#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bkt s SER 3 N 0.00 0.01 -0.08 8.00 0.01 0.19 -4.99 113.70 116.84 2bkt s SER 3 Ca 0.00 0.00 0.04 0.00 1.31 0.00 0.00 55.95 57.30 2bkt s SER 3 Cb 0.00 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 2bkt s SER 3 CO 0.00 -0.01 -0.20 -0.94 0.41 0.00 0.00 173.24 172.50 2bkt s SER 4 N 0.12 3.51 -0.23 2.44 1.04 -1.26 0.10 113.70 119.42 2bkt s SER 4 Ca -0.01 -0.40 -0.07 0.00 0.48 0.00 0.00 55.95 55.95 2bkt s SER 4 Cb -0.01 -1.08 -0.03 0.00 0.10 0.00 0.00 66.02 64.99 2bkt s SER 4 CO -0.00 0.24 0.06 -0.69 0.98 0.00 0.00 173.24 173.83 2bkt s VAL 5 N -0.11 4.36 0.25 5.02 1.01 0.12 -4.76 120.40 126.29 2bkt s VAL 5 Ca -0.04 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 2bkt s VAL 5 Cb -0.14 -3.01 -0.09 0.00 0.00 0.00 0.00 36.38 33.14 2bkt s VAL 5 CO 0.04 0.37 1.14 -0.63 0.00 0.00 0.00 175.10 176.02 2bkt s ILE 6 N 1.27 3.48 0.09 2.22 -1.09 -1.26 -1.48 121.20 124.42 2bkt s ILE 6 Ca 0.05 1.41 0.08 0.00 -2.23 0.00 0.00 60.65 59.95 2bkt s ILE 6 Cb -0.15 -3.90 -0.04 0.00 -1.58 0.00 0.00 42.46 36.80 2bkt s ILE 6 CO 0.03 0.30 -0.16 -0.76 -1.23 0.00 0.00 174.94 173.13 2bkt s LEU 7 N -1.12 2.77 -0.19 2.97 1.43 -0.73 -4.35 118.68 119.47 2bkt s LEU 7 Ca 0.47 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 53.00 2bkt s LEU 7 Cb -0.32 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 2bkt s LEU 7 CO 0.40 0.21 0.16 -0.89 0.23 0.00 0.00 176.35 176.46 2bkt s THR 8 N -1.09 5.39 -0.37 5.49 2.01 0.18 -2.19 115.64 125.06 2bkt s THR 8 Ca 0.18 0.25 -0.13 0.00 0.31 0.00 0.00 61.69 62.30 2bkt s THR 8 Cb -0.11 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 68.91 2bkt s THR 8 CO 0.09 0.44 0.26 0.21 -0.69 0.00 0.00 174.62 174.93 2bkt s ASN 9 N 0.34 6.01 -0.42 3.53 3.04 -1.26 -1.74 114.94 124.43 2bkt s ASN 9 Ca 0.10 -0.69 -0.11 0.00 0.04 0.00 0.00 52.86 52.19 2bkt s ASN 9 Cb -0.11 -2.13 0.06 0.00 -1.54 0.00 0.00 41.25 37.54 2bkt s ASN 9 CO -0.01 -0.34 0.28 -0.47 -3.04 0.00 0.00 177.10 173.53 2bkt s TYR 10 N 1.68 3.29 -1.68 0.43 5.04 0.97 -4.68 117.35 122.40 2bkt s TYR 10 Ca 0.05 -1.24 -0.13 0.00 -2.44 0.00 0.00 57.07 53.31 2bkt s TYR 10 Cb -0.18 -2.89 0.12 0.00 0.35 0.00 0.00 41.96 39.36 2bkt s TYR 10 CO 0.10 -0.79 0.50 -1.33 -1.34 0.00 0.00 175.55 172.68 2bkt n MET 11 N 5.01 -1.93 -0.47 4.97 2.81 -1.26 -1.80 117.12 124.46 2bkt n MET 11 Ca -0.11 0.24 -0.00 0.00 -1.81 0.00 0.00 57.70 56.02 2bkt n MET 11 Cb 0.44 -4.55 -0.00 0.00 -0.71 0.00 0.00 33.22 28.39 2bkt n MET 11 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2bkt n ASP 12 N -2.70 -2.61 -0.05 7.83 10.43 -1.26 -4.58 116.55 123.61 2bkt n ASP 12 Ca -0.06 0.01 -0.05 0.00 2.57 0.00 0.00 54.79 57.26 2bkt n ASP 12 Cb 0.56 -1.83 -0.10 0.00 1.84 0.00 0.00 41.12 41.59 2bkt n ASP 12 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 2bkt n THR 13 N -0.90 0.75 -3.84 -3.53 -2.24 -0.77 -4.79 114.28 98.96 2bkt n THR 13 Ca -0.00 -0.49 -0.27 0.00 -2.27 0.00 0.00 64.05 61.02 2bkt n THR 13 Cb 0.22 -0.60 -0.17 0.00 -2.10 0.00 0.00 70.33 67.69 2bkt n THR 13 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2bkt s GLN 14 N -2.35 1.16 -0.24 -0.78 -0.21 -0.75 -4.21 119.66 112.28 2bkt s GLN 14 Ca -0.06 -0.39 -0.03 0.00 0.02 0.00 0.00 55.36 54.90 2bkt s GLN 14 Cb 0.04 -1.84 0.01 0.00 1.00 0.00 0.00 33.01 32.21 2bkt s GLN 14 CO 0.50 -0.44 -0.03 0.71 -2.12 0.00 0.00 175.29 173.90 2bkt s TYR 15 N 1.73 3.01 0.06 0.91 1.51 -1.26 -0.02 117.35 123.30 2bkt s TYR 15 Ca 0.01 -1.15 -0.00 0.00 -1.01 0.00 0.00 57.07 54.92 2bkt s TYR 15 Cb -0.15 -2.11 -0.04 0.00 -0.11 0.00 0.00 41.96 39.55 2bkt s TYR 15 CO -0.07 -0.61 -0.04 1.52 -1.11 0.00 0.00 175.55 175.23 2bkt s TYR 16 N 1.43 0.60 0.00 2.71 1.13 -0.71 -4.46 117.35 118.05 2bkt s TYR 16 Ca 0.04 -1.00 0.00 0.00 -1.41 0.00 0.00 57.07 54.69 2bkt s TYR 16 Cb -0.15 -0.41 0.00 0.00 -1.10 0.00 0.00 41.96 40.29 2bkt s TYR 16 CO -0.03 -0.31 0.00 0.41 -2.51 0.00 0.00 175.55 173.11 2bkt n GLY 17 N 0.15 5.69 3.21 5.49 0.00 0.33 0.48 105.19 120.55 2bkt n GLY 17 Ca -0.14 -1.95 -0.30 0.00 0.00 0.00 0.00 46.02 43.63 2bkt n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bkt s GLU 18 N -0.42 2.45 0.12 1.61 2.02 -1.26 0.28 118.70 123.49 2bkt s GLU 18 Ca 0.00 -0.81 0.08 0.00 0.02 0.00 0.00 54.97 54.27 2bkt s GLU 18 Cb 0.00 -2.02 -0.04 0.00 0.10 0.00 0.00 34.13 32.18 2bkt s GLU 18 CO 0.00 0.29 -0.20 0.96 0.02 0.00 0.00 175.26 176.32 2bkt s ILE 19 N 0.04 1.76 -0.11 -1.63 -4.36 -0.82 -4.51 121.20 111.58 2bkt s ILE 19 Ca -0.08 -1.67 -0.01 0.00 -0.26 0.00 0.00 60.65 58.64 2bkt s ILE 19 Cb -0.14 -1.66 -0.03 0.00 1.25 0.00 0.00 42.46 41.88 2bkt s ILE 19 CO 0.05 -0.13 -0.07 -0.83 0.24 0.00 0.00 174.94 174.19 2bkt s GLY 20 N -2.15 1.66 -0.09 6.27 0.00 -0.41 -0.83 107.32 111.78 2bkt s GLY 20 Ca 0.09 -0.87 0.03 0.00 0.00 0.00 0.00 44.72 43.98 2bkt s GLY 20 CO 0.05 -0.35 -0.18 -0.42 0.00 0.00 0.00 173.10 172.20 2bkt s ILE 21 N -0.14 1.59 0.00 0.90 1.01 0.48 0.11 121.20 125.15 2bkt s ILE 21 Ca 0.01 -0.74 0.00 0.00 0.00 0.00 0.00 60.65 59.92 2bkt s ILE 21 Cb -0.13 -1.41 0.00 0.00 0.01 0.00 0.00 42.46 40.93 2bkt s ILE 21 CO 0.03 0.46 0.00 0.61 0.00 0.00 0.00 174.94 176.04 2bkt n GLY 22 N 3.71 -3.04 2.81 6.18 0.00 -0.47 0.19 105.19 114.56 2bkt n GLY 22 Ca -0.21 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 2bkt n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bkt s THR 23 N -0.82 0.96 0.76 2.61 2.01 -1.26 -1.48 115.64 118.42 2bkt s THR 23 Ca 0.00 -0.98 -0.11 0.00 0.31 0.00 0.00 61.69 60.91 2bkt s THR 23 Cb 0.00 -1.44 0.05 0.00 0.01 0.00 0.00 72.50 71.11 2bkt s THR 23 CO 0.00 -0.27 1.08 -2.16 -0.69 0.00 0.00 174.62 172.58 2bkt s PRO 24 N 1.64 2.41 -0.10 4.92 0.04 -1.25 -0.91 135.00 141.74 2bkt s PRO 24 Ca -0.00 0.84 -0.34 0.00 0.04 0.00 0.00 61.00 61.53 2bkt s PRO 24 Cb -0.18 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.31 2bkt s PRO 24 CO -0.11 -1.44 1.90 -2.30 0.04 0.00 0.00 177.00 175.09 2bkt n PRO 25 N -3.34 2.17 -3.35 0.56 -0.02 -0.55 -4.83 135.00 125.63 2bkt n PRO 25 Ca 0.07 0.79 -0.43 0.00 -2.02 0.00 0.00 63.50 61.91 2bkt n PRO 25 Cb 0.55 -2.66 -0.09 0.00 -0.02 0.00 0.00 33.50 31.28 2bkt n PRO 25 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2bkt s GLN 26 N 4.19 3.05 0.23 -0.52 -0.21 0.49 -4.70 119.66 122.19 2bkt s GLN 26 Ca 0.93 -0.91 -0.30 0.00 0.02 0.00 0.00 55.36 55.10 2bkt s GLN 26 Cb -0.69 -4.01 -0.09 0.00 1.00 0.00 0.00 33.01 29.23 2bkt s GLN 26 CO 0.51 -0.89 1.30 0.99 -2.12 0.00 0.00 175.29 175.09 2bkt s THR 27 N 2.01 3.12 -0.04 -0.19 2.01 -1.26 -0.39 115.64 120.90 2bkt s THR 27 Ca 0.10 0.96 0.01 0.00 0.31 0.00 0.00 61.69 63.07 2bkt s THR 27 Cb -0.19 -3.61 0.02 0.00 0.01 0.00 0.00 72.50 68.73 2bkt s THR 27 CO 0.12 0.16 -0.03 -0.36 -0.69 0.00 0.00 174.62 173.82 2bkt s PHE 28 N -0.15 0.61 -0.23 4.92 0.08 -0.01 -4.96 117.98 118.24 2bkt s PHE 28 Ca 0.55 -0.14 -0.27 0.00 0.12 0.00 0.00 56.93 57.18 2bkt s PHE 28 Cb -0.37 -0.59 0.00 0.00 -0.57 0.00 0.00 43.02 41.49 2bkt s PHE 28 CO 0.41 -0.18 0.96 0.15 -0.10 0.00 0.00 175.22 176.46 2bkt s LYS 29 N 0.98 4.23 0.06 0.44 1.02 -1.26 -1.93 119.74 123.28 2bkt s LYS 29 Ca -0.10 1.21 0.02 0.00 0.02 0.00 0.00 55.97 57.12 2bkt s LYS 29 Cb -0.14 -3.64 -0.03 0.00 -0.52 0.00 0.00 37.83 33.50 2bkt s LYS 29 CO -0.01 -0.59 -0.08 0.14 -0.92 0.00 0.00 175.35 173.90 2bkt s VAL 30 N 3.06 0.61 -0.14 3.17 -7.23 0.14 0.21 120.40 120.22 2bkt s VAL 30 Ca 0.41 -1.29 -0.16 0.00 -1.81 0.00 0.00 61.98 59.13 2bkt s VAL 30 Cb -0.15 -0.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.87 2bkt s VAL 30 CO 0.07 -0.48 0.40 -0.69 -0.31 0.00 0.00 175.10 174.08 2bkt s VAL 31 N -1.88 5.24 -0.52 1.32 1.01 -0.16 0.12 120.40 125.53 2bkt s VAL 31 Ca -0.05 0.77 -0.21 0.00 0.00 0.00 0.00 61.98 62.50 2bkt s VAL 31 Cb -0.07 -3.74 0.05 0.00 0.00 0.00 0.00 36.38 32.63 2bkt s VAL 31 CO -0.01 0.35 0.75 -0.36 0.00 0.00 0.00 175.10 175.83 2bkt s PHE 32 N 0.58 2.95 -0.38 5.22 0.40 -1.26 -0.86 117.98 124.63 2bkt s PHE 32 Ca 0.22 -0.33 -0.13 0.00 -0.60 0.00 0.00 56.93 56.09 2bkt s PHE 32 Cb -0.14 -3.74 0.02 0.00 0.51 0.00 0.00 43.02 39.67 2bkt s PHE 32 CO 0.07 -1.15 0.25 0.34 0.70 0.00 0.00 175.22 175.44 2bkt s ASP 33 N 2.73 5.95 0.00 1.36 3.68 0.68 -4.11 116.67 126.97 2bkt s ASP 33 Ca 0.21 -0.85 0.18 0.00 2.13 0.00 0.00 52.55 54.23 2bkt s ASP 33 Cb -0.17 -2.10 1.05 0.00 -1.45 0.00 0.00 42.92 40.25 2bkt s ASP 33 CO 0.15 -0.39 1.68 0.35 0.13 0.00 0.00 175.17 177.09 2bkt n THR 34 N 5.09 0.02 0.90 1.71 -2.24 -1.26 0.19 114.28 118.69 2bkt n THR 34 Ca -0.12 -0.03 0.10 0.00 -2.27 0.00 0.00 64.05 61.74 2bkt n THR 34 Cb 0.47 -0.23 -0.11 0.00 -2.10 0.00 0.00 70.33 68.36 2bkt n THR 34 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bkt n GLY 35 N 0.81 -1.01 3.33 3.38 0.00 -1.26 -4.16 105.19 106.27 2bkt n GLY 35 Ca 0.14 -0.58 -0.17 0.00 0.00 0.00 0.00 46.02 45.41 2bkt n GLY 35 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bkt s SER 36 N -3.15 1.91 -0.02 1.61 1.04 -1.13 -4.92 113.70 109.04 2bkt s SER 36 Ca 0.07 -1.20 0.04 0.00 0.48 0.00 0.00 55.95 55.33 2bkt s SER 36 Cb 0.16 -0.01 0.05 0.00 0.10 0.00 0.00 66.02 66.33 2bkt s SER 36 CO 0.87 -0.48 0.96 -1.20 0.98 0.00 0.00 173.24 174.36 2bkt n SER 37 N -0.42 1.72 -4.60 7.02 7.64 -1.26 0.97 113.62 124.70 2bkt n SER 37 Ca -0.05 -2.07 -0.25 0.00 1.01 0.00 0.00 58.87 57.51 2bkt n SER 37 Cb 0.64 -0.09 -0.08 0.00 -1.01 0.00 0.00 64.21 63.66 2bkt n SER 37 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2bkt s ASN 38 N -1.22 4.32 -0.24 6.43 -0.87 -1.26 -4.43 114.94 117.67 2bkt s ASN 38 Ca 0.06 -0.67 -0.10 0.00 -1.57 0.00 0.00 52.86 50.59 2bkt s ASN 38 Cb 0.05 -0.73 -0.05 0.00 -0.02 0.00 0.00 41.25 40.51 2bkt s ASN 38 CO 0.01 0.04 0.14 -0.69 -2.57 0.00 0.00 177.10 174.03 2bkt s VAL 39 N -2.11 5.14 -0.03 1.60 1.01 -1.25 0.70 120.40 125.45 2bkt s VAL 39 Ca 0.29 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.39 2bkt s VAL 39 Cb -0.07 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.92 2bkt s VAL 39 CO 0.17 0.35 -0.08 0.26 0.00 0.00 0.00 175.10 175.81 2bkt s TRP 40 N 1.08 0.92 -0.02 5.22 0.51 0.36 0.13 118.94 127.14 2bkt s TRP 40 Ca 0.07 -0.24 -0.07 0.00 -2.12 0.00 0.00 56.10 53.73 2bkt s TRP 40 Cb -0.14 -0.68 0.01 0.00 -0.81 0.00 0.00 33.47 31.85 2bkt s TRP 40 CO 0.04 -0.13 0.16 0.14 -0.51 0.00 0.00 176.95 176.66 2bkt s VAL 41 N 0.35 0.06 0.40 4.03 -7.23 -0.05 -0.81 120.40 117.15 2bkt s VAL 41 Ca -0.05 -0.49 -0.26 0.00 -1.81 0.00 0.00 61.98 59.37 2bkt s VAL 41 Cb -0.10 -0.39 -0.09 0.00 0.56 0.00 0.00 36.38 36.36 2bkt s VAL 41 CO 0.01 -0.27 1.25 -2.16 -0.31 0.00 0.00 175.10 173.61 2bkt s PRO 42 N -0.97 4.03 0.46 4.82 0.04 -1.25 0.90 135.00 143.02 2bkt s PRO 42 Ca -0.11 2.03 -0.17 0.00 0.04 0.00 0.00 61.00 62.79 2bkt s PRO 42 Cb -0.06 -2.75 -0.09 0.00 0.04 0.00 0.00 34.50 31.65 2bkt s PRO 42 CO 0.01 -0.40 0.93 0.45 0.04 0.00 0.00 177.00 178.03 2bkt s SER 43 N -0.88 6.71 0.51 6.66 0.15 0.26 -0.60 113.70 126.50 2bkt s SER 43 Ca 0.56 1.53 0.31 0.00 0.70 0.00 0.00 55.95 59.05 2bkt s SER 43 Cb -0.35 -2.48 1.15 0.00 -1.71 0.00 0.00 66.02 62.62 