe5 n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xe5 s LYS 16 N -2.00 1.00 -0.14 1.61 -2.85 0.90 -1.48 119.74 116.78 2xe5 s LYS 16 Ca 0.00 -0.45 0.02 0.00 -1.00 0.00 0.00 55.97 54.55 2xe5 s LYS 16 Cb 0.00 0.45 0.01 0.00 -2.06 0.00 0.00 37.83 36.23 2xe5 s LYS 16 CO 0.00 -0.37 -0.22 0.08 0.10 0.00 0.00 175.35 174.94 2xe5 s VAL 17 N -2.93 2.05 -0.37 1.79 1.01 0.27 -0.59 120.40 121.65 2xe5 s VAL 17 Ca -0.03 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 60.95 2xe5 s VAL 17 Cb 0.00 -1.82 0.09 0.00 0.00 0.00 0.00 36.38 34.65 2xe5 s VAL 17 CO -0.06 0.55 0.13 -0.70 0.00 0.00 0.00 175.10 175.02 2xe5 s GLU 18 N 0.82 2.16 -0.38 2.72 2.12 0.05 -1.53 118.70 124.66 2xe5 s GLU 18 Ca -0.07 -1.60 -0.29 0.00 0.36 0.00 0.00 54.97 53.37 2xe5 s GLU 18 Cb -0.15 -3.43 0.01 0.00 0.26 0.00 0.00 34.13 30.81 2xe5 s GLU 18 CO -0.02 -0.89 1.39 0.20 -0.54 0.00 0.00 175.26 175.40 2xe5 s GLY 19 N 1.57 1.17 -0.02 -1.50 0.00 0.31 -1.83 107.32 107.02 2xe5 s GLY 19 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.68 2xe5 s GLY 19 CO -0.03 2.73 0.01 -2.27 0.00 0.00 0.00 173.10 173.55 2xe5 s LEU 20 N 5.17 1.18 -0.04 0.66 2.96 -1.26 -0.63 118.68 126.73 2xe5 s LEU 20 Ca 0.60 0.00 0.03 0.00 -0.22 0.00 0.00 54.13 54.54 2xe5 s LEU 20 Cb -0.15 -0.14 0.01 0.00 0.50 0.00 0.00 46.19 46.41 2xe5 s LEU 20 CO 0.30 -0.11 -0.11 -2.28 -1.32 0.00 0.00 176.35 172.84 2xe5 s HIS 21 N 0.98 1.22 -0.13 5.38 5.65 0.12 -0.23 115.29 128.27 2xe5 s HIS 21 Ca -0.09 -0.36 -0.06 0.00 0.25 0.00 0.00 55.06 54.80 2xe5 s HIS 21 Cb -0.13 -0.88 -0.04 0.00 -1.18 0.00 0.00 32.58 30.36 2xe5 s HIS 21 CO -0.02 -0.17 0.08 0.71 -0.65 0.00 0.00 174.74 174.69 2xe5 s TYR 22 N 0.36 3.39 -0.15 3.88 1.51 0.19 -0.80 117.35 125.72 2xe5 s TYR 22 Ca -0.07 0.32 0.01 0.00 -1.01 0.00 0.00 57.07 56.32 2xe5 s TYR 22 Cb -0.12 -1.94 0.00 0.00 -0.11 0.00 0.00 41.96 39.80 2xe5 s TYR 22 CO 0.02 0.51 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.72 2xe5 s PHE 23 N -0.59 2.74 -0.01 2.71 0.08 0.68 -0.13 117.98 123.46 2xe5 s PHE 23 Ca 0.11 -1.22 -0.27 0.00 0.12 0.00 0.00 56.93 55.67 2xe5 s PHE 23 Cb -0.12 -1.87 0.06 0.00 -0.57 0.00 0.00 43.02 40.52 2xe5 s PHE 23 CO 0.02 -0.57 0.61 0.45 -0.10 0.00 0.00 175.22 175.64 2xe5 s SER 24 N 0.89 -0.57 0.42 1.36 0.15 -1.26 -1.44 113.70 113.25 2xe5 s SER 24 Ca -0.04 0.51 0.23 0.00 0.70 0.00 0.00 55.95 57.34 2xe5 s SER 24 Cb -0.15 0.51 0.76 0.00 -1.71 0.00 0.00 66.02 65.43 2xe5 s SER 24 CO -0.02 -0.64 1.76 0.44 1.20 0.00 0.00 173.24 175.97 2xe5 h ASP 25 N 2.96 0.00 -3.38 5.45 3.32 -1.96 -3.41 116.42 119.40 2xe5 h ASP 25 Ca -0.28 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.20 2xe5 h ASP 25 Cb 1.17 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.66 2xe5 h ASP 25 CO 0.39 0.26 0.98 0.21 -1.72 0.00 0.00 179.24 179.36 2xe5 s ASN 26 N -6.23 6.56 0.48 6.45 3.84 -1.26 -4.91 114.94 119.86 2xe5 s ASN 26 Ca 0.01 0.83 0.20 0.00 0.21 0.00 0.00 52.86 54.12 2xe5 s ASN 26 Cb 0.10 -2.54 1.20 0.00 -0.55 0.00 0.00 41.25 39.45 2xe5 s ASN 26 CO 0.65 -1.25 2.03 0.44 -2.79 0.00 0.00 177.10 176.18 2xe5 h ASP 27 N 9.69 0.00 0.41 -4.21 3.32 -1.94 -0.33 116.42 123.37 2xe5 h ASP 27 Ca -0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.80 2xe5 h ASP 27 Cb 1.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.64 2xe5 h ASP 27 CO 1.08 0.16 0.00 -1.54 -1.72 0.00 0.00 179.24 177.22 2xe5 n SER 28 N -4.03 0.00 -0.07 6.45 3.41 -1.26 -2.63 113.62 115.50 2xe5 n SER 28 Ca -0.02 -0.11 0.01 0.00 -0.26 0.00 0.00 58.87 58.48 2xe5 n SER 28 Cb 0.24 -0.26 0.01 0.00 -0.26 0.00 0.00 64.21 63.95 2xe5 n SER 28 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2xe5 n LYS 29 N -1.26 2.09 -4.25 4.33 4.76 -0.15 -5.03 118.16 118.65 2xe5 n LYS 29 Ca 0.12 -1.33 -0.34 0.00 -2.87 0.00 0.00 58.31 53.89 2xe5 n LYS 29 Cb 0.18 -1.03 -0.13 0.00 -1.84 0.00 0.00 35.03 32.21 2xe5 n LYS 29 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2xe5 s ASP 30 N -0.79 4.52 0.00 4.39 2.15 -1.08 -4.44 116.67 121.42 2xe5 s ASP 30 Ca 0.02 -0.26 0.00 0.00 0.43 0.00 0.00 52.55 52.75 2xe5 s ASP 30 Cb 0.01 -1.75 0.00 0.00 -0.30 0.00 0.00 42.92 40.88 2xe5 s ASP 30 CO 0.02 0.09 0.00 0.61 -0.17 0.00 0.00 175.17 175.72 2xe5 n GLY 31 N 4.06 0.62 3.70 2.66 0.00 0.81 -4.96 105.19 112.08 2xe5 n GLY 31 Ca -0.18 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.22 2xe5 n GLY 31 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2xe5 s ASP 32 N -4.00 6.75 -0.08 1.61 2.15 -1.26 -0.64 116.67 121.20 2xe5 s ASP 32 Ca 0.00 2.35 0.12 0.00 0.43 0.00 0.00 52.55 55.45 2xe5 s ASP 32 Cb 0.00 -2.58 0.18 0.00 -0.30 0.00 0.00 42.92 40.23 2xe5 s ASP 32 CO 0.00 -0.74 1.08 0.29 -0.17 0.00 0.00 175.17 175.63 2xe5 n LYS 33 N 4.66 0.97 -1.63 4.34 4.76 0.68 -4.85 118.16 127.08 2xe5 n LYS 33 Ca 0.13 -2.01 -0.45 0.00 -2.87 0.00 0.00 58.31 53.12 2xe5 n LYS 33 Cb 0.42 -1.16 -0.02 0.00 -1.84 0.00 0.00 35.03 32.43 2xe5 n LYS 33 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 2xe5 n THR 34 N -0.93 1.57 -3.95 -0.18 -1.04 -0.97 -4.62 114.28 104.16 2xe5 n THR 34 Ca 0.10 -0.39 -0.08 0.00 -2.04 0.00 0.00 64.05 61.63 2xe5 n THR 34 Cb 0.63 -1.23 -0.04 0.00 -1.82 0.00 0.00 70.33 67.87 2xe5 n THR 34 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 2xe5 s TYR 35 N -0.69 0.19 0.02 -1.42 1.13 -0.76 -0.61 117.35 115.21 2xe5 s TYR 35 Ca 0.62 -0.57 0.06 0.00 -1.41 0.00 0.00 57.07 55.77 2xe5 s TYR 35 Cb -0.68 0.35 -0.02 0.00 -1.10 0.00 0.00 41.96 40.51 2xe5 s TYR 35 CO 0.57 -1.06 -0.18 1.41 -2.51 0.00 0.00 175.55 173.78 2xe5 s MET 36 N -3.98 1.30 0.06 -3.49 1.75 0.31 -0.77 119.30 114.47 2xe5 s MET 36 Ca 0.19 -0.77 0.05 0.00 -1.25 0.00 0.00 55.69 53.91 2xe5 s MET 36 Cb -0.02 -1.32 -0.03 0.00 2.84 0.00 0.00 34.83 36.30 2xe5 s MET 36 CO 0.08 0.35 -0.15 1.03 -0.65 0.00 0.00 175.02 175.67 2xe5 s ARG 37 N -0.85 0.93 -0.16 4.11 0.52 0.24 -1.03 118.95 122.71 2xe5 s ARG 37 Ca 0.06 -0.90 -0.13 0.00 -0.52 0.00 0.00 55.73 54.24 2xe5 s ARG 37 Cb -0.08 -0.98 0.04 0.00 0.52 0.00 0.00 34.95 34.46 2xe5 s ARG 37 CO 0.01 0.23 0.41 -1.17 0.02 0.00 0.00 175.30 174.80 2xe5 s LEU 38 N -1.48 0.31 0.34 2.53 2.96 -0.64 -0.07 118.68 122.63 2xe5 s LEU 38 Ca 0.01 0.84 -0.16 0.00 -0.22 0.00 0.00 54.13 54.61 2xe5 s LEU 38 Cb -0.09 1.39 0.04 0.00 0.50 0.00 0.00 46.19 48.03 2xe5 s LEU 38 CO 0.02 -0.15 0.71 -0.83 -1.32 0.00 0.00 176.35 174.78 2xe5 s GLY 39 N 0.50 0.36 0.04 7.98 0.00 0.73 -0.38 107.32 116.54 2xe5 s GLY 39 Ca -0.02 -0.71 0.04 0.00 0.00 0.00 0.00 44.72 44.02 2xe5 s GLY 39 CO -0.03 -0.34 -0.11 -0.11 0.00 0.00 0.00 173.10 172.51 2xe5 s PHE 40 N -2.98 0.99 -0.08 1.90 -0.71 -0.06 -0.77 117.98 116.27 2xe5 s PHE 40 Ca 0.16 -0.37 -0.01 0.00 -1.04 0.00 0.00 56.93 55.67 2xe5 s PHE 40 Cb -0.05 -0.59 0.03 0.00 -1.21 0.00 0.00 43.02 41.20 2xe5 s PHE 40 CO 0.11 0.00 -0.01 0.21 -1.34 0.00 0.00 175.22 174.19 2xe5 s LYS 41 N -1.21 0.76 -0.03 1.99 2.20 -0.16 -1.95 119.74 121.34 2xe5 s LYS 41 Ca -0.02 0.04 0.05 0.00 -0.36 0.00 0.00 55.97 55.68 2xe5 s LYS 41 Cb -0.08 -1.05 -0.01 0.00 -1.51 0.00 0.00 37.83 35.18 2xe5 s LYS 41 CO 0.01 -0.28 -0.17 0.20 -0.36 0.00 0.00 175.35 174.75 2xe5 s GLY 42 N 1.84 0.87 -0.03 5.54 0.00 -0.15 -0.38 107.32 115.01 2xe5 s GLY 42 Ca 0.04 -0.71 -0.00 0.00 0.00 0.00 0.00 44.72 44.04 2xe5 s GLY 42 CO -0.05 -0.49 0.03 1.85 0.00 0.00 0.00 173.10 174.44 2xe5 s GLU 43 N -0.20 0.06 -0.08 2.90 2.12 -0.79 -1.59 118.70 121.12 2xe5 s GLU 43 Ca 0.02 0.21 0.05 0.00 0.36 0.00 0.00 54.97 55.60 2xe5 s GLU 43 Cb -0.09 -0.40 -0.00 0.00 0.26 0.00 0.00 34.13 33.90 2xe5 s GLU 43 CO 0.01 -0.21 -0.23 -0.08 -0.54 0.00 0.00 175.26 174.21 2xe5 s THR 44 N 1.38 1.92 -0.35 -1.70 -1.32 0.13 -1.07 115.64 114.62 2xe5 s THR 44 Ca -0.05 -0.96 -0.27 0.00 -1.21 0.00 0.00 61.69 59.20 2xe5 s THR 44 Cb -0.13 -1.65 0.01 0.00 -1.51 0.00 0.00 72.50 69.23 2xe5 s THR 44 CO -0.03 0.53 0.96 -1.10 -2.21 0.00 0.00 174.62 172.78 2xe5 s GLN 45 N 0.16 3.92 -0.15 7.08 -1.52 -0.30 -0.20 119.66 128.65 2xe5 s GLN 45 Ca -0.12 0.73 -0.12 0.00 -1.95 0.00 0.00 55.36 53.90 2xe5 s GLN 45 Cb -0.16 -3.78 -0.09 0.00 -0.22 0.00 0.00 33.01 28.77 2xe5 s GLN 45 CO 0.06 -0.92 0.06 0.28 -0.25 0.00 0.00 175.29 174.52 2xe5 h VAL 46 N 5.78 0.42 -4.42 1.09 2.07 -1.11 -3.48 116.25 116.60 2xe5 h VAL 46 Ca -0.22 -1.43 -0.41 0.00 0.82 0.00 0.00 66.70 65.45 2xe5 h VAL 46 Cb 1.07 0.91 -0.09 0.00 -1.52 0.00 0.00 31.29 31.67 2xe5 h VAL 46 CO 0.99 0.14 -0.33 0.35 0.02 0.00 0.00 177.57 178.74 2xe5 n THR 47 N -4.61 0.00 0.30 2.57 -2.24 -0.96 -4.98 114.28 104.36 2xe5 n THR 47 Ca -0.12 -1.70 0.17 0.00 -2.27 0.00 0.00 64.05 60.14 2xe5 n THR 47 Cb 0.33 0.56 0.91 0.00 -2.10 0.00 0.00 70.33 70.04 2xe5 n THR 47 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2xe5 h ASP 48 N 1.11 0.00 0.00 3.42 3.32 -2.03 -3.02 116.42 119.22 2xe5 h ASP 48 Ca -0.24 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 2xe5 h ASP 48 Cb 0.87 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.42 2xe5 h ASP 48 CO 0.38 0.04 -1.50 0.00 -1.72 0.00 0.00 179.24 176.44 2xe5 n GLN 49 N -3.39 0.34 -3.88 3.56 6.02 -1.26 -4.97 117.38 113.80 2xe5 n GLN 49 Ca -0.02 -0.10 -0.35 0.00 -0.01 0.00 0.00 57.00 56.52 2xe5 n GLN 49 Cb 0.17 -1.26 -0.14 0.00 1.02 0.00 0.00 30.24 30.03 2xe5 n GLN 49 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2xe5 s LEU 50 N -3.77 3.13 0.03 1.08 2.96 -1.14 -1.26 118.68 119.72 2xe5 s LEU 50 Ca -0.04 -0.49 0.04 0.00 -0.22 0.00 0.00 54.13 53.43 2xe5 s LEU 50 Cb 0.07 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 2xe5 s LEU 50 CO 0.46 -0.06 -0.07 0.42 -1.32 0.00 0.00 176.35 175.78 2xe5 s THR 51 N 1.48 3.59 0.07 3.68 -4.23 -0.19 -0.48 115.64 119.56 2xe5 s THR 51 Ca 0.05 -0.91 0.03 0.00 -1.18 0.00 0.00 61.69 59.68 2xe5 s THR 51 Cb -0.15 -2.60 -0.04 0.00 1.34 0.00 0.00 72.50 71.05 2xe5 s THR 51 CO -0.02 0.31 0.04 -0.83 -0.54 0.00 0.00 174.62 173.58 2xe5 s GLY 52 N -1.67 1.97 0.12 3.99 0.00 0.71 -0.58 107.32 111.87 2xe5 s GLY 52 Ca 0.19 -1.04 -0.15 0.00 0.00 0.00 0.00 44.72 43.72 2xe5 s GLY 52 CO 0.10 -1.00 0.37 -2.52 0.00 0.00 0.00 173.10 170.04 2xe5 s TYR 53 N -1.32 -0.12 0.00 1.90 1.13 0.09 0.18 117.35 119.20 2xe5 s TYR 53 Ca 0.27 -0.22 -0.21 0.00 -1.41 0.00 0.00 57.07 55.50 2xe5 s TYR 53 Cb -0.12 0.20 0.04 0.00 -1.10 0.00 0.00 41.96 40.99 2xe5 s TYR 53 CO 0.19 -0.68 0.47 0.20 -2.51 0.00 0.00 175.55 173.21 2xe5 s GLY 54 N -2.82 -0.34 -0.12 5.49 0.00 -0.62 -0.25 107.32 108.66 2xe5 s GLY 54 Ca 0.04 0.63 -0.16 0.00 0.00 0.00 0.00 44.72 45.23 2xe5 s GLY 54 CO -0.11 0.35 0.41 1.62 0.00 0.00 0.00 173.10 175.37 2xe5 s GLN 55 N -1.76 0.57 -0.07 2.90 0.74 -0.34 -0.97 119.66 120.73 2xe5 s GLN 55 Ca -0.09 0.39 -0.04 0.00 0.05 0.00 0.00 55.36 55.67 2xe5 s GLN 55 Cb -0.02 0.27 0.03 0.00 1.10 0.00 0.00 33.01 34.39 2xe5 s GLN 55 CO 0.03 -0.10 0.17 -0.46 -0.55 0.00 0.00 175.29 174.38 2xe5 s TRP 56 N -0.21 -0.20 -0.06 1.67 -0.00 -0.82 -1.05 118.94 118.28 2xe5 s TRP 56 Ca -0.04 0.52 -0.05 0.00 -0.00 0.00 0.00 56.10 56.53 2xe5 s TRP 56 Cb -0.03 -0.02 0.02 0.00 -0.00 0.00 0.00 33.47 33.43 2xe5 s TRP 56 CO 0.02 -0.16 0.15 -2.00 -0.00 0.00 0.00 176.95 174.96 2xe5 s GLU 57 N 0.89 0.16 0.02 5.86 2.12 -0.42 -0.88 118.70 126.44 2xe5 s GLU 57 Ca -0.07 0.23 0.03 