#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b3w h PRO 2 N 0.00 0.40 -4.00 3.17 0.11 -2.08 -3.44 132.00 126.15 2b3w h PRO 2 Ca 0.00 -0.28 -0.32 0.00 0.11 0.00 0.00 66.00 65.51 2b3w h PRO 2 Cb 0.00 0.04 -0.30 0.00 0.11 0.00 0.00 31.00 30.85 2b3w h PRO 2 CO 0.00 0.90 -0.75 0.54 -0.21 0.00 0.00 178.00 178.48 2b3w s VAL 3 N -3.80 0.28 -0.96 3.15 0.11 -1.26 -5.09 120.40 112.83 2b3w s VAL 3 Ca -0.06 -0.08 -0.20 0.00 -2.93 0.00 0.00 61.98 58.72 2b3w s VAL 3 Cb 0.11 -0.28 0.11 0.00 -1.53 0.00 0.00 36.38 34.79 2b3w s VAL 3 CO 0.83 0.11 1.22 -0.60 -3.33 0.00 0.00 175.10 173.32 2b3w s ARG 4 N 0.33 3.62 -0.04 1.54 3.52 -1.26 -4.83 118.95 121.83 2b3w s ARG 4 Ca -0.03 -1.64 -0.03 0.00 -0.13 0.00 0.00 55.73 53.90 2b3w s ARG 4 Cb -0.06 -5.03 -0.01 0.00 -1.56 0.00 0.00 34.95 28.29 2b3w s ARG 4 CO -0.01 -1.88 -0.06 0.00 -0.81 0.00 0.00 175.30 172.55 2b3w n ALA 5 N 7.08 0.15 -2.08 6.12 0.00 -1.26 -4.83 120.51 125.68 2b3w n ALA 5 Ca 0.27 -0.25 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 2b3w n ALA 5 Cb 0.49 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.92 2b3w n ALA 5 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2b3w s GLN 6 N -1.38 3.28 0.00 0.00 -0.44 -1.26 -4.65 119.66 115.21 2b3w s GLN 6 Ca -0.05 1.20 0.00 0.00 -2.50 0.00 0.00 55.36 54.01 2b3w s GLN 6 Cb 0.01 -4.19 0.00 0.00 -1.64 0.00 0.00 33.01 27.19 2b3w s GLN 6 CO 0.07 -1.92 0.00 2.89 0.50 0.00 0.00 175.29 176.83 2b3w n ARG 7 N 8.47 0.00 -3.63 1.67 1.85 -1.26 -5.03 116.66 118.73 2b3w n ARG 7 Ca 0.21 0.00 -0.39 0.00 -1.00 0.00 0.00 57.85 56.67 2b3w n ARG 7 Cb 0.48 -0.16 -0.09 0.00 -1.05 0.00 0.00 32.46 31.63 2b3w n ARG 7 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2b3w s ILE 8 N 0.00 3.91 0.04 8.89 -1.09 -1.26 -4.89 121.20 126.79 2b3w s ILE 8 Ca 0.00 -1.92 -0.04 0.00 -2.23 0.00 0.00 60.65 56.46 2b3w s ILE 8 Cb 0.00 -3.60 -0.28 0.00 -1.58 0.00 0.00 42.46 36.99 2b3w s ILE 8 CO 0.00 -0.76 1.01 0.06 -1.23 0.00 0.00 174.94 174.02 2b3w h GLN 9 N 8.27 0.27 -0.79 2.79 3.07 -1.95 -3.47 115.11 123.30 2b3w h GLN 9 Ca -0.17 -0.46 0.20 0.00 0.09 0.00 0.00 58.65 58.30 2b3w h GLN 9 Cb 1.06 0.17 -0.25 0.00 0.08 0.00 0.00 27.48 28.54 2b3w h GLN 9 CO 0.80 1.18 0.34 -1.58 0.09 0.00 0.00 178.83 179.66 2b3w s HIS 10 N -2.64 -0.48 0.20 0.06 5.04 -1.26 -5.15 115.29 111.07 2b3w s HIS 10 Ca -0.06 0.84 -0.30 0.00 -1.54 0.00 0.00 55.06 54.00 2b3w s HIS 10 Cb 0.07 0.29 -0.08 0.00 0.04 0.00 0.00 32.58 32.89 2b3w s HIS 10 CO 0.87 -0.24 1.22 0.14 -2.34 0.00 0.00 174.74 174.39 2b3w s VAL 11 N 2.22 3.46 -1.59 0.89 -7.23 -1.26 -4.91 120.40 111.98 2b3w s VAL 11 Ca -0.02 1.25 0.00 0.00 -1.81 0.00 0.00 61.98 61.39 2b3w s VAL 11 Cb -0.04 -3.79 0.00 0.00 0.56 0.00 0.00 36.38 33.10 2b3w s VAL 11 CO -0.17 0.21 0.78 1.15 -0.31 0.00 0.00 175.10 176.76 2b3w n MET 