2bkt s SER 43 CO 0.45 -0.47 1.90 0.77 1.20 0.00 0.00 173.24 177.08 2bkt h SER 44 N 1.33 0.00 0.93 5.45 4.64 -0.56 -0.92 113.55 124.42 2bkt h SER 44 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2bkt h SER 44 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2bkt h SER 44 CO 0.62 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.87 2bkt n LYS 45 N -3.03 0.02 -1.75 4.77 4.76 -1.26 -4.78 118.16 116.89 2bkt n LYS 45 Ca 0.01 0.06 -0.42 0.00 -2.87 0.00 0.00 58.31 55.09 2bkt n LYS 45 Cb 0.34 -1.52 -0.03 0.00 -1.84 0.00 0.00 35.03 31.98 2bkt n LYS 45 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bkt n SER 47 N 6.63 2.90 0.26 0.00 2.88 -1.21 -4.81 113.62 120.27 2bkt n SER 47 Ca 0.18 1.09 0.12 0.00 -1.33 0.00 0.00 58.87 58.94 2bkt n SER 47 Cb 0.40 -1.40 0.67 0.00 -0.75 0.00 0.00 64.21 63.13 2bkt n SER 47 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 2bkt h ARG 48 N 5.62 0.00 -0.35 -1.46 9.65 -1.93 0.12 114.38 126.03 2bkt h ARG 48 Ca -0.45 0.00 -0.06 0.00 -1.10 0.00 0.00 59.98 58.36 2bkt h ARG 48 Cb 1.26 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.83 2bkt h ARG 48 CO 0.86 0.00 -0.06 -0.07 2.80 0.00 0.00 179.97 183.51 2bkt h LEU 49 N 0.00 0.54 -8.38 3.80 -0.00 -1.99 -3.39 115.31 105.90 2bkt h LEU 49 Ca 0.00 -0.13 -0.49 0.00 -0.00 0.00 0.00 57.88 57.26 2bkt h LEU 49 Cb 0.51 -0.14 -0.06 0.00 -0.00 0.00 0.00 40.66 40.97 2bkt h LEU 49 CO 0.00 0.65 1.19 -0.31 -0.00 0.00 0.00 178.44 179.98 2bkt s TYR 50 N -4.86 1.95 0.33 1.13 2.02 0.40 -4.85 117.35 113.48 2bkt s TYR 50 Ca -0.08 0.35 0.12 0.00 -0.37 0.00 0.00 57.07 57.10 2bkt s TYR 50 Cb 0.15 -4.31 1.01 0.00 -0.40 0.00 0.00 41.96 38.41 2bkt s TYR 50 CO 0.78 -2.13 1.66 1.15 -1.57 0.00 0.00 175.55 175.44 2bkt h THR 51 N 6.65 0.30 -0.10 -0.71 2.02 -1.85 1.26 112.91 120.49 2bkt h THR 51 Ca -0.18 -0.10 0.03 0.00 0.77 0.00 0.00 66.41 66.93 2bkt h THR 51 Cb 1.09 -0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.47 2bkt h THR 51 CO 1.26 0.06 0.26 0.00 0.37 0.00 0.00 175.52 177.46 2bkt h ALA 52 N 1.84 1.50 0.01 6.16 0.00 -1.85 -0.22 119.26 126.69 2bkt h ALA 52 Ca 0.70 -0.00 -0.31 0.00 0.00 0.00 0.00 54.91 55.29 2bkt h ALA 52 Cb 1.56 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.31 2bkt h ALA 52 CO -0.62 -0.31 -1.85 0.00 0.00 0.00 0.00 179.25 176.47 2bkt h VAL 54 N 0.01 1.13 -0.97 0.00 2.07 -0.77 -3.06 116.25 114.66 2bkt h VAL 54 Ca -0.34 -0.29 -0.64 0.00 0.82 0.00 0.00 66.70 66.24 2bkt h VAL 54 Cb 2.05 0.19 -0.34 0.00 -1.52 0.00 0.00 31.29 31.68 2bkt h VAL 54 CO 0.07 0.16 0.30 -1.22 0.02 0.00 0.00 177.57 176.90 2bkt n TYR 55 N -4.66 3.07 -3.86 1.57 4.02 -1.12 -4.98 117.16 111.21 2bkt n TYR 55 Ca 0.06 -2.75 -0.11 0.00 -0.01 0.00 0.00 57.90 55.10 2bkt n TYR 55 Cb 0.05 -1.06 -0.09 0.00 -0.02 0.00 0.00 39.34 38.23 2bkt n TYR 55 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 2bkt s HIS 56 N -3.76 0.05 0.15 -0.72 3.76 -1.16 -5.06 115.29 108.56 2bkt s HIS 56 Ca 0.60 -0.21 -0.31 0.00 -0.15 0.00 0.00 55.06 54.98 2bkt s HIS 56 Cb 0.47 -0.04 -0.11 0.00 1.11 0.00 0.00 32.58 34.01 2bkt s HIS 56 CO -0.01 -0.37 1.79 0.21 -0.85 0.00 0.00 174.74 175.51 2bkt s LYS 57 N -2.06 4.13 -0.09 1.40 2.47 -1.26 -4.93 119.74 119.39 2bkt s LYS 57 Ca -0.09 2.59 -0.03 0.00 -1.56 0.00 0.00 55.97 56.88 2bkt s LYS 57 Cb -0.04 -3.42 -0.03 0.00 -1.46 0.00 0.00 37.83 32.88 2bkt s LYS 57 CO -0.01 -0.81 0.02 -0.51 0.16 0.00 0.00 175.35 174.20 2bkt s LEU 58 N 2.21 3.69 -0.12 5.43 1.43 -1.26 -4.36 118.68 125.69 2bkt s LEU 58 Ca 0.79 0.18 -0.23 0.00 -1.03 0.00 0.00 54.13 53.84 2bkt s LEU 58 Cb -0.47 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 2bkt s LEU 58 CO 0.35 0.37 0.70 0.12 0.23 0.00 0.00 176.35 178.12 2bkt s PHE 59 N -0.85 3.49 -0.41 0.29 2.19 0.23 -4.73 117.98 118.20 2bkt s PHE 59 Ca 0.13 1.16 -0.08 0.00 0.33 0.00 0.00 56.93 58.46 2bkt s PHE 59 Cb -0.11 -2.83 0.08 0.00 -1.31 0.00 0.00 43.02 38.84 2bkt s PHE 59 CO 0.02 -0.04 0.24 0.34 1.83 0.00 0.00 175.22 177.62 2bkt s ASP 60 N 0.96 5.55 0.23 6.13 -1.08 -1.26 0.17 116.67 127.37 2bkt s ASP 60 Ca 0.35 -1.55 -0.08 0.00 -0.52 0.00 0.00 52.55 50.75 2bkt s ASP 60 Cb -0.17 -1.95 0.23 0.00 -1.46 0.00 0.00 42.92 39.56 2bkt s ASP 60 CO 0.15 -0.52 1.88 0.00 0.52 0.00 0.00 175.17 177.20 2bkt h ALA 61 N 8.34 1.09 0.00 3.66 0.00 -1.94 -1.80 119.26 128.61 2bkt h ALA 61 Ca -0.22 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2bkt h ALA 61 Cb 1.08 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2bkt h ALA 61 CO 0.74 0.42 0.00 -1.13 0.00 0.00 0.00 179.25 179.27 2bkt n SER 62 N -4.53 0.50 0.00 0.00 3.41 -1.26 -1.17 113.62 110.56 2bkt n SER 62 Ca 0.10 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 2bkt n SER 62 Cb 0.06 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 2bkt n SER 62 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2bkt n ASP 63 N 0.14 0.21 -4.34 4.04 10.43 -0.68 -5.00 116.55 121.36 2bkt n ASP 63 Ca 0.00 -0.57 -0.34 0.00 2.57 0.00 0.00 54.79 56.45 2bkt n ASP 63 Cb 0.12 0.65 -0.14 0.00 1.84 0.00 0.00 41.12 43.59 2bkt n ASP 63 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 2bkt s SER 64 N -0.65 4.16 0.43 -2.24 0.15 -0.32 -3.94 113.70 111.30 2bkt s SER 64 Ca 0.00 -0.36 0.24 0.00 0.70 0.00 0.00 55.95 56.53 2bkt s SER 64 Cb 0.00 -1.68 0.67 0.00 -1.71 0.00 0.00 66.02 63.31 2bkt s SER 64 CO 0.00 0.07 1.72 0.77 1.20 0.00 0.00 173.24 177.00 2bkt h SER 65 N 7.40 0.00 0.55 5.45 4.64 -1.31 -3.12 113.55 127.16 2bkt h SER 65 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2bkt h SER 65 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2bkt h SER 65 CO 0.59 0.17 -0.63 -1.54 -0.87 0.00 0.00 176.83 174.55 2bkt n SER 66 N -3.21 0.58 -4.58 4.97 3.41 -1.26 -4.96 113.62 108.57 2bkt n SER 66 Ca 0.02 -0.20 -0.45 0.00 -0.26 0.00 0.00 58.87 57.99 2bkt n SER 66 Cb 0.49 0.35 -0.02 0.00 -0.26 0.00 0.00 64.21 64.78 2bkt n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bkt n TYR 67 N -1.70 1.17 -3.75 7.33 -0.00 -1.18 -4.69 117.16 114.35 2bkt n TYR 67 Ca 0.04 0.71 -0.30 0.00 -0.00 0.00 0.00 57.90 58.36 2bkt n TYR 67 Cb 0.37 -2.23 -0.15 0.00 -0.00 0.00 0.00 39.34 37.33 2bkt n TYR 67 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 2bkt s LYS 68 N -1.54 0.87 0.62 2.98 -0.14 0.11 -4.99 119.74 117.67 2bkt s LYS 68 Ca 0.59 -1.31 -0.17 0.00 -1.36 0.00 0.00 55.97 53.71 2bkt s LYS 68 Cb -0.71 -2.13 -0.07 0.00 -1.68 0.00 0.00 37.83 33.25 2bkt s LYS 68 CO 0.60 -1.02 0.58 1.58 -0.76 0.00 0.00 175.35 176.33 2bkt n HIS 69 N 4.54 -0.54 0.12 3.18 -0.00 -1.26 -2.14 115.22 119.12 2bkt n HIS 69 Ca 0.01 0.41 0.00 0.00 -0.00 0.00 0.00 57.72 58.14 2bkt n HIS 69 Cb 0.40 -1.96 0.00 0.00 -0.00 0.00 0.00 29.99 28.43 2bkt n HIS 69 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 2bkt n ASN 70 N 0.08 -0.04 0.00 0.26 2.85 -1.24 -4.81 115.26 112.37 2bkt n ASN 70 Ca 0.11 0.42 0.00 0.00 -0.11 0.00 0.00 54.58 55.00 2bkt n ASN 70 Cb 0.48 0.31 0.00 0.00 1.24 0.00 0.00 39.78 41.81 2bkt n ASN 70 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2bkt n GLY 71 N 1.72 2.89 3.47 8.20 0.00 -0.54 -4.97 105.19 115.96 2bkt n GLY 71 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.47 2bkt n GLY 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2bkt n THR 72 N -0.33 0.16 -2.05 2.61 -1.04 -1.26 -4.32 114.28 108.05 2bkt n THR 72 Ca 0.00 -0.13 -0.42 0.00 -2.04 0.00 0.00 64.05 61.46 2bkt n THR 72 Cb 0.00 -1.21 -0.03 0.00 -1.82 0.00 0.00 70.33 67.28 2bkt n THR 72 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2bkt s GLU 73 N 5.41 4.23 -0.05 -2.82 -6.30 -1.26 0.11 118.70 118.02 2bkt s GLU 73 Ca 1.09 2.19 -0.00 0.00 -2.50 0.00 0.00 54.97 55.75 2bkt s GLU 73 Cb -1.10 -3.56 -0.03 0.00 0.00 0.00 0.00 34.13 29.44 2bkt s GLU 73 CO 0.59 -0.66 -0.00 -0.51 0.02 0.00 0.00 175.26 174.70 2bkt s LEU 74 N 2.42 3.53 0.04 2.70 1.43 -0.18 -4.88 118.68 123.74 2bkt s LEU 74 Ca 0.70 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.88 2bkt s LEU 74 Cb -0.37 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.94 2bkt s LEU 74 CO 0.30 0.34 -0.04 -0.89 0.23 0.00 0.00 176.35 176.29 2bkt s THR 75 N -0.95 0.29 -0.30 5.49 2.01 -1.26 -1.79 115.64 119.13 2bkt s THR 75 Ca 0.15 -1.29 -0.13 0.00 0.31 0.00 0.00 61.69 60.73 2bkt s THR 75 Cb -0.11 -0.81 0.15 0.00 0.01 0.00 0.00 72.50 71.73 2bkt s THR 75 CO 0.05 -0.65 0.86 -1.48 -0.69 0.00 0.00 174.62 172.71 2bkt s LEU 76 N -2.04 -0.78 -0.14 4.42 -0.00 -0.82 -4.98 118.68 114.34 2bkt s LEU 76 Ca -0.06 1.09 -0.27 0.00 -0.00 0.00 0.00 54.13 54.90 2bkt s LEU 76 Cb -0.04 1.92 -0.02 0.00 -0.00 0.00 0.00 46.19 48.05 2bkt s LEU 76 CO -0.03 -0.15 0.88 0.00 -0.00 0.00 0.00 176.35 177.04 2bkt s ARG 77 N 2.47 4.35 -0.65 1.48 3.03 -1.26 -1.25 118.95 127.12 2bkt s ARG 77 Ca -0.05 1.13 0.02 0.00 2.03 0.00 0.00 55.73 58.86 2bkt s ARG 77 Cb -0.08 -3.55 0.38 0.00 -1.03 0.00 0.00 34.95 30.67 2bkt s ARG 77 CO -0.18 -0.30 1.53 0.98 -1.13 0.00 0.00 175.30 176.21 2bkt n TYR 78 N 5.05 3.23 -3.56 5.89 9.36 -0.19 -4.94 117.16 132.00 2bkt n TYR 78 Ca 0.05 -2.79 -0.07 0.00 3.32 0.00 0.00 57.90 58.42 2bkt n TYR 78 Cb 0.49 -0.62 0.00 0.00 -0.63 0.00 0.00 39.34 38.58 2bkt n TYR 78 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 2bkt n SER 79 N -0.48 -0.71 0.00 2.98 3.41 -1.26 -3.87 113.62 113.69 2bkt n SER 79 Ca 0.46 -0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 2bkt n SER 79 Cb 0.45 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 2bkt n SER 79 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2bkt n THR 80 N -1.46 0.00 0.00 6.66 5.66 -1.26 -5.09 114.28 118.79 2bkt n THR 80 Ca -0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 2bkt n THR 80 Cb 0.10 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.88 2bkt n THR 80 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2bkt n GLY 81 N 0.00 4.19 3.53 1.09 0.00 -1.25 -4.82 105.19 107.93 2bkt n GLY 81 Ca 0.00 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.74 2bkt n GLY 81 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2bkt s THR 82 N -1.87 4.75 0.39 2.61 -1.32 -1.26 -1.03 115.64 117.92 2bkt s THR 82 Ca 0.00 0.25 -0.23 0.00 -1.21 0.00 0.00 61.69 60.50 2bkt s THR 82 Cb 0.00 -4.26 -0.10 0.00 -1.51 0.00 0.00 72.50 66.63 2bkt s THR 82 CO 0.00 -0.65 0.96 0.54 -2.21 0.00 0.00 174.62 173.26 2bkt s VAL 83 N 3.02 4.27 -0.00 5.08 0.11 -0.38 -4.77 120.40 127.72 2bkt s VAL 83 Ca 0.26 1.58 -0.05 0.00 -2.93 0.00 0.00 61.98 60.84 2bkt s VAL 83 Cb -0.13 -3.74 -0.00 0.00 -1.53 0.00 0.00 36.38 30.98 2bkt s VAL 83 CO 0.21 -0.14 0.09 -0.94 -3.33 0.00 0.00 175.10 170.98 2bkt s SER 84 N -1.95 0.04 0.00 3.54 1.04 0.11 -1.94 113.70 114.54 2bkt s SER 84 Ca 0.58 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.85 2bkt s SER 84 Cb -0.13 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.17 2bkt s SER 84 CO 0.18 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.74 2bkt n GLY 85 N 1.91 3.34 3.08 7.32 0.00 -0.74 -0.33 105.19 119.77 2bkt n GLY 85 Ca -0.20 -0.91 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 2bkt n GLY 85 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bkt s PHE 86 N -3.08 0.55 0.22 1.61 -0.71 -0.96 -1.02 117.98 114.60 2bkt s PHE 86 Ca 0.00 -0.86 -0.30 0.00 -1.04 0.00 0.00 56.93 54.74 2bkt s PHE 86 Cb 0.00 -0.37 -0.08 0.00 -1.21 0.00 0.00 43.02 41.35 2bkt s PHE 86 CO 0.00 -0.26 1.14 -1.17 -1.34 0.00 0.00 175.22 173.60 2bkt s LEU 87 N -2.48 4.49 0.04 -1.99 0.20 0.31 -2.42 118.68 116.83 2bkt s LEU 87 Ca 0.01 2.22 -0.02 0.00 0.69 0.00 0.00 54.13 57.03 2bkt s LEU 87 Cb 0.01 -3.61 -0.03 0.00 -0.43 0.00 0.00 46.19 42.14 2bkt s LEU 87 CO -0.06 -0.27 0.00 -0.44 -0.29 0.00 0.00 176.35 175.30 2bkt s SER 88 N -0.26 0.33 -0.01 3.68 0.01 0.61 -1.46 113.70 116.60 2bkt s SER 88 Ca 0.49 -0.72 0.06 0.00 1.31 0.00 0.00 55.95 57.09 2bkt s SER 88 Cb -0.32 0.