0.00 0.36 0.00 0.00 54.97 55.52 2xe5 s GLU 57 Cb -0.08 0.05 -0.01 0.00 0.26 0.00 0.00 34.13 34.34 2xe5 s GLU 57 CO -0.05 -0.04 -0.09 -0.47 -0.54 0.00 0.00 175.26 174.08 2xe5 s TYR 58 N 0.21 0.78 -0.02 5.30 5.04 0.49 0.14 117.35 129.28 2xe5 s TYR 58 Ca -0.01 -0.26 0.08 0.00 -2.44 0.00 0.00 57.07 54.44 2xe5 s TYR 58 Cb -0.02 -0.48 -0.02 0.00 0.35 0.00 0.00 41.96 41.79 2xe5 s TYR 58 CO -0.01 -0.02 -0.25 -1.14 -1.34 0.00 0.00 175.55 172.79 2xe5 s GLN 59 N -0.70 2.17 -0.10 4.97 0.74 0.93 -1.63 119.66 126.04 2xe5 s GLN 59 Ca -0.00 -0.92 -0.02 0.00 0.05 0.00 0.00 55.36 54.47 2xe5 s GLN 59 Cb -0.06 -2.07 0.03 0.00 1.10 0.00 0.00 33.01 32.02 2xe5 s GLN 59 CO 0.00 0.55 0.01 0.42 -0.55 0.00 0.00 175.29 175.72 2xe5 s ILE 60 N -0.58 0.40 0.33 -2.34 1.01 -0.20 -1.11 121.20 118.72 2xe5 s ILE 60 Ca 0.09 -0.01 -0.28 0.00 0.00 0.00 0.00 60.65 60.45 2xe5 s ILE 60 Cb -0.10 -0.63 -0.10 0.00 0.01 0.00 0.00 42.46 41.64 2xe5 s ILE 60 CO -0.01 0.17 1.27 -1.10 0.00 0.00 0.00 174.94 175.28 2xe5 s GLN 61 N 1.95 4.35 -0.07 2.79 -1.52 -0.72 -0.53 119.66 125.90 2xe5 s GLN 61 Ca 0.04 2.14 0.10 0.00 -1.95 0.00 0.00 55.36 55.69 2xe5 s GLN 61 Cb -0.13 -3.04 0.21 0.00 -0.22 0.00 0.00 33.01 29.83 2xe5 s GLN 61 CO -0.06 -0.17 1.14 0.41 -0.25 0.00 0.00 175.29 176.37 2xe5 n GLY 62 N 0.83 3.78 0.68 3.09 0.00 0.22 -4.65 105.19 109.14 2xe5 n GLY 62 Ca 0.00 -0.59 0.07 0.00 0.00 0.00 0.00 46.02 45.50 2xe5 n GLY 62 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2xe5 n ASN 63 N -0.70 3.27 -4.61 1.61 6.94 -1.02 -4.73 115.26 116.02 2xe5 n ASN 63 Ca 0.10 -2.51 -0.25 0.00 -0.02 0.00 0.00 54.58 51.89 2xe5 n ASN 63 Cb 0.50 -0.37 -0.08 0.00 -2.36 0.00 0.00 39.78 37.47 2xe5 n ASN 63 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2xe5 s GLU 64 N -1.92 2.21 0.88 -3.83 2.02 -1.26 -4.98 118.70 111.81 2xe5 s GLU 64 Ca 0.31 -1.28 -0.12 0.00 0.02 0.00 0.00 54.97 53.90 2xe5 s GLU 64 Cb 0.22 -2.20 0.12 0.00 0.10 0.00 0.00 34.13 32.37 2xe5 s GLU 64 CO 0.11 0.42 1.10 -1.25 0.02 0.00 0.00 175.26 175.66 2xe5 s PRO 65 N -3.12 1.43 0.23 0.39 0.04 -1.26 -4.94 135.00 127.76 2xe5 s PRO 65 Ca 0.28 0.60 0.25 0.00 0.04 0.00 0.00 61.00 62.17 2xe5 s PRO 65 Cb -0.08 -1.85 0.90 0.00 0.04 0.00 0.00 34.50 33.51 2xe5 s PRO 65 CO 0.17 -2.07 1.75 0.39 0.04 0.00 0.00 177.00 177.28 2xe5 n GLU 66 N -3.73 0.23 0.11 4.56 1.02 -1.26 -2.91 120.64 118.65 2xe5 n GLU 66 Ca 0.07 0.31 0.13 0.00 -0.02 0.00 0.00 57.16 57.64 2xe5 n GLU 66 Cb 0.57 -1.83 0.37 0.00 -0.02 0.00 0.00 31.44 30.52 2xe5 n GLU 66 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2xe5 h SER 67 N 0.00 0.00 -0.92 1.62 4.64 -2.07 -3.41 113.55 113.42 2xe5 h SER 67 Ca 0.00 -0.02 -0.25 0.00 -0.47 0.00 0.00 61.79 61.05 2xe5 h SER 67 Cb 0.56 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.45 2xe5 h SER 67 CO 0.00 0.01 -0.59 -0.67 -0.87 0.00 0.00 176.83 174.71 2xe5 n ASP 68 N -2.30 -2.71 -4.48 4.97 2.03 -1.15 -5.14 116.55 107.77 2xe5 n ASP 68 Ca 0.05 -2.96 -0.33 0.00 0.52 0.00 0.00 54.79 52.07 2xe5 n ASP 68 Cb 0.44 1.36 -0.12 0.00 -0.72 0.00 0.00 41.12 42.07 2xe5 n ASP 68 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2xe5 s ASN 69 N -0.14 4.56 -0.02 1.67 3.04 -1.24 -4.50 114.94 118.31 2xe5 s ASN 69 Ca 0.31 -0.16 0.02 0.00 0.04 0.00 0.00 52.86 53.07 2xe5 s ASN 69 Cb 0.09 -1.59 -0.03 0.00 -1.54 0.00 0.00 41.25 38.17 2xe5 s ASN 69 CO -0.13 0.21 -0.03 -0.94 -3.04 0.00 0.00 177.10 173.17 2xe5 s SER 70 N 0.08 4.92 0.19 -4.21 1.04 -1.26 -5.05 113.70 109.41 2xe5 s SER 70 Ca -0.02 -0.04 -0.10 0.00 0.48 0.00 0.00 55.95 56.27 2xe5 s SER 70 Cb -0.14 -1.25 -0.01 0.00 0.10 0.00 0.00 66.02 64.73 2xe5 s SER 70 CO 0.03 0.30 0.35 -0.94 0.98 0.00 0.00 173.24 173.97 2xe5 s SER 71 N -1.35 -0.02 -0.08 7.02 1.04 -1.26 -1.76 113.70 117.29 2xe5 s SER 71 Ca 0.17 -0.88 -0.30 0.00 0.48 0.00 0.00 55.95 55.43 2xe5 s SER 71 Cb -0.11 0.49 0.11 0.00 0.10 0.00 0.00 66.02 66.60 2xe5 s SER 71 CO 0.07 -0.97 0.91 -1.66 0.98 0.00 0.00 173.24 172.57 2xe5 s TRP 72 N -3.98 -0.40 -0.15 5.02 -2.14 -0.27 -4.99 118.94 112.03 2xe5 s TRP 72 Ca 0.19 0.53 -0.25 0.00 2.66 0.00 0.00 56.10 59.23 2xe5 s TRP 72 Cb 0.02 0.48 -0.02 0.00 -3.10 0.00 0.00 33.47 30.85 2xe5 s TRP 72 CO 0.03 -0.46 0.81 0.99 -2.66 0.00 0.00 176.95 175.65 2xe5 s THR 73 N -1.95 4.91 -0.16 0.66 2.01 -1.26 -0.05 115.64 119.81 2xe5 s THR 73 Ca -0.00 1.60 -0.19 0.00 0.31 0.00 0.00 61.69 63.41 2xe5 s THR 73 Cb -0.01 -4.12 -0.16 0.00 0.01 0.00 0.00 72.50 68.22 2xe5 s THR 73 CO -0.02 0.07 0.32 0.03 -0.69 0.00 0.00 174.62 174.33 2xe5 h ARG 74 N 7.24 0.00 -4.81 4.92 3.08 -0.64 -3.48 114.38 120.69 2xe5 h ARG 74 Ca -0.31 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.43 2xe5 h ARG 74 Cb 1.14 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.99 2xe5 h ARG 74 CO 0.82 0.70 -0.74 0.14 -1.07 0.00 0.00 179.97 179.81 2xe5 s VAL 75 N -2.17 0.74 -0.31 2.04 -7.23 -1.11 -4.59 120.40 107.79 2xe5 s VAL 75 Ca -0.19 -1.29 -0.00 0.00 -1.81 0.00 0.00 61.98 58.69 2xe5 s VAL 75 Cb 0.01 -0.92 0.19 0.00 0.56 0.00 0.00 36.38 36.22 2xe5 s VAL 75 CO 0.48 -0.42 0.78 0.00 -0.31 0.00 0.00 175.10 175.63 2xe5 s ALA 76 N -1.71 -3.09 0.02 1.32 0.00 -0.54 -1.31 121.76 116.46 2xe5 s ALA 76 Ca -0.04 1.07 -0.12 0.00 0.00 0.00 0.00 51.96 52.87 2xe5 s ALA 76 Cb -0.08 -2.70 0.01 0.00 0.00 0.00 0.00 23.12 20.36 2xe5 s ALA 76 CO 0.00 -2.01 0.25 -0.59 0.00 0.00 0.00 175.76 173.41 2xe5 s PHE 77 N 2.69 -0.06 0.08 0.00 -0.12 -0.21 -0.93 117.98 119.43 2xe5 s PHE 77 Ca 0.17 -0.04 0.10 0.00 -0.05 0.00 0.00 56.93 57.10 2xe5 s PHE 77 Cb -0.06 0.04 -0.03 0.00 -0.63 0.00 0.00 43.02 42.34 2xe5 s PHE 77 CO -0.22 -0.43 -0.26 0.00 -0.05 0.00 0.00 175.22 174.27 2xe5 s ALA 78 N -2.10 2.23 0.33 1.99 0.00 -0.89 -1.19 121.76 122.12 2xe5 s ALA 78 Ca -0.08 -1.33 -0.18 0.00 0.00 0.00 0.00 51.96 50.37 2xe5 s ALA 78 Cb -0.03 -0.41 0.04 0.00 0.00 0.00 0.00 23.12 22.72 2xe5 s ALA 78 CO -0.01 0.51 0.76 0.20 0.00 0.00 0.00 175.76 177.22 2xe5 s GLY 79 N -1.59 0.14 0.04 0.00 0.00 0.65 -1.24 107.32 105.32 2xe5 s GLY 79 Ca 0.12 -0.53 0.07 0.00 0.00 0.00 0.00 44.72 44.38 2xe5 s GLY 79 CO 0.04 -0.19 -0.19 1.08 0.00 0.00 0.00 173.10 173.84 2xe5 s LEU 80 N -3.00 2.17 -0.09 0.66 1.43 0.32 -0.73 118.68 119.45 2xe5 s LEU 80 Ca 0.13 -0.51 -0.01 0.00 -1.03 0.00 0.00 54.13 52.72 2xe5 s LEU 80 Cb -0.06 -0.86 0.03 0.00 0.03 0.00 0.00 46.19 45.33 2xe5 s LEU 80 CO 0.09 0.12 -0.04 -0.75 0.23 0.00 0.00 176.35 176.00 2xe5 s LYS 81 N -1.19 1.07 -0.10 1.70 2.20 0.26 -0.79 119.74 122.88 2xe5 s LYS 81 Ca 0.06 -0.09 -0.00 0.00 -0.36 0.00 0.00 55.97 55.57 2xe5 s LYS 81 Cb -0.09 -1.24 -0.03 0.00 -1.51 0.00 0.00 37.83 34.97 2xe5 s LYS 81 CO 0.02 -0.25 -0.07 0.12 -0.36 0.00 0.00 175.35 174.81 2xe5 s PHE 82 N 1.69 2.94 0.24 4.03 5.36 -0.03 -1.02 117.98 131.18 2xe5 s PHE 82 Ca 0.02 -0.15 -0.31 0.00 -0.96 0.00 0.00 56.93 55.53 2xe5 s PHE 82 Cb -0.13 -1.79 -0.11 0.00 -0.34 0.00 0.00 43.02 40.66 2xe5 s PHE 82 CO -0.06 0.16 1.55 -1.14 -1.46 0.00 0.00 175.22 174.27 2xe5 s GLN 83 N -0.35 4.19 -1.68 10.12 2.00 -0.38 -1.78 119.66 131.78 2xe5 s GLN 83 Ca 0.05 2.44 0.00 0.00 -2.00 0.00 0.00 55.36 55.84 2xe5 s GLN 83 Cb -0.12 -3.09 0.00 0.00 0.80 0.00 0.00 33.01 30.60 2xe5 s GLN 83 CO 0.02 -0.57 0.00 -0.25 -0.50 0.00 0.00 175.29 174.00 2xe5 n ASP 84 N 2.85 -4.97 0.00 6.67 8.00 -1.26 -4.70 116.55 123.14 2xe5 n ASP 84 Ca 0.10 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.99 2xe5 n ASP 84 Cb 0.38 -4.20 0.00 0.00 -0.02 0.00 0.00 41.12 37.28 2xe5 n ASP 84 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2xe5 n VAL 85 N -2.16 0.00 0.00 2.53 0.31 -0.92 -4.43 118.33 113.66 2xe5 n VAL 85 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 2xe5 n VAL 85 Cb 0.59 -0.37 0.00 0.00 -0.91 0.00 0.00 33.84 33.15 2xe5 n VAL 85 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2xe5 n GLY 86 N 2.78 0.69 3.33 2.92 0.00 -0.74 -4.81 105.19 109.37 2xe5 n GLY 86 Ca 0.00 -2.11 -0.20 0.00 0.00 0.00 0.00 46.02 43.71 2xe5 n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2xe5 s SER 87 N -3.08 2.57 -0.02 1.61 1.04 0.34 -0.85 113.70 115.31 2xe5 s SER 87 Ca 0.00 -0.93 0.01 0.00 0.48 0.00 0.00 55.95 55.52 2xe5 s SER 87 Cb 0.00 -0.14 0.01 0.00 0.10 0.00 0.00 66.02 65.99 2xe5 s SER 87 CO 0.00 -0.10 -0.04 0.12 0.98 0.00 0.00 173.24 174.19 2xe5 s PHE 88 N -2.46 0.56 0.02 5.02 5.36 0.03 -1.08 117.98 125.42 2xe5 s PHE 88 Ca 0.18 -0.12 -0.08 0.00 -0.96 0.00 0.00 56.93 55.96 2xe5 s PHE 88 Cb -0.03 -0.45 0.00 0.00 -0.34 0.00 0.00 43.02 42.19 2xe5 s PHE 88 CO 0.06 -0.09 0.15 0.16 -1.46 0.00 0.00 175.22 174.04 2xe5 s ASP 89 N 0.40 0.05 -0.01 6.13 1.47 -0.75 -0.52 116.67 123.44 2xe5 s ASP 89 Ca -0.05 -0.28 0.02 0.00 1.18 0.00 0.00 52.55 53.42 2xe5 s ASP 89 Cb -0.08 0.23 -0.00 0.00 -0.34 0.00 0.00 42.92 42.72 2xe5 s ASP 89 CO -0.00 -0.43 -0.08 -0.47 0.68 0.00 0.00 175.17 174.87 2xe5 s TYR 90 N -1.81 0.72 -5.00 2.11 5.04 -0.37 -1.22 117.35 116.81 2xe5 s TYR 90 Ca -0.11 -0.14 0.00 0.00 -2.44 0.00 0.00 57.07 54.38 2xe5 s TYR 90 Cb -0.05 -0.47 0.00 0.00 0.35 0.00 0.00 41.96 41.78 2xe5 s TYR 90 CO -0.00 -0.02 0.00 0.41 -1.34 0.00 0.00 175.55 174.59 2xe5 n GLY 91 N 2.95 -0.01 3.71 8.97 0.00 -1.01 -2.10 105.19 117.70 2xe5 n GLY 91 Ca -0.14 -1.15 -0.40 0.00 0.00 0.00 0.00 46.02 44.33 2xe5 n GLY 91 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2xe5 s ARG 92 N -2.00 4.46 0.00 1.61 3.52 -0.11 -1.06 118.95 125.37 2xe5 s ARG 92 Ca 0.00 1.00 0.00 0.00 -0.13 0.00 0.00 55.73 56.60 2xe5 s ARG 92 Cb 0.00 -3.45 0.00 0.00 -1.56 0.00 0.00 34.95 29.94 2xe5 s ARG 92 CO 0.00 0.03 0.00 -1.71 -0.81 0.00 0.00 175.30 172.81 2xe5 n ASN 93 N 3.84 0.00 -4.71 -2.12 2.85 -0.62 -1.47 115.26 113.03 2xe5 n ASN 93 Ca 0.00 -0.97 -0.39 0.00 -0.11 0.00 0.00 54.58 53.12 2xe5 n ASN 93 Cb 0.51 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 41.47 2xe5 n ASN 93 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 2xe5 s TYR 94 N -8.20 3.50 0.55 1.20 1.51 -1.26 -0.83 117.35 113.82 2xe5 s TYR 94 Ca 0.00 0.94 -0.22 0.00 -1.01 0.00 0.00 57.07 56.78 2xe5 s TYR 94 Cb 0.00 -2.63 -0.05 0.00 -0.11 0.00 0.00 41.96 39.17 2xe5 s TYR 94 CO 0.00 0.10 1.36 0.41 -1.11 0.00 0.00 175.55 176.31 2xe5 n GLY 95 N 3.35 0.78 0.25 0.71 0.00 0.92 -4.91 105.19 106.30 2xe5 n GLY 95 Ca -0.05 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.07 2xe5 n GLY 95 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2xe5 h VAL 96 N 1.43 0.96 -0.91 1.61 3.04 -1.89 -0.73 116.25 119.75 2xe5 h VAL 96 Ca -0.51 -0.37 0.20 0.00 -1.01 0.00 0.00 66.70 65.01 2xe5 h VAL 96 Cb 1.30 1.21 -0.11 0.00 -2.01 0.00 0.00 31.29 31.68 2xe5 h VAL 96 CO 0.57 0.10 0.47 0.58 -1.01 0.00 0.00 177.57 178.28 2xe5 h VAL 97 N 0.00 0.59 0.00 1.51 2.07 -1.85 0.20 116.25 118.78 2xe5 h VAL 97 Ca -0.00 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2xe5 h VAL 97 Cb 0.20 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 2xe5 h VAL 97 CO 0.01 0.10 0.00 0.22 0.02 0.00 0.00 177.57 177.92 2xe5 h TYR 98 N 0.54 0.00 -0.05 1.57 3.20 -1.18 -1.39 116.97 119.66 2xe5 h TYR 98 Ca 0.55 0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.43 2xe5 h TYR 98 Cb 0.94 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.21 2xe5 h TYR 98 CO -0.09 0.00 0.06 -0.44 -1.64 0.00 0.00 178.16 176.05 2xe5 h ASP 99 N 0.00 0.00 0.00 -2.11 3.32 -1.07 -1.81 116.42 114.75 2xe5 h ASP 99 Ca 0.00 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.81 2xe5 h ASP 99 Cb 0.08 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.59 2xe5 h ASP 99 CO 0.00 0.00 -1.84 0.52 -1.72 0.00 0.00 179.24 176.20 2xe5 n VAL 100 N -3.92 0.83 0.27 -1.35 0.31 -0.58 -4.64 118.33 109.26 2xe5 n VAL 100 Ca -0.02 -0.26 0.12 0.00 -0.01 0.00 0.00 64.34 64.18 2xe5 n VAL 100 Cb 0.15 -1.41 0.76 0.00 -0.91 0.00 0.00 33.84 32.43 2xe5 n VAL 100 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2xe5 h THR 101 N -0.31 0.69 -0.18 2.52 1.35 -1.46 -1.84 112.91 113.68 2xe5 h THR 101 Ca -0.36 -0.28 0.05 0.00 -0.55 0.00 0.00 66.41 65.27 2xe5 h THR 101 Cb 1.41 1.17 -0.01 0.00 -1.73 0.00 0.00 68.15 68.99 2xe5 h THR 101 CO -0.16 0.07 0.21 0.77 -0.25 0.00 0.00 175.52 176.16 2xe5 h SER 102 N 0.00 0.00 -0.03 5.36 4.64 -1.58 -2.78 113.55 119.16 2xe5 h SER 102 Ca -0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2xe5 h SER 102 Cb 0.