12 N 2.38 0.98 -0.77 4.82 0.00 -1.26 -4.98 117.12 118.29 2b3w n MET 12 Ca 0.04 0.00 0.09 0.00 0.00 0.00 0.00 57.70 57.83 2b3w n MET 12 Cb 0.44 -1.20 -0.05 0.00 0.00 0.00 0.00 33.22 32.41 2b3w n MET 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 2b3w n GLN 13 N -0.29 -1.79 -2.41 3.17 1.13 -1.26 -4.82 117.38 111.10 2b3w n GLN 13 Ca 0.00 1.46 -0.12 0.00 -1.94 0.00 0.00 57.00 56.41 2b3w n GLN 13 Cb 0.10 -2.07 -0.01 0.00 0.11 0.00 0.00 30.24 28.37 2b3w n GLN 13 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2b3w n ASP 14 N -3.19 -3.72 -4.67 1.08 9.92 -1.26 -4.89 116.55 109.83 2b3w n ASP 14 Ca -0.05 0.22 -0.41 0.00 -0.53 0.00 0.00 54.79 54.02 2b3w n ASP 14 Cb 0.36 -3.18 -0.05 0.00 -0.64 0.00 0.00 41.12 37.61 2b3w n ASP 14 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2b3w s THR 15 N -2.56 4.96 -0.27 -3.53 2.01 -1.26 -5.00 115.64 109.99 2b3w s THR 15 Ca 0.00 1.40 -0.05 0.00 0.31 0.00 0.00 61.69 63.35 2b3w s THR 15 Cb 0.00 -4.04 0.01 0.00 0.01 0.00 0.00 72.50 68.49 2b3w s THR 15 CO 0.00 0.09 0.03 -0.63 -0.69 0.00 0.00 174.62 173.42 2b3w s ILE 16 N 1.88 3.59 -0.52 1.82 1.01 -1.26 -0.58 121.20 127.15 2b3w s ILE 16 Ca 0.34 -0.77 -0.22 0.00 0.00 0.00 0.00 60.65 60.00 2b3w s ILE 16 Cb -0.16 -2.83 0.05 0.00 0.01 0.00 0.00 42.46 39.53 2b3w s ILE 16 CO 0.12 0.15 0.79 -0.63 0.00 0.00 0.00 174.94 175.37 2b3w s ILE 17 N 1.45 4.62 -0.19 2.92 1.01 0.67 -4.94 121.20 126.73 2b3w s ILE 17 Ca 0.02 -0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.59 2b3w s ILE 17 Cb -0.17 -4.41 -0.03 0.00 0.01 0.00 0.00 42.46 37.86 2b3w s ILE 17 CO -0.00 -0.94 0.02 0.21 0.00 0.00 0.00 174.94 174.23 2b3w s ASN 18 N 2.69 5.14 0.23 3.58 3.84 -1.24 -2.30 114.94 126.88 2b3w s ASN 18 Ca 0.24 -0.09 0.02 0.00 0.21 0.00 0.00 52.86 53.24 2b3w s ASN 18 Cb -0.15 -1.88 -0.01 0.00 -0.55 0.00 0.00 41.25 38.66 2b3w s ASN 18 CO 0.17 0.11 0.07 2.22 -2.79 0.00 0.00 177.10 176.87 2b3w n PHE 19 N 3.96 0.17 -3.53 0.43 -1.74 -1.25 -4.97 117.46 110.54 2b3w n PHE 19 Ca -0.17 -1.41 -0.24 0.00 -0.56 0.00 0.00 57.45 55.08 2b3w n PHE 19 Cb 0.52 -0.03 -0.14 0.00 1.52 0.00 0.00 39.48 41.34 2b3w n PHE 19 CO 0.00 0.00 0.00 0.71 -0.56 0.00 0.00 176.76 176.91 2b3w s TYR 20 N -2.30 0.04 0.00 2.97 2.02 -1.26 -3.79 117.35 115.02 2b3w s TYR 20 Ca 0.09 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.40 2b3w s TYR 20 Cb 0.00 -0.67 0.00 0.00 -0.40 0.00 0.00 41.96 40.90 2b3w s TYR 20 CO 0.07 -0.71 0.00 -1.13 -1.57 0.00 0.00 175.55 172.20 2b3w n SER 21 N 5.28 -3.41 -0.05 2.29 3.41 -1.26 -4.52 113.62 115.35 2b3w n SER 21 Ca -0.06 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.54 2b3w n SER 21 Cb 0.46 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.40 2b3w n SER 21 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2b3w h THR 22 N 0.00 