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.07 2bkt s SER 88 CO 0.38 -0.48 -0.19 -1.58 0.41 0.00 0.00 173.24 171.79 2bkt s GLN 89 N -2.76 1.51 0.06 12.44 0.74 -0.91 0.61 119.66 131.35 2bkt s GLN 89 Ca -0.04 -0.68 -0.28 0.00 0.05 0.00 0.00 55.36 54.41 2bkt s GLN 89 Cb -0.00 -1.47 0.10 0.00 1.10 0.00 0.00 33.01 32.73 2bkt s GLN 89 CO -0.06 0.40 1.16 0.34 -0.55 0.00 0.00 175.29 176.58 2bkt s ASP 90 N -0.46 -0.10 -0.13 6.67 3.68 -0.74 0.10 116.67 125.68 2bkt s ASP 90 Ca 0.07 -0.26 -0.28 0.00 2.13 0.00 0.00 52.55 54.22 2bkt s ASP 90 Cb -0.07 0.30 -0.01 0.00 -1.45 0.00 0.00 42.92 41.68 2bkt s ASP 90 CO -0.01 -0.55 0.92 0.27 0.13 0.00 0.00 175.17 175.94 2bkt s ILE 91 N -2.73 4.83 -0.16 4.11 -4.36 -1.26 0.29 121.20 121.92 2bkt s ILE 91 Ca 0.14 1.85 -0.02 0.00 -0.26 0.00 0.00 60.65 62.37 2bkt s ILE 91 Cb 0.02 -4.23 -0.01 0.00 1.25 0.00 0.00 42.46 39.49 2bkt s ILE 91 CO -0.01 0.02 -0.10 -0.63 0.24 0.00 0.00 174.94 174.46 2bkt s ILE 92 N 2.05 3.23 -0.15 8.37 1.01 0.17 -1.37 121.20 134.50 2bkt s ILE 92 Ca 0.44 -0.58 -0.15 0.00 0.00 0.00 0.00 60.65 60.36 2bkt s ILE 92 Cb -0.17 -2.40 -0.05 0.00 0.01 0.00 0.00 42.46 39.85 2bkt s ILE 92 CO 0.15 0.49 0.33 -0.89 0.00 0.00 0.00 174.94 175.02 2bkt s THR 93 N 0.68 5.28 -0.23 2.92 2.01 0.29 -1.15 115.64 125.44 2bkt s THR 93 Ca -0.05 0.62 -0.02 0.00 0.31 0.00 0.00 61.69 62.55 2bkt s THR 93 Cb -0.15 -3.67 0.07 0.00 0.01 0.00 0.00 72.50 68.77 2bkt s THR 93 CO 0.02 0.38 0.05 -0.69 -0.69 0.00 0.00 174.62 173.70 2bkt s VAL 94 N 0.47 0.59 -1.08 3.82 1.01 0.21 -1.29 120.40 124.13 2bkt s VAL 94 Ca 0.18 -0.79 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 2bkt s VAL 94 Cb -0.13 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 2bkt s VAL 94 CO 0.05 -0.35 0.80 0.61 0.00 0.00 0.00 175.10 176.21 2bkt n GLY 95 N 5.01 -1.06 3.92 4.51 0.00 -1.26 -1.21 105.19 115.10 2bkt n GLY 95 Ca -0.07 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2bkt n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bkt n GLY 96 N -1.61 1.32 3.66 -0.02 0.00 -1.26 -4.62 105.19 102.67 2bkt n GLY 96 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 2bkt n GLY 96 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bkt s ILE 97 N -2.08 5.36 -0.17 -0.61 1.01 -0.35 -5.07 121.20 119.29 2bkt s ILE 97 Ca 0.00 0.20 -0.10 0.00 0.00 0.00 0.00 60.65 60.75 2bkt s ILE 97 Cb 0.00 -3.50 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 2bkt s ILE 97 CO 0.00 0.35 0.15 -0.89 0.00 0.00 0.00 174.94 174.55 2bkt s THR 98 N 1.03 5.42 -0.04 2.92 2.01 -1.26 0.65 115.64 126.37 2bkt s THR 98 Ca 0.08 0.25 -0.04 0.00 0.31 0.00 0.00 61.69 62.28 2bkt s THR 98 Cb -0.13 -3.47 0.01 0.00 0.01 0.00 0.00 72.50 68.92 2bkt s THR 98 CO 0.04 0.50 0.11 -0.69 -0.69 0.00 0.00 174.62 173.89 2bkt s VAL 99 N -0.11 0.00 -0.28 3.82 1.01 -0.30 -4.96 120.40 119.58 2bkt s VAL 99 Ca 0.11 -0.03 -0.29 0.00 0.00 0.00 0.00 61.98 61.77 2bkt s VAL 99 Cb -0.12 -0.17 0.01 0.00 0.00 0.00 0.00 36.38 36.10 2bkt s VAL 99 CO 0.01 -0.02 1.13 -0.89 0.00 0.00 0.00 175.10 175.33 2bkt s THR 100 N 0.00 4.45 -0.02 3.92 2.01 -1.26 0.42 115.64 125.16 2bkt s THR 100 Ca -0.01 1.70 0.03 0.00 0.31 0.00 0.00 61.69 63.72 2bkt s THR 100 Cb -0.01 -4.31 0.00 0.00 0.01 0.00 0.00 72.50 68.19 2bkt s THR 100 CO 0.00 -0.39 -0.09 -1.58 -0.69 0.00 0.00 174.62 171.87 2bkt s GLN 101 N 3.64 0.92 0.03 4.92 2.00 0.14 -4.94 119.66 126.39 2bkt s GLN 101 Ca 0.48 -0.32 -0.19 0.00 -2.00 0.00 0.00 55.36 53.33 2bkt s GLN 101 Cb -0.14 -0.87 -0.06 0.00 0.80 0.00 0.00 33.01 32.74 2bkt s GLN 101 CO 0.15 0.14 0.54 -1.64 -0.50 0.00 0.00 175.29 173.98 2bkt s MET 102 N 0.07 4.17 0.23 1.67 -1.94 -1.26 -1.79 119.30 120.46 2bkt s MET 102 Ca -0.01 0.66 -0.09 0.00 -1.71 0.00 0.00 55.69 54.53 2bkt s MET 102 Cb -0.07 -3.26 -0.01 0.00 2.01 0.00 0.00 34.83 33.49 2bkt s MET 102 CO 0.00 0.57 0.38 -0.59 -0.01 0.00 0.00 175.02 175.38 2bkt s PHE 103 N -0.84 0.59 -0.11 -0.03 -0.71 0.20 -4.69 117.98 112.39 2bkt s PHE 103 Ca 0.28 -0.91 -0.06 0.00 -1.04 0.00 0.00 56.93 55.20 2bkt s PHE 103 Cb -0.18 -0.02 -0.04 0.00 -1.21 0.00 0.00 43.02 41.56 2bkt s PHE 103 CO 0.17 -0.89 0.12 0.20 -1.34 0.00 0.00 175.22 173.48 2bkt s GLY 104 N -3.06 2.12 -0.26 1.99 0.00 0.12 -0.28 107.32 107.95 2bkt s GLY 104 Ca 0.27 -0.67 -0.06 0.00 0.00 0.00 0.00 44.72 44.26 2bkt s GLY 104 CO 0.10 -0.42 0.04 -0.54 0.00 0.00 0.00 173.10 172.28 2bkt s GLU 105 N -1.05 3.35 -0.03 2.90 2.02 -1.02 -0.87 118.70 124.00 2bkt s GLU 105 Ca 0.15 -0.67 -0.30 0.00 0.02 0.00 0.00 54.97 54.17 2bkt s GLU 105 Cb -0.12 -3.25 -0.03 0.00 0.10 0.00 0.00 34.13 30.83 2bkt s GLU 105 CO 0.04 -0.29 1.11 0.08 0.02 0.00 0.00 175.26 176.22 2bkt s VAL 106 N 1.53 4.47 -0.33 2.63 1.01 0.26 -2.27 120.40 127.70 2bkt s VAL 106 Ca 0.05 1.77 0.12 0.00 0.00 0.00 0.00 61.98 63.92 2bkt s VAL 106 Cb -0.16 -4.14 -0.15 0.00 0.00 0.00 0.00 36.38 31.94 2bkt s VAL 106 CO 0.01 0.06 0.40 0.35 0.00 0.00 0.00 175.10 175.92 2bkt n THR 107 N 4.31 0.00 -3.69 3.92 -2.24 0.56 0.90 114.28 118.03 2bkt n THR 107 Ca 0.09 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.51 2bkt n THR 107 Cb 0.48 0.68 -0.11 0.00 -2.10 0.00 0.00 70.33 69.28 2bkt n THR 107 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2bkt s GLU 108 N -2.39 0.29 -0.28 -0.78 2.12 -0.01 -3.32 118.70 114.33 2bkt s GLU 108 Ca 0.01 0.78 -0.23 0.00 0.36 0.00 0.00 54.97 55.88 2bkt s GLU 108 Cb 0.08 0.03 0.11 0.00 0.26 0.00 0.00 34.13 34.61 2bkt s GLU 108 CO 0.48 -0.21 0.91 0.00 -0.54 0.00 0.00 175.26 175.91 2bkt s MET 109 N 1.84 0.60 0.70 4.30 0.23 -1.26 0.08 119.30 125.79 2bkt s MET 109 Ca -0.06 0.77 -0.16 0.00 -1.03 0.00 0.00 55.69 55.20 2bkt s MET 109 Cb -0.10 0.26 0.02 0.00 -1.53 0.00 0.00 34.83 33.48 2bkt s MET 109 CO -0.11 -0.08 1.24 -0.35 -2.03 0.00 0.00 175.02 173.69 2bkt n PRO 110 N 2.68 0.80 0.03 3.16 -0.04 -1.26 -4.68 135.00 135.69 2bkt n PRO 110 Ca -0.14 0.34 -0.12 0.00 -0.04 0.00 0.00 63.50 63.54 2bkt n PRO 110 Cb 0.56 -2.48 -0.07 0.00 -0.04 0.00 0.00 33.50 31.47 2bkt n PRO 110 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bkt h ALA 111 N 0.06 0.02 -2.41 0.55 0.00 -1.97 -3.38 119.26 112.13 2bkt h ALA 111 Ca -0.49 -0.01 -0.57 0.00 0.00 0.00 0.00 54.91 53.84 2bkt h ALA 111 Cb 1.33 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.06 2bkt h ALA 111 CO 0.50 -0.47 0.37 -0.51 0.00 0.00 0.00 179.25 179.15 2bkt s LEU 112 N -10.16 4.23 0.00 0.00 1.02 -1.26 0.17 118.68 112.68 2bkt s LEU 112 Ca -0.13 1.30 0.19 0.00 0.02 0.00 0.00 54.13 55.51 2bkt s LEU 112 Cb 0.06 -3.31 0.09 0.00 0.02 0.00 0.00 46.19 43.05 2bkt s LEU 112 CO 0.66 -0.35 1.03 -0.81 0.02 0.00 0.00 176.35 176.91 2bkt n PRO 113 N 4.80 1.60 0.25 1.29 -0.04 -1.26 -4.79 135.00 136.85 2bkt n PRO 113 Ca 0.05 -1.35 0.15 0.00 -0.04 0.00 0.00 63.50 62.30 2bkt n PRO 113 Cb 0.49 -1.35 0.64 0.00 -0.04 0.00 0.00 33.50 33.24 2bkt n PRO 113 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2bkt h PHE 114 N 3.08 0.00 -0.15 0.54 0.05 -1.44 0.38 116.94 119.41 2bkt h PHE 114 Ca 0.00 0.00 -0.17 0.00 3.82 0.00 0.00 57.97 61.62 2bkt h PHE 114 Cb 0.72 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.67 2bkt h PHE 114 CO 0.00 0.00 -0.60 1.98 -0.18 0.00 0.00 178.31 179.51 2bkt h MET 115 N 0.00 0.50 0.00 1.51 4.05 0.15 -3.15 114.93 117.99 2bkt h MET 115 Ca 0.07 -0.34 0.00 0.00 -0.28 0.00 0.00 59.70 59.15 2bkt h MET 115 Cb 1.14 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.99 2bkt h MET 115 CO -0.00 0.96 -0.12 1.28 0.23 0.00 0.00 176.91 179.26 2bkt n LEU 116 N -3.92 0.15 -4.73 3.39 4.77 0.12 -4.90 117.00 111.89 2bkt n LEU 116 Ca -0.04 0.39 -0.42 0.00 -0.03 0.00 0.00 56.01 55.91 2bkt n LEU 116 Cb 0.63 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2bkt n LEU 116 CO 0.47 0.02 1.27 0.00 -1.33 0.00 0.00 177.39 177.83 2bkt s ALA 117 N -3.01 3.82 -0.74 -1.18 0.00 -1.19 -4.87 121.76 114.59 2bkt s ALA 117 Ca 0.13 1.48 0.26 0.00 0.00 0.00 0.00 51.96 53.83 2bkt s ALA 117 Cb 0.18 -3.65 0.75 0.00 0.00 0.00 0.00 23.12 20.41 2bkt s ALA 117 CO 0.57 -0.87 1.70 0.39 0.00 0.00 0.00 175.76 177.56 2bkt n GLU 118 N 3.50 0.24 -3.79 0.00 -0.58 -1.26 -4.81 120.64 113.94 2bkt n GLU 118 Ca 0.13 0.17 -0.22 0.00 -0.42 0.00 0.00 57.16 56.82 2bkt n GLU 118 Cb 0.37 -1.75 -0.04 0.00 -0.57 0.00 0.00 31.44 29.44 2bkt n GLU 118 CO 0.00 0.00 0.00 -0.59 -0.48 0.00 0.00 177.13 176.06 2bkt s PHE 119 N -3.10 2.72 -0.29 -0.32 -0.71 -1.26 -4.95 117.98 110.07 2bkt s PHE 119 Ca 0.10 -0.46 0.17 0.00 -1.04 0.00 0.00 56.93 55.69 2bkt s PHE 119 Cb 0.13 -1.99 -0.23 0.00 -1.21 0.00 0.00 43.02 39.72 2bkt s PHE 119 CO 0.62 0.05 0.49 -0.25 -1.34 0.00 0.00 175.22 174.79 2bkt n ASP 120 N -1.40 1.01 -2.69 1.98 9.92 0.56 -4.96 116.55 120.97 2bkt n ASP 120 Ca 0.01 -0.32 -0.08 0.00 -0.53 0.00 0.00 54.79 53.87 2bkt n ASP 120 Cb 0.62 1.50 0.03 0.00 -0.64 0.00 0.00 41.12 42.62 2bkt n ASP 120 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2bkt n GLY 121 N 1.49 1.05 3.23 0.44 0.00 -0.87 -3.88 105.19 106.65 2bkt n GLY 121 Ca -0.01 -1.25 -0.30 0.00 0.00 0.00 0.00 46.02 44.46 2bkt n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bkt s VAL 122 N -2.16 1.90 -0.45 1.61 1.01 0.01 -0.99 120.40 121.33 2bkt s VAL 122 Ca 0.15 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 61.07 2bkt s VAL 122 Cb -0.05 -1.61 0.10 0.00 0.00 0.00 0.00 36.38 34.82 2bkt s VAL 122 CO 0.11 0.53 0.31 -0.69 0.00 0.00 0.00 175.10 175.36 2bkt s VAL 123 N -0.07 4.19 -0.02 2.92 1.01 -0.04 -0.49 120.40 127.90 2bkt s VAL 123 Ca -0.05 -1.64 -0.30 0.00 0.00 0.00 0.00 61.98 60.00 2bkt s VAL 123 Cb -0.14 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.51 2bkt s VAL 123 CO 0.04 -0.66 1.52 -0.83 0.00 0.00 0.00 175.10 175.17 2bkt s GLY 124 N 2.42 1.67 0.00 4.51 0.00 0.22 -0.23 107.32 115.91 2bkt s GLY 124 Ca 0.05 0.92 0.22 0.00 0.00 0.00 0.00 44.72 45.91 2bkt s GLY 124 CO 0.00 2.76 1.07 1.03 0.00 0.00 0.00 173.10 177.96 2bkt n MET 125 N 6.14 1.24 -0.21 2.90 2.81 0.51 -4.46 117.12 126.04 2bkt n MET 125 Ca 0.15 -0.98 -0.14 0.00 -1.81 0.00 0.00 57.70 54.92 2bkt n MET 125 Cb 0.43 -1.46 0.13 0.00 -0.71 0.00 0.00 33.22 31.60 2bkt n MET 125 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2bkt n GLY 126 N 1.40 -3.49 3.91 3.03 0.00 0.27 -4.83 105.19 105.48 2bkt n GLY 126 Ca 0.09 -1.32 -0.27 0.00 0.00 0.00 0.00 46.02 44.52 2bkt n GLY 126 