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2xe5 h SER 102 CO 0.01 0.00 0.03 -0.50 -0.87 0.00 0.00 176.83 175.50 2xe5 h TRP 103 N 0.00 0.00 -0.01 4.77 6.55 -1.59 -1.46 115.95 124.21 2xe5 h TRP 103 Ca 0.09 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.93 2xe5 h TRP 103 Cb 0.51 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.81 2xe5 h TRP 103 CO 0.00 0.00 -0.52 0.25 -1.05 0.00 0.00 178.44 177.12 2xe5 n THR 104 N -3.87 0.00 -1.64 1.49 -2.24 -1.05 -4.70 114.28 102.27 2xe5 n THR 104 Ca -0.02 -0.24 -0.40 0.00 -2.27 0.00 0.00 64.05 61.12 2xe5 n THR 104 Cb 0.12 1.19 -0.02 0.00 -2.10 0.00 0.00 70.33 69.52 2xe5 n THR 104 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2xe5 n ASP 105 N -0.32 8.34 -0.26 3.42 2.03 -0.55 -4.42 116.55 124.78 2xe5 n ASP 105 Ca 0.07 -2.84 0.04 0.00 0.52 0.00 0.00 54.79 52.58 2xe5 n ASP 105 Cb 0.40 -1.47 0.05 0.00 -0.72 0.00 0.00 41.12 39.38 2xe5 n ASP 105 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2xe5 n VAL 106 N 2.75 0.79 -1.80 5.18 0.24 -1.26 -4.96 118.33 119.26 2xe5 n VAL 106 Ca 0.71 -0.94 -0.31 0.00 -2.04 0.00 0.00 64.34 61.76 2xe5 n VAL 106 Cb 0.24 0.26 0.02 0.00 -1.47 0.00 0.00 33.84 32.90 2xe5 n VAL 106 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2xe5 s LEU 107 N -1.17 3.15 0.20 1.34 1.43 -1.26 -4.98 118.68 117.39 2xe5 s LEU 107 Ca 0.12 1.42 -0.11 0.00 -1.03 0.00 0.00 54.13 54.53 2xe5 s LEU 107 Cb 0.11 -4.39 0.16 0.00 0.03 0.00 0.00 46.19 42.09 2xe5 s LEU 107 CO 0.01 -1.07 1.84 -0.65 0.23 0.00 0.00 176.35 176.71 2xe5 h PRO 108 N -0.46 0.75 0.00 1.29 0.11 -1.96 -3.42 132.00 128.32 2xe5 h PRO 108 Ca -0.44 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2xe5 h PRO 108 Cb 1.20 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2xe5 h PRO 108 CO 0.61 0.50 -0.24 -1.91 -0.21 0.00 0.00 178.00 176.75 2xe5 n GLU 109 N -4.71 0.00 -0.03 1.05 4.07 -1.26 -5.07 120.64 114.69 2xe5 n GLU 109 Ca 0.06 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.16 2xe5 n GLU 109 Cb 0.08 -0.53 0.00 0.00 -0.06 0.00 0.00 31.44 30.93 2xe5 n GLU 109 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 2xe5 n PHE 110 N -1.89 -0.51 0.00 4.31 3.72 -1.26 -5.03 117.46 116.79 2xe5 n PHE 110 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2xe5 n PHE 110 Cb 0.12 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 2xe5 n PHE 110 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2xe5 n GLY 111 N 5.00 -1.02 2.38 1.37 0.00 -1.26 -4.44 105.19 107.22 2xe5 n GLY 111 Ca 0.00 -1.65 -0.15 0.00 0.00 0.00 0.00 46.02 44.22 2xe5 n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xe5 n GLY 112 N -1.12 0.77 0.77 -0.02 0.00 -1.26 -4.88 105.19 99.44 2xe5 n GLY 112 Ca 0.00 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.81 2xe5 n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2xe5 n ASP 113 N -0.68 1.54 -0.39 1.61 5.75 -1.26 -4.36 116.55 118.76 2xe5 n ASP 113 Ca -0.17 -3.34 0.04 0.00 -0.01 0.00 0.00 54.79 51.32 2xe5 n ASP 113 Cb 0.56 -0.46 0.13 0.00 -1.03 0.00 0.00 41.12 40.33 2xe5 n ASP 113 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2xe5 n THR 114 N -0.73 0.27 -3.88 2.12 -2.24 -1.26 -4.89 114.28 103.67 2xe5 n THR 114 Ca 0.15 -0.28 -0.09 0.00 -2.27 0.00 0.00 64.05 61.56 2xe5 n THR 114 Cb 0.80 0.14 -0.00 0.00 -2.10 0.00 0.00 70.33 69.16 2xe5 n THR 114 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2xe5 s TYR 115 N -1.73 0.20 0.27 4.78 1.13 -1.26 -4.87 117.35 115.87 2xe5 s TYR 115 Ca 0.16 -0.74 0.03 0.00 -1.41 0.00 0.00 57.07 55.11 2xe5 s TYR 115 Cb 0.08 0.62 -0.06 0.00 -1.10 0.00 0.00 41.96 41.51 2xe5 s TYR 115 CO 0.11 -1.38 0.04 -0.51 -2.51 0.00 0.00 175.55 171.30 2xe5 s ASP 116 N -3.05 1.82 0.57 -0.18 1.01 -1.26 -5.03 116.67 110.55 2xe5 s ASP 116 Ca 0.17 -1.31 -0.20 0.00 0.71 0.00 0.00 52.55 51.92 2xe5 s ASP 116 Cb -0.04 0.02 -0.04 0.00 1.01 0.00 0.00 42.92 43.87 2xe5 s ASP 116 CO 0.11 -0.60 1.22 -0.44 0.21 0.00 0.00 175.17 175.67 2xe5 s SER 117 N -3.36 5.32 -1.40 0.27 0.01 -1.26 -3.95 113.70 109.32 2xe5 s SER 117 Ca 0.34 2.42 -0.05 0.00 1.31 0.00 0.00 55.95 59.96 2xe5 s SER 117 Cb 0.07 -2.60 0.03 0.00 0.21 0.00 0.00 66.02 63.73 2xe5 s SER 117 CO 0.12 -1.51 0.80 0.47 0.41 0.00 0.00 173.24 173.54 2xe5 n ASP 118 N -1.40 -2.58 -3.28 2.44 8.00 0.80 -4.91 116.55 115.61 2xe5 n ASP 118 Ca 0.13 -0.81 -0.25 0.00 0.71 0.00 0.00 54.79 54.56 2xe5 n ASP 118 Cb 0.49 -3.96 -0.07 0.00 -0.02 0.00 0.00 41.12 37.56 2xe5 n ASP 118 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2xe5 n ASN 119 N -2.97 2.15 0.00 -2.24 4.05 -1.25 -4.02 115.26 110.97 2xe5 n ASN 119 Ca -0.17 -3.12 0.00 0.00 0.45 0.00 0.00 54.58 51.74 2xe5 n ASN 119 Cb 0.62 -0.65 0.00 0.00 1.23 0.00 0.00 39.78 40.98 2xe5 n ASN 119 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 2xe5 n PHE 120 N 0.98 0.00 -1.03 1.20 3.72 -1.26 -2.90 117.46 118.17 2xe5 n PHE 120 Ca 0.26 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.64 2xe5 n PHE 120 Cb 0.47 0.02 0.32 0.00 -0.94 0.00 0.00 39.48 39.36 2xe5 n PHE 120 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 2xe5 n MET 121 N 14.00 3.89 0.04 -1.08 2.81 -1.26 -4.44 117.12 131.08 2xe5 n MET 121 Ca 0.00 -3.10 -0.09 0.00 -1.81 0.00 0.00 57.70 52.70 2xe5 n MET 121 Cb 0.00 -2.20 -0.13 0.00 -0.71 0.00 0.00 33.22 30.18 2xe5 n MET 121 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 2xe5 h GLN 122 N 2.86 0.05 0.00 0.03 4.20 -1.84 -3.22 115.11 117.19 2xe5 h GLN 122 Ca 0.19 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.82 2xe5 h GLN 122 Cb 2.19 0.03 0.00 0.00 0.30 0.00 0.00 27.48 30.00 2xe5 h GLN 122 CO 0.65 0.91 0.00 0.94 -0.67 0.00 0.00 178.83 180.65 2xe5 n GLN 123 N -3.30 0.00 -2.17 1.46 7.27 -1.26 -3.59 117.38 115.79 2xe5 n GLN 123 Ca -0.07 0.00 -0.36 0.00 0.07 0.00 0.00 57.00 56.64 2xe5 n GLN 123 Cb 0.99 0.00 0.01 0.00 2.41 0.00 0.00 30.24 33.64 2xe5 n GLN 123 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2xe5 s ARG 124 N 4.98 3.38 -0.06 3.69 0.52 -1.26 -0.06 118.95 130.15 2xe5 s ARG 124 Ca 0.00 1.75 -0.31 0.00 -0.52 0.00 0.00 55.73 56.65 2xe5 s ARG 124 Cb 0.00 -2.13 0.12 0.00 0.52 0.00 0.00 34.95 33.46 2xe5 s ARG 124 CO 0.00 -0.86 1.15 0.20 0.02 0.00 0.00 175.30 175.81 2xe5 s GLY 125 N -1.55 -0.35 0.17 -3.53 0.00 -0.01 -0.14 107.32 101.91 2xe5 s GLY 125 Ca 0.71 1.00 -0.22 0.00 0.00 0.00 0.00 44.72 46.22 2xe5 s GLY 125 CO 0.32 0.29 0.71 -1.31 0.00 0.00 0.00 173.10 173.11 2xe5 s ASN 126 N -2.60 7.17 -0.35 1.64 0.02 -1.26 -1.58 114.94 117.98 2xe5 s ASN 126 Ca 0.11 1.47 -0.02 0.00 -1.02 0.00 0.00 52.86 53.39 2xe5 s ASN 126 Cb 0.01 -2.43 0.00 0.00 0.02 0.00 0.00 41.25 38.85 2xe5 s ASN 126 CO -0.04 0.14 0.30 0.61 0.02 0.00 0.00 177.10 178.13 2xe5 n GLY 127 N 1.21 0.48 3.66 0.66 0.00 -0.95 -4.62 105.19 105.64 2xe5 n GLY 127 Ca -0.05 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.17 2xe5 n GLY 127 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2xe5 s PHE 128 N -3.09 3.38 -0.37 1.61 0.08 -0.22 -2.15 117.98 117.23 2xe5 s PHE 128 Ca 0.12 0.91 -0.13 0.00 0.12 0.00 0.00 56.93 57.95 2xe5 s PHE 128 Cb -0.05 -2.77 0.01 0.00 -0.57 0.00 0.00 43.02 39.63 2xe5 s PHE 128 CO 0.19 -0.15 0.24 0.00 -0.10 0.00 0.00 175.22 175.40 2xe5 s ALA 129 N 1.82 3.41 -0.14 5.36 0.00 0.47 -2.41 121.76 130.27 2xe5 s ALA 129 Ca 0.28 -1.57 0.02 0.00 0.00 0.00 0.00 51.96 50.69 2xe5 s ALA 129 Cb -0.16 -2.68 0.02 0.00 0.00 0.00 0.00 23.12 20.29 2xe5 s ALA 129 CO 0.10 -1.21 -0.19 0.99 0.00 0.00 0.00 175.76 175.46 2xe5 s THR 130 N 1.66 1.84 -0.13 0.00 2.01 -0.36 -1.11 115.64 119.54 2xe5 s THR 130 Ca 0.05 -0.83 -0.06 0.00 0.31 0.00 0.00 61.69 61.16 2xe5 s THR 130 Cb -0.18 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.63 2xe5 s THR 130 CO 0.09 0.51 0.09 -0.31 -0.69 0.00 0.00 174.62 174.30 2xe5 s TYR 131 N 1.08 3.39 0.00 4.92 2.02 0.13 -1.81 117.35 127.08 2xe5 s TYR 131 Ca -0.02 0.32 0.02 0.00 -0.37 0.00 0.00 57.07 57.02 2xe5 s TYR 131 Cb -0.14 -1.95 -0.01 0.00 -0.40 0.00 0.00 41.96 39.46 2xe5 s TYR 131 CO -0.06 0.50 -0.07 1.03 -1.57 0.00 0.00 175.55 175.38 2xe5 s ARG 132 N -0.56 0.53 -0.09 -0.62 0.52 -0.24 -1.56 118.95 116.93 2xe5 s ARG 132 Ca 0.11 -0.32 0.01 0.00 -0.52 0.00 0.00 55.73 55.01 2xe5 s ARG 132 Cb -0.12 -0.49 0.02 0.00 0.52 0.00 0.00 34.95 34.88 2xe5 s ARG 132 CO 0.02 0.13 -0.10 1.21 0.02 0.00 0.00 175.30 176.58 2xe5 s ASN 133 N -0.38 2.01 -0.10 0.23 3.84 0.03 -0.50 114.94 120.08 2xe5 s ASN 133 Ca 0.01 -0.31 0.01 0.00 0.21 0.00 0.00 52.86 52.78 2xe5 s ASN 133 Cb -0.04 -0.85 -0.02 0.00 -0.55 0.00 0.00 41.25 39.79 2xe5 s ASN 133 CO -0.00 -0.04 -0.14 0.42 -2.79 0.00 0.00 177.10 174.55 2xe5 s THR 134 N 1.20 3.06 -1.52 -5.21 -4.23 -1.26 -1.28 115.64 106.39 2xe5 s THR 134 Ca -0.04 -0.