0.09 0.00 6.66 2.02 -1.92 -3.36 112.91 116.40 2b3w h THR 22 Ca 0.00 -1.07 0.00 0.00 0.77 0.00 0.00 66.41 66.11 2b3w h THR 22 Cb 0.00 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.58 2b3w h THR 22 CO 0.00 0.03 0.00 -0.24 0.37 0.00 0.00 175.52 175.68 2b3w n SER 23 N -4.74 0.00 0.04 4.18 2.88 -1.26 -2.68 113.62 112.03 2b3w n SER 23 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2b3w n SER 23 Cb 0.07 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 2b3w n SER 23 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2b3w n ASP 24 N 6.03 -0.23 0.00 -3.46 8.00 -1.26 -5.01 116.55 120.61 2b3w n ASP 24 Ca 0.00 0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.63 2b3w n ASP 24 Cb 0.00 0.34 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 2b3w n ASP 24 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2b3w n ASP 25 N -2.71 0.00 -0.35 -2.24 -0.08 -1.26 -4.49 116.55 105.42 2b3w n ASP 25 Ca 0.00 0.03 0.14 0.00 -1.51 0.00 0.00 54.79 53.45 2b3w n ASP 25 Cb 0.00 -0.03 0.52 0.00 2.34 0.00 0.00 41.12 43.95 2b3w n ASP 25 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2b3w n TYR 26 N -0.64 0.00 0.66 -0.67 9.36 -1.26 -4.15 117.16 120.46 2b3w n TYR 26 Ca 0.00 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.27 2b3w n TYR 26 Cb 0.00 -0.05 0.32 0.00 -0.63 0.00 0.00 39.34 38.98 2b3w n TYR 26 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2b3w n GLY 27 N 1.22 -0.37 0.45 2.98 0.00 -1.09 -3.35 105.19 105.02 2b3w n GLY 27 Ca 0.17 -0.07 0.26 0.00 0.00 0.00 0.00 46.02 46.39 2b3w n GLY 27 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2b3w h ASP 28 N 0.00 0.16 0.79 1.61 3.58 -1.78 0.24 116.42 121.03 2b3w h ASP 28 Ca 0.00 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2b3w h ASP 28 Cb 0.01 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2b3w h ASP 28 CO 0.00 0.05 0.00 0.49 -2.88 0.00 0.00 179.24 176.90 2b3w n PHE 29 N -4.37 0.46 -2.56 0.28 3.01 -1.21 -4.67 117.46 108.39 2b3w n PHE 29 Ca 0.20 0.17 -0.42 0.00 1.01 0.00 0.00 57.45 58.41 2b3w n PHE 29 Cb 0.92 -0.77 -0.03 0.00 -0.01 0.00 0.00 39.48 39.59 2b3w n PHE 29 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2b3w s SER 30 N -3.72 7.17 0.62 4.37 1.04 0.07 -4.90 113.70 118.36 2b3w s SER 30 Ca 0.07 1.74 0.27 0.00 0.48 0.00 0.00 55.95 58.51 2b3w s SER 30 Cb 0.11 -2.56 1.40 0.00 0.10 0.00 0.00 66.02 65.07 2b3w s SER 30 CO 0.39 -0.47 1.81 -0.55 0.98 0.00 0.00 173.24 175.40 2b3w h ASN 31 N 7.14 0.00 0.68 7.02 7.08 -1.87 -0.09 115.58 135.54 2b3w h ASN 31 Ca -0.36 0.00 -0.03 0.00 -3.08 0.00 0.00 56.30 52.83 2b3w h ASN 31 Cb 1.18 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 37.42 2b3w h ASN 31 CO 0.84 0.00 -0.33 0.15 -2.08 0.00 0.00 177.43 176.01 2b3w h PHE 32 N 0.00 -0.85 0.00 4.14 3.57 -1.92 -3.30 116.94 118.58 