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bkt s PHE 127 N -1.61 3.53 0.41 1.61 0.40 -1.26 -4.69 117.98 116.37 2bkt s PHE 127 Ca 0.31 0.76 0.24 0.00 -0.60 0.00 0.00 56.93 57.63 2bkt s PHE 127 Cb -0.05 -2.24 1.29 0.00 0.51 0.00 0.00 43.02 42.53 2bkt s PHE 127 CO 0.25 -0.15 2.03 0.97 0.70 0.00 0.00 175.22 179.02 2bkt h ILE 128 N 0.52 0.73 -0.58 0.64 2.10 -1.90 -2.04 117.51 116.97 2bkt h ILE 128 Ca -0.47 -0.63 0.17 0.00 1.08 0.00 0.00 64.86 65.00 2bkt h ILE 128 Cb 1.20 1.39 -0.02 0.00 -1.09 0.00 0.00 36.82 38.30 2bkt h ILE 128 CO 0.62 0.15 0.49 -0.33 -1.08 0.00 0.00 178.15 178.00 2bkt h GLU 129 N 0.00 0.00 -0.28 2.19 3.07 -1.94 -0.08 114.58 117.55 2bkt h GLU 129 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2bkt h GLU 129 Cb 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.29 2bkt h GLU 129 CO 0.02 0.00 0.00 1.04 -1.40 0.00 0.00 179.01 178.67 2bkt n GLN 130 N -4.05 2.87 -2.52 2.33 6.02 -0.77 -4.98 117.38 116.28 2bkt n GLN 130 Ca 0.11 -2.05 -0.43 0.00 -0.01 0.00 0.00 57.00 54.62 2bkt n GLN 130 Cb 0.72 -1.29 -0.02 0.00 1.02 0.00 0.00 30.24 30.67 2bkt n GLN 130 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bkt s ALA 131 N -1.21 3.61 0.65 -1.58 0.00 -0.05 -4.57 121.76 118.61 2bkt s ALA 131 Ca 0.21 0.27 -0.17 0.00 0.00 0.00 0.00 51.96 52.27 2bkt s ALA 131 Cb 0.13 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 2bkt s ALA 131 CO 0.12 -1.25 0.78 -0.89 0.00 0.00 0.00 175.76 174.52 2bkt n ILE 132 N 5.52 2.88 -0.86 0.00 5.41 -1.26 0.83 119.36 131.89 2bkt n ILE 132 Ca 0.13 -0.46 0.00 0.00 1.00 0.00 0.00 62.75 63.43 2bkt n ILE 132 Cb 0.46 -0.95 0.00 0.00 -0.71 0.00 0.00 39.64 38.43 2bkt n ILE 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2bkt n GLY 133 N 1.44 0.00 2.68 7.39 0.00 -1.26 -1.94 105.19 113.50 2bkt n GLY 133 Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.08 2bkt n GLY 133 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2bkt n ARG 134 N 0.61 -1.78 -1.65 1.61 0.63 0.24 -4.88 116.66 111.44 2bkt n ARG 134 Ca 0.00 0.66 -0.49 0.00 -0.92 0.00 0.00 57.85 57.10 2bkt n ARG 134 Cb 0.40 -4.92 -0.05 0.00 0.45 0.00 0.00 32.46 28.34 2bkt n ARG 134 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2bkt n VAL 135 N -1.89 0.13 -1.66 5.15 0.31 -0.82 -4.86 118.33 114.69 2bkt n VAL 135 Ca -0.07 -0.02 -0.45 0.00 -0.01 0.00 0.00 64.34 63.79 2bkt n VAL 135 Cb 0.49 -1.36 -0.04 0.00 -0.91 0.00 0.00 33.84 32.01 2bkt n VAL 135 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2bkt n THR 136 N 3.57 0.67 -1.30 2.52 -1.04 -1.26 -4.77 114.28 112.67 2bkt n THR 136 Ca 0.19 -0.14 -0.35 0.00 -2.04 0.00 0.00 64.05 61.71 2bkt n THR 136 Cb 0.25 -2.14 0.10 0.00 -1.82 0.00 0.00 70.33 66.72 2bkt n THR 136 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2bkt n PRO 137 N 7.25 0.45 -0.12 -2.82 -0.02 -1.26 -4.71 135.00 133.78 2bkt n PRO 137 Ca 0.22 0.22 -0.05 0.00 -2.02 0.00 0.00 63.50 61.87 2bkt n PRO 137 Cb 0.36 -2.36 0.02 0.00 -0.02 0.00 0.00 33.50 31.50 2bkt n PRO 137 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2bkt h ILE 138 N -0.44 0.68 -0.04 4.25 6.09 -1.84 -0.87 117.51 125.34 2bkt h ILE 138 Ca -0.47 -0.02 -0.10 0.00 -1.37 0.00 0.00 64.86 62.90 2bkt h ILE 138 Cb 1.32 0.60 -0.01 0.00 0.47 0.00 0.00 36.82 39.20 2bkt h ILE 138 CO 0.47 0.01 -0.42 0.15 -3.07 0.00 0.00 178.15 175.29 2bkt h PHE 139 N 0.07 0.10 -0.45 2.19 3.04 -1.91 -0.25 116.94 119.73 2bkt h PHE 139 Ca 0.19 -0.03 -0.08 0.00 3.98 0.00 0.00 57.97 62.04 2bkt h PHE 139 Cb 0.28 -0.02 -0.02 0.00 2.56 0.00 0.00 35.95 38.74 2bkt h PHE 139 CO -0.29 0.50 -0.04 -0.44 -2.02 0.00 0.00 178.31 176.02 2bkt h ASP 140 N 0.07 0.73 0.63 0.41 3.45 -1.78 0.42 116.42 120.35 2bkt h ASP 140 Ca 0.00 -0.19 -0.06 0.00 0.43 0.00 0.00 57.03 57.22 2bkt h ASP 140 Cb 0.78 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 39.35 2bkt h ASP 140 CO 0.06 0.82 -0.29 0.78 -1.57 0.00 0.00 179.24 179.04 2bkt h ASN 141 N 0.70 0.00 0.27 6.45 -0.26 0.02 -1.60 115.58 121.15 2bkt h ASN 141 Ca 0.13 0.00 -0.34 0.00 -0.56 0.00 0.00 56.30 55.53 2bkt h ASN 141 Cb 0.49 0.00 0.03 0.00 -1.06 0.00 0.00 38.32 37.78 2bkt h ASN 141 CO 0.03 0.29 -1.54 0.40 -1.06 0.00 0.00 177.43 175.54 2bkt h ILE 142 N 0.00 1.20 -0.74 2.81 2.04 -0.23 -3.29 117.51 119.31 2bkt h ILE 142 Ca -0.00 -2.68 0.05 0.00 1.00 0.00 0.00 64.86 63.23 2bkt h ILE 142 Cb 0.68 2.97 -0.05 0.00 -0.74 0.00 0.00 36.82 39.68 2bkt h ILE 142 CO 0.04 0.83 0.45 0.40 0.00 0.00 0.00 178.15 179.86 2bkt h ILE 143 N 0.13 1.04 -0.71 -0.67 2.04 -0.73 -0.51 117.51 118.11 2bkt h ILE 143 Ca -0.27 -0.29 0.18 0.00 1.00 0.00 0.00 64.86 65.48 2bkt h ILE 143 Cb 2.15 0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 38.32 2bkt h ILE 143 CO 0.25 0.15 0.49 0.28 0.00 0.00 0.00 178.15 179.33 2bkt h SER 144 N 0.84 0.12 0.66 1.72 0.02 -1.36 0.51 113.55 116.06 2bkt h SER 144 Ca 0.31 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2bkt h SER 144 Cb 0.11 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.64 2bkt h SER 144 CO -0.15 0.06 0.00 0.00 -1.14 0.00 0.00 176.83 175.60 2bkt n GLN 145 N -4.39 0.09 -2.83 3.45 6.02 -0.20 -4.88 117.38 114.65 2bkt n GLN 145 Ca 0.14 0.30 -0.17 0.00 -0.01 0.00 0.00 57.00 57.26 2bkt n GLN 145 Cb 0.69 -1.66 -0.00 0.00 1.02 0.00 0.00 30.24 30.29 2bkt n GLN 145 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2bkt n GLY 146 N 0.14 -0.50 0.12 1.08 0.00 0.18 -4.82 105.19 101.39 2bkt n GLY 146 Ca 0.03 0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 2bkt n GLY 146 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bkt n VAL 147 N -3.65 1.43 -1.72 1.61 0.24 -1.26 -4.97 118.33 110.01 2bkt n VAL 147 Ca -0.09 -0.69 -0.43 0.00 -2.04 0.00 0.00 64.34 61.10 2bkt n VAL 147 Cb 0.58 -1.00 -0.02 0.00 -1.47 0.00 0.00 33.84 31.93 2bkt n VAL 147 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2bkt n LEU 148 N -3.03 4.00 0.31 1.34 4.77 -1.26 -4.41 117.00 118.71 2bkt n LEU 148 Ca -0.40 1.15 0.19 0.00 -0.03 0.00 0.00 56.01 56.92 2bkt n LEU 148 Cb 1.06 -1.54 0.98 0.00 -2.33 0.00 0.00 43.42 41.59 2bkt n LEU 148 CO 0.33 -0.05 1.10 0.11 -1.33 0.00 0.00 177.39 177.55 2bkt h LYS 149 N 4.47 0.00 -2.27 3.23 6.56 -1.90 -3.44 116.57 123.22 2bkt h LYS 149 Ca -0.47 0.00 -0.07 0.00 -1.06 0.00 0.00 60.65 59.05 2bkt h LYS 149 Cb 1.24 0.00 -0.21 0.00 -0.57 0.00 0.00 32.23 32.69 2bkt h LYS 149 CO 0.77 0.02 0.03 -2.00 -2.06 0.00 0.00 179.45 176.21 2bkt s GLU 150 N -4.08 0.81 -0.96 3.15 2.12 -0.76 -5.03 118.70 113.95 2bkt s GLU 150 Ca -0.03 0.55 -0.07 0.00 0.36 0.00 0.00 54.97 55.79 2bkt s GLU 150 Cb 0.12 0.39 -0.09 0.00 0.26 0.00 0.00 34.13 34.81 2bkt s GLU 150 CO 0.48 -0.17 2.51 -3.47 -0.54 0.00 0.00 175.26 174.07 2bkt n ASP 151 N 2.02 5.93 -3.67 -1.70 2.03 -1.26 -3.93 116.55 115.97 2bkt n ASP 151 Ca -0.16 -2.38 -0.13 0.00 0.52 0.00 0.00 54.79 52.64 2bkt n ASP 151 Cb 0.56 -1.23 -0.06 0.00 -0.72 0.00 0.00 41.12 39.67 2bkt n ASP 151 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2bkt s VAL 152 N 2.67 0.06 0.03 5.18 -7.23 -1.26 -0.86 120.40 118.99 2bkt s VAL 152 Ca 0.51 -0.48 0.02 0.00 -1.81 0.00 0.00 61.98 60.21 2bkt s VAL 152 Cb 0.15 -0.96 -0.02 0.00 0.56 0.00 0.00 36.38 36.11 2bkt s VAL 152 CO -0.04 -0.27 -0.07 0.72 -0.31 0.00 0.00 175.10 175.14 2bkt s PHE 153 N -2.55 0.62 0.19 2.82 -0.71 -0.64 0.86 117.98 118.56 2bkt s PHE 153 Ca -0.05 -0.41 0.09 0.00 -1.04 0.00 0.00 56.93 55.53 2bkt s PHE 153 Cb -0.01 -0.38 -0.04 0.00 -1.21 0.00 0.00 43.02 41.38 2bkt s PHE 153 CO -0.03 -0.07 -0.18 -1.12 -1.34 0.00 0.00 175.22 172.49 2bkt s SER 154 N -1.24 2.80 -0.06 1.98 0.01 0.11 -0.72 113.70 116.58 2bkt s SER 154 Ca -0.07 -0.93 0.05 0.00 1.31 0.00 0.00 55.95 56.31 2bkt s SER 154 Cb -0.08 -0.17 -0.00 0.00 0.21 0.00 0.00 66.02 65.97 2bkt s SER 154 CO 0.00 -0.05 -0.21 -0.36 0.41 0.00 0.00 173.24 173.03 2bkt s PHE 155 N -2.34 2.12 -0.22 2.43 0.40 0.18 -1.12 117.98 119.43 2bkt s PHE 155 Ca 0.20 -0.70 -0.00 0.00 -0.60 0.00 0.00 56.93 55.82 2bkt s PHE 155 Cb -0.04 -1.42 0.06 0.00 0.51 0.00 0.00 43.02 42.12 2bkt s PHE 155 CO 0.08 -0.25 -0.03 -0.47 0.70 0.00 0.00 175.22 175.24 2bkt s TYR 156 N 0.10 2.02 -0.39 0.36 5.04 0.64 -1.63 117.35 123.49 2bkt s TYR 156 Ca -0.08 -1.48 -0.06 0.00 -2.44 0.00 0.00 57.07 53.00 2bkt s TYR 156 Cb -0.14 -1.43 0.08 0.00 0.35 0.00 0.00 41.96 40.82 2bkt s TYR 156 CO 0.04 -0.72 0.20 0.71 -1.34 0.00 0.00 175.55 174.44 2bkt s TYR 157 N 1.52 3.39 1.00 4.97 4.12 -1.26 0.12 117.35 131.22 2bkt s TYR 157 Ca -0.04 -1.83 -0.11 0.00 0.02 0.00 0.00 57.07 55.11 2bkt s TYR 157 Cb -0.18 -2.88 0.19 0.00 -1.52 0.00 0.00 41.96 37.58 2bkt s TYR 157 CO -0.07 -0.87 1.11 1.21 0.02 0.00 0.00 175.55 176.95 2bkt s ASN 158 N 1.88 2.22 -0.60 2.29 3.04 -0.45 -4.15 114.94 119.17 2bkt s ASN 158 Ca 0.03 1.99 -0.03 0.00 0.04 0.00 0.00 52.86 54.89 2bkt s ASN 158 Cb -0.22 -2.49 0.22 0.00 -1.54 0.00 0.00 41.25 37.22 2bkt s ASN 158 CO -0.00 -3.51 2.35 0.54 -3.04 0.00 0.00 177.10 173.44 2bkt n ARG 159 N -4.49 2.49 -1.27 0.43 1.74 -1.26 -4.89 116.66 109.40 2bkt n ARG 159 Ca 0.09 -2.77 0.15 0.00 -0.77 0.00 0.00 57.85 54.55 2bkt n ARG 159 Cb 0.53 -2.15 -0.06 0.00 -1.02 0.00 0.00 32.46 29.77 2bkt n ARG 159 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2bkt n ASP 160 N 0.12 -6.98 -3.59 0.55 4.64 -1.26 -5.08 116.55 104.95 2bkt n ASP 160 Ca 0.50 0.85 -0.02 0.00 -1.38 0.00 0.00 54.79 54.74 2bkt n ASP 160 Cb 0.46 -4.10 0.00 0.00 -1.04 0.00 0.00 41.12 36.43 2bkt n ASP 160 CO 0.00 0.00 0.00 -0.44 -0.82 0.00 0.00 177.20 175.94 2bkt s SER 161 N -6.41 -0.08 0.00 1.67 0.01 -1.26 -5.06 113.70 102.57 2bkt s SER 161 Ca 0.00 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 56.81 2bkt s SER 161 Cb 0.00 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.65 2bkt s SER 161 CO 0.00 -0.81 0.00 1.21 0.41 0.00 0.00 173.24 174.05 2bkt n GLU 162 N -0.58 0.00 0.00 12.44 4.07 -1.26 -5.08 120.64 130.23 2bkt n GLU 162 Ca -0.05 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.05 2bkt n GLU 162 Cb 0.60 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.98 2bkt n GLU 162 CO 0.00 0.00 0.00 1.47 -0.06 0.00 0.00 177.13 178.54 2bkt n LEU 165 N 0.00 0.00 0.24 4.31 -0.00 -1.26 -5.73 117.00 114.56 2bkt n LEU 165 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 56.01 56.14 2bkt n LEU 165 Cb 0.00 0.00 0.48 0.00 -0.00 0.00 0.00 43.42 43.90 2bkt n LEU 165 CO 0.00 0.00 0.87 1.23 -0.00 0.00 0.00 177.39 179.49 2bkt h GLY 166 N 0.00 0.00 0.00 1.47 0.00 -1.89 -3.42 103.07 99.23 2bkt h GLY 166 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bkt h GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2bkt n GLY 167 N 0.35 -0.59 3.63 4.60 0.00 -0.93 -1.34 105.19 110.91 2bkt n GLY 167 Ca 0.01 -0.98 -0.04 0.00 0.00 0.00 0.00 46.02 45.01 2bkt n GLY 167 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2bkt s GLN 168 N -2.00 0.54 -0.12 1.61 0.74 0.33 -1.76 119.66 119.00 2bkt s GLN 168 Ca 0.00 0.97 -0.02 0.00 0.05 0.00 0.00 55.36 56.36 2bkt s GLN 168 Cb 0.00 0.16 -0.03 0.00 1.10 0.00 0.00 33.01 34.25 2bkt s GLN 168 CO 0.00 -0.12 -0.05 0.42 -0.55 0.00 0.00 175.29 174.99 2bkt s ILE 169 N 1.61 3.79 -0.20 -2.34 1.01 -0.55 -0.26 121.20 124.26 2bkt s ILE 169 Ca -0.09 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.12 2bkt s ILE 169 Cb -0.05 -2.62 -0.00 0.00 0.01 0.00 0.00 42.46 39.80 2bkt s ILE 169 CO -0.18 0.53 -0.10 -0.69 0.00 0.00 0.00 174.94 174.51 2bkt s VAL 170 N -0.05 2.96 -0.21 2.92 1.01 -0.28 0.12 120.40 126.88 2bkt s VAL 170 Ca 0.01 -0.64 -0.19 0.00 0.00 0.00 0.00 61.98 61.16 2bkt s VAL 170 Cb -0.13 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 2bkt s VAL 170 CO 0.03 0.47 0.54 -0.76 0.00 0.00 0.00 175.10 175.38 2bkt s LEU 171 N 1.32 4.13 0.00 3.92 1.02 0.29 0.10 118.68 129.46 2bkt s LEU 171 Ca 0.04 0.69 0.00 0.00 0.02 0.00 0.00 54.13 54.88 2bkt s LEU 171 Cb -0.14 -2.74 0.00 0.00 0.02 0.00 0.00 46.19 43.32 2bkt s LEU 171 CO -0.05 -0.21 0.00 0.61 0.02 0.00 0.00 176.35 176.71 2bkt n GLY 172 N 3.92 1.13 0.00 -3.19 0.00 0.25 -0.64 105.19 106.66 2bkt n GLY 172 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2bkt n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bkt n GLY 173 N -2.00 2.39 3.37 -0.02 0.00 -1.07 -1.84 105.19 106.02 2bkt n GLY 173 Ca 0.00 -0.05 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 2bkt n GLY 173 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bkt s SER 174 N 2.00 -0.39 -0.41 1.61 1.04 -1.26 -3.13 113.70 113.16 2bkt s SER 174 Ca 0.00 0.19 -0.12 0.00 0.48 0.00 0.00 55.95 56.50 2bkt s SER 174 Cb 0.00 0.46 0.05 0.00 0.10 0.00 0.00 66.02 66.62 2bkt s SER 174 CO 0.00 -0.65 0.27 -0.62 0.98 0.00 0.00 173.24 173.21 2bkt s ASP 175 N -1.79 5.84 0.60 7.02 3.68 -1.26 -4.93 116.67 125.83 2bkt s ASP 175 Ca -0.07 -1.17 0.29 0.00 2.13 0.00 0.00 52.55 53.73 2bkt s ASP 175 Cb -0.01 -2.06 1.52 0.00 -1.45 0.00 0.00 42.92 40.92 2bkt s ASP 175 CO 0.01 -0.48 1.93 -0.65 0.13 0.00 0.00 175.17 176.11 2bkt h PRO 176 N 8.52 0.00 0.00 4.34 0.11 -2.01 0.31 132.00 143.27 2bkt h PRO 176 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2bkt h PRO 176 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2bkt h PRO 176 CO 0.74 0.00 0.00 0.94 -0.21 0.00 0.00 178.00 179.47 2bkt n GLN 177 N -3.61 0.15 -0.19 1.05 -0.06 -1.26 -3.11 117.38 110.36 2bkt n GLN 177 Ca 0.06 0.44 0.06 0.00 -2.00 0.00 0.00 57.00 55.56 2bkt n GLN 177 Cb 0.57 -1.82 0.15 0.00 -4.06 0.00 0.00 30.24 25.07 2bkt n GLN 177 CO 0.00 0.00 0.00 0.72 -0.20 0.00 0.00 177.06 177.58 2bkt n HIS 178 N -2.12 0.39 -3.88 3.69 8.25 0.11 -4.82 115.22 116.84 2bkt n HIS 178 Ca 0.02 -0.73 -0.09 0.00 -0.26 0.00 0.00 57.72 56.66 2bkt n HIS 178 Cb 0.18 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.11 2bkt n HIS 178 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 2bkt s TYR 179 N -1.97 0.06 0.17 4.41 1.13 -1.18 -0.80 117.35 119.17 2bkt s TYR 179 Ca 0.26 -0.45 -0.09 0.00 -1.41 0.00 0.00 57.07 55.38 2bkt s TYR 179 Cb 0.19 0.40 -0.01 0.00 -1.10 0.00 0.00 41.96 41.45 2bkt s TYR 179 CO 0.07 -1.04 0.29 -1.83 -2.51 0.00 0.00 175.55 170.54 2bkt s GLU 180 N -3.95 1.18 2.07 -3.49 -1.05 0.04 -4.72 118.70 108.78 2bkt s GLU 180 Ca 0.15 -1.18 0.00 0.00 -0.15 0.00 0.00 54.97 53.80 2bkt s GLU 180 Cb -0.02 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 34.05 2bkt s GLU 180 CO 0.05 -0.43 0.00 0.41 0.95 0.00 0.00 175.26 176.23 2bkt n GLY 181 N -0.23 -1.07 3.46 -3.83 0.00 -1.26 -3.07 105.19 99.19 2bkt n GLY 181 Ca -0.07 -1.22 -0.24 0.00 0.00 0.00 0.00 46.02 44.49 2bkt n GLY 181 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bkt s ASN 182 N -4.00 3.55 0.11 1.61 -0.87 -1.26 -4.92 114.94 109.15 2bkt s ASN 182 Ca 0.00 -1.00 -0.31 0.00 -1.57 0.00 0.00 52.86 49.98 2bkt s ASN 182 Cb 0.00 -0.29 -0.07 0.00 -0.02 0.00 0.00 41.25 40.87 2bkt s ASN 182 CO 0.00 0.05 1.29 -0.36 -2.57 0.00 0.00 177.10 175.51 2bkt s PHE 183 N -2.39 3.34 -0.27 2.20 0.40 -1.26 -4.61 117.98 115.38 2bkt s PHE 183 Ca 0.28 1.16 -0.02 0.00 -0.60 0.00 0.00 56.93 57.75 2bkt s PHE 183 Cb -0.05 -3.55 0.04 0.00 0.51 0.00 0.00 43.02 39.97 2bkt s PHE 183 CO 0.14 -1.80 -0.03 -1.01 0.70 0.00 0.00 175.22 173.22 2bkt s HIS 184 N 0.90 3.17 -0.03 0.36 3.76 -0.90 -4.90 115.29 117.66 2bkt s HIS 184 Ca 0.61 -1.71 -0.16 0.00 -0.15 0.00 0.00 55.06 53.65 2bkt s HIS 184 Cb -0.33 -2.08 -0.05 0.00 1.11 0.00 0.00 32.58 31.22 2bkt s HIS 184 CO 0.31 -0.76 0.43 0.71 -0.85 0.00 0.00 174.74 174.57 2bkt s TYR 185 N 1.29 3.68 -0.09 1.40 1.51 -1.26 -2.76 117.35 121.12 2bkt s TYR 185 Ca -0.03 0.97 0.01 0.00 -1.01 0.00 0.00 57.07 57.01 2bkt s TYR 185 Cb -0.18 -2.36 -0.03 0.00 -0.11 0.00 0.00 41.96 39.29 2bkt s TYR 185 CO -0.03 0.53 -0.10 0.42 -1.11 0.00 0.00 175.55 175.26 2bkt s ILE 186 N -0.66 3.42 0.61 2.71 1.09 -0.28 -4.79 121.20 123.30 2bkt s ILE 186 Ca 0.24 -0.57 -0.13 0.00 -1.10 0.00 0.00 60.65 59.09 2bkt s ILE 186 Cb -0.16 -2.40 -0.04 0.00 -1.06 0.00 0.00 42.46 38.80 2bkt s ILE 186 CO 0.13 0.57 1.03 0.20 -0.10 0.00 0.00 174.94 176.77 2bkt s ASN 187 N -0.41 6.01 -0.14 3.58 0.02 -1.26 -0.95 114.94 121.79 2bkt s ASN 187 Ca 0.05 1.60 -0.26 0.00 -1.02 0.00 0.00 52.86 53.23 2bkt s ASN 187 Cb -0.12 -2.50 -0.02 0.00 0.02 0.00 0.00 41.25 38.63 2bkt s ASN 187 CO 0.02 -1.01 0.84 -0.76 0.02 0.00 0.00 177.10 176.21 2bkt s LEU 188 N -4.84 4.21 0.00 0.60 1.43 0.07 -4.36 118.68 115.79 2bkt s LEU 188 Ca 0.59 1.24 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 2bkt s LEU 188 Cb -0.13 -3.27 0.00 0.00 0.03 0.00 0.00 46.19 42.83 2bkt s LEU 188 CO 0.45 -0.36 0.00 -0.38 0.23 0.00 0.00 176.35 176.29 2bkt n ILE 189 N 4.55 0.00 -2.20 -0.59 5.41 -1.01 -4.55 119.36 120.96 2bkt n ILE 189 Ca 0.04 0.16 -0.42 0.00 1.00 0.00 0.00 62.75 63.53 2bkt n ILE 189 Cb 0.49 -1.13 -0.03 0.00 -0.71 0.00 0.00 39.64 38.26 2bkt n ILE 189 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2bkt s LYS 190 N 0.00 4.29 0.05 0.38 2.47 -1.26 -4.97 119.74 120.69 2bkt s LYS 190 Ca 0.00 2.00 -0.27 0.00 -1.56 0.00 0.00 55.97 56.14 2bkt s LYS 190 Cb 0.00 -3.51 -0.05 0.00 -1.46 0.00 0.00 37.83 32.81 2bkt s LYS 190 CO 0.00 -0.55 0.83 0.99 0.16 0.00 0.00 175.35 176.78 2bkt s THR 191 N 2.15 4.71 0.00 3.43 2.01 -1.26 -3.70 115.64 122.98 2bkt s THR 191 Ca 0.64 1.76 0.00 0.00 0.31 0.00 0.00 61.69 64.40 2bkt s THR 191 Cb -0.33 -4.18 0.00 0.00 0.01 0.00 0.00 72.50 68.00 2bkt s THR 191 CO 0.28 0.32 0.00 0.61 -0.69 0.00 0.00 174.62 175.14 2bkt n GLY 192 N 2.46 0.79 3.19 4.40 0.00 -1.26 -5.04 105.19 109.72 2bkt n GLY 192 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 2bkt n GLY 192 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bkt s VAL 193 N -1.68 -0.01 -1.39 1.61 1.01 -1.24 -4.03 120.40 114.67 2bkt s VAL 193 Ca 0.00 0.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.88 2bkt s VAL 193 Cb 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2bkt s VAL 193 CO 0.00 0.01 2.40 0.79 0.00 0.00 0.00 175.10 178.30 2bkt n TRP 194 N 3.30 2.87 -4.87 5.22 7.02 -1.26 -4.84 117.44 124.88 2bkt n TRP 194 Ca -0.16 -2.80 -0.25 0.00 -1.02 0.00 0.00 57.50 53.26 2bkt n TRP 194 Cb 0.57 -2.38 -0.15 0.00 -2.42 0.00 0.00 31.31 26.92 2bkt n TRP 194 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 2bkt s GLN 195 N 3.13 1.47 0.14 -0.99 0.74 -1.26 -0.87 119.66 122.02 2bkt s GLN 195 Ca 0.54 -0.65 0.06 0.00 0.05 0.00 0.00 55.36 55.36 2bkt s GLN 195 Cb 0.15 -1.42 -0.04 0.00 1.10 0.00 0.00 33.01 32.80 2bkt s GLN 195 CO -0.05 0.39 -0.13 0.96 -0.55 0.00 0.00 175.29 175.90 2bkt s ILE 196 N -0.43 1.36 0.31 -2.34 -4.36 -0.24 -2.40 121.20 113.10 2bkt s ILE 196 Ca 0.07 -1.88 -0.29 0.00 -0.26 0.00 0.00 60.65 58.29 2bkt s ILE 196 Cb -0.07 -1.69 -0.10 0.00 1.25 0.00 0.00 42.46 41.85 2bkt s ILE 196 CO -0.01 -0.52 1.27 -1.58 0.24 0.00 0.00 174.94 174.34 2bkt s GLN 197 N -3.07 4.42 -0.16 0.37 2.00 -1.26 -0.51 119.66 121.44 2bkt s GLN 197 Ca 0.13 2.12 0.01 0.00 -2.00 0.00 0.00 55.36 55.61 2bkt s GLN 197 Cb -0.03 -3.11 0.02 0.00 0.80 0.00 0.00 33.01 30.70 2bkt s GLN 197 CO 0.03 -0.11 -0.16 1.41 -0.50 0.00 0.00 175.29 175.96 2bkt s MET 198 N -1.57 2.51 -1.56 1.67 -2.45 0.26 -4.67 119.30 113.50 2bkt s MET 198 Ca 0.49 -0.68 -0.11 0.00 -1.25 0.00 0.00 55.69 54.13 2bkt s MET 198 Cb -0.38 -2.30 -0.05 0.00 1.25 0.00 0.00 34.83 33.36 2bkt s MET 198 CO 0.49 -0.25 2.72 1.63 1.05 0.00 0.00 175.02 180.66 2bkt n LYS 199 N 4.71 3.40 -0.43 4.11 5.02 0.14 -1.75 118.16 133.36 2bkt n LYS 199 Ca -0.18 -2.32 0.05 0.00 -2.02 0.00 0.00 58.31 53.85 2bkt n LYS 199 Cb 0.50 -2.95 -0.02 0.00 -0.02 0.00 0.00 35.03 32.53 2bkt n LYS 199 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bkt n GLY 200 N 3.75 -2.46 3.10 0.72 0.00 -1.24 -4.22 105.19 104.85 2bkt n GLY 200 Ca 0.70 -1.36 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 2bkt n GLY 200 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bkt s VAL 201 N -2.82 1.29 0.17 1.61 1.01 -0.38 -1.47 120.40 119.81 2bkt s VAL 201 Ca 0.00 -0.64 0.07 0.00 0.00 0.00 0.00 61.98 61.41 2bkt s VAL 201 Cb 0.00 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2bkt s VAL 201 CO 0.00 0.38 0.04 -0.55 0.00 0.00 0.00 175.10 174.97 2bkt s SER 202 N 0.08 5.01 -0.30 3.32 0.15 0.21 -3.02 113.70 119.13 2bkt s SER 202 Ca -0.04 -0.31 0.03 0.00 0.70 0.00 0.00 55.95 56.33 2bkt s SER 202 Cb -0.11 -1.15 0.08 0.00 -1.71 0.00 0.00 66.02 63.13 2bkt s SER 202 CO 0.02 0.08 -0.02 -0.69 1.20 0.00 0.00 173.24 173.83 2bkt s VAL 203 N -1.74 2.30 0.00 4.45 1.01 -0.74 -1.21 120.40 124.47 2bkt s VAL 203 Ca 0.29 -1.95 0.00 0.00 0.00 0.00 0.00 61.98 60.32 2bkt s VAL 203 Cb -0.09 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2bkt s VAL 203 CO 0.20 -0.30 0.00 0.61 0.00 0.00 0.00 175.10 175.61 2bkt n GLY 204 N 4.37 0.40 2.48 4.51 0.00 0.50 -1.94 105.19 115.50 2bkt n GLY 204 Ca -0.06 0.63 -0.26 0.00 0.00 0.00 0.00 46.02 46.33 2bkt n GLY 204 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2bkt n SER 205 N 4.56 3.17 0.00 1.61 2.88 -1.26 -4.83 113.62 119.75 2bkt n SER 205 Ca 0.00 -3.35 0.00 0.00 -1.33 0.00 0.00 58.87 54.19 2bkt n SER 205 Cb 0.00 -0.64 0.00 0.00 -0.75 0.00 0.00 64.21 62.82 2bkt n SER 205 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2bkt n SER 206 N 0.68 0.00 -3.39 -3.46 3.41 -0.82 -5.05 113.62 105.00 2bkt n SER 206 Ca 0.28 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.57 2bkt n SER 206 Cb 0.44 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.36 2bkt n SER 206 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2bkt n THR 207 N 0.00 2.44 -1.62 6.66 -1.04 -1.26 -1.80 114.28 117.66 2bkt n THR 207 Ca 0.00 -1.71 -0.35 0.00 -2.04 0.00 0.00 64.05 59.95 2bkt n THR 207 Cb 0.00 -2.27 0.04 0.00 -1.82 0.00 0.00 70.33 66.28 2bkt n THR 207 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2bkt n LEU 208 N 5.45 7.39 -3.59 -4.42 -0.00 -1.25 -4.75 117.00 115.84 2bkt n LEU 208 Ca 0.49 -4.47 -0.09 0.00 -0.00 0.00 0.00 56.01 51.94 2bkt n LEU 208 Cb 0.25 -1.06 -0.05 0.00 -0.00 0.00 0.00 43.42 42.56 2bkt n LEU 208 CO 0.85 1.63 0.83 -0.76 -0.00 0.00 0.00 177.39 179.94 2bkt s LEU 209 N -3.62 -0.32 0.00 1.47 1.43 -1.17 -4.92 118.68 111.55 2bkt s LEU 209 Ca 0.55 0.35 0.00 0.00 -1.03 0.00 0.00 54.13 54.00 2bkt s LEU 209 Cb 0.44 1.75 0.00 0.00 0.03 0.00 0.00 46.19 48.41 2bkt