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.78 2xe5 s THR 134 Cb -0.14 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.45 2xe5 s THR 134 CO -0.03 0.55 0.00 0.47 -0.54 0.00 0.00 174.62 175.07 2xe5 n ASP 135 N 3.02 -4.99 -3.49 3.99 8.00 0.28 -3.97 116.55 119.40 2xe5 n ASP 135 Ca -0.18 0.08 -0.36 0.00 0.71 0.00 0.00 54.79 55.04 2xe5 n ASP 135 Cb 0.52 -4.06 0.03 0.00 -0.02 0.00 0.00 41.12 37.59 2xe5 n ASP 135 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2xe5 n PHE 136 N -3.69 -2.50 -2.17 1.24 7.35 -0.18 -0.86 117.46 116.66 2xe5 n PHE 136 Ca -0.19 1.05 -0.15 0.00 -0.76 0.00 0.00 57.45 57.40 2xe5 n PHE 136 Cb 0.63 -1.83 -0.02 0.00 0.35 0.00 0.00 39.48 38.61 2xe5 n PHE 136 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 2xe5 n PHE 137 N -0.55 -1.05 -1.00 -5.13 3.72 -1.25 -0.47 117.46 111.74 2xe5 n PHE 137 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 2xe5 n PHE 137 Cb 0.67 -2.99 0.00 0.00 -0.94 0.00 0.00 39.48 36.22 2xe5 n PHE 137 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2xe5 n GLY 138 N -0.71 0.62 0.09 1.37 0.00 -0.62 -4.82 105.19 101.12 2xe5 n GLY 138 Ca -0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 2xe5 n GLY 138 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2xe5 n LEU 139 N 0.00 0.33 -3.75 0.99 4.77 0.38 -4.83 117.00 114.89 2xe5 n LEU 139 Ca 0.00 0.16 -0.30 0.00 -0.03 0.00 0.00 56.01 55.84 2xe5 n LEU 139 Cb 0.01 0.34 -0.15 0.00 -2.33 0.00 0.00 43.42 41.29 2xe5 n LEU 139 CO 0.00 0.41 -0.32 -0.69 -1.33 0.00 0.00 177.39 175.46 2xe5 s VAL 140 N -2.62 1.05 0.08 4.08 1.01 -0.38 -5.01 120.40 118.61 2xe5 s VAL 140 Ca -0.08 -1.61 -0.31 0.00 0.00 0.00 0.00 61.98 59.98 2xe5 s VAL 140 Cb 0.07 -1.79 -0.10 0.00 0.00 0.00 0.00 36.38 34.56 2xe5 s VAL 140 CO 0.83 -0.70 1.89 0.47 0.00 0.00 0.00 175.10 177.60 2xe5 n ASP 141 N 4.65 4.03 0.00 3.32 8.00 -1.26 -1.65 116.55 133.64 2xe5 n ASP 141 Ca -0.00 0.96 0.00 0.00 0.71 0.00 0.00 54.79 56.45 2xe5 n ASP 141 Cb 0.41 -1.52 0.00 0.00 -0.02 0.00 0.00 41.12 39.99 2xe5 n ASP 141 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2xe5 n GLY 142 N 4.35 0.50 3.50 0.44 0.00 -1.26 -4.85 105.19 107.86 2xe5 n GLY 142 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 2xe5 n GLY 142 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2xe5 s LEU 143 N 0.00 4.68 0.11 0.99 2.96 -0.66 -2.23 118.68 124.54 2xe5 s LEU 143 Ca 0.00 -0.52 0.09 0.00 -0.22 0.00 0.00 54.13 53.48 2xe5 s LEU 143 Cb 0.00 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.08 2xe5 s LEU 143 CO 0.00 -0.71 -0.20 -1.81 -1.32 0.00 0.00 176.35 172.31 2xe5 s ASP 144 N 1.98 3.76 0.13 3.68 1.01 -0.32 -0.55 116.67 126.36 2xe5 s ASP 144 Ca 0.18 -0.59 -0.15 0.00 0.71 0.00 0.00 52.55 52.70 2xe5 s ASP 144 Cb -0.16 -0.48 0.03 0.00 1.01 0.00 0.00 42.92 43.32 2xe5 s ASP 144 CO 0.16 0.18 0.38 0.72 0.21 0.00 0.00 175.17 176.83 2xe5 s PHE 145 N -1.11 -0.13 -0.05 4.23 -0.71 -0.41 -1.10 117.98 118.70 2xe5 s PHE 145 Ca 0.17 -0.21 -0.04 0.00 -1.04 0.00 0.00 56.93 55.81 2xe5 s PHE 145 Cb -0.10 0.22 0.02 0.00 -1.21 0.00 0.00 43.02 41.94 2xe5 s PHE 145 CO 0.09 -0.70 0.13 0.00 -1.34 0.00 0.00 175.22 173.39 2xe5 s ALA 146 N -3.82 -0.31 -0.08 1.99 0.00 -0.30 -0.79 121.76 118.46 2xe5 s ALA 146 Ca 0.04 0.40 0.04 0.00 0.00 0.00 0.00 51.96 52.44 2xe5 s ALA 146 Cb 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 2xe5 s ALA 146 CO -0.11 -0.07 -0.21 0.08 0.00 0.00 0.00 175.76 175.45 2xe5 s VAL 147 N 0.20 2.39 -0.01 0.00 1.01 -0.60 -1.34 120.40 122.05 2xe5 s VAL 147 Ca -0.01 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.04 2xe5 s VAL 147 Cb -0.02 -1.91 0.01 0.00 0.00 0.00 0.00 36.38 34.45 2xe5 s VAL 147 CO -0.01 0.56 -0.02 -1.58 0.00 0.00 0.00 175.10 174.05 2xe5 s GLN 148 N -0.08 0.28 -0.05 2.72 0.74 0.18 -0.70 119.66 122.76 2xe5 s GLN 148 Ca -0.05 -0.07 0.05 0.00 0.05 0.00 0.00 55.36 55.34 2xe5 s GLN 148 Cb -0.14 -0.32 -0.02 0.00 1.10 0.00 0.00 33.01 33.63 2xe5 s GLN 148 CO 0.04 0.02 -0.21 0.71 -0.55 0.00 0.00 175.29 175.30 2xe5 s TYR 149 N 0.21 2.52 -0.15 1.67 2.02 -0.27 -0.53 117.35 122.81 2xe5 s TYR 149 Ca -0.02 -0.46 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 2xe5 s TYR 149 Cb -0.05 -1.60 0.02 0.00 -0.40 0.00 0.00 41.96 39.93 2xe5 s TYR 149 CO -0.00 -0.04 -0.19 -1.14 -1.57 0.00 0.00 175.55 172.61 2xe5 s GLN 150 N -0.43 2.74 0.41 -0.62 0.74 -0.48 -0.39 119.66 121.63 2xe5 s GLN 150 Ca 0.04 -0.74 -0.23 0.00 0.05 0.00 0.00 55.36 54.49 2xe5 s GLN 150 Cb -0.12 -2.33 -0.10 0.00 1.10 0.00 0.00 33.01 31.56 2xe5 s GLN 150 CO 0.01 -0.14 1.00 0.20 -0.55 0.00 0.00 175.29 175.82 2xe5 s GLY 151 N 1.15 2.61 -0.24 2.59 0.00 -0.91 -0.80 107.32 111.72 2xe5 s GLY 151 Ca -0.00 0.56 -0.43 0.00 0.00 0.00 0.00 44.72 44.85 2xe5 s GLY 151 CO -0.08 0.93 1.32 1.17 0.00 0.00 0.00 173.10 176.44 2xe5 n LYS 152 N -0.26 0.00 -4.01 2.90 4.81 -1.26 -4.71 118.16 115.63 2xe5 n LYS 152 Ca 0.06 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.17 2xe5 n LYS 152 Cb 0.51 -1.49 -0.15 0.00 0.02 0.00 0.00 35.03 33.93 2xe5 n LYS 152 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2xe5 s ASN 153 N 1.41 4.65 0.00 3.14 0.01 -0.16 -4.95 114.94 119.04 2xe5 s ASN 153 Ca 0.97 -1.59 0.00 0.00 -0.71 0.00 0.00 52.86 51.53 2xe5 s ASN 153 Cb -1.37 -1.61 0.00 0.00 0.41 0.00 0.00 41.25 38.67 2xe5 s ASN 153 CO 0.69 -0.27 0.00 0.61 -1.51 0.00 0.00 177.10 176.62 2xe5 n GLY 154 N 4.43 3.91 3.89 0.66 0.00 -1.26 -1.06 105.19 115.76 2xe5 n GLY 154 Ca -0.09 -1.90 -0.29 0.00 0.00 0.00 0.00 46.02 43.74 2xe5 n GLY 154 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2xe5 s SER 155 N 0.03 5.59 0.38 1.61 1.04 -0.82 -0.35 113.70 121.18 2xe5 s SER 155 Ca 0.00 1.04 0.25 0.00 0.48 0.00 0.00 55.95 57.72 2xe5 s SER 155 Cb 0.00 -1.94 0.59 0.00 0.10 0.00 0.00 66.02 64.77 2xe5 s SER 155 CO 0.00 -1.19 1.69 0.00 0.98 0.00 0.00 173.24 174.72 2xe5 h ALA 156 N -0.46 1.00 -2.98 5.32 0.00 -1.73 -2.89 119.26 117.52 2xe5 h ALA 156 Ca -0.45 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.30 2xe5 h ALA 156 Cb 1.25 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 18.81 2xe5 h ALA 156 CO 0.63 0.00 -0.51 -1.01 0.00 0.00 0.00 179.25 178.35 2xe5 s HIS 157 N -3.22 -0.03 0.00 0.00 3.76 -1.26 -4.92 115.29 109.61 2xe5 s HIS 157 Ca 0.07 0.05 0.00 0.00 -0.15 0.00 0.00 55.06 55.04 2xe5 s HIS 157 Cb 0.08 -0.01 0.00 0.00 1.11 0.00 0.00 32.58 33.75 2xe5 s HIS 157 CO 0.63 -0.21 0.00 0.41 -0.85 0.00 0.00 174.74 174.72 2xe5 n GLY 158 N 2.01 0.55 3.77 -2.22 0.00 -1.26 -4.60 105.19 103.45 2xe5 n GLY 158 Ca -0.19 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.56 2xe5 n GLY 158 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2xe5 s GLU 159 N 0.00 4.09 -0.20 1.61 2.02 -1.26 -2.86 118.70 122.10 2xe5 s GLU 159 Ca 0.00 2.43 0.00 0.00 0.02 0.00 0.00 54.97 57.42 2xe5 s GLU 159 Cb 0.00 -2.93 0.00 0.00 0.10 0.00 0.00 34.13 31.30 2xe5 s GLU 159 CO 0.00 -0.49 0.00 0.41 0.02 0.00 0.00 175.26 175.20 2xe5 n GLY 160 N 0.57 0.54 3.75 -1.39 0.00 -1.26 -4.75 105.19 102.65 2xe5 n GLY 160 Ca 0.02 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 2xe5 n GLY 160 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2xe5 s MET 161 N -1.49 4.41 0.32 1.61 0.00 -1.13 -1.94 119.30 121.07 2xe5 s MET 161 Ca 0.00 2.08 0.11 0.00 0.00 0.00 0.00 55.69 57.87 2xe5 s MET 161 Cb 0.00 -3.15 -0.06 0.00 0.00 0.00 0.00 34.83 31.62 2xe5 s MET 161 CO 0.00 -0.16 -0.14 0.95 0.00 0.00 0.00 175.02 175.67 2xe5 s THR 162 N -0.53 2.34 0.49 10.11 -4.23 -1.09 -4.83 115.64 117.89 2xe5 s THR 162 Ca 0.52 -2.30 0.16 0.00 -1.18 0.00 0.00 61.69 58.90 2xe5 s THR 162 Cb -0.37 -2.49 0.31 0.00 1.34 0.00 0.00 72.50 71.28 2xe5 s THR 162 CO 0.44 -0.29 2.07 0.00 -0.54 0.00 0.00 174.62 176.30 2xe5 h THR 163 N 2.13 0.94 -0.83 3.99 1.03 -1.95 -0.63 112.91 117.59 2xe5 h THR 163 Ca -0.41 -0.06 -0.51 0.00 -0.01 0.00 0.00 66.41 65.42 2xe5 h THR 163 Cb 1.25 0.76 -0.28 0.00 -1.07 0.00 0.00 68.15 68.82 2xe5 h THR 163 CO 0.66 0.03 0.38 -0.46 -0.01 0.00 0.00 175.52 176.12 2xe5 n ASN 164 N -4.48 5.04 -4.73 0.00 6.94 -1.26 -5.05 115.26 111.72 2xe5 n ASN 164 Ca 0.03 -3.73 -0.36 0.00 -0.02 0.00 0.00 54.58 50.49 2xe5 n ASN 164 Cb 0.25 -0.78 0.08 0.00 -2.36 0.00 0.00 39.78 36.96 2xe5 n ASN 164 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2xe5 s GLY 165 N -2.06 2.76 -0.00 4.83 0.00 -0.25 -4.71 107.32 107.89 2xe5 s GLY 165 Ca 0.56 1.16 0.01 0.00 0.00 0.00 0.00 44.72 46.46 2xe5 s GLY 165 CO 0.03 1.59 -0.03 1.09 0.00 0.00 0.00 173.10 175.78 2xe5 s ARG 166 N -3.49 0.29 0.35 2.90 3.03 0.53 -4.21 118.95 118.35 2xe5 s ARG 166 Ca 0.81 -0.12 0.24 0.00 2.03 0.00 0.00 55.73 58.69 2xe5 s ARG 166 Cb -0.36 -0.28 0.42 0.00 -1.03 0.00 0.00 34.95 33.69 2xe5 s ARG 166 CO 0.41 0.07 1.58 -0.44 -1.13 0.00 0.00 175.30 175.79 2xe5 h ASP 167 N 6.11 0.00 -3.16 -2.89 3.32 -1.92 -3.36 116.42 114.52 2xe5 h ASP 167 Ca -0.27 -0.01 -0.56 0.00 0.02 0.00 0.00 57.03 56.20 2xe5 h ASP 167 Cb 1.20 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.69 2xe5 h ASP 167 CO 0.50 0.01 1.09 -0.62 -1.72 0.00 0.00 179.24 178.50 2xe5 s ASP 168 N -5.62 6.26 0.47 6.45 -1.08 -1.26 -4.85 116.67 117.04 2xe5 s ASP 168 Ca 0.07 0.73 0.17 0.00 -0.52 0.00 0.00 52.55 53.00 2xe5 s ASP 168 Cb 0.08 -2.54 1.14 0.00 -1.46 0.00 0.00 42.92 40.14 2xe5 s ASP 168 CO 0.67 -1.51 2.01 0.58 0.52 0.00 0.00 175.17 177.43 2xe5 h VAL 169 N 6.47 0.88 0.00 1.11 2.07 -1.96 0.04 116.25 124.87 2xe5 h VAL 169 Ca -0.28 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.15 2xe5 h VAL 169 Cb 1.11 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2xe5 h VAL 169 CO 1.10 0.05 0.00 0.49 0.02 0.00 0.00 177.57 179.23 2xe5 n PHE 170 N -4.46 0.68 0.04 1.57 3.72 -1.26 -2.79 117.46 114.97 2xe5 n PHE 170 Ca 0.08 0.27 0.08 0.00 -0.05 0.00 0.00 57.45 57.83 2xe5 n PHE 170 Cb 0.38 -0.93 0.17 0.00 -0.94 0.00 0.00 39.48 38.16 2xe5 n PHE 170 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2xe5 n GLU 171 N -2.12 2.29 -3.01 -1.08 1.02 -0.00 -4.52 120.64 113.21 2xe5 n GLU 171 Ca 0.02 -2.01 -0.22 0.00 -0.02 0.00 0.00 57.16 54.93 2xe5 n GLU 171 Cb 0.22 -1.35 0.01 0.00 -0.02 0.00 0.00 31.44 30.30 2xe5 n GLU 171 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2xe5 s GLN 172 N -1.10 3.04 0.01 3.49 -0.21 -1.12 -4.90 119.66 118.87 2xe5 s GLN 172 Ca 0.28 -0.56 -0.28 0.00 0.02 0.00 0.00 55.36 54.83 2xe5 s GLN 172 Cb 0.16 -2.58 0.09 0.00 1.00 0.00 0.00 33.01 31.68 2xe5 s GLN 172 CO 0.21 -0.26 0.77 0.54 -2.12 0.00 0.00 175.29 174.43 2xe5 s ASN 173 N -4.22 -0.50 0.58 5.90 4.22 -0.22 -4.64 114.94 116.05 2xe5 s ASN 173 Ca 0.48 0.25 -0.01 0.00 -2.14 0.00 0.00 52.86 51.45 2xe5 s ASN 173 Cb -0.10 0.48 0.05 0.00 1.28 0.00 0.00 41.25 42.96 2xe5 s ASN 173 CO 0.37 -0.68 0.36 0.61 -2.04 0.00 0.00 177.10 175.73 2xe5 n GLY 174 N 0.18 0.42 3.70 0.45 0.00 0.46 -0.99 105.19 109.41 2xe5 n GLY 174 Ca -0.14 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 2xe5 n GLY 174 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2xe5 n ASP 175 N -3.02 3.15 -4.06 1.61 8.00 -1.26 -3.98 116.55 117.00 2xe5 n ASP 175 Ca 0.06 1.16 -0.07 0.00 0.71 0.00 0.00 54.79 56.64 2xe5 n ASP 175 Cb 0.20 -1.50 -0.10 0.00 -0.02 0.00 0.00 41.12 39.71 2xe5 n ASP 175 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2xe5 s GLY 176 N 0.27 0.41 -0.00 0.44 0.00 0.02 -1.05 107.32 107.41 2xe5 s GLY 176 Ca 0.65 -1.11 -0.02 0.00 0.00 0.00 0.00 44.72 44.24 2xe5 s GLY 176 CO 0.51 -1.23 0.03 0.14 0.00 0.00 0.00 173.10 172.56 2xe5 s VAL 177 N -3.83 0.05 0.19 1.40 1.01 -0.13 -1.38 120.40 117.71 2xe5 s VAL 177 Ca 0.06 -0.41 -0.19 0.00 0.00 0.00 0.00 61.98 61.44 2xe5 s VAL 177 Cb 0.07 -0.19 0.04 0.00 0.00 0.00 0.00 36.38 36.30 2xe5 s VAL 177 CO -0.10 -0.23 0.55 -0.83 0.00 0.00 0.00 175.10 174.49 2xe5 s GLY 178 N -0.69 -0.22 0.10 4.51 0.00 0.31 -0.90 107.32 110.43 2xe5 s GLY 178 Ca -0.08 -0.06 -0.09 0.00 0.00 0.00 0.00 44.72 44.49 2xe5 s GLY 178 CO -0.00 -0.15 0.21 -0.32 0.00 0.00 0.00 173.10 172.84 2xe5 s GLY 179 N -2.85 0.12 -0.02 0.20 0.00 -0.11 -0.65 107.32 104.01 2xe5 s GLY 179 Ca 0.07 -0.62 -0.13 0.00 0.00 0.00 0.00 44.72 44.05 2xe5 s GLY 179 CO -0.05 -0.78 0.27 -1.35 0.00 0.00 0.00 173.10 171.19 2xe5 s SER 180 N -2.87 -0.15 -0.01 1.64 1.04 -0.45 -1.56 113.70 111.33 2xe5 s SER 180 Ca 0.06 0.07 0.02 0.00 0.48 0.00 0.00 55.95 56.58 2xe5 s SER 180 Cb 0.05 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.48 2xe5 s SER 180 CO -0.10 -0.40 -0.05 -0.63 0.98 0.00 0.00 173.24 173.04 2xe5 s ILE 181 N -1.20 0.43 -0.04 -1.02 1.01 -0.07 -1.14 121.20 119.17 2xe5 s ILE 181 Ca -0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 