2b3w h PHE 32 Ca 0.13 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.61 2b3w h PHE 32 Cb 1.14 0.28 0.00 0.00 2.79 0.00 0.00 35.95 40.16 2b3w h PHE 32 CO 0.00 -0.53 0.00 0.00 -2.23 0.00 0.00 178.31 175.55 2b3w n ALA 33 N -2.53 0.00 -2.71 2.41 0.00 -0.05 -4.16 120.51 113.47 2b3w n ALA 33 Ca -0.11 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.26 2b3w n ALA 33 Cb 0.36 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.89 2b3w n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b3w n ALA 34 N 1.88 -2.00 -3.81 0.00 0.00 -1.26 -4.95 120.51 110.37 2b3w n ALA 34 Ca 0.00 -1.03 -0.25 0.00 0.00 0.00 0.00 53.44 52.16 2b3w n ALA 34 Cb 0.00 -1.97 -0.17 0.00 0.00 0.00 0.00 19.45 17.31 2b3w n ALA 34 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2b3w s TRP 35 N 0.37 1.25 0.14 0.00 0.52 -1.19 -4.95 118.94 115.09 2b3w s TRP 35 Ca 0.27 -0.56 -0.32 0.00 0.02 0.00 0.00 56.10 55.51 2b3w s TRP 35 Cb 0.25 -1.08 -0.11 0.00 -1.15 0.00 0.00 33.47 31.37 2b3w s TRP 35 CO -0.16 -0.43 1.80 -0.35 0.02 0.00 0.00 176.95 177.83 2b3w n PRO 36 N 4.82 2.75 -4.45 4.98 -0.04 -1.15 -3.38 135.00 138.52 2b3w n PRO 36 Ca -0.13 1.00 -0.25 0.00 -0.04 0.00 0.00 63.50 64.07 2b3w n PRO 36 Cb 0.50 -2.87 -0.11 0.00 -0.04 0.00 0.00 33.50 30.98 2b3w n PRO 36 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2b3w s ILE 37 N 2.28 2.45 -0.43 0.52 -4.36 0.14 -4.92 121.20 116.88 2b3w s ILE 37 Ca 0.80 -2.25 0.03 0.00 -0.26 0.00 0.00 60.65 58.97 2b3w s ILE 37 Cb -0.50 -2.24 0.12 0.00 1.25 0.00 0.00 42.46 41.08 2b3w s ILE 37 CO 0.36 -0.29 0.16 -0.75 0.24 0.00 0.00 174.94 174.67 2b3w s LYS 38 N -3.19 1.76 0.01 0.37 2.47 -1.26 -0.70 119.74 119.20 2b3w s LYS 38 Ca 0.26 -2.22 0.04 0.00 -1.56 0.00 0.00 55.97 52.49 2b3w s LYS 38 Cb -0.06 -3.29 -0.01 0.00 -1.46 0.00 0.00 37.83 33.00 2b3w s LYS 38 CO 0.13 -1.03 -0.12 0.08 0.16 0.00 0.00 175.35 174.57 2b3w s VAL 39 N 0.36 0.95 -1.01 4.02 1.01 -0.63 -4.70 120.40 120.40 2b3w s VAL 39 Ca 0.14 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.44 2b3w s VAL 39 Cb -0.22 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.33 2b3w s VAL 39 CO -0.04 0.14 0.00 -0.67 0.00 0.00 0.00 175.10 174.53 2b3w n ASP 40 N 2.45 -4.72 -0.70 3.32 2.03 -1.26 -0.54 116.55 117.14 2b3w n ASP 40 Ca -0.16 0.24 -0.08 0.00 0.52 0.00 0.00 54.79 55.31 2b3w n ASP 40 Cb 0.56 -3.05 -0.03 0.00 -0.72 0.00 0.00 41.12 37.87 2b3w n ASP 40 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2b3w n GLY 41 N -1.06 0.79 3.35 0.27 0.00 -1.26 -5.02 105.19 102.26 2b3w n GLY 41 Ca -0.10 -0.64 -0.27 0.00 0.00 0.00 0.00 46.02 45.01 2b3w n GLY 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2b3w s LYS 42 N -3.08 1.31 -0.37 1.61 2.47 0.30 -5.11 119.74 116.87 2b3w s LYS 42 Ca 0.00 -1.28 -0.17 0.00 -1.56 0.00 0.00 55.97 52.96 2b3w s LYS 