s LEU 209 CO -0.24 -0.30 0.00 0.00 0.23 0.00 0.00 176.35 176.04 2bkt n GLU 211 N 0.23 0.46 0.00 0.00 1.02 -1.26 0.71 120.64 121.80 2bkt n GLU 211 Ca 0.00 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 2bkt n GLU 211 Cb 0.26 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 2bkt n GLU 211 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2bkt n ASP 212 N 1.59 0.00 0.00 1.62 10.43 -1.26 -4.84 116.55 124.09 2bkt n ASP 212 Ca 0.12 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.48 2bkt n ASP 212 Cb 0.36 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.32 2bkt n ASP 212 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2bkt n GLY 213 N -2.00 2.61 3.66 0.44 0.00 0.22 -4.99 105.19 105.13 2bkt n GLY 213 Ca 0.00 -2.03 0.02 0.00 0.00 0.00 0.00 46.02 44.01 2bkt n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkt s LEU 215 N -3.08 4.18 -0.18 0.00 1.02 -1.26 0.91 118.68 120.28 2bkt s LEU 215 Ca 0.16 0.26 0.01 0.00 0.02 0.00 0.00 54.13 54.58 2bkt s LEU 215 Cb 0.04 -2.48 0.03 0.00 0.02 0.00 0.00 46.19 43.81 2bkt s LEU 215 CO -0.04 0.27 -0.13 0.00 0.02 0.00 0.00 176.35 176.47 2bkt s ALA 216 N -1.27 1.96 -0.30 4.21 0.00 0.33 0.25 121.76 126.94 2bkt s ALA 216 Ca 0.26 -1.08 -0.24 0.00 0.00 0.00 0.00 51.96 50.90 2bkt s ALA 216 Cb -0.12 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 21.82 2bkt s ALA 216 CO 0.17 -0.60 0.80 -1.17 0.00 0.00 0.00 175.76 174.97 2bkt s LEU 217 N 1.43 4.08 -0.90 0.00 0.20 0.17 -1.08 118.68 122.57 2bkt s LEU 217 Ca 0.02 0.70 -0.20 0.00 0.69 0.00 0.00 54.13 55.33 2bkt s LEU 217 Cb -0.15 -3.10 0.10 0.00 -0.43 0.00 0.00 46.19 42.61 2bkt s LEU 217 CO -0.10 -0.62 1.18 -0.69 -0.29 0.00 0.00 176.35 175.83 2bkt s VAL 218 N 2.99 4.47 -0.55 1.68 1.01 -0.04 0.83 120.40 130.78 2bkt s VAL 218 Ca 0.33 -1.17 -0.14 0.00 0.00 0.00 0.00 61.98 61.00 2bkt s VAL 218 Cb -0.14 -4.83 0.14 0.00 0.00 0.00 0.00 36.38 31.55 2bkt s VAL 218 CO 0.12 -1.60 0.48 -0.62 0.00 0.00 0.00 175.10 173.48 2bkt s ASP 219 N 3.94 6.08 0.59 3.32 3.68 -0.41 -4.66 116.67 129.22 2bkt s ASP 219 Ca 0.34 -1.93 0.39 0.00 2.13 0.00 0.00 52.55 53.49 2bkt s ASP 219 Cb -0.06 -2.15 1.98 0.00 -1.45 0.00 0.00 42.92 41.25 2bkt s ASP 219 CO -0.06 -0.78 2.18 0.71 0.13 0.00 0.00 175.17 177.35 2bkt h THR 220 N 5.85 0.00 0.00 1.71 1.35 -1.83 -2.35 112.91 117.64 2bkt h THR 220 Ca -0.23 -0.16 -0.16 0.00 -0.55 0.00 0.00 66.41 65.30 2bkt h THR 220 Cb 1.08 1.11 -0.02 0.00 -1.73 0.00 0.00 68.15 68.59 2bkt h THR 220 CO 0.96 0.00 -0.89 1.23 -0.25 0.00 0.00 175.52 176.57 2bkt h GLY 221 N 0.70 0.00 -4.48 5.82 0.00 -1.90 -3.43 103.07 99.78 2bkt h GLY 221 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 2bkt h GLY 221 CO 0.00 0.00 0.51 0.00 0.00 0.00 0.00 176.54 177.05 2bkt s ALA 222 N -2.85 3.33 0.21 3.60 0.00 -0.88 -4.94 121.76 120.22 2bkt s ALA 222 Ca 0.01 0.74 -0.10 0.00 0.00 0.00 0.00 51.96 52.62 2bkt s ALA 222 Cb 0.09 -3.42 0.16 0.00 0.00 0.00 0.00 23.12 19.95 2bkt s ALA 222 CO 0.79 -0.39 1.86 0.77 0.00 0.00 0.00 175.76 178.79 2bkt h SER 223 N 6.84 0.91 -3.00 0.00 0.02 -1.88 0.36 113.55 116.80 2bkt h SER 223 Ca -0.41 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2bkt h SER 223 Cb 1.21 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.52 2bkt h SER 223 CO 0.80 0.69 0.00 -1.22 -1.14 0.00 0.00 176.83 175.95 2bkt n TYR 224 N -4.51 -0.42 -4.13 3.45 0.53 -1.26 -2.68 117.16 108.14 2bkt n TYR 224 Ca 0.07 0.00 -0.34 0.00 -1.02 0.00 0.00 57.90 56.61 2bkt n TYR 224 Cb 0.04 0.00 -0.07 0.00 -1.03 0.00 0.00 39.34 38.28 2bkt n TYR 224 CO 0.00 0.00 0.00 0.42 -1.02 0.00 0.00 176.86 176.26 2bkt s ILE 225 N -0.55 4.77 0.24 -0.72 1.01 -0.95 -1.18 121.20 123.82 2bkt s ILE 225 Ca 0.00 -0.26 -0.05 0.00 0.00 0.00 0.00 60.65 60.34 2bkt s ILE 225 Cb 0.00 -3.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.32 2bkt s ILE 225 CO 0.00 0.46 0.30 -0.94 0.00 0.00 0.00 174.94 174.76 2bkt s SER 226 N -1.41 0.18 0.22 3.58 1.04 0.13 -2.08 113.70 115.36 2bkt s SER 226 Ca 0.19 -1.23 -0.21 0.00 0.48 0.00 0.00 55.95 55.18 2bkt s SER 226 Cb -0.12 0.49 0.07 0.00 0.10 0.00 0.00 66.02 66.56 2bkt s SER 226 CO 0.09 -1.00 0.98 -0.83 0.98 0.00 0.00 173.24 173.46 2bkt s GLY 227 N -3.12 0.12 0.58 7.32 0.00 -1.23 0.25 107.32 111.23 2bkt s GLY 227 Ca 0.32 -0.35 -0.19 0.00 0.00 0.00 0.00 44.72 44.49 2bkt s GLY 227 CO 0.12 1.63 0.99 -1.14 0.00 0.00 0.00 173.10 174.70 2bkt n SER 228 N -1.16 0.91 -0.24 1.64 3.41 -1.26 -0.98 113.62 115.94 2bkt n SER 228 Ca -0.04 0.83 0.17 0.00 -0.26 0.00 0.00 58.87 59.57 2bkt n SER 228 Cb 0.60 -1.39 0.47 0.00 -0.26 0.00 0.00 64.21 63.62 2bkt n SER 228 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2bkt h THR 229 N 0.63 0.73 0.12 6.66 2.02 -1.90 -1.46 112.91 119.72 2bkt h THR 229 Ca -0.48 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.53 2bkt h THR 229 Cb 1.36 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2bkt h THR 229 CO 0.52 0.09 -0.22 0.28 0.37 0.00 0.00 175.52 176.56 2bkt h SER 230 N 0.49 -0.63 -1.00 4.18 0.02 -1.99 0.40 113.55 115.02 2bkt h SER 230 Ca 0.45 0.06 0.21 0.00 -0.84 0.00 0.00 61.79 61.67 2bkt h SER 230 Cb 1.00 0.22 -0.11 0.00 0.14 0.00 0.00 62.40 63.65 2bkt h SER 230 CO -0.18 -0.25 0.61 0.28 -1.14 0.00 0.00 176.83 176.15 2bkt h SER 231 N -0.36 0.70 0.33 3.07 0.02 -1.68 -0.17 113.55 115.44 2bkt h SER 231 Ca -0.01 0.10 -0.20 0.00 -0.84 0.00 0.00 61.79 60.83 2bkt h SER 231 Cb 0.34 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 2bkt h SER 231 CO -0.08 0.21 -0.83 0.40 -1.14 0.00 0.00 176.83 175.39 2bkt h ILE 232 N 0.66 1.40 -0.41 3.27 1.08 -0.83 0.24 117.51 122.92 2bkt h ILE 232 Ca 0.59 -2.32 -0.11 0.00 -0.39 0.00 0.00 64.86 62.62 2bkt h ILE 232 Cb 1.05 2.28 -0.02 0.00 -3.07 0.00 0.00 36.82 37.06 2bkt h ILE 232 CO -0.37 0.69 -0.19 -0.33 -0.69 0.00 0.00 178.15 177.26 2bkt h GLU 233 N 0.24 0.80 0.61 2.37 5.08 0.95 0.30 114.58 124.94 2bkt h GLU 233 Ca -0.05 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 57.97 2bkt h GLU 233 Cb 1.44 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.65 2bkt h GLU 233 CO 0.14 0.93 -0.29 -0.22 -1.00 0.00 0.00 179.01 178.57 2bkt h LYS 234 N 0.71 -0.79 -0.13 2.33 3.64 -0.97 -2.53 116.57 118.81 2bkt h LYS 234 Ca 0.10 0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.58 2bkt h LYS 234 Cb 0.71 0.18 -0.07 0.00 -0.41 0.00 0.00 32.23 32.64 2bkt h LYS 234 CO 0.05 -0.53 -0.41 1.25 -2.27 0.00 0.00 179.45 177.54 2bkt h LEU 235 N -1.09 -1.29 -1.55 5.20 6.46 -0.45 -0.67 115.31 121.90 2bkt h LEU 235 Ca -0.08 0.17 0.01 0.00 -0.12 0.00 0.00 57.88 57.86 2bkt h LEU 235 Cb 0.63 0.53 -0.02 0.00 -0.73 0.00 0.00 40.66 41.06 2bkt h LEU 235 CO 0.14 -0.42 0.32 0.24 -0.62 0.00 0.00 178.44 178.09 2bkt h MET 236 N -0.48 0.59 -0.07 1.25 2.86 -0.50 -1.40 114.93 117.17 2bkt h MET 236 Ca 0.08 -0.04 -0.18 0.00 -2.06 0.00 0.00 59.70 57.50 2bkt h MET 236 Cb 0.62 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 2bkt h MET 236 CO -0.39 0.39 -0.72 1.05 1.06 0.00 0.00 176.91 178.29 2bkt h GLU 237 N 0.61 0.36 0.00 1.72 -0.00 -0.97 0.56 114.58 116.85 2bkt h GLU 237 Ca 0.18 -0.29 0.00 0.00 -0.00 0.00 0.00 59.36 59.25 2bkt h GLU 237 Cb -0.01 0.06 0.00 0.00 -0.00 0.00 0.00 28.75 28.80 2bkt h GLU 237 CO -0.04 0.94 0.00 0.00 -0.00 0.00 0.00 179.01 179.90 2bkt n ALA 238 N -2.50 1.57 -0.01 1.06 0.00 -0.31 -2.13 120.51 118.19 2bkt n ALA 238 Ca -0.04 0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.57 2bkt n ALA 238 Cb 0.70 -1.33 -0.17 0.00 0.00 0.00 0.00 19.45 18.65 2bkt n ALA 238 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2bkt n LEU 239 N -2.06 0.00 0.00 0.00 4.77 -0.88 -4.95 117.00 113.88 2bkt n LEU 239 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2bkt n LEU 239 Cb 0.19 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2bkt n LEU 239 CO 0.17 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 2bkt n GLY 240 N 1.30 1.00 3.63 -0.72 0.00 -0.91 -4.86 105.19 104.64 2bkt n GLY 240 Ca -0.04 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 2bkt n GLY 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkt s ALA 241 N -2.00 3.27 -0.53 4.61 0.00 0.19 -4.85 121.76 122.45 2bkt s ALA 241 Ca 0.00 0.54 -0.18 0.00 0.00 0.00 0.00 51.96 52.32 2bkt s ALA 241 Cb 0.00 -3.86 0.08 0.00 0.00 0.00 0.00 23.12 19.34 2bkt s ALA 241 CO 0.00 -1.96 0.60 0.21 0.00 0.00 0.00 175.76 174.61 2bkt s LYS 242 N 4.74 3.07 0.33 0.00 2.20 -0.79 -4.39 119.74 124.89 2bkt s LYS 242 Ca 0.74 -1.15 -0.27 0.00 -0.36 0.00 0.00 55.97 54.93 2bkt s LYS 242 Cb -0.26 -4.16 -0.13 0.00 -1.51 0.00 0.00 37.83 31.76 2bkt s LYS 242 CO 0.30 -1.28 1.02 1.17 -0.36 0.00 0.00 175.35 176.20 2bkt n LYS 243 N 5.98 1.41 0.00 4.03 4.81 -1.26 -2.74 118.16 130.39 2bkt n LYS 243 Ca -0.09 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 57.85 2bkt n LYS 243 Cb 0.44 -1.92 0.00 0.00 0.02 0.00 0.00 35.03 33.56 2bkt n LYS 243 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2bkt n ARG 244 N 0.58 3.60 -0.17 1.64 1.74 -0.81 -4.88 116.66 118.36 2bkt n ARG 244 Ca 0.09 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.32 2bkt n ARG 244 Cb 0.34 0.00 0.50 0.00 -1.02 0.00 0.00 32.46 32.28 2bkt n ARG 244 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2bkt h LEU 245 N 0.00 0.40 0.00 0.55 3.38 -2.02 -3.43 115.31 114.20 2bkt h LEU 245 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2bkt h LEU 245 Cb 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2bkt h LEU 245 CO 0.00 0.21 0.00 0.49 0.09 0.00 0.00 178.44 179.23 2bkt n PHE 246 N -4.48 0.00 -1.38 1.13 3.01 -1.26 -5.12 117.46 109.36 2bkt n PHE 246 Ca 0.14 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.25 2bkt n PHE 246 Cb 0.53 0.00 0.09 0.00 -0.01 0.00 0.00 39.48 40.09 2bkt n PHE 246 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2bkt n ASP 247 N 0.00 0.86 -4.89 4.37 3.85 -1.26 -4.98 116.55 114.49 2bkt n ASP 247 Ca 0.00 0.68 -0.29 0.00 -0.71 0.00 0.00 54.79 54.47 2bkt n ASP 247 Cb 0.00 -1.45 -0.04 0.00 -1.35 0.00 0.00 41.12 38.28 2bkt n ASP 247 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 2bkt s TYR 248 N -1.80 3.47 0.00 2.11 1.51 -1.26 -1.92 117.35 119.46 2bkt s TYR 248 Ca 0.75 0.77 0.00 0.00 -1.01 0.00 0.00 57.07 57.58 2bkt s TYR 248 Cb -0.34 -2.21 0.00 0.00 -0.11 0.00 0.00 41.96 39.30 2bkt s TYR 248 CO 0.49 0.13 0.00 1.33 -1.11 0.00 0.00 175.55 176.38 2bkt n VAL 249 N -0.89 0.00 -3.65 0.71 0.24 -1.11 -2.59 118.33 111.04 2bkt n VAL 249 Ca -0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 2bkt n VAL 249 Cb 0.54 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.84 2bkt n VAL 249 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2bkt s VAL 250 N -1.13 0.00 0.02 3.34 0.11 -0.74 -1.88 120.40 120.12 2bkt s VAL 250 Ca 0.00 0.00 -0.39 0.00 -2.93 0.00 0.00 61.98 58.66 2bkt s VAL 250 Cb 0.00 -1.00 -0.19 0.00 -1.53 0.00 0.00 36.38 33.66 2bkt s VAL 250 CO 0.00 0.00 1.20 0.29 -3.33 0.00 0.00 175.10 173.26 2bkt n LYS 251 N 2.22 0.48 0.01 1.54 4.01 -1.26 -2.22 118.16 122.94 2bkt n LYS 251 Ca -0.13 0.17 -0.12 0.00 -0.51 0.00 0.00 58.31 57.72 2bkt n LYS 251 Cb 0.57 -1.73 -0.06 0.00 -0.51 0.00 0.00 35.03 33.29 2bkt n LYS 251 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2bkt h ASN 253 N -0.49 0.00 -0.33 0.00 -1.07 -0.39 0.34 115.58 113.64 2bkt h ASN 253 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.44 2bkt h ASN 253 Cb 0.62 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.87 2bkt h ASN 253 CO -0.38 0.00 0.00 1.21 0.07 0.00 0.00 177.43 178.33 2bkt n GLU 254 N -2.12 2.72 -0.12 4.14 2.13 0.13 -4.63 120.64 122.90 2bkt n GLU 254 Ca -0.01 -2.00 -0.13 0.00 0.66 0.00 0.00 57.16 55.68 2bkt n GLU 254 Cb 0.40 -1.27 -0.03 0.00 0.27 0.00 0.00 31.44 30.82 2bkt n GLU 254 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2bkt h GLY 255 N 2.07 0.88 2.00 8.31 0.00 -0.10 -3.14 103.07 113.07 2bkt h GLY 255 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 47.33 46.48 2bkt h GLY 255 CO 0.00 0.77 0.00 -2.55 0.00 0.00 0.00 176.54 174.76 2bkt h PRO 256 N 0.59 0.00 0.00 4.80 0.11 -1.82 -2.49 132.00 133.19 2bkt h PRO 256 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 2bkt h PRO 256 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2bkt h PRO 256 CO 0.07 0.00 -0.83 0.25 -0.21 0.00 0.00 178.00 177.28 2bkt n THR 257 N -3.06 0.40 -1.69 -1.15 -2.24 -1.19 -4.82 114.28 100.53 2bkt n THR 257 Ca -0.02 -0.36 -0.43 0.00 -2.27 0.00 0.00 64.05 60.98 2bkt n THR 257 Cb 0.13 -0.13 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 2bkt n THR 257 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2bkt n LEU 258 N -2.26 3.45 -4.71 3.22 4.77 -0.94 -4.93 117.00 115.60 2bkt n LEU 258 Ca 0.02 1.20 -0.32 0.00 -0.03 0.00 0.00 56.01 56.88 2bkt n LEU 258 Cb 0.47 -1.47 0.12 0.00 -2.33 0.00 0.00 43.42 40.22 2bkt n LEU 258 CO 0.38 -0.52 0.73 -2.16 -1.33 0.00 0.00 177.39 174.50 2bkt s PRO 259 N -1.75 1.67 0.18 3.23 0.04 -1.26 -4.35 135.00 132.76 2bkt s PRO 259 Ca 0.56 1.59 -0.30 0.00 0.04 0.00 0.00 61.00 62.89 2bkt s PRO 259 Cb -0.58 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.08 2bkt s PRO 259 CO 0.61 -2.16 1.18 -0.51 0.04 0.00 0.00 177.00 176.17 2bkt s ASP 260 N -2.49 7.11 -0.18 6.66 -0.00 -1.26 -4.59 116.67 121.91 2bkt s ASP 260 Ca 0.69 2.21 -0.08 0.00 -0.00 0.00 0.00 52.55 55.37 2bkt s ASP 260 Cb -0.25 -2.61 -0.04 0.00 -0.00 0.00 0.00 42.92 40.02 2bkt s ASP 260 CO 0.52 -0.35 0.10 -0.63 -0.00 0.00 0.00 175.17 174.81 2bkt s ILE 261 N -0.09 5.10 0.02 0.77 -1.09 -0.70 0.19 121.20 125.40 2bkt s ILE 261 Ca 0.52 0.08 0.06 0.00 -2.23 0.00 0.00 60.65 59.07 2bkt s ILE 261 Cb -0.32 -3.30 -0.02 0.00 -1.58 0.00 0.00 42.46 37.24 2bkt s ILE 261 CO 0.36 0.47 -0.17 -0.44 -1.23 0.00 0.00 174.94 173.94 2bkt s SER 262 N 0.19 1.99 -0.09 3.58 0.01 -0.35 0.12 113.70 119.15 2bkt s SER 262 Ca 0.07 -0.42 0.04 0.00 1.31 0.00 0.00 55.95 56.94 2bkt s SER 262 Cb -0.12 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 65.94 2bkt s SER 262 CO -0.00 0.13 -0.23 -0.36 0.41 0.00 0.00 173.24 173.19 2bkt s PHE 263 N -0.68 2.43 -0.36 2.43 0.40 0.40 0.64 117.98 123.23 2bkt s PHE 263 Ca 0.05 -0.97 -0.17 0.00 -0.60 0.00 0.00 56.93 55.24 2bkt s PHE 263 Cb -0.08 -1.63 -0.00 0.00 0.51 0.00 0.00 43.02 41.82 2bkt s PHE 263 CO 0.01 -0.39 0.44 -1.01 0.70 0.00 0.00 175.22 174.97 2bkt s HIS 264 N 0.34 3.19 -0.03 0.36 3.76 -0.54 -0.37 115.29 121.99 2bkt s HIS 264 Ca -0.17 -0.02 -0.01 0.00 -0.15 0.00 0.00 55.06 54.70 2bkt s HIS 264 Cb -0.17 -2.83 0.03 0.00 1.11 0.00 0.00 32.58 30.72 2bkt s HIS 264 CO 0.08 -0.54 0.06 -0.51 -0.85 0.00 0.00 174.74 172.98 2bkt s LEU 265 N 2.20 0.74 -1.59 0.89 1.43 -0.71 0.25 118.68 121.90 2bkt s LEU 265 Ca 0.15 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 2bkt s LEU 265 Cb -0.16 -0.02 0.00 0.00 0.03 0.00 0.00 46.19 46.03 2bkt s LEU 265 CO 0.13 -0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.15 2bkt n GLY 266 N 4.53 1.01 1.71 -3.19 0.00 -1.26 -2.26 105.19 105.73 2bkt n GLY 266 Ca -0.20 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.57 2bkt n GLY 266 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bkt n GLY 267 N -1.02 0.49 3.13 -0.02 0.00 -1.26 -4.93 105.19 101.59 2bkt n GLY 267 Ca -0.17 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 44.98 2bkt n GLY 267 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bkt s LYS 268 N -1.34 0.72 -0.27 1.61 2.47 -0.96 -5.13 119.74 116.84 2bkt s LYS 268 Ca 0.00 -0.92 -0.10 0.00 -1.56 0.00 0.00 55.97 53.39 2bkt s LYS 268 Cb 0.00 -0.57 -0.04 0.00 -1.46 0.00 0.00 37.83 35.76 2bkt s LYS 268 CO 0.00 0.11 0.15 -2.00 0.16 0.00 0.00 175.35 173.78 2bkt s GLU 269 N -1.89 3.85 -0.48 4.03 2.12 -1.26 -1.73 118.70 123.33 2bkt s GLU 269 Ca -0.03 -0.38 -0.13 0.00 0.36 0.00 0.00 54.97 54.79 2bkt s GLU 269 Cb -0.09 -3.56 0.10 0.00 0.26 0.00 0.00 34.13 30.85 2bkt s GLU 269 CO 0.01 -0.19 0.39 0.71 -0.54 0.00 0.00 175.26 175.64 2bkt s TYR 270 N 1.71 3.30 -0.06 5.30 1.51 0.51 -4.91 117.35 124.72 2bkt s TYR 270 Ca 0.07 -1.36 -0.13 0.00 -1.01 0.00 0.00 57.07 54.64 2bkt s TYR 270 Cb -0.16 -3.38 -0.05 0.00 -0.11 0.00 0.00 41.96 38.26 2bkt s TYR 270 CO 0.09 -0.91 0.34 0.99 -1.11 0.00 0.00 175.55 174.94 2bkt s THR 271 N 1.52 5.19 -0.31 -0.71 2.01 -1.26 -0.46 115.64 121.63 2bkt s THR 271 Ca 0.04 0.67 -0.01 0.00 0.31 0.00 0.00 61.69 62.70 2bkt s THR 271 Cb -0.26 -3.64 0.06 0.00 0.01 0.00 0.00 72.50 68.67 2bkt s THR 271 CO 0.03 0.54 0.01 -0.76 -0.69 0.00 0.00 174.62 173.74 2bkt s LEU 272 N -0.69 4.01 1.15 4.42 1.43 0.32 -4.97 118.68 124.35 2bkt s LEU 272 Ca 0.21 -1.40 -0.13 0.00 -1.03 0.00 0.00 54.13 51.78 2bkt s LEU 272 Cb -0.15 -1.70 0.27 0.00 0.03 0.00 0.00 46.19 44.65 2bkt s LEU 272 CO 0.10 -0.28 1.04 0.28 0.23 0.00 0.00 176.35 177.71 2bkt s THR 273 N 1.20 2.01 0.38 5.49 -1.32 -1.26 -1.72 115.64 120.42 2bkt s THR 273 Ca -0.04 0.00 0.36 0.00 -1.21 0.00 0.00 61.69 60.81 2bkt s THR 273 Cb -0.20 -2.15 0.39 0.00 -1.51 0.00 0.00 72.50 69.03 2bkt s THR 273 CO -0.02 -0.00 2.15 0.77 -2.21 0.00 0.00 174.62 175.30 2bkt h SER 274 N -2.52 0.00 0.73 8.08 4.64 -1.81 -0.40 113.55 122.27 2bkt h SER 274 Ca -0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.71 2bkt h SER 274 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 2bkt h SER 274 CO 0.52 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 176.51 2bkt n ALA 275 N -2.13 2.32 0.01 5.18 0.00 -1.26 -2.47 120.51 122.16 2bkt n ALA 275 Ca -0.01 -0.11 -0.15 0.00 0.00 0.00 0.00 53.44 53.16 2bkt n ALA 275 Cb 0.21 -1.45 -0.14 0.00 0.00 0.00 0.00 19.45 18.07 2bkt n ALA 275 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2bkt h ASP 276 N 0.00 0.25 -0.09 0.00 5.19 -1.37 -3.40 116.42 117.00 2bkt h ASP 276 Ca 0.00 -0.49 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 2bkt h ASP 276 Cb 0.36 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.79 2bkt h ASP 276 CO 0.00 1.43 0.00 0.00 -3.12 0.00 0.00 179.24 177.55 2bkt n TYR 277 N -3.31 0.11 -4.63 4.55 0.18 -1.22 -4.90 117.16 107.94 2bkt n TYR 277 Ca -0.22 -0.14 -0.33 0.00 1.88 0.00 0.00 57.90 59.09 2bkt n TYR 277 Cb 1.05 -0.01 -0.12 0.00 -0.38 0.00 0.00 39.34 39.88 2bkt n TYR 277 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2bkt s VAL 278 N -0.88 3.54 -1.08 -3.48 0.11 -1.03 0.21 120.40 117.78 2bkt s VAL 278 Ca 0.14 -0.52 -0.18 0.00 -2.93 0.00 0.00 61.98 58.50 2bkt s VAL 278 Cb 0.09 -2.48 0.12 0.00 -1.53 0.00 0.00 36.38 32.59 2bkt s VAL 278 CO 0.13 0.55 1.36 -0.36 -3.33 0.00 0.00 175.10 173.46 2bkt s PHE 279 N -0.24 3.10 -0.88 1.54 0.40 0.14 -4.85 117.98 117.19 2bkt s PHE 279 Ca 0.03 -1.58 -0.18 0.00 -0.60 0.00 0.00 56.93 54.60 2bkt s PHE 279 Cb -0.13 -4.42 -0.12 0.00 0.51 0.00 0.00 43.02 38.86 2bkt s PHE 279 CO 0.03 -1.57 2.01 0.94 0.70 0.00 0.00 175.22 177.32 2bkt n GLN 280 N 6.88 1.79 -0.27 0.44 -0.06 -1.26 -3.94 117.38 120.96 2bkt n GLN 280 Ca 0.33 -1.86 0.01 0.00 -2.00 0.00 0.00 57.00 53.48 2bkt n GLN 280 Cb 0.47 -2.87 0.14 0.00 -4.06 0.00 0.00 30.24 23.92 2bkt n GLN 280 CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 2bkt h GLU 281 N 7.35 0.75 0.00 3.69 4.57 -1.93 -3.45 114.58 125.55 2bkt h GLU 281 Ca 0.46 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 58.45 2bkt h GLU 281 Cb 0.56 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.95 2bkt h GLU 281 CO 1.86 0.50 -0.04 -1.13 -1.18 0.00 0.00 179.01 179.01 2bkt n SER 282 N -4.75 -1.00 0.00 1.04 3.41 -1.26 -5.06 113.62 106.00 2bkt n SER 282 Ca 0.12 -2.17 0.00 0.00 -0.26 0.00 0.00 58.87 56.56 2bkt n SER 282 Cb 0.23 1.80 0.00 0.00 -0.26 0.00 0.00 64.21 65.98 2bkt n SER 282 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2bkt n TYR 283 N -0.36 0.00 -0.45 7.33 4.01 -1.26 -4.60 117.16 121.83 2bkt n TYR 283 Ca -0.01 -0.36 -0.29 0.00 -0.16 0.00 0.00 57.90 57.08 2bkt n TYR 283 Cb 0.38 -0.04 0.26 0.00 -0.31 0.00 0.00 39.34 39.63 2bkt n TYR 283 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2bkt n SER 284 N -0.36 -2.31 -0.04 7.72 2.88 -1.26 -2.76 113.62 117.48 2bkt n SER 284 Ca 0.00 -0.30 0.01 0.00 -1.33 0.00 0.00 58.87 57.25 2bkt n SER 284 Cb 0.19 -1.16 -0.12 0.00 -0.75 0.00 0.00 64.21 62.37 2bkt n SER 284 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2bkt n SER 285 N -4.65 1.48 -0.03 -3.46 7.64 -1.26 -0.19 113.62 113.14 2bkt n SER 285 Ca 0.03 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.77 2bkt n SER 285 Cb 0.56 1.30 -0.11 0.00 -1.01 0.00 0.00 64.21 64.95 2bkt n SER 285 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2bkt h LYS 286 N 0.00 0.18 -7.08 1.43 1.57 -2.00 -3.44 116.57 107.22 2bkt h LYS 286 Ca -0.18 -0.16 -0.46 0.00 -1.87 0.00 0.00 60.65 57.98 2bkt h LYS 286 Cb 1.26 0.04 0.01 0.00 0.08 0.00 0.00 32.23 33.62 2bkt h LYS 286 CO 0.01 0.85 0.36 0.15 -0.57 0.00 0.00 179.45 180.26 2bkt s LYS 287 N -3.38 3.99 0.01 3.15 1.02 -1.26 -5.01 119.74 118.26 2bkt s LYS 287 Ca -0.16 1.22 -0.03 0.00 0.02 0.00 0.00 55.97 57.02 2bkt s LYS 287 Cb 0.01 -2.13 -0.04 0.00 -0.52 0.00 0.00 37.83 35.15 2bkt s LYS 287 CO 0.74 -0.25 0.21 -0.51 -0.92 0.00 0.00 175.35 174.61 2bkt s LEU 288 N -3.42 4.36 -0.05 3.17 1.43 -1.26 -3.01 118.68 119.91 2bkt s LEU 288 Ca 0.64 0.37 0.06 0.00 -1.03 0.00 0.00 54.13 54.18 2bkt s LEU 288 Cb -0.13 -2.71 -0.01 0.00 0.03 0.00 0.00 46.19 43.37 2bkt s LEU 288 CO 0.18 0.24 -0.24 0.00 0.23 0.00 0.00 176.35 176.75 2bkt s THR 290 N -0.28 4.76 -0.14 0.00 2.01 -1.25 -1.79 115.64 118.95 2bkt s THR 290 Ca -0.00 0.66 -0.05 0.00 0.31 0.00 0.00 61.69 62.61 2bkt s THR 290 Cb -0.13 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 2bkt s THR 290 CO 0.03 -0.78 0.01 -0.76 -0.69 0.00 0.00 174.62 172.43 2bkt s LEU 291 N -4.43 3.57 0.00 4.42 1.43 -1.07 0.28 118.68 122.88 2bkt s LEU 291 Ca 0.52 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 2bkt s LEU 291 Cb -0.10 -1.86 0.00 0.00 0.03 0.00 0.00 46.19 44.25 2bkt s LEU 291 CO 0.40 0.24 0.65 0.00 0.23 0.00 0.00 176.35 177.87 2bkt n ALA 292 N 3.09 2.26 -2.94 4.21 0.00 0.56 -4.66 120.51 123.02 2bkt n ALA 292 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 2bkt n ALA 292 Cb 0.53 -1.32 -0.12 0.00 0.00 0.00 0.00 19.45 18.54 2bkt n ALA 292 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2bkt s ILE 293 N 