60.65 60.29 2xe5 s ILE 181 Cb -0.05 -0.39 0.01 0.00 0.01 0.00 0.00 42.46 42.03 2xe5 s ILE 181 CO 0.03 0.14 0.12 0.42 0.00 0.00 0.00 174.94 175.65 2xe5 s THR 182 N 0.11 -0.00 -0.10 2.92 -4.23 -0.26 -1.12 115.64 112.96 2xe5 s THR 182 Ca -0.01 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.51 2xe5 s THR 182 Cb -0.05 -0.17 0.02 0.00 1.34 0.00 0.00 72.50 73.64 2xe5 s THR 182 CO -0.00 0.00 -0.11 -0.47 -0.54 0.00 0.00 174.62 173.50 2xe5 s TYR 183 N 0.07 1.65 -0.10 3.99 5.04 0.05 -1.17 117.35 126.88 2xe5 s TYR 183 Ca -0.00 -0.77 0.03 0.00 -2.44 0.00 0.00 57.07 53.89 2xe5 s TYR 183 Cb -0.01 -1.26 0.01 0.00 0.35 0.00 0.00 41.96 41.05 2xe5 s TYR 183 CO 0.00 -0.46 -0.19 -0.80 -1.34 0.00 0.00 175.55 172.76 2xe5 s ASN 184 N 1.24 2.67 -0.08 4.32 0.01 -0.95 -1.53 114.94 120.61 2xe5 s ASN 184 Ca -0.03 -0.48 -0.03 0.00 -0.71 0.00 0.00 52.86 51.60 2xe5 s ASN 184 Cb -0.14 -1.22 0.04 0.00 0.41 0.00 0.00 41.25 40.35 2xe5 s ASN 184 CO -0.04 0.09 0.17 -0.47 -1.51 0.00 0.00 177.10 175.34 2xe5 s TYR 185 N 0.64 -0.20 -1.64 2.20 5.04 -0.05 -4.45 117.35 118.89 2xe5 s TYR 185 Ca -0.13 0.59 -0.15 0.00 -2.44 0.00 0.00 57.07 54.94 2xe5 s TYR 185 Cb -0.16 -0.16 0.13 0.00 0.35 0.00 0.00 41.96 42.12 2xe5 s TYR 185 CO 0.04 -0.23 0.76 0.39 -1.34 0.00 0.00 175.55 175.16 2xe5 n GLU 186 N 4.81 -3.48 0.00 4.97 -0.58 -1.26 -1.08 120.64 124.02 2xe5 n GLU 186 Ca -0.15 0.40 0.00 0.00 -0.42 0.00 0.00 57.16 57.00 2xe5 n GLU 186 Cb 0.51 -5.06 0.00 0.00 -0.57 0.00 0.00 31.44 26.32 2xe5 n GLU 186 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2xe5 n GLY 187 N -1.53 2.82 3.81 0.62 0.00 -1.26 -4.96 105.19 104.70 2xe5 n GLY 187 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 2xe5 n GLY 187 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2xe5 s PHE 188 N -2.22 3.74 -0.02 1.61 0.08 -0.25 -0.38 117.98 120.54 2xe5 s PHE 188 Ca 0.00 1.37 0.00 0.00 0.12 0.00 0.00 56.93 58.43 2xe5 s PHE 188 Cb 0.00 -2.59 0.03 0.00 -0.57 0.00 0.00 43.02 39.88 2xe5 s PHE 188 CO 0.00 0.45 0.01 0.20 -0.10 0.00 0.00 175.22 175.77 2xe5 s GLY 189 N -1.42 0.19 0.07 4.36 0.00 0.16 -0.87 107.32 109.81 2xe5 s GLY 189 Ca 0.37 0.19 0.08 0.00 0.00 0.00 0.00 44.72 45.36 2xe5 s GLY 189 CO 0.21 0.57 -0.22 -0.42 0.00 0.00 0.00 173.10 173.25 2xe5 s ILE 190 N 0.95 1.79 0.01 0.90 1.01 -0.58 -0.39 121.20 124.89 2xe5 s ILE 190 Ca -0.09 -1.39 -0.28 0.00 0.00 0.00 0.00 60.65 58.89 2xe5 s ILE 190 Cb -0.13 -1.58 0.09 0.00 0.01 0.00 0.00 42.46 40.85 2xe5 s ILE 190 CO -0.02 0.12 0.79 -0.83 0.00 0.00 0.00 174.94 175.00 2xe5 s GLY 191 N -1.52 -0.50 -0.02 6.18 0.00 -0.64 -0.77 107.32 110.05 2xe5 s GLY 191 Ca 0.08 1.06 -0.11 0.00 0.00 0.00 0.00 44.72 45.75 2xe5 s GLY 191 CO 0.03 0.49 0.24 0.00 0.00 0.00 0.00 173.10 173.86 2xe5 s ALA 192 N -2.70 -0.60 -0.11 3.20 0.00 -0.27 -1.37 121.76 119.90 2xe5 s ALA 192 Ca 0.00 0.25 -0.15 0.00 0.00 0.00 0.00 51.96 52.06 2xe5 s ALA 192 Cb -0.01 -0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.14 2xe5 s ALA 192 CO -0.06 -0.22 0.38 0.00 0.00 0.00 0.00 175.76 175.87 2xe5 s ALA 193 N -1.07 -0.95 0.01 0.00 0.00 -0.73 -0.89 121.76 118.13 2xe5 s ALA 193 Ca -0.11 0.92 0.03 0.00 0.00 0.00 0.00 51.96 52.80 2xe5 s ALA 193 Cb -0.05 -0.44 -0.01 0.00 0.00 0.00 0.00 23.12 22.61 2xe5 s ALA 193 CO 0.03 -0.21 -0.09 0.08 0.00 0.00 0.00 175.76 175.56 2xe5 s VAL 194 N -0.23 0.72 0.04 0.00 1.01 -0.60 -0.91 120.40 120.43 2xe5 s VAL 194 Ca -0.04 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.26 2xe5 s VAL 194 Cb -0.03 -0.65 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 2xe5 s VAL 194 CO 0.02 0.03 0.09 -0.94 0.00 0.00 0.00 175.10 174.30 2xe5 s SER 195 N -0.67 0.19 -0.22 3.32 1.04 -0.49 -0.94 113.70 115.94 2xe5 s SER 195 Ca 0.00 -0.56 -0.04 0.00 0.48 0.00 0.00 55.95 55.84 2xe5 s SER 195 Cb -0.05 0.23 0.12 0.00 0.10 0.00 0.00 66.02 66.41 2xe5 s SER 195 CO 0.00 -0.52 0.35 -0.55 0.98 0.00 0.00 173.24 173.50 2xe5 s SER 196 N -2.19 0.35 -0.03 7.02 0.15 -0.08 -1.25 113.70 117.69 2xe5 s SER 196 Ca -0.04 0.28 0.07 0.00 0.70 0.00 0.00 55.95 56.96 2xe5 s SER 196 Cb -0.01 1.01 -0.02 0.00 -1.71 0.00 0.00 66.02 65.30 2xe5 s SER 196 CO -0.05 -0.29 -0.25 -0.44 1.20 0.00 0.00 173.24 173.41 2xe5 s SER 197 N 2.51 2.93 0.39 5.45 0.01 0.25 -0.96 113.70 124.29 2xe5 s SER 197 Ca 0.09 -0.46 -0.26 0.00 1.31 0.00 0.00 55.95 56.64 2xe5 s SER 197 Cb -0.15 -0.45 -0.09 0.00 0.21 0.00 0.00 66.02 65.54 2xe5 s SER 197 CO -0.14 0.29 1.21 -0.75 0.41 0.00 0.00 173.24 174.25 2xe5 s LYS 198 N -0.47 4.07 0.14 12.44 2.20 -0.21 0.35 119.74 138.27 2xe5 s LYS 198 Ca 0.06 1.94 -0.08 0.00 -0.36 0.00 0.00 55.97 57.54 2xe5 s LYS 198 Cb -0.11 -2.74 -0.06 0.00 -1.51 0.00 0.00 37.83 33.41 2xe5 s LYS 198 CO 0.00 -0.34 0.43 1.03 -0.36 0.00 0.00 175.35 176.11 2xe5 s ARG 199 N -2.22 3.71 0.66 4.03 0.52 0.15 -0.40 118.95 125.41 2xe5 s ARG 199 Ca 0.56 0.09 -0.08 0.00 -0.52 0.00 0.00 55.73 55.78 2xe5 s ARG 199 Cb -0.33 -2.85 0.03 0.00 0.52 0.00 0.00 34.95 32.32 2xe5 s ARG 199 CO 0.42 0.46 0.99 0.95 0.02 0.00 0.00 175.30 178.14 2xe5 s THR 200 N -1.62 3.09 0.13 0.02 -4.23 -1.26 -4.68 115.64 107.09 2xe5 s THR 200 Ca 0.40 0.02 -0.17 0.00 -1.18 0.00 0.00 61.69 60.76 2xe5 s THR 200 Cb -0.12 -3.29 -0.02 0.00 1.34 0.00 0.00 72.50 70.41 2xe5 s THR 200 CO 0.22 -0.33 1.71 -0.25 -0.54 0.00 0.00 174.62 175.43 2xe5 h TRP 201 N -0.46 0.52 -0.84 3.99 7.01 -1.96 -2.49 115.95 121.72 2xe5 h TRP 201 Ca -0.45 -0.02 0.09 0.00 2.11 0.00 0.00 58.89 60.62 2xe5 h TRP 201 Cb 1.28 -0.16 -0.07 0.00 -2.10 0.00 0.00 29.16 28.11 2xe5 h TRP 201 CO 0.43 0.44 0.49 -0.44 -2.79 0.00 0.00 178.44 176.56 2xe5 h ASP 202 N 0.45 0.71 0.03 2.65 5.19 -1.92 -0.65 116.42 122.88 2xe5 h ASP 202 Ca 0.12 0.04 -0.06 0.00 -0.62 0.00 0.00 57.03 56.52 2xe5 h ASP 202 Cb 0.11 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.51 2xe5 h ASP 202 CO -0.02 0.41 -0.17 1.56 -3.12 0.00 0.00 179.24 177.91 2xe5 h GLN 203 N 0.83 0.28 -0.02 3.56 4.20 -1.78 -2.95 115.11 119.23 2xe5 h GLN 203 Ca 0.40 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 59.03 2xe5 h GLN 203 Cb 0.34 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2xe5 h GLN 203 CO -0.24 0.45 -0.27 0.09 -0.67 0.00 0.00 178.83 178.19 2xe5 n ASN 204 N -4.23 1.78 -1.19 1.46 3.02 -0.73 -4.55 115.26 110.83 2xe5 n ASN 204 Ca -0.01 -1.39 0.04 0.00 -0.03 0.00 0.00 54.58 53.20 2xe5 n ASN 204 Cb 0.31 0.23 0.06 0.00 -0.61 0.00 0.00 39.78 39.76 2xe5 n ASN 204 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2xe5 n ASN 205 N 0.01 1.07 -0.57 6.41 3.02 -0.33 -4.73 115.26 120.14 2xe5 n ASN 205 Ca 0.12 -2.38 0.06 0.00 -0.03 0.00 0.00 54.58 52.35 2xe5 n ASN 205 Cb 0.43 -0.34 0.19 0.00 -0.61 0.00 0.00 39.78 39.46 2xe5 n ASN 205 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2xe5 n THR 206 N 0.10 2.18 -1.32 3.41 -2.24 -1.15 -4.94 114.28 110.31 2xe5 n THR 206 Ca 0.08 -2.65 -0.10 0.00 -2.27 0.00 0.00 64.05 59.11 2xe5 n THR 206 Cb 1.00 -0.26 -0.04 0.00 -2.10 0.00 0.00 70.33 68.94 2xe5 n THR 206 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xe5 n GLY 207 N -1.15 1.09 3.92 3.38 0.00 -1.26 -5.03 105.19 106.13 2xe5 n GLY 207 Ca 0.21 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 45.39 2xe5 n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2xe5 s LEU 208 N -2.24 3.71 0.61 0.99 1.43 -1.26 -5.07 118.68 116.85 2xe5 s LEU 208 Ca 0.00 0.74 -0.12 0.00 -1.03 0.00 0.00 54.13 53.72 2xe5 s LEU 208 Cb 0.00 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2xe5 s LEU 208 CO 0.00 -0.54 1.03 0.27 0.23 0.00 0.00 176.35 177.34 2xe5 s ILE 209 N -2.63 4.56 -0.42 -0.59 -4.36 -0.84 -4.42 121.20 112.51 2xe5 s ILE 209 Ca 0.46 0.90 -0.01 0.00 -0.26 0.00 0.00 60.65 61.74 2xe5 s ILE 209 Cb -0.10 -3.77 0.00 0.00 1.25 0.00 0.00 42.46 39.84 2xe5 s ILE 209 CO 0.42 -1.02 0.36 0.61 0.24 0.00 0.00 174.94 175.54 2xe5 n GLY 210 N -2.42 0.26 3.95 6.27 0.00 -1.14 -0.41 105.19 111.70 2xe5 n GLY 210 Ca 0.06 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.54 2xe5 n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2xe5 s THR 211 N -3.12 3.81 0.00 2.61 -4.23 -1.26 -4.50 115.64 108.96 2xe5 s THR 211 Ca 0.07 -0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.19 2xe5 s THR 211 Cb -0.03 -3.44 0.00 0.00 1.34 0.00 0.00 72.50 70.37 2xe5 s THR 211 CO 0.25 -0.34 0.00 0.61 -0.54 0.00 0.00 174.62 174.59 2xe5 n GLY 212 N -2.23 0.77 0.27 3.99 0.00 -1.26 -4.95 105.19 101.79 2xe5 n GLY 212 Ca 0.03 -1.34 -0.00 0.00 0.00 0.00 0.00 46.02 44.70 2xe5 n GLY 212 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2xe5 h ASP 213 N 0.00 0.51 -4.43 1.61 1.82 -1.96 -3.42 116.42 110.54 2xe5 h ASP 213 Ca 0.00 -0.09 -0.17 0.00 -0.39 0.00 0.00 57.03 56.37 2xe5 h ASP 213 Cb 0.00 -0.13 -0.24 0.00 0.68 0.00 0.00 39.33 39.64 2xe5 h ASP 213 CO 0.00 0.56 -0.57 -0.13 -1.61 0.00 0.00 179.24 177.49 2xe5 s ARG 214 N -5.01 0.29 -0.20 0.28 0.52 -1.26 -0.67 118.95 112.90 2xe5 s ARG 214 Ca -0.08 -0.18 -0.08 0.00 -0.52 0.00 0.00 55.73 54.87 2xe5 s ARG 214 Cb 0.16 0.12 -0.04 0.00 0.52 0.00 0.00 34.95 35.70 2xe5 s ARG 214 CO 0.77 -0.06 0.09 0.00 0.02 0.00 0.00 175.30 176.12 2xe5 s ALA 215 N -0.74 3.46 0.01 2.13 0.00 0.16 -4.58 121.76 122.21 2xe5 s ALA 215 Ca -0.08 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.10 2xe5 s ALA 215 Cb -0.05 -2.06 -0.01 0.00 0.00 0.00 0.00 23.12 21.00 2xe5 s ALA 215 CO 0.00 0.03 -0.09 -1.21 0.00 0.00 0.00 175.76 174.50 2xe5 s GLU 216 N 0.64 0.63 0.00 0.00 2.02 -0.24 -0.58 118.70 121.17 2xe5 s GLU 216 Ca 0.05 -0.47 -0.00 0.00 0.02 0.00 0.00 54.97 54.57 2xe5 s GLU 216 Cb -0.13 -0.57 -0.00 0.00 0.10 0.00 0.00 34.13 33.53 2xe5 s GLU 216 CO 0.01 0.14 -0.00 0.95 0.02 0.00 0.00 175.26 176.38 2xe5 s THR 217 N -0.59 0.02 -0.06 3.63 -4.23 -0.38 -0.78 115.64 113.26 2xe5 s THR 217 Ca -0.01 -0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.35 2xe5 s THR 217 Cb -0.05 -0.05 0.02 0.00 1.34 0.00 0.00 72.50 73.75 2xe5 s THR 217 CO 0.00 -0.08 -0.04 -0.31 -0.54 0.00 0.00 174.62 173.64 2xe5 s TYR 218 N -0.25 0.87 -0.04 3.99 2.02 -0.50 -1.39 117.35 122.05 2xe5 s TYR 218 Ca -0.03 -0.28 0.02 0.00 -0.37 0.00 0.00 57.07 56.41 2xe5 s TYR 218 Cb -0.02 -0.79 0.01 0.00 -0.40 0.00 0.00 41.96 40.76 2xe5 s TYR 218 CO -0.00 -0.27 -0.08 0.99 -1.57 0.00 0.00 175.55 174.62 2xe5 s THR 219 N 1.23 0.79 0.12 -0.71 2.01 -0.09 -0.07 115.64 118.93 2xe5 s THR 219 Ca -0.06 -0.32 0.10 0.00 0.31 0.00 0.00 61.69 61.72 2xe5 s THR 219 Cb -0.14 -0.73 -0.04 0.00 0.01 0.00 0.00 72.50 71.61 2xe5 s THR 219 CO -0.02 0.26 -0.26 -0.83 -0.69 0.00 0.00 174.62 173.09 2xe5 s GLY 220 N 0.46 1.50 0.00 4.40 0.00 0.64 -1.78 107.32 112.53 2xe5 s GLY 220 Ca -0.08 -1.41 -0.23 0.00 0.00 0.00 0.00 44.72 43.00 2xe5 s GLY 220 CO 0.01 -1.39 0.51 -0.32 0.00 0.00 0.00 173.10 171.91 2xe5 s GLY 221 N -1.99 -0.40 0.00 0.20 0.00 -0.47 -0.77 107.32 103.89 2xe5 s GLY 221 Ca 0.12 0.74 -0.03 0.00 0.00 0.00 0.00 44.72 45.55 2xe5 s GLY 221 CO 0.05 0.45 0.06 1.08 0.00 0.00 0.00 173.10 174.74 2xe5 s LEU 222 N -1.59 1.86 -0.06 0.66 1.43 -0.24 -1.62 118.68 119.13 2xe5 s LEU 222 Ca -0.09 -0.23 -0.23 0.00 -1.03 0.00 0.00 54.13 52.55 2xe5 s LEU 222 Cb -0.01 0.34 0.05 0.00 0.03 0.00 0.00 46.19 46.60 2xe5 s LEU 222 