42 Cb 0.00 -1.72 0.00 0.00 -1.46 0.00 0.00 37.83 34.65 2b3w s LYS 42 CO 0.00 0.41 0.47 0.99 0.16 0.00 0.00 175.35 177.38 2b3w s THR 43 N -1.09 5.05 -0.20 3.43 2.01 -1.26 -1.61 115.64 121.97 2b3w s THR 43 Ca 0.11 0.10 -0.04 0.00 0.31 0.00 0.00 61.69 62.17 2b3w s THR 43 Cb -0.10 -3.97 -0.02 0.00 0.01 0.00 0.00 72.50 68.42 2b3w s THR 43 CO 0.05 -0.27 -0.02 0.26 -0.69 0.00 0.00 174.62 173.95 2b3w s TRP 44 N 2.29 3.00 -0.64 4.92 0.52 0.13 -4.97 118.94 124.19 2b3w s TRP 44 Ca 0.16 -0.62 0.08 0.00 0.02 0.00 0.00 56.10 55.75 2b3w s TRP 44 Cb -0.16 -2.08 0.44 0.00 -1.15 0.00 0.00 33.47 30.52 2b3w s TRP 44 CO 0.14 -0.34 1.23 -2.30 0.02 0.00 0.00 176.95 175.70 2b3w n PRO 45 N 4.38 0.05 0.00 4.98 -0.02 -1.26 0.25 135.00 143.38 2b3w n PRO 45 Ca -0.17 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 2b3w n PRO 45 Cb 0.52 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 2b3w n PRO 45 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2b3w n THR 46 N -1.77 0.00 -0.35 3.45 5.66 -1.22 -2.95 114.28 117.10 2b3w n THR 46 Ca -0.01 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 60.97 2b3w n THR 46 Cb 0.04 0.00 0.11 0.00 -1.55 0.00 0.00 70.33 68.93 2b3w n THR 46 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 2b3w h SER 47 N 0.00 1.08 -0.90 1.09 4.64 -1.75 -1.93 113.55 115.77 2b3w h SER 47 Ca 0.00 -0.02 0.22 0.00 -0.47 0.00 0.00 61.79 61.51 2b3w h SER 47 Cb 0.00 -0.26 -0.12 0.00 -0.31 0.00 0.00 62.40 61.70 2b3w h SER 47 CO 0.00 0.77 0.40 -0.08 -0.87 0.00 0.00 176.83 177.05 2b3w h GLU 48 N 1.27 0.40 -0.58 4.77 4.57 -1.72 0.30 114.58 123.59 2b3w h GLU 48 Ca 0.36 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.45 2b3w h GLU 48 Cb -0.12 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.36 2b3w h GLU 48 CO -0.09 0.27 0.14 0.45 -1.18 0.00 0.00 179.01 178.60 2b3w h HIS 49 N 0.42 0.98 -0.25 0.92 3.86 -1.69 0.32 115.15 119.71 2b3w h HIS 49 Ca 0.56 -0.12 -0.11 0.00 -1.16 0.00 0.00 60.37 59.54 2b3w h HIS 49 Cb 1.05 -0.28 -0.00 0.00 1.06 0.00 0.00 27.41 29.24 2b3w h HIS 49 CO -0.13 0.84 -0.26 -0.92 0.86 0.00 0.00 177.93 178.32 2b3w h TYR 50 N 0.84 0.74 -0.71 2.45 3.20 -1.32 0.32 116.97 122.49 2b3w h TYR 50 Ca 0.18 -0.23 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 2b3w h TYR 50 Cb 0.35 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 2b3w h TYR 50 CO 0.03 0.94 0.41 0.35 -1.64 0.00 0.00 178.16 178.24 2b3w h PHE 51 N 0.32 0.96 -0.20 -3.82 3.57 -0.77 0.15 116.94 117.15 2b3w h PHE 51 Ca 0.04 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 2b3w h PHE 51 Cb 0.83 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.25 2b3w h PHE 51 CO 0.08 0.66 -0.13 0.37 -2.23 0.00 0.00 178.31 177.06 2b3w h GLN 52 N 0.97 0.44 -0.16 1.11 5.75 -0.28 -1.74 115.11 121.20 2b3w h GLN 52 Ca 0.25 -0.20 -0.02 