0.91 0.12 0.26 0.00 1.01 -1.26 -2.24 121.20 120.00 2bkt s ILE 293 Ca 0.00 -0.70 -0.16 0.00 0.00 0.00 0.00 60.65 59.79 2bkt s ILE 293 Cb 0.00 -0.23 0.01 0.00 0.01 0.00 0.00 42.46 42.25 2bkt s ILE 293 CO 0.00 -0.37 0.57 -1.38 0.00 0.00 0.00 174.94 173.77 2bkt s HIS 294 N -1.10 0.17 -0.18 3.97 -3.43 -0.88 -4.50 115.29 109.34 2bkt s HIS 294 Ca -0.12 -0.57 -0.20 0.00 -0.80 0.00 0.00 55.06 53.37 2bkt s HIS 294 Cb -0.08 0.39 -0.03 0.00 -1.43 0.00 0.00 32.58 31.44 2bkt s HIS 294 CO -0.01 -1.10 0.60 0.00 -2.00 0.00 0.00 174.74 172.23 2bkt s ALA 295 N -3.92 3.52 -0.29 -1.38 0.00 -1.26 -3.53 121.76 114.90 2bkt s ALA 295 Ca 0.18 -0.25 0.01 0.00 0.00 0.00 0.00 51.96 51.90 2bkt s ALA 295 Cb -0.03 -2.91 0.09 0.00 0.00 0.00 0.00 23.12 20.26 2bkt s ALA 295 CO 0.09 -0.45 0.04 1.41 0.00 0.00 0.00 175.76 176.85 2bkt s MET 296 N 1.66 1.12 -1.15 0.00 0.00 -0.15 -4.89 119.30 115.90 2bkt s MET 296 Ca 0.28 -1.20 -0.18 0.00 0.00 0.00 0.00 55.69 54.59 2bkt s MET 296 Cb -0.16 -2.44 0.10 0.00 0.00 0.00 0.00 34.83 32.33 2bkt s MET 296 CO 0.11 -0.85 1.49 -0.51 0.00 0.00 0.00 175.02 175.25 2bkt s ASP 297 N 1.40 6.77 -0.07 1.11 -0.00 -1.26 -4.00 116.67 120.63 2bkt s ASP 297 Ca 0.05 -2.26 -0.30 0.00 -0.00 0.00 0.00 52.55 50.05 2bkt s ASP 297 Cb -0.18 -2.50 -0.03 0.00 -0.00 0.00 0.00 42.92 40.21 2bkt s ASP 297 CO -0.15 -1.14 1.13 -0.63 -0.00 0.00 0.00 175.17 174.38 2bkt s ILE 298 N 3.53 4.43 0.39 0.77 1.01 -1.26 -5.02 121.20 125.06 2bkt s ILE 298 Ca 0.46 1.74 -0.24 0.00 0.00 0.00 0.00 60.65 62.60 2bkt s ILE 298 Cb -0.00 -4.12 -0.09 0.00 0.01 0.00 0.00 42.46 38.26 2bkt s ILE 298 CO -0.01 0.00 1.06 -2.16 0.00 0.00 0.00 174.94 173.83 2bkt s PRO 299 N 2.11 4.17 1.08 2.79 0.04 -1.26 -2.90 135.00 141.03 2bkt s PRO 299 Ca 0.53 1.56 -0.19 0.00 0.04 0.00 0.00 61.00 62.94 2bkt s PRO 299 Cb -0.23 -2.58 0.06 0.00 0.04 0.00 0.00 34.50 31.79 2bkt s PRO 299 CO 0.21 -0.15 -0.15 -2.30 0.04 0.00 0.00 177.00 174.65 2bkt n PRO 300 N -0.01 -1.22 0.02 0.56 -0.02 -0.86 -2.57 135.00 130.90 2bkt n PRO 300 Ca 0.05 -0.34 -0.10 0.00 -2.02 0.00 0.00 63.50 61.09 2bkt n PRO 300 Cb 0.49 -1.62 0.05 0.00 -0.02 0.00 0.00 33.50 32.40 2bkt n PRO 300 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2bkt h PRO 301 N -1.86 0.52 -0.84 0.52 0.13 -2.01 -3.42 132.00 125.04 2bkt h PRO 301 Ca -0.51 -0.35 0.05 0.00 -0.87 0.00 0.00 66.00 64.33 2bkt h PRO 301 Cb 1.35 0.05 -0.05 0.00 0.13 0.00 0.00 31.00 32.48 2bkt h PRO 301 CO 0.35 0.96 0.55 1.79 -0.23 0.00 0.00 178.00 181.42 2bkt h THR 302 N 0.39 1.09 -1.98 1.56 1.35 -1.94 -3.43 112.91 109.95 2bkt h THR 302 Ca -0.00 -0.33 -0.44 0.00 -0.55 0.00 0.00 66.41 65.08 2bkt h THR 302 Cb 1.14 0.03 0.01 0.00 -1.73 0.00 0.00 68.15 67.60 2bkt h THR 302 CO 0.11 0.18 -0.32 -0.83 -0.25 0.00 0.00 175.52 174.41 2bkt s GLY 303 N -3.42 1.55 0.55 5.82 0.00 -1.06 -4.26 107.32 106.50 2bkt s GLY 303 Ca -0.11 -1.38 -0.21 0.00 0.00 0.00 0.00 44.72 43.03 2bkt s GLY 303 CO 0.79 -1.29 1.26 -4.14 0.00 0.00 0.00 173.10 169.72 2bkt s PRO 304 N -4.21 3.16 -0.29 2.90 0.02 -1.14 -2.02 135.00 133.42 2bkt s PRO 304 Ca 0.44 1.99 -0.23 0.00 0.02 0.00 0.00 61.00 63.22 2bkt s PRO 304 Cb -0.10 -2.14 0.15 0.00 0.02 0.00 0.00 34.50 32.43 2bkt s PRO 304 CO 0.32 -1.10 1.15 -0.08 -0.33 0.00 0.00 177.00 176.95 2bkt s THR 305 N -1.45 0.00 0.96 0.99 -1.32 -1.26 -4.71 115.64 108.85 2bkt s THR 305 Ca 0.73 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 61.09 2bkt s THR 305 Cb -0.34 -1.00 0.17 0.00 -1.51 0.00 0.00 72.50 69.81 2bkt s THR 305 CO 0.39 0.00 1.09 0.26 -2.21 0.00 0.00 174.62 174.15 2bkt s TRP 306 N 0.39 2.10 -0.04 9.09 0.52 0.14 -4.58 118.94 126.56 2bkt s TRP 306 Ca 0.02 1.18 -0.01 0.00 0.02 0.00 0.00 56.10 57.31 2bkt s TRP 306 Cb -0.05 -3.20 0.03 0.00 -1.15 0.00 0.00 33.47 29.11 2bkt s TRP 306 CO -0.10 -2.76 0.03 0.00 0.02 0.00 0.00 176.95 174.13 2bkt s ALA 307 N -2.88 0.32 -0.46 0.98 0.00 0.14 0.45 121.76 120.31 2bkt s ALA 307 Ca 0.65 0.14 -0.17 0.00 0.00 0.00 0.00 51.96 52.58 2bkt s ALA 307 Cb -0.19 -0.51 0.05 0.00 0.00 0.00 0.00 23.12 22.46 2bkt s ALA 307 CO 0.58 -0.32 0.46 -0.51 0.00 0.00 0.00 175.76 175.98 2bkt s LEU 308 N 1.67 5.16 0.00 0.00 1.43 0.24 0.19 118.68 127.38 2bkt s LEU 308 Ca -0.01 -0.97 0.00 0.00 -1.03 0.00 0.00 54.13 52.12 2bkt s LEU 308 Cb -0.13 -2.32 0.00 0.00 0.03 0.00 0.00 46.19 43.78 2bkt s LEU 308 CO -0.03 -0.68 0.00 0.61 0.23 0.00 0.00 176.35 176.48 2bkt n GLY 309 N 5.16 2.43 0.32 -3.19 0.00 -0.33 -1.28 105.19 108.31 2bkt n GLY 309 Ca -0.09 -1.97 0.18 0.00 0.00 0.00 0.00 46.02 44.14 2bkt n GLY 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkt h ALA 310 N -0.77 1.57 -0.45 4.61 0.00 -0.21 0.22 119.26 124.24 2bkt h ALA 310 Ca 0.00 0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.22 2bkt h ALA 310 Cb 0.00 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 17.98 2bkt h ALA 310 CO 0.00 -0.53 -0.04 1.15 0.00 0.00 0.00 179.25 179.83 2bkt h THR 311 N 0.23 0.62 0.21 0.00 2.02 -1.76 0.48 112.91 114.71 2bkt h THR 311 Ca 0.64 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.78 2bkt h THR 311 Cb 1.38 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 68.33 2bkt h THR 311 CO -0.66 0.01 -0.10 0.15 0.37 0.00 0.00 175.52 175.30 2bkt h PHE 312 N 0.07 -0.26 -0.98 3.16 3.57 -0.99 -3.28 116.94 118.23 2bkt h PHE 312 Ca 0.22 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.88 2bkt h PHE 312 Cb 0.33 0.09 -0.09 0.00 2.79 0.00 0.00 35.95 39.07 2bkt h PHE 312 CO -0.32 0.12 0.61 0.82 -2.23 0.00 0.00 178.31 177.31 2bkt h ILE 313 N -0.74 0.80 -0.94 1.41 2.04 -0.56 -1.40 117.51 118.12 2bkt h ILE 313 Ca -0.03 -0.28 0.16 0.00 1.00 0.00 0.00 64.86 65.71 2bkt h ILE 313 Cb 0.50 -0.08 -0.08 0.00 -0.74 0.00 0.00 36.82 36.41 2bkt h ILE 313 CO 0.05 0.15 0.60 0.03 0.00 0.00 0.00 178.15 178.97 2bkt h ARG 314 N 0.81 0.71 0.08 2.37 3.08 -0.11 -2.26 114.38 119.06 2bkt h ARG 314 Ca 0.52 -0.04 -0.32 0.00 0.07 0.00 0.00 59.98 60.21 2bkt h ARG 314 Cb 0.75 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 2bkt h ARG 314 CO -0.30 0.47 -1.76 -0.22 -1.07 0.00 0.00 179.97 177.09 2bkt h LYS 315 N 0.73 0.17 -4.54 0.04 3.64 -1.45 -3.43 116.57 111.72 2bkt h LYS 315 Ca 0.49 -0.29 -0.68 0.00 -1.27 0.00 0.00 60.65 58.91 2bkt h LYS 315 Cb 0.77 0.11 -0.37 0.00 -0.41 0.00 0.00 32.23 32.33 2bkt h LYS 315 CO -0.25 0.94 -0.63 -0.06 -2.27 0.00 0.00 179.45 177.18 2bkt s PHE 316 N -2.59 3.66 0.12 1.91 0.40 -0.61 0.54 117.98 121.41 2bkt s PHE 316 Ca -0.12 -2.71 -0.35 0.00 -0.60 0.00 0.00 56.93 53.15 2bkt s PHE 316 Cb 0.07 -3.08 -0.17 0.00 0.51 0.00 0.00 43.02 40.35 2bkt s PHE 316 CO 0.81 -0.96 1.11 0.98 0.70 0.00 0.00 175.22 177.86 2bkt n TYR 317 N 4.39 1.00 -5.18 0.36 4.19 0.14 -4.43 117.16 117.62 2bkt n TYR 317 Ca 0.01 0.79 -0.32 0.00 3.31 0.00 0.00 57.90 61.69 2bkt n TYR 317 Cb 0.41 -2.21 -0.15 0.00 0.49 0.00 0.00 39.34 37.88 2bkt n TYR 317 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 2bkt s THR 318 N -0.11 2.35 -0.11 2.97 2.01 -0.64 -1.04 115.64 121.07 2bkt s THR 318 Ca 0.78 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 61.83 2bkt s THR 318 Cb -0.97 -1.85 0.00 0.00 0.01 0.00 0.00 72.50 69.69 2bkt s THR 318 CO 0.53 0.58 -0.23 -0.70 -0.69 0.00 0.00 174.62 174.10 2bkt s GLU 319 N -0.59 3.01 -0.35 4.92 2.12 0.70 0.48 118.70 128.99 2bkt s GLU 319 Ca 0.09 -0.86 -0.09 0.00 0.36 0.00 0.00 54.97 54.46 2bkt s GLU 319 Cb -0.11 -2.30 0.02 0.00 0.26 0.00 0.00 34.13 32.01 2bkt s GLU 319 CO -0.00 0.14 0.16 -0.06 -0.54 0.00 0.00 175.26 174.96 2bkt s PHE 320 N 0.43 3.22 -0.39 5.30 0.40 0.10 0.39 117.98 127.44 2bkt s PHE 320 Ca -0.17 -0.99 -0.12 0.00 -0.60 0.00 0.00 56.93 55.05 2bkt s PHE 320 Cb -0.18 -2.37 0.03 0.00 0.51 0.00 0.00 43.02 41.01 2bkt s PHE 320 CO 0.07 -0.62 0.24 0.34 0.70 0.00 0.00 175.22 175.94 2bkt s ASP 321 N 1.53 5.86 -0.08 1.36 3.68 0.10 -1.62 116.67 127.50 2bkt s ASP 321 Ca 0.02 -0.98 -0.22 0.00 2.13 0.00 0.00 52.55 53.50 2bkt s ASP 321 Cb -0.19 -2.07 -0.18 0.00 -1.45 0.00 0.00 42.92 39.04 2bkt s ASP 321 CO 0.05 -0.41 0.82 0.03 0.13 0.00 0.00 175.17 175.79 2bkt h ARG 322 N 8.50 -0.10 -1.06 4.34 2.47 -1.25 -2.03 114.38 125.25 2bkt h ARG 322 Ca -0.26 0.01 0.28 0.00 -1.26 0.00 0.00 59.98 58.75 2bkt h ARG 322 Cb 1.11 0.02 -0.08 0.00 -1.65 0.00 0.00 29.97 29.37 2bkt h ARG 322 CO 0.69 0.46 0.70 -0.09 0.56 0.00 0.00 179.97 182.29 2bkt h ARG 323 N -0.86 0.29 -0.22 0.04 2.43 -1.92 -1.12 114.38 113.02 2bkt h ARG 323 Ca -0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2bkt h ARG 323 Cb 0.60 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 2bkt h ARG 323 CO 0.02 0.19 0.00 0.09 -1.51 0.00 0.00 179.97 178.76 2bkt n ASN 324 N -4.53 2.53 -4.04 -3.80 5.03 -1.25 -5.01 115.26 104.20 2bkt n ASN 324 Ca 0.25 -1.79 -0.28 0.00 0.87 0.00 0.00 54.58 53.63 2bkt n ASN 324 Cb 0.96 -0.14 -0.03 0.00 -1.02 0.00 0.00 39.78 39.55 2bkt n ASN 324 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2bkt n ASN 325 N 0.54 -0.95 -4.18 6.41 3.02 -0.43 -4.87 115.26 114.81 2bkt n ASN 325 Ca 0.09 -1.02 -0.11 0.00 -0.03 0.00 0.00 54.58 53.51 2bkt n ASN 325 Cb 0.37 -2.90 -0.10 0.00 -0.61 0.00 0.00 39.78 36.54 2bkt n ASN 325 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bkt s ARG 326 N -6.70 1.07 -0.07 3.52 1.04 -0.83 -0.75 118.95 116.24 2bkt s ARG 326 Ca 0.17 -1.54 0.03 0.00 -1.04 0.00 0.00 55.73 53.36 2bkt s ARG 326 Cb -0.09 0.22 0.01 0.00 -2.04 0.00 0.00 34.95 33.04 2bkt s ARG 326 CO 0.90 -0.31 -0.16 0.42 -0.04 0.00 0.00 175.30 176.11 2bkt s ILE 327 N -4.07 1.44 0.09 4.99 1.01 -0.12 -0.72 121.20 123.82 2bkt s ILE 327 Ca 0.31 -0.67 0.01 0.00 0.00 0.00 0.00 60.65 60.30 2bkt s ILE 327 Cb 0.07 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 2bkt s ILE 327 CO 0.07 0.42 0.21 -0.83 0.00 0.00 0.00 174.94 174.81 2bkt s GLY 328 N 0.42 2.01 -0.02 6.18 0.00 0.16 -1.13 107.32 114.94 2bkt s GLY 328 Ca -0.13 -0.94 0.01 0.00 0.00 0.00 0.00 44.72 43.66 2bkt s GLY 328 CO 0.05 -0.92 -0.01 -1.36 0.00 0.00 0.00 173.10 170.85 2bkt s PHE 329 N -1.57 0.28 0.02 1.90 2.99 -1.11 -0.21 117.98 120.27 2bkt s PHE 329 Ca 0.34 -0.01 -0.06 0.00 0.00 0.00 0.00 56.93 57.20 2bkt s PHE 329 Cb -0.12 -0.31 -0.01 0.00 0.00 0.00 0.00 43.02 42.58 2bkt s PHE 329 CO 0.27 -0.08 0.10 0.00 -0.00 0.00 0.00 175.22 175.50 2bkt s ALA 330 N 0.65 -0.17 -0.26 5.36 0.00 -0.21 -2.11 121.76 125.02 2bkt s ALA 330 Ca -0.06 -0.35 -0.33 0.00 0.00 0.00 0.00 51.96 51.21 2bkt s ALA 330 Cb -0.09 0.17 -0.10 0.00 0.00 0.00 0.00 23.12 23.10 2bkt s ALA 330 CO -0.01 -0.24 2.14 -0.11 0.00 0.00 0.00 175.76 177.54 2bkt n LEU 331 N 1.23 2.70 -4.76 0.00 0.00 -1.17 0.24 117.00 115.24 2bkt n LEU 331 Ca -0.22 0.46 -0.40 0.00 0.00 0.00 0.00 56.01 55.85 2bkt n LEU 331 Cb 0.56 -1.36 0.01 0.00 0.00 0.00 0.00 43.42 42.63 2bkt n LEU 331 CO 0.21 -0.59 1.07 0.00 0.00 0.00 0.00 177.39 178.08 2bkt n ALA 332 N 9.73 2.04 -0.42 1.96 0.00 0.19 -0.78 120.51 133.23 2bkt n ALA 332 Ca 0.34 0.28 0.00 0.00 0.00 0.00 0.00 53.44 54.06 2bkt n ALA 332 Cb 0.30 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.37 2bkt n ALA 332 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37