CO 0.03 -0.25 0.53 -1.59 0.23 0.00 0.00 176.35 175.29 2xe5 s LYS 223 N -1.05 0.85 -0.10 1.70 -2.85 0.47 -1.08 119.74 117.68 2xe5 s LYS 223 Ca -0.11 0.18 0.03 0.00 -1.00 0.00 0.00 55.97 55.06 2xe5 s LYS 223 Cb -0.07 0.40 0.01 0.00 -2.06 0.00 0.00 37.83 36.11 2xe5 s LYS 223 CO 0.00 -0.24 -0.18 -0.47 0.10 0.00 0.00 175.35 174.56 2xe5 s TYR 224 N -1.01 2.15 -0.41 1.78 5.04 0.13 0.37 117.35 125.41 2xe5 s TYR 224 Ca -0.10 -0.94 0.03 0.00 -2.44 0.00 0.00 57.07 53.62 2xe5 s TYR 224 Cb -0.03 -1.49 0.16 0.00 0.35 0.00 0.00 41.96 40.95 2xe5 s TYR 224 CO 0.06 -0.44 0.36 0.34 -1.34 0.00 0.00 175.55 174.54 2xe5 s ASP 225 N 0.69 1.35 0.21 4.32 2.15 0.49 -0.17 116.67 125.71 2xe5 s ASP 225 Ca -0.12 -2.53 -0.22 0.00 0.43 0.00 0.00 52.55 50.10 2xe5 s ASP 225 Cb -0.16 -0.02 0.06 0.00 -0.30 0.00 0.00 42.92 42.50 2xe5 s ASP 225 CO 0.03 -0.20 0.93 0.00 -0.17 0.00 0.00 175.17 175.77 2xe5 s ALA 226 N 0.55 -1.45 -1.67 3.66 0.00 -0.89 -4.56 121.76 117.39 2xe5 s ALA 226 Ca 0.27 -0.20 -0.12 0.00 0.00 0.00 0.00 51.96 51.92 2xe5 s ALA 226 Cb -0.05 0.70 0.11 0.00 0.00 0.00 0.00 23.12 23.89 2xe5 s ALA 226 CO -0.12 -1.04 0.42 0.09 0.00 0.00 0.00 175.76 175.11 2xe5 n ASN 227 N -0.85 -1.03 0.00 0.00 3.02 -1.26 -0.34 115.26 114.80 2xe5 n ASN 227 Ca -0.05 -1.17 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 2xe5 n ASN 227 Cb 0.60 -2.05 0.00 0.00 -0.61 0.00 0.00 39.78 37.72 2xe5 n ASN 227 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2xe5 n ASN 228 N -2.71 -0.15 -4.72 6.41 3.02 -1.26 -4.96 115.26 110.89 2xe5 n ASN 228 Ca -0.10 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.10 2xe5 n ASN 228 Cb 0.57 -1.88 -0.08 0.00 -0.61 0.00 0.00 39.78 37.78 2xe5 n ASN 228 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2xe5 s ILE 229 N -1.76 5.04 -0.19 2.41 1.01 0.54 -1.62 121.20 126.63 2xe5 s ILE 229 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.71 2xe5 s ILE 229 Cb 0.00 -3.25 0.04 0.00 0.01 0.00 0.00 42.46 39.27 2xe5 s ILE 229 CO 0.00 0.51 -0.10 -0.47 0.00 0.00 0.00 174.94 174.88 2xe5 s TYR 230 N -0.10 2.31 -0.04 3.97 5.04 -0.42 -2.10 117.35 126.02 2xe5 s TYR 230 Ca 0.08 -1.51 0.06 0.00 -2.44 0.00 0.00 57.07 53.26 2xe5 s TYR 230 Cb -0.12 -1.59 -0.01 0.00 0.35 0.00 0.00 41.96 40.59 2xe5 s TYR 230 CO 0.01 -0.72 -0.23 -0.51 -1.34 0.00 0.00 175.55 172.75 2xe5 s LEU 231 N 1.43 2.04 -0.07 6.97 1.43 0.76 -0.65 118.68 130.59 2xe5 s LEU 231 Ca -0.01 -0.45 -0.27 0.00 -1.03 0.00 0.00 54.13 52.38 2xe5 s LEU 231 Cb -0.16 -1.24 0.06 0.00 0.03 0.00 0.00 46.19 44.88 2xe5 s LEU 231 CO -0.08 0.26 0.60 0.00 0.23 0.00 0.00 176.35 177.35 2xe5 s ALA 232 N -0.33 -1.55 -0.09 4.21 0.00 -0.57 0.21 121.76 123.65 2xe5 s ALA 232 Ca 0.03 1.19 -0.08 0.00 0.00 0.00 0.00 51.96 53.09 2xe5 s ALA 232 Cb -0.11 -0.12 0.02 0.00 0.00 0.00 0.00 23.12 22.91 2xe5 s ALA 232 CO 0.01 -0.34 0.23 0.00 0.00 0.00 0.00 175.76 175.66 2xe5 s ALA 233 N -1.01 -0.57 -0.01 0.00 0.00 -0.24 -0.67 121.76 119.26 2xe5 s ALA 233 Ca -0.10 0.65 0.02 0.00 0.00 0.00 0.00 51.96 52.53 2xe5 s ALA 233 Cb -0.02 -0.38 -0.00 0.00 0.00 0.00 0.00 23.12 22.72 2xe5 s ALA 233 CO 0.08 -0.11 -0.07 1.14 0.00 0.00 0.00 175.76 176.80 2xe5 s GLN 234 N 0.13 0.61 -0.11 0.00 1.03 0.14 -1.08 119.66 120.38 2xe5 s GLN 234 Ca -0.00 -0.22 0.03 0.00 0.04 0.00 0.00 55.36 55.21 2xe5 s GLN 234 Cb -0.02 -0.59 0.00 0.00 0.03 0.00 0.00 33.01 32.43 2xe5 s GLN 234 CO 0.00 0.11 -0.23 -0.47 -2.54 0.00 0.00 175.29 172.17 2xe5 s TYR 235 N 0.02 2.60 -0.04 9.60 5.04 0.05 -1.59 117.35 133.03 2xe5 s TYR 235 Ca 0.00 -1.08 0.02 0.00 -2.44 0.00 0.00 57.07 53.58 2xe5 s TYR 235 Cb -0.05 -1.74 0.01 0.00 0.35 0.00 0.00 41.96 40.53 2xe5 s TYR 235 CO -0.00 -0.44 -0.09 0.99 -1.34 0.00 0.00 175.55 174.66 2xe5 s THR 236 N 0.45 0.86 -0.17 4.34 2.01 0.09 -0.26 115.64 122.96 2xe5 s THR 236 Ca -0.16 -0.37 -0.02 0.00 0.31 0.00 0.00 61.69 61.46 2xe5 s THR 236 Cb -0.17 -0.78 -0.01 0.00 0.01 0.00 0.00 72.50 71.55 2xe5 s THR 236 CO 0.06 0.28 -0.09 -1.58 -0.69 0.00 0.00 174.62 172.59 2xe5 s GLN 237 N 0.39 3.38 0.12 4.92 0.74 0.91 -0.21 119.66 129.92 2xe5 s GLN 237 Ca -0.07 -0.66 0.09 0.00 0.05 0.00 0.00 55.36 54.77 2xe5 s GLN 237 Cb -0.11 -2.79 -0.04 0.00 1.10 0.00 0.00 33.01 31.17 2xe5 s GLN 237 CO 0.01 0.04 -0.21 0.95 -0.55 0.00 0.00 175.29 175.54 2xe5 s THR 238 N 0.82 1.79 -0.09 -0.34 -4.23 -0.16 -1.41 115.64 112.02 2xe5 s THR 238 Ca -0.03 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 58.82 2xe5 s THR 238 Cb -0.15 -1.67 0.02 0.00 1.34 0.00 0.00 72.50 72.05 2xe5 s THR 238 CO 0.01 -0.11 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.59 2xe5 s TYR 239 N -1.38 1.27 -1.33 3.99 1.51 0.04 -0.85 117.35 120.61 2xe5 s TYR 239 Ca 0.09 -0.54 -0.03 0.00 -1.01 0.00 0.00 57.07 55.58 2xe5 s TYR 239 Cb -0.09 -1.06 0.02 0.00 -0.11 0.00 0.00 41.96 40.72 2xe5 s TYR 239 CO 0.05 -0.38 0.24 0.09 -1.11 0.00 0.00 175.55 174.44 2xe5 n ASN 240 N 4.53 -4.65 0.00 2.29 3.02 -0.45 -1.08 115.26 118.93 2xe5 n ASN 240 Ca -0.16 -0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.31 2xe5 n ASN 240 Cb 0.51 -3.86 0.00 0.00 -0.61 0.00 0.00 39.78 35.81 2xe5 n ASN 240 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2xe5 n ALA 241 N -2.76 1.62 -2.65 5.41 0.00 -1.26 -4.49 120.51 116.39 2xe5 n ALA 241 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.93 2xe5 n ALA 241 Cb 0.61 0.16 -0.09 0.00 0.00 0.00 0.00 19.45 20.14 2xe5 n ALA 241 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2xe5 s THR 242 N -1.57 5.24 0.24 0.00 2.01 -1.26 -4.90 115.64 115.40 2xe5 s THR 242 Ca 0.00 0.51 -0.30 0.00 0.31 0.00 0.00 61.69 62.22 2xe5 s THR 242 Cb 0.00 -3.65 -0.09 0.00 0.01 0.00 0.00 72.50 68.77 2xe5 s THR 242 CO 0.00 0.26 1.13 -0.60 -0.69 0.00 0.00 174.62 174.71 2xe5 s ARG 243 N 1.43 4.59 -0.73 4.92 3.52 -1.26 -0.59 118.95 130.83 2xe5 s ARG 243 Ca 0.15 1.81 0.04 0.00 -0.13 0.00 0.00 55.73 57.60 2xe5 s ARG 243 Cb -0.15 -3.22 0.20 0.00 -1.56 0.00 0.00 34.95 30.23 2xe5 s ARG 243 CO 0.08 0.11 0.63 0.28 -0.81 0.00 0.00 175.30 175.58 2xe5 n VAL 244 N 1.72 2.13 -0.73 7.11 0.31 -0.20 -4.88 118.33 123.80 2xe5 n VAL 244 Ca 0.01 -5.03 0.00 0.00 -0.01 0.00 0.00 64.34 59.31 2xe5 n VAL 244 Cb 0.45 -2.19 0.00 0.00 -0.91 0.00 0.00 33.84 31.19 2xe5 n VAL 244 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2xe5 n GLY 245 N 1.70 3.21 0.23 2.92 0.00 -1.26 -1.39 105.19 110.60 2xe5 n GLY 245 Ca 0.23 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.26 2xe5 n GLY 245 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2xe5 n SER 246 N 3.29 0.90 0.07 1.61 3.41 -0.42 -4.40 113.62 118.09 2xe5 n SER 246 Ca 0.00 -0.87 -0.07 0.00 -0.26 0.00 0.00 58.87 57.67 2xe5 n SER 246 Cb 0.00 0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 63.91 2xe5 n SER 246 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2xe5 h LEU 247 N 1.14 0.01 0.00 1.04 3.38 -1.47 -3.50 115.31 115.92 2xe5 h LEU 247 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2xe5 h LEU 247 Cb 0.45 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2xe5 h LEU 247 CO 0.00 0.98 0.00 0.61 0.09 0.00 0.00 178.44 180.12 2xe5 n GLY 248 N 1.26 0.48 3.59 0.83 0.00 -1.23 -1.98 105.19 108.13 2xe5 n GLY 248 Ca -0.00 -1.21 -0.27 0.00 0.00 0.00 0.00 46.02 44.53 2xe5 n GLY 248 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2xe5 s TRP 249 N -3.19 2.34 -0.19 1.61 0.51 0.45 -1.04 118.94 119.43 2xe5 s TRP 249 Ca 0.00 -0.77 -0.18 0.00 -2.12 0.00 0.00 56.10 53.03 2xe5 s TRP 249 Cb 0.00 -1.64 -0.03 0.00 -0.81 0.00 0.00 33.47 30.98 2xe5 s TRP 249 CO 0.00 0.32 0.50 0.00 -0.51 0.00 0.00 176.95 177.26 2xe5 s ALA 250 N -2.87 3.54 0.26 0.98 0.00 0.24 -2.88 121.76 121.03 2xe5 s ALA 250 Ca 0.33 -0.39 -0.02 0.00 0.00 0.00 0.00 51.96 51.88 2xe5 s ALA 250 Cb 0.09 -2.77 0.53 0.00 0.00 0.00 0.00 23.12 20.98 2xe5 s ALA 250 CO 0.16 -0.36 1.70 -0.91 0.00 0.00 0.00 175.76 176.35 2xe5 h ASN 251 N 7.35 0.18 -3.76 0.00 2.35 -1.82 -1.19 115.58 118.70 2xe5 h ASN 251 Ca -0.35 0.14 -0.20 0.00 -0.55 0.00 0.00 56.30 55.34 2xe5 h ASN 251 Cb 1.16 0.15 -0.27 0.00 0.05 0.00 0.00 38.32 39.40 2xe5 h ASN 251 CO 0.74 0.02 -0.59 -0.75 -1.65 0.00 0.00 177.43 175.20 2xe5 s LYS 252 N -5.99 0.13 -0.00 0.81 2.20 -1.24 -3.00 119.74 112.64 2xe5 s LYS 252 Ca -0.12 0.16 0.03 0.00 -0.36 0.00 0.00 55.97 55.68 2xe5 s LYS 252 Cb 0.22 0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.59 2xe5 s LYS 252 CO 0.76 -0.02 -0.09 0.00 -0.36 0.00 0.00 175.35 175.65 2xe5 s ALA 253 N 0.10 0.71 -0.26 3.13 0.00 -0.03 -0.92 121.76 124.50 2xe5 s ALA 253 Ca -0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 51.96 51.52 2xe5 s ALA 253 Cb -0.01 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.96 2xe5 s ALA 253 CO -0.00 0.16 -0.03 -0.65 0.00 0.00 0.00 175.76 175.24 2xe5 s GLN 254 N -0.32 2.89 -0.10 0.00 -0.21 0.21 -0.99 119.66 121.14 2xe5 s GLN 254 Ca 0.02 -0.95 0.01 0.00 0.02 0.00 0.00 55.36 54.47 2xe5 s GLN 254 Cb -0.04 -3.07 -0.02 0.00 1.00 0.00 0.00 33.01 30.89 2xe5 s GLN 254 CO -0.00 -0.41 -0.13 -0.80 -2.12 0.00 0.00 175.29 171.83 2xe5 s ASN 255 N 1.36 4.03 -0.01 5.90 0.01 0.71 -0.50 114.94 126.44 2xe5 s ASN 255 Ca 0.01 -0.27 -0.00 0.00 -0.71 0.00 0.00 52.86 51.88 2xe5 s ASN 255 Cb -0.17 -1.33 0.01 0.00 0.41 0.00 0.00 41.25 40.18 2xe5 s ASN 255 CO -0.03 0.23 0.02 0.12 -1.51 0.00 0.00 177.10 175.94 2xe5 s PHE 256 N -0.06 -0.01 -0.02 2.20 5.36 0.65 -0.73 117.98 125.38 2xe5 s PHE 256 Ca -0.02 0.08 0.00 0.00 -0.96 0.00 0.00 56.93 56.02 2xe5 s PHE 256 Cb -0.14 -0.06 0.02 0.00 -0.34 0.00 0.00 43.02 42.50 2xe5 s PHE 256 CO 0.04 -0.03 0.01 -1.21 -1.46 0.00 0.00 175.22 172.57 2xe5 s GLU 257 N 0.33 0.04 0.03 10.12 2.02 -0.62 -0.24 118.70 130.38 2xe5 s GLU 257 Ca -0.03 0.11 0.02 0.00 0.02 0.00 0.00 54.97 55.09 2xe5 s GLU 257 Cb -0.04 -0.23 -0.02 0.00 0.10 0.00 0.00 34.13 33.94 2xe5 s GLU 257 CO -0.01 -0.11 -0.07 0.00 0.02 0.00 0.00 175.26 175.09 2xe5 s ALA 258 N 0.74 0.54 -0.07 5.21 0.00 -0.06 -0.68 121.76 127.43 2xe5 s ALA 258 Ca -0.06 -0.63 -0.05 0.00 0.00 0.00 0.00 51.96 51.22 2xe5 s ALA 258 Cb -0.09 0.00 0.03 0.00 0.00 0.00 0.00 23.12 23.06 2xe5 s ALA 258 CO -0.02 0.01 0.19 0.08 0.00 0.00 0.00 175.76 176.02 2xe5 s VAL 259 N -1.05 -0.02 -0.04 0.00 1.01 0.16 -0.62 120.40 119.84 2xe5 s VAL 259 Ca -0.07 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.01 2xe5 s VAL 259 Cb -0.08 -0.28 0.00 0.00 0.00 0.00 0.00 36.38 36.02 2xe5 s VAL 259 CO 0.00 0.03 -0.13 0.00 0.00 0.00 0.00 175.10 175.00 2xe5 s ALA 260 N 0.54 1.20 0.01 5.51 0.00 0.16 -1.51 121.76 127.67 2xe5 s ALA 260 Ca -0.04 -0.48 -0.06 0.00 0.00 0.00 0.00 51.96 51.38 2xe5 s ALA 260 Cb -0.05 -0.44 -0.00 0.00 0.00 0.00 0.00 23.12 22.62 2xe5 s ALA 260 CO -0.03 0.18 0.11 -0.65 0.00 0.00 0.00 175.76 175.38 2xe5 s GLN 261 N 0.25 0.47 0.01 0.00 -0.21 0.18 -1.18 119.66 119.18 2xe5 s GLN 261 Ca -0.06 -0.45 0.01 0.00 0.02 0.00 0.00 55.36 54.88 2xe5 s GLN 261 Cb -0.11 0.19 -0.01 0.00 1.00 0.00 0.00 33.01 34.08 2xe5 s GLN 261 CO 0.02 -0.11 -0.04 -0.47 -2.12 0.00 0.00 175.29 172.57 2xe5 s TYR 262 N -1.48 0.32 -0.34 0.91 5.04 -1.08 -1.29 117.35 119.42 2xe5 s TYR 262 Ca -0.14 -0.19 0.00 0.00 -2.44 0.00 0.00 57.07 54.30 2xe5 s TYR 262 Cb -0.08 -0.20 0.08 0.00 0.35 0.00 