0.00 -0.15 0.00 0.00 58.65 58.52 2b3w h GLN 52 Cb 0.01 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 2b3w h GLN 52 CO -0.04 0.75 0.01 0.00 -2.65 0.00 0.00 178.83 176.89 2b3w h ALA 53 N 0.68 0.22 0.00 3.38 0.00 -0.75 -2.85 119.26 119.93 2b3w h ALA 53 Ca 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2b3w h ALA 53 Cb 0.63 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2b3w h ALA 53 CO 0.03 -0.09 0.00 1.04 0.00 0.00 0.00 179.25 180.24 2b3w n GLN 54 N -4.75 0.18 0.03 0.00 3.00 0.03 -2.15 117.38 113.72 2b3w n GLN 54 Ca -0.05 0.27 0.06 0.00 -0.01 0.00 0.00 57.00 57.28 2b3w n GLN 54 Cb 0.21 -1.76 0.48 0.00 0.00 0.00 0.00 30.24 29.16 2b3w n GLN 54 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 2b3w h LYS 55 N 0.00 0.41 -6.17 -1.09 3.64 -1.06 -3.44 116.57 108.86 2b3w h LYS 55 Ca 0.00 -0.02 -0.50 0.00 -1.27 0.00 0.00 60.65 58.85 2b3w h LYS 55 Cb 0.52 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.21 2b3w h LYS 55 CO 0.00 0.27 -0.43 -0.06 -2.27 0.00 0.00 179.45 176.96 2b3w s PHE 56 N -5.39 2.80 -0.45 1.91 0.08 -0.91 -4.46 117.98 111.56 2b3w s PHE 56 Ca -0.07 -0.39 0.07 0.00 0.12 0.00 0.00 56.93 56.66 2b3w s PHE 56 Cb 0.18 -1.92 0.20 0.00 -0.57 0.00 0.00 43.02 40.91 2b3w s PHE 56 CO 0.72 0.09 1.16 1.47 -0.10 0.00 0.00 175.22 178.56 2b3w n LEU 57 N -1.41 2.59 -4.64 -0.37 -0.00 -1.26 -4.97 117.00 106.94 2b3w n LEU 57 Ca -0.00 -2.14 -0.38 0.00 -0.00 0.00 0.00 56.01 53.49 2b3w n LEU 57 Cb 0.61 -0.17 -0.09 0.00 -0.00 0.00 0.00 43.42 43.76 2b3w n LEU 57 CO 0.43 0.63 -0.03 -0.62 -0.00 0.00 0.00 177.39 177.80 2b3w s ASP 58 N -1.19 6.24 0.17 1.45 2.15 -1.26 -4.98 116.67 119.25 2b3w s ASP 58 Ca 0.16 0.27 -0.10 0.00 0.43 0.00 0.00 52.55 53.31 2b3w s ASP 58 Cb 0.10 -2.17 0.04 0.00 -0.30 0.00 0.00 42.92 40.58 2b3w s ASP 58 CO 0.08 -0.06 1.59 -0.33 -0.17 0.00 0.00 175.17 176.29 2b3w h GLU 59 N 7.74 1.04 0.38 4.34 4.39 -1.97 0.35 114.58 130.85 2b3w h GLU 59 Ca -0.35 -0.38 -0.02 0.00 0.34 0.00 0.00 59.36 58.94 2b3w h GLU 59 Cb 1.17 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 2b3w h GLU 59 CO 0.66 1.07 -0.18 -0.22 -1.16 0.00 0.00 179.01 179.18 2b3w h LYS 60 N 0.92 -0.49 -0.17 2.33 3.64 -1.99 -1.69 116.57 119.12 2b3w h LYS 60 Ca 0.14 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.48 2b3w h LYS 60 Cb 0.67 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 2b3w h LYS 60 CO 0.05 -0.32 -0.24 -0.92 -2.27 0.00 0.00 179.45 175.75 2b3w h TYR 61 N -0.52 0.33 -0.06 1.91 3.20 -1.96 0.28 116.97 120.15 2b3w h TYR 61 Ca -0.05 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.76 2b3w h TYR 61 Cb 0.40 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 2b3w h TYR 61 CO -0.05 0.53 0.04 -0.09 -1.64 0.00 0.00 178.16 176.94 2b3w h ARG 62 N 0.27 0.08 0.00 1.82 2.43 -0.71 0.31 114.38 118.58 2b3w h ARG 62 Ca 0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2b3w h ARG 62 Cb 0.58 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 2b3w h ARG 62 CO 0.04 0.08 0.00 1.49 -1.51 0.00 0.00 179.97 180.07 2b3w h GLU 63 N 0.05 0.00 -0.08 0.20 4.81 -1.02 -2.09 114.58 116.45 2b3w h GLU 63 Ca 0.02 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.01 2b3w h GLU 63 Cb 0.02 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.42 2b3w h GLU 63 CO -0.00 0.00 -0.89 1.49 -0.73 0.00 0.00 179.01 178.88 2b3w h GLU 64 N 0.00 0.73 0.00 1.92 4.81 -0.35 -0.60 114.58 121.09 2b3w h GLU 64 Ca 0.00 -0.69 -0.06 0.00 -0.13 0.00 0.00 59.36 58.48 2b3w h GLU 64 Cb 0.70 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 2b3w h GLU 64 CO 0.00 1.28 -0.30 0.82 -0.73 0.00 0.00 179.01 180.08 2b3w h ILE 65 N 0.44 0.80 0.00 2.32 2.04 -0.75 -1.64 117.51 120.72 2b3w h ILE 65 Ca -0.09 -1.25 -0.04 0.00 1.00 0.00 0.00 64.86 64.48 2b3w h ILE 65 Cb 1.53 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 39.38 2b3w h ILE 65 CO 0.18 0.30 -0.18 -0.09 0.00 0.00 0.00 178.15 178.36 2b3w h ARG 66 N 0.00 0.00 0.00 2.37 2.43 -1.21 -3.25 114.38 114.72 2b3w h ARG 66 Ca -0.00 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 58.95 2b3w h ARG 66 Cb 0.75 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.27 2b3w h ARG 66 CO 0.04 0.18 -1.07 -0.09 -1.51 0.00 0.00 179.97 177.52 2b3w h ARG 67 N 0.00 0.00 -6.35 0.20 2.43 -0.16 -3.45 114.38 107.05 2b3w h ARG 67 Ca -0.00 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.62 2b3w h ARG 67 Cb 0.99 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.52 2b3w h ARG 67 CO 0.02 0.95 0.64 0.54 -1.51 0.00 0.00 179.97 180.61 2b3w s VAL 68 N -2.70 4.29 0.06 0.20 0.11 -0.95 -4.93 120.40 116.48 2b3w s VAL 68 Ca 0.00 1.62 -0.16 0.00 -2.93 0.00 0.00 61.98 60.52 2b3w s VAL 68 Cb 0.10 -4.04 -0.19 0.00 -1.53 0.00 0.00 36.38 30.71 2b3w s VAL 68 CO 0.82 0.04 1.22 0.28 -3.33 0.00 0.00 175.10 174.13 2b3w h SER 69 N 7.25 0.78 -3.01 3.54 0.02 -1.88 -3.44 113.55 116.80 2b3w h SER 69 Ca -0.36 -0.68 -0.53 0.00 -0.84 0.00 0.00 61.79 59.38 2b3w h SER 69 Cb 1.18 -0.23 0.02 0.00 0.14 0.00 0.00 62.40 63.51 2b3w h SER 69 CO 0.85 1.34 0.72 -0.55 -1.14 0.00 0.00 176.83 178.06 2b3w s SER 70 N -6.97 6.83 0.35 3.07 0.15 -1.26 -4.91 113.70 110.96 2b3w s SER 70 Ca -0.11 2.33 0.18 0.00 0.70 0.00 0.00 55.95 59.04 2b3w s SER 70 Cb 0.06 -2.59 0.57 0.00 -1.71 0.00 0.00 66.02 62.36 2b3w s SER 70 CO 0.87 -0.65 1.68 -0.65 1.20 0.00 0.00 173.24 175.69 2b3w h PRO 71 N 6.78 0.00 -0.23 5.44 0.11 -1.93 -3.15 132.00 139.01 2b3w h PRO 71 Ca -0.42 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.57 2b3w h PRO 71 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2b3w h PRO 71 CO 0.86 0.41 -0.31 1.98 -0.21 0.00 0.00 178.00 180.73 