0.00 41.96 42.12 2xe5 s TYR 262 CO 0.01 -0.04 0.06 -1.14 -1.34 0.00 0.00 175.55 173.10 2xe5 s GLN 263 N -0.52 2.00 0.24 4.97 2.00 -0.64 -2.78 119.66 124.93 2xe5 s GLN 263 Ca -0.03 -1.63 -0.30 0.00 -2.00 0.00 0.00 55.36 51.40 2xe5 s GLN 263 Cb -0.04 -3.28 -0.09 0.00 0.80 0.00 0.00 33.01 30.40 2xe5 s GLN 263 CO -0.00 -0.85 1.30 -0.06 -0.50 0.00 0.00 175.29 175.18 2xe5 s PHE 264 N 1.10 3.23 0.33 1.67 0.08 -0.40 -4.85 117.98 119.13 2xe5 s PHE 264 Ca 0.03 1.29 0.11 0.00 0.12 0.00 0.00 56.93 58.49 2xe5 s PHE 264 Cb -0.21 -3.60 1.03 0.00 -0.57 0.00 0.00 43.02 39.67 2xe5 s PHE 264 CO -0.05 -1.80 1.60 -0.44 -0.10 0.00 0.00 175.22 174.44 2xe5 h ASP 265 N 4.79 0.08 0.48 1.36 5.19 -1.99 -0.42 116.42 125.92 2xe5 h ASP 265 Ca -0.46 0.24 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 2xe5 h ASP 265 Cb 1.22 0.31 0.00 0.00 0.18 0.00 0.00 39.33 41.03 2xe5 h ASP 265 CO 0.74 -0.32 0.00 2.22 -3.12 0.00 0.00 179.24 178.76 2xe5 n PHE 266 N -5.28 0.00 0.00 4.55 -1.74 -1.26 -4.89 117.46 108.83 2xe5 n PHE 266 Ca 0.30 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.19 2xe5 n PHE 266 Cb 0.99 -0.40 0.00 0.00 1.52 0.00 0.00 39.48 41.59 2xe5 n PHE 266 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2xe5 n GLY 267 N 0.31 1.68 3.73 4.97 0.00 -0.17 -4.91 105.19 110.80 2xe5 n GLY 267 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2xe5 n GLY 267 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2xe5 s LEU 268 N 0.00 4.48 -0.43 0.99 2.96 -1.25 -1.69 118.68 123.74 2xe5 s LEU 268 Ca 0.00 1.93 0.02 0.00 -0.22 0.00 0.00 54.13 55.86 2xe5 s LEU 268 Cb 0.00 -3.59 0.13 0.00 0.50 0.00 0.00 46.19 43.23 2xe5 s LEU 268 CO 0.00 -0.16 0.22 -0.60 -1.32 0.00 0.00 176.35 174.49 2xe5 s ARG 269 N -0.07 1.24 0.69 1.98 3.52 0.62 -1.28 118.95 125.65 2xe5 s ARG 269 Ca 0.49 -1.92 -0.15 0.00 -0.13 0.00 0.00 55.73 54.02 2xe5 s ARG 269 Cb -0.26 -2.32 0.02 0.00 -1.56 0.00 0.00 34.95 30.82 2xe5 s ARG 269 CO 0.32 -1.14 1.14 -2.14 -0.81 0.00 0.00 175.30 172.66 2xe5 s PRO 270 N 0.47 2.56 -0.09 5.12 0.02 -1.12 -2.21 135.00 139.76 2xe5 s PRO 270 Ca 0.17 1.49 -0.06 0.00 0.02 0.00 0.00 61.00 62.62 2xe5 s PRO 270 Cb -0.24 -1.91 0.03 0.00 0.02 0.00 0.00 34.50 32.40 2xe5 s PRO 270 CO -0.02 -1.45 0.21 0.45 -0.33 0.00 0.00 177.00 175.86 2xe5 s SER 271 N -2.46 -0.21 -0.04 2.53 0.15 0.12 -2.65 113.70 111.13 2xe5 s SER 271 Ca 0.69 0.44 0.01 0.00 0.70 0.00 0.00 55.95 57.79 2xe5 s SER 271 Cb -0.23 0.37 0.02 0.00 -1.71 0.00 0.00 66.02 64.48 2xe5 s SER 271 CO 0.43 -0.12 -0.05 -0.22 1.20 0.00 0.00 173.24 174.48 2xe5 s LEU 272 N 0.74 1.39 0.06 3.45 2.96 -0.32 -1.15 118.68 125.80 2xe5 s LEU 272 Ca -0.05 -0.14 -0.08 0.00 -0.22 0.00 0.00 54.13 53.63 2xe5 s LEU 272 Cb -0.07 -0.48 -0.00 0.00 0.50 0.00 0.00 46.19 46.14 2xe5 s LEU 272 CO -0.04 -0.04 0.17 0.00 -1.32 0.00 0.00 176.35 175.11 2xe5 s ALA 273 N 0.84 -0.23 -0.03 5.97 0.00 0.86 -0.66 121.76 128.51 2xe5 s ALA 273 Ca -0.12 -0.48 0.01 0.00 0.00 0.00 0.00 51.96 51.37 2xe5 s ALA 273 Cb -0.14 0.34 0.02 0.00 0.00 0.00 0.00 23.12 23.34 2xe5 s ALA 273 CO 0.01 -0.40 -0.03 -0.47 0.00 0.00 0.00 175.76 174.87 2xe5 s TYR 274 N -3.07 0.50 0.01 0.00 5.04 0.21 0.30 117.35 120.35 2xe5 s TYR 274 Ca -0.01 -0.09 0.03 0.00 -2.44 0.00 0.00 57.07 54.56 2xe5 s TYR 274 Cb 0.01 -0.48 -0.01 0.00 0.35 0.00 0.00 41.96 41.83 2xe5 s TYR 274 CO -0.07 -0.13 -0.10 -0.51 -1.34 0.00 0.00 175.55 173.40 2xe5 s LEU 275 N 0.76 2.09 -0.17 6.97 1.02 -0.42 -0.88 118.68 128.05 2xe5 s LEU 275 Ca -0.09 -0.30 -0.11 0.00 0.02 0.00 0.00 54.13 53.65 2xe5 s LEU 275 Cb -0.12 -0.48 0.05 0.00 0.02 0.00 0.00 46.19 45.67 2xe5 s LEU 275 CO -0.01 0.05 0.42 -1.58 0.02 0.00 0.00 176.35 175.25 2xe5 s GLN 276 N -0.64 0.43 -0.18 1.70 0.74 0.66 -1.26 119.66 121.10 2xe5 s GLN 276 Ca 0.01 0.72 0.00 0.00 0.05 0.00 0.00 55.36 56.14 2xe5 s GLN 276 Cb -0.06 0.07 0.04 0.00 1.10 0.00 0.00 33.01 34.17 2xe5 s GLN 276 CO 0.00 -0.12 -0.08 0.45 -0.55 0.00 0.00 175.29 174.99 2xe5 s SER 277 N 0.98 3.14 -0.36 6.67 0.15 0.13 -0.25 113.70 124.15 2xe5 s SER 277 Ca -0.06 -0.79 -0.10 0.00 0.70 0.00 0.00 55.95 55.70 2xe5 s SER 277 Cb -0.06 -1.08 0.02 0.00 -1.71 0.00 0.00 66.02 63.19 2xe5 s SER 277 CO -0.08 -0.17 0.19 -0.54 1.20 0.00 0.00 173.24 173.84 2xe5 s LYS 278 N 1.51 2.91 -0.01 5.44 1.02 0.35 0.13 119.74 131.08 2xe5 s LYS 278 Ca -0.00 -1.02 -0.26 0.00 0.02 0.00 0.00 55.97 54.71 2xe5 s LYS 278 Cb -0.16 -3.68 -0.04 0.00 -0.52 0.00 0.00 37.83 33.44 2xe5 s LYS 278 CO -0.08 -0.64 0.82 0.20 -0.92 0.00 0.00 175.35 174.73 2xe5 s GLY 279 N 1.55 2.77 -0.05 -3.33 0.00 0.12 -0.62 107.32 107.76 2xe5 s GLY 279 Ca 0.02 0.32 0.03 0.00 0.00 0.00 0.00 44.72 45.09 2xe5 s GLY 279 CO 0.06 1.34 -0.11 0.54 0.00 0.00 0.00 173.10 174.93 2xe5 s LYS 280 N 0.65 2.57 -0.99 2.90 -0.14 -0.10 -1.28 119.74 123.35 2xe5 s LYS 280 Ca 0.43 -0.66 -0.29 0.00 -1.36 0.00 0.00 55.97 54.09 2xe5 s LYS 280 Cb -0.20 -2.45 0.04 0.00 -1.68 0.00 0.00 37.83 33.54 2xe5 s LYS 280 CO 0.23 0.63 0.55 -1.71 -0.76 0.00 0.00 175.35 174.30 2xe5 n ASN 281 N 2.19 -3.32 0.16 2.83 5.15 -0.80 -3.71 115.26 117.76 2xe5 n ASN 281 Ca -0.17 -1.08 0.01 0.00 -0.60 0.00 0.00 54.58 52.75 2xe5 n ASN 281 Cb 0.52 -1.29 0.25 0.00 -0.53 0.00 0.00 39.78 38.74 2xe5 n ASN 281 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2xe5 h LEU 282 N -1.62 0.00 0.00 1.20 3.38 -1.40 -3.42 115.31 113.45 2xe5 h LEU 282 Ca -0.59 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.38 2xe5 h LEU 282 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2xe5 h LEU 282 CO 0.42 0.51 0.00 0.61 0.09 0.00 0.00 178.44 180.08 2xe5 n GLY 283 N 0.14 1.05 2.57 0.83 0.00 -1.26 -4.38 105.19 104.13 2xe5 n GLY 283 Ca -0.01 -2.03 -0.19 0.00 0.00 0.00 0.00 46.02 43.80 2xe5 n GLY 283 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2xe5 n ARG 284 N 1.42 -2.71 -0.99 1.61 0.63 -1.26 -2.01 116.66 113.35 2xe5 n ARG 284 Ca 0.00 0.85 0.00 0.00 -0.92 0.00 0.00 57.85 57.78 2xe5 n ARG 284 Cb 0.00 -5.41 0.00 0.00 0.45 0.00 0.00 32.46 27.50 2xe5 n ARG 284 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2xe5 n GLY 285 N -1.20 0.49 0.09 5.14 0.00 -1.26 -4.94 105.19 103.51 2xe5 n GLY 285 Ca -0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2xe5 n GLY 285 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2xe5 n TYR 286 N -2.77 0.78 0.00 1.61 4.01 -0.85 -5.03 117.16 114.91 2xe5 n TYR 286 Ca 0.00 0.27 0.00 0.00 -0.16 0.00 0.00 57.90 58.01 2xe5 n TYR 286 Cb 0.05 -1.10 0.00 0.00 -0.31 0.00 0.00 39.34 37.99 2xe5 n TYR 286 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2xe5 n ASP 287 N -2.91 0.00 -4.65 7.72 8.00 -1.26 -4.47 116.55 118.98 2xe5 n ASP 287 Ca -0.17 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 54.98 2xe5 n ASP 287 Cb 0.98 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.99 2xe5 n ASP 287 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2xe5 s ASP 288 N -4.00 5.87 0.00 -2.24 1.01 -1.26 -1.05 116.67 115.00 2xe5 s ASP 288 Ca 0.00 0.10 -0.05 0.00 0.71 0.00 0.00 52.55 53.31 2xe5 s ASP 288 Cb 0.00 -2.03 -0.00 0.00 1.01 0.00 0.00 42.92 41.89 2xe5 s ASP 288 CO 0.00 0.12 0.10 -1.61 0.21 0.00 0.00 175.17 173.99 2xe5 s GLU 289 N 0.69 0.41 0.02 8.23 0.41 -0.41 -5.00 118.70 123.06 2xe5 s GLU 289 Ca 0.06 -0.40 -0.30 0.00 -0.41 0.00 0.00 54.97 53.92 2xe5 s GLU 289 Cb -0.13 0.17 -0.05 0.00 -1.78 0.00 0.00 34.13 32.34 2xe5 s GLU 289 CO 0.01 -0.09 1.27 -0.51 -0.49 0.00 0.00 175.26 175.45 2xe5 s ASP 290 N -1.27 6.99 -0.02 -0.19 1.01 -1.26 0.14 116.67 122.07 2xe5 s ASP 290 Ca -0.14 2.01 0.14 0.00 0.71 0.00 0.00 52.55 55.27 2xe5 s ASP 290 Cb -0.08 -2.57 -0.21 0.00 1.01 0.00 0.00 42.92 41.08 2xe5 s ASP 290 CO 0.01 -0.58 0.69 -0.38 0.21 0.00 0.00 175.17 175.12 2xe5 n ILE 291 N 4.31 1.49 -3.67 0.77 5.41 0.12 -4.88 119.36 122.90 2xe5 n ILE 291 Ca 0.11 -0.77 -0.14 0.00 1.00 0.00 0.00 62.75 62.95 2xe5 n ILE 291 Cb 0.45 -0.94 -0.08 0.00 -0.71 0.00 0.00 39.64 38.36 2xe5 n ILE 291 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 2xe5 s LEU 292 N -5.99 -0.21 -0.30 1.39 2.96 -1.09 -4.94 118.68 110.50 2xe5 s LEU 292 Ca -0.04 1.13 -0.05 0.00 -0.22 0.00 0.00 54.13 54.94 2xe5 s LEU 292 Cb 0.08 2.00 0.19 0.00 0.50 0.00 0.00 46.19 48.96 2xe5 s LEU 292 CO 0.82 -0.22 0.81 -0.75 -1.32 0.00 0.00 176.35 175.69 2xe5 s LYS 293 N 0.21 0.38 0.04 1.98 2.20 -1.25 -0.69 119.74 122.60 2xe5 s LYS 293 Ca -0.01 0.58 -0.20 0.00 -0.36 0.00 0.00 55.97 55.98 2xe5 s LYS 293 Cb -0.04 0.31 0.04 0.00 -1.51 0.00 0.00 37.83 36.63 2xe5 s LYS 293 CO 0.01 -0.50 0.47 1.52 -0.36 0.00 0.00 175.35 176.49 2xe5 s TYR 294 N 2.90 -0.35 -0.06 4.03 -0.85 -0.39 -0.52 117.35 122.12 2xe5 s TYR 294 Ca 0.12 0.37 -0.03 0.00 -0.52 0.00 0.00 57.07 57.02 2xe5 s TYR 294 Cb -0.11 0.27 -0.04 0.00 0.38 0.00 0.00 41.96 42.47 2xe5 s TYR 294 CO -0.19 -0.59 0.10 0.08 -1.52 0.00 0.00 175.55 173.43 2xe5 s VAL 295 N -2.35 4.99 -0.11 -3.49 1.01 -0.50 -1.29 120.40 118.66 2xe5 s VAL 295 Ca -0.06 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.79 2xe5 s VAL 295 Cb -0.01 -3.22 0.02 0.00 0.00 0.00 0.00 36.38 33.17 2xe5 s VAL 295 CO -0.01 0.49 -0.14 -0.62 0.00 0.00 0.00 175.10 174.82 2xe5 s ASP 296 N -1.36 2.36 -0.09 3.32 2.15 0.15 -0.15 116.67 123.05 2xe5 s ASP 296 Ca 0.19 -0.41 0.04 0.00 0.43 0.00 0.00 52.55 52.80 2xe5 s ASP 296 Cb -0.12 -1.04 0.00 0.00 -0.30 0.00 0.00 42.92 41.46 2xe5 s ASP 296 CO 0.09 -0.00 -0.22 -0.69 -0.17 0.00 0.00 175.17 174.18 2xe5 s VAL 297 N 1.06 1.86 0.31 1.11 1.01 -0.23 -0.10 120.40 125.43 2xe5 s VAL 297 Ca -0.06 -0.91 -0.19 0.00 0.00 0.00 0.00 61.98 60.83 2xe5 s VAL 297 Cb -0.15 -1.62 0.05 0.00 0.00 0.00 0.00 36.38 34.66 2xe5 s VAL 297 CO -0.02 0.52 0.81 -0.83 0.00 0.00 0.00 175.10 175.58 2xe5 s GLY 298 N 0.39 0.16 -0.19 4.51 0.00 -0.30 0.76 107.32 112.64 2xe5 s GLY 298 Ca -0.17 -0.51 -0.16 0.00 0.00 0.00 0.00 44.72 43.87 2xe5 s GLY 298 CO 0.08 0.10 0.51 0.00 0.00 0.00 0.00 173.10 173.78 2xe5 s ALA 299 N -2.82 -1.27 -0.08 3.20 0.00 -0.36 0.13 121.76 120.56 2xe5 s ALA 299 Ca 0.15 1.51 0.04 0.00 0.00 0.00 0.00 51.96 53.66 2xe5 s ALA 299 Cb -0.05 -0.88 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 2xe5 s ALA 299 CO 0.09 -0.25 -0.21 0.99 0.00 0.00 0.00 175.76 176.37 2xe5 s THR 300 N 0.50 2.37 -0.22 0.00 2.01 -0.94 -1.50 115.64 117.87 2xe5 s THR 300 Ca -0.02 -0.93 -0.05 0.00 0.31 0.00 0.00 61.69 61.00 2xe5 s THR 300 Cb -0.04 -1.91 -0.02 0.00 0.01 0.00 0.00 72.50 70.54 2xe5 s THR 300 CO -0.02 0.56 0.00 -0.47 -0.69 0.00 0.00 174.62 174.00 2xe5 s TYR 301 N 0.02 3.02 -0.49 4.92 5.04 0.21 -0.27 117.35 129.80 2xe5 s TYR 301 Ca -0.08 -0.60 -0.16 0.00 -2.44 0.00 0.00 57.07 53.79 2xe5 s TYR 301 Cb -0.15 -2.12 0.08 0.00 0.35 0.00 0.00 41.96 40.11 2xe5 s TYR 301 CO 0.05 -0.37 0.45 0.71 -1.34 0.00 0.00 175.55 175.06 2xe5 s TYR 302 N 1.29 3.20 0.19 4.97 2.02 -0.68 -0.99 117.35 127.36 2xe5 s TYR 302 Ca 0.04 -0.89 -0.09 0.00 -0.37 0.00 0.00 57.07 55.76 2xe5 s TYR 302 Cb -0.15 -3.31 0.11 0.00 -0.40 0.00 0.00 41.96 38.21 2xe5 s TYR 302 CO 0.01 -0.87 1.72 0.74 -1.57 0.00 0.00 175.55 175.58 2xe5 h PHE 303 N 8.82 1.11 -0.61 2.71 0.04 -1.48 -3.43 116.94 124.10 2xe5 h PHE 303 Ca -0.28 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.37 2xe5 h PHE 303 Cb 1.11 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 38.94 2xe5 h PHE 303 CO 0.67 0.89 0.00 0.27 -0.60 0.00 0.00 178.31 179.54 2xe5 n ASN 304 N -4.31 0.00 0.19 2.17 0.23 -1.15 -4.99 115.26 107.40 2xe5 n ASN 304 Ca 0.05 -0.10 0.14 0.00 -0.53 0.00 0.00 54.58 54.14 2xe5 n ASN 304 Cb 0.22 0.00 0.55 0.00 -2.08 0.00 0.00 39.78 38.47 2xe5 n ASN 304 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 2xe5 h LYS 305 N 0.00 0.00 -0.00 -3.83 1.57 -1.97 -3.24 116.57 109.10 2xe5 h LYS 305 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2xe5 h LYS 305 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2xe5 h LYS 305 CO 0.00 0.00 -0.41 0.09 -0.57 0.00 0.00 179.45 178.56 2xe5 n ASN 306 N -2.59 0.57 -3.77 0.86 4.13 -1.26 -4.84 115.26 108.35 2xe5 n ASN 306 Ca 0.02 -0.78 -0.14 0.00 1.68 0.00 0.00 54.58 55.36 2xe5 n ASN 306 Cb 0.28 0.92 -0.15 0.00 -1.54 0.00 0.00 39.78 39.29 2xe5 n ASN 306 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 2xe5 s MET 307 N -1.81 0.06 0.13 3.52 1.75 -1.22 -0.67 119.30 121.06 2xe5 s MET 307 Ca 0.04 0.29 -0.18 0.00 -1.25 0.00 0.00 55.69 54.59 2xe5 s MET 307 Cb 0.07 -0.17 0.04 0.00 2.84 0.00 0.00 34.83 37.62 2xe5 s MET 307 CO 0.37 -0.14 0.45 -1.54 -0.65 0.00 0.00 175.02 173.50 2xe5 s SER 308 N 0.98 -0.32 0.02 1.11 1.04 -0.69 -1.18 113.70 114.66 2xe5 s SER 308 Ca -0.08 -0.24 0.01 0.00 0.48 0.00 0.00 55.95 56.13 2xe5 s SER 308 Cb -0.10 0.50 -0.02 0.00 0.10 0.00 0.00 66.02 66.50 2xe5 s SER 308 CO -0.04 -0.88 -0.05 0.28 0.98 0.00 0.00 173.24 173.53 2xe5 s THR 309 N -3.78 0.27 0.05 2.02 -1.32 -0.16 -0.59 115.64 112.13 2xe5 s THR 309 Ca 0.02 -0.85 -0.16 0.00 -1.21 0.00 0.00 61.69 59.49 2xe5 s THR 309 Cb 0.01 -0.36 0.03 0.00 -1.51 0.00 0.00 72.50 70.67 2xe5 s THR 309 CO -0.12 -0.38 0.37 -0.72 -2.21 0.00 0.00 174.62 171.55 2xe5 s TYR 310 N -1.23 -0.19 -0.05 9.09 -0.85 -0.47 0.64 117.35 124.29 2xe5 s TYR 310 Ca -0.12 0.08 0.06 0.00 -0.52 0.00 0.00 57.07 56.57 2xe5 s TYR 310 Cb -0.09 0.17 -0.01 0.00 0.38 0.00 0.00 41.96 42.41 2xe5 s TYR 310 CO -0.00 -0.56 -0.21 0.54 -1.52 0.00 0.00 175.55 173.80 2xe5 s VAL 311 N -2.65 1.76 -0.09 -3.49 0.11 -0.56 -1.36 120.40 114.12 2xe5 s VAL 311 Ca -0.04 -0.91 0.01 0.00 -2.93 0.00 0.00 61.98 58.11 2xe5 s VAL 311 Cb -0.00 -1.49 0.02 0.00 -1.53 0.00 0.00 36.38 33.37 2xe5 s VAL 311 CO -0.04 0.50 -0.11 -0.62 -3.33 0.00 0.00 175.10 171.50 2xe5 s ASP 312 N -0.14 2.00 -0.29 3.54 -1.08 -0.42 -1.23 116.67 119.06 2xe5 s ASP 312 Ca -0.02 -0.32 0.01 0.00 -0.52 0.00 0.00 52.55 51.71 2xe5 s ASP 312 Cb -0.12 -0.87 0.06 0.00 -1.46 0.00 0.00 42.92 40.53 2xe5 s ASP 312 CO 0.02 -0.02 -0.05 -0.47 0.52 0.00 0.00 175.17 175.17 2xe5 s TYR 313 N 1.06 3.33 -0.44 -5.34 5.04 0.23 -0.47 117.35 120.75 2xe5 s TYR 313 Ca -0.07 -2.26 -0.21 0.00 -2.44 0.00 0.00 57.07 52.09 2xe5 s TYR 313 Cb -0.15 -2.13 0.02 0.00 0.35 0.00 0.00 41.96 40.06 2xe5 s TYR 313 CO -0.01 -0.87 0.67 0.21 -1.34 0.00 0.00 175.55 174.21 2xe5 s LYS 314 N 1.13 3.30 -0.60 4.97 2.20 0.07 -1.06 119.74 129.74 2xe5 s LYS 314 Ca -0.05 -0.34 -0.21 0.00 -0.36 0.00 0.00 55.97 55.02 2xe5 s LYS 314 Cb -0.20 -3.95 0.08 0.00 -1.51 0.00 0.00 37.83 32.25 2xe5 s LYS 314 CO -0.04 -1.03 0.80 0.42 -0.36 0.00 0.00 175.35 175.14 2xe5 s ILE 315 N 2.89 4.63 -0.30 5.43 1.01 0.79 -2.38 121.20 133.28 2xe5 s ILE 315 Ca 0.24 -0.62 -0.26 0.00 0.00 0.00 0.00 60.65 60.01 2xe5 s ILE 315 Cb -0.14 -4.53 0.01 0.00 0.01 0.00 0.00 42.46 37.81 2xe5 s ILE 315 CO 0.20 -1.19 0.91 0.21 0.00 0.00 0.00 174.94 175.06 2xe5 s ASN 316 N 3.46 6.81 0.00 3.58 3.84 -1.26 -1.41 114.94 129.95 2xe5 s ASN 316 Ca 0.17 0.89 0.25 0.00 0.21 0.00 0.00 52.86 54.39 2xe5 s ASN 316 Cb -0.20 -2.47 0.48 0.00 -0.55 0.00 0.00 41.25 38.51 2xe5 s ASN 316 CO 0.09 -0.70 1.42 0.18 -2.79 0.00 0.00 177.10 175.31 2xe5 n LEU 317 N 6.41 2.42 -4.77 3.21 4.77 0.32 -4.79 117.00 124.58 2xe5 n LEU 317 Ca 0.07 -0.81 -0.39 0.00 -0.03 0.00 0.00 56.01 54.85 2xe5 n LEU 317 Cb 0.47 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.55 2xe5 n LEU 317 CO 0.53 0.41 0.90 -0.76 -1.33 0.00 0.00 177.39 177.14 2xe5 s LEU 318 N -2.03 4.26 0.08 2.23 1.43 -1.19 -4.99 118.68 118.47 2xe5 s LEU 318 Ca 0.31 2.50 -0.17 0.00 -1.03 0.00 0.00 54.13 55.74 2xe5 s LEU 318 Cb 0.20 -3.89 -0.07 0.00 0.03 0.00 0.00 46.19 42.46 2xe5 s LEU 318 CO 0.33 -0.68 0.53 -1.81 0.23 0.00 0.00 176.35 174.95 2xe5 s ASP 319 N -0.87 6.95 -0.27 2.29 1.01 -1.26 -4.85 116.67 119.67 2xe5 s ASP 319 Ca 0.55 1.16 -0.29 0.00 0.71 0.00 0.00 52.55 54.67 2xe5 s ASP 319 Cb -0.35 -2.32 -0.01 0.00 1.01 0.00 0.00 42.92 41.25 2xe5 s ASP 319 CO 0.45 0.24 1.48 -0.62 0.21 0.00 0.00 175.17 176.93 2xe5 s ASP 320 N -1.26 6.48 0.20 0.27 2.15 -1.26 -4.80 116.67 118.46 2xe5 s ASP 320 Ca 0.30 1.40 0.00 0.00 0.43 0.00 0.00 52.55 54.68 2xe5 s ASP 320 Cb -0.18 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 2xe5 s ASP 320 CO 0.18 -1.21 0.26 -0.46 -0.17 0.00 0.00 175.17 173.77 2xe5 n ASN 321 N 8.18 -0.72 -0.12 -0.34 0.23 -1.26 -5.04 115.26 116.19 2xe5 n ASN 321 Ca 0.17 -2.14 -0.06 0.00 -0.53 0.00 0.00 54.58 52.03 2xe5 n ASN 321 Cb 0.46 1.38 0.02 0.00 -2.08 0.00 0.00 39.78 39.57 2xe5 n ASN 321 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 2xe5 h ARG 322 N 0.00 0.30 -0.25 -3.83 2.43 -2.00 -2.45 114.38 108.59 2xe5 h ARG 322 Ca -0.15 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.00 2xe5 h ARG 322 Cb 0.69 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 2xe5 h ARG 322 CO 0.21 0.20 0.14 0.35 -1.51 0.00 0.00 179.97 179.36 2xe5 h PHE 323 N 0.31 0.33 -0.09 2.20 3.57 -1.97 -0.66 116.94 120.64 2xe5 h PHE 323 Ca 0.17 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.55 2xe5 h PHE 323 Cb 0.14 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 2xe5 h PHE 323 CO -0.14 0.27 -0.47 1.79 -2.23 0.00 0.00 178.31 177.53 2xe5 h THR 324 N 0.30 1.34 -0.12 4.41 1.35 -1.82 0.66 112.91 119.03 2xe5 h THR 324 Ca 0.09 -1.67 -0.07 0.00 -0.55 0.00 0.00 66.41 64.21 2xe5 h THR 324 Cb 0.04 1.80 -0.00 0.00 -1.73 0.00 0.00 68.15 68.26 2xe5 h THR 324 CO -0.02 0.50 -0.19 0.03 -0.25 0.00 0.00 175.52 175.59 2xe5 h ARG 325 N 0.18 0.33 -0.57 4.72 3.08 -1.32 0.12 114.38 120.92 2xe5 h ARG 325 Ca 0.01 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2xe5 h ARG 325 Cb 0.91 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.95 2xe5 h ARG 325 CO 0.07 0.78 0.37 -0.44 -1.07 0.00 0.00 179.97 179.68 2xe5 h ASP 326 N -0.09 0.67 1.32 7.04 5.19 -1.00 -2.69 116.42 126.85 2xe5 h ASP 326 Ca 0.01 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2xe5 h ASP 326 Cb 0.76 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.10 2xe5 h ASP 326 CO 0.04 0.50 0.00 0.00 -3.12 0.00 0.00 179.24 176.66 2xe5 h ALA 327 N 1.20 1.00 -1.03 3.45 0.00 -0.85 -3.45 119.26 119.57 2xe5 h ALA 327 Ca 0.21 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 2xe5 h ALA 327 Cb -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2xe5 h ALA 327 CO -0.04 0.00 -0.20 0.41 0.00 0.00 0.00 179.25 179.42 2xe5 n GLY 328 N 0.41 0.17 3.76 0.00 0.00 0.19 -1.30 105.19 108.42 2xe5 n GLY 328 Ca 0.02 -0.57 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 2xe5 n GLY 328 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2xe5 s ILE 329 N -2.38 4.80 0.02 -0.61 1.01 0.15 -4.93 121.20 119.26 2xe5 s ILE 329 Ca 0.00 1.43 -0.30 0.00 0.00 0.00 0.00 60.65 61.78 2xe5 s ILE 329 Cb 0.00 -4.02 -0.06 0.00 0.01 0.00 0.00 42.46 38.39 2xe5 s ILE 329 CO 0.00 0.40 1.36 0.21 0.00 0.00 0.00 174.94 176.91 2xe5 s ASN 330 N -0.20 6.89 0.00 3.58 2.47 -1.26 -4.71 114.94 121.70 2xe5 s ASN 330 Ca 0.34 2.11 0.11 0.00 0.42 0.00 0.00 52.86 55.84 2xe5 s ASN 330 Cb -0.19 -2.57 0.09 0.00 -1.45 0.00 0.00 41.25 37.13 2xe5 s ASN 330 CO 0.20 -0.67 0.86 0.35 -3.72 0.00 0.00 177.10 174.12 2xe5 n THR 331 N 4.46 0.00 -3.04 -5.21 -2.24 -1.26 -4.93 114.28 102.06 2xe5 n THR 331 Ca 0.12 -0.50 -0.28 0.00 -2.27 0.00 0.00 64.05 61.12 2xe5 n THR 331 Cb 0.44 1.24 -0.02 0.00 -2.10 0.00 0.00 70.33 69.89 2xe5 n THR 331 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2xe5 s ASP 332 N -0.95 6.39 0.56 3.42 1.01 -1.26 -4.60 116.67 121.24 2xe5 s ASP 332 Ca 0.13 0.82 -0.18 0.00 0.71 0.00 0.00 52.55 54.04 2xe5 s ASP 332 Cb 0.09 -2.19 -0.05 0.00 1.01 0.00 0.00 42.92 41.78 2xe5 s ASP 332 CO 0.14 -0.36 1.08 -1.81 0.21 0.00 0.00 175.17 174.43 2xe5 s ASP 333 N -3.57 5.79 -0.01 0.27 1.01 -1.26 -4.59 116.67 114.31 2xe5 s ASP 333 Ca 0.46 1.97 0.01 0.00 0.71 0.00 0.00 52.55 55.70 2xe5 s ASP 333 Cb -0.10 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.28 2xe5 s ASP 333 CO 0.35 -1.16 -0.03 -0.63 0.21 0.00 0.00 175.17 173.91 2xe5 s ILE 334 N -2.13 0.30 -0.11 0.77 1.01 -1.00 -4.32 121.20 115.71 2xe5 s ILE 334 Ca 0.67 -0.10 -0.01 0.00 0.00 0.00 0.00 60.65 61.22 2xe5 s ILE 334 Cb -0.19 -0.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.96 2xe5 s ILE 334 CO 0.31 0.12 -0.09 -0.69 0.00 0.00 0.00 174.94 174.58 2xe5 s VAL 335 N 0.30 3.45 -0.08 2.92 1.01 -0.52 -0.75 120.40 126.73 2xe5 s VAL 335 Ca -0.03 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.45 2xe5 s VAL 335 Cb -0.06 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.85 2xe5 s VAL 335 CO -0.01 0.54 -0.18 0.00 0.00 0.00 0.00 175.10 175.46 2xe5 s ALA 336 N -0.03 2.48 -0.11 5.51 0.00 0.38 -0.23 121.76 129.75 2xe5 s ALA 336 Ca -0.01 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 50.98 2xe5 s ALA 336 Cb -0.14 -0.94 0.02 0.00 0.00 0.00 0.00 23.12 22.06 2xe5 s ALA 336 CO 0.03 0.41 -0.12 -1.17 0.00 0.00 0.00 175.76 174.91 2xe5 s LEU 337 N -0.20 1.55 0.04 0.00 2.96 0.02 -1.30 118.68 121.75 2xe5 s LEU 337 Ca -0.01 -0.39 0.03 0.00 -0.22 0.00 0.00 54.13 53.54 2xe5 s LEU 337 Cb -0.13 -1.01 -0.02 0.00 0.50 0.00 0.00 46.19 45.53 2xe5 s LEU 337 CO 0.03 -0.04 -0.09 -0.83 -1.32 0.00 0.00 176.35 174.11 2xe5 s GLY 338 N 1.27 0.53 -0.07 7.98 0.00 -0.46 -0.70 107.32 115.87 2xe5 s GLY 338 Ca -0.02 -0.73 -0.00 0.00 0.00 0.00 0.00 44.72 43.97 2xe5 s GLY 338 CO -0.05 -0.76 -0.02 -2.27 0.00 0.00 0.00 173.10 169.99 2xe5 s LEU 339 N -1.39 0.92 -0.15 0.66 2.96 0.20 -1.37 118.68 120.51 2xe5 s LEU 339 Ca -0.07 -0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 53.70 2xe5 s LEU 339 Cb -0.09 -0.49 0.04 0.00 0.50 0.00 0.00 46.19 46.15 2xe5 s LEU 339 CO 0.01 -0.14 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.18 2xe5 s VAL 340 N 1.57 0.90 -0.20 1.68 1.01 0.24 -0.53 120.40 125.08 2xe5 s VAL 340 Ca -0.01 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.43 2xe5 s VAL 340 Cb -0.13 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 2xe5 s VAL 340 CO -0.04 0.13 0.10 -0.47 0.00 0.00 0.00 175.10 174.82 2xe5 s TYR 341 N 1.73 3.29 0.08 5.22 5.04 -0.58 -1.71 117.35 130.42 2xe5 s TYR 341 Ca 0.02 0.13 0.02 0.00 -2.44 0.00 0.00 57.07 54.81 2xe5 s TYR 341 Cb -0.15 -2.14 -0.03 0.00 0.35 0.00 0.00 41.96 39.98 2xe5 s TYR 341 CO -0.07 0.14 -0.08 1.14 -1.34 0.00 0.00 175.55 175.33 2xe5 s GLN 342 N 0.57 0.73 0.00 4.97 -2.07 0.16 -0.56 119.66 123.46 2xe5 s GLN 342 Ca 0.05 -1.08 0.00 0.00 -1.82 0.00 0.00 55.36 52.51 2xe5 s GLN 342 Cb -0.12 -0.33 0.00 0.00 -1.09 0.00 0.00 33.01 31.46 2xe5 s GLN 342 CO 0.01 0.03 0.11 1.97 -1.32 0.00 0.00 175.29 176.09