2b3w h MET 72 N 0.00 0.62 -0.31 1.05 4.05 -1.97 -1.41 114.93 116.96 2b3w h MET 72 Ca -0.00 -0.36 -0.05 0.00 -0.28 0.00 0.00 59.70 59.01 2b3w h MET 72 Cb 0.99 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.80 2b3w h MET 72 CO 0.05 0.96 -0.01 0.28 0.23 0.00 0.00 176.91 178.43 2b3w h VAL 73 N 0.32 1.19 -0.04 -5.77 2.07 -1.97 -0.25 116.25 111.80 2b3w h VAL 73 Ca 0.03 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 2b3w h VAL 73 Cb 0.88 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2b3w h VAL 73 CO 0.07 0.26 0.02 0.00 0.02 0.00 0.00 177.57 177.94 2b3w h ALA 74 N 1.53 0.05 -0.74 1.67 0.00 -1.45 -1.18 119.26 119.15 2b3w h ALA 74 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2b3w h ALA 74 Cb 0.32 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2b3w h ALA 74 CO 0.01 -0.37 0.48 0.00 0.00 0.00 0.00 179.25 179.37 2b3w h ALA 75 N 0.86 1.45 -0.35 0.00 0.00 -0.93 -1.33 119.26 118.97 2b3w h ALA 75 Ca 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2b3w h ALA 75 Cb 0.16 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2b3w h ALA 75 CO -0.00 0.50 0.11 -0.09 0.00 0.00 0.00 179.25 179.77 2b3w h ARG 76 N 1.01 0.49 0.05 0.00 9.65 -0.68 -0.11 114.38 124.79 2b3w h ARG 76 Ca 0.27 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 59.08 2b3w h ARG 76 Cb -0.10 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 28.39 2b3w h ARG 76 CO -0.06 0.43 -0.02 0.52 2.80 0.00 0.00 179.97 183.64 2b3w h MET 77 N 0.49 -0.06 -0.25 0.20 2.86 -0.05 -3.25 114.93 114.87 2b3w h MET 77 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2b3w h MET 77 Cb 0.14 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.82 2b3w h MET 77 CO -0.01 0.22 0.00 0.41 1.06 0.00 0.00 176.91 178.59 2b3w n GLY 78 N -0.34 0.90 0.21 8.32 0.00 -1.07 -4.00 105.19 109.21 2b3w n GLY 78 Ca -0.08 -0.56 0.08 0.00 0.00 0.00 0.00 46.02 45.46 2b3w n GLY 78 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2b3w h ARG 79 N 3.26 0.00 -5.38 1.61 9.65 -1.05 -3.42 114.38 119.06 2b3w h ARG 79 Ca 0.00 0.00 -0.61 0.00 -1.10 0.00 0.00 59.98 58.27 2b3w h ARG 79 Cb 0.71 0.00 -0.11 0.00 -1.39 0.00 0.00 29.97 29.19 2b3w h ARG 79 CO 0.00 0.29 -0.46 0.16 2.80 0.00 0.00 179.97 182.76 2b3w s ASP 80 N -6.32 6.28 -0.43 -3.80 -4.77 -1.26 -4.99 116.67 101.39 2b3w s ASP 80 Ca 0.00 0.32 0.05 0.00 -3.30 0.00 0.00 52.55 49.62 2b3w s ASP 80 Cb 0.11 -2.10 0.65 0.00 -1.09 0.00 0.00 42.92 40.49 2b3w s ASP 80 CO 0.66 0.21 1.87 0.54 0.70 0.00 0.00 175.17 179.15 2b3w n ARG 81 N 3.22 2.24 -0.12 2.11 1.74 -1.26 -4.33 116.66 120.26 2b3w n ARG 81 Ca -0.16 -3.03 0.01 0.00 -0.77 0.00 0.00 57.85 53.90 2b3w n ARG 81 Cb 0.53 -2.14 0.05 0.00 -1.02 0.00 0.00 32.46 29.88 2b3w n ARG 81 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2b3w n SER 82 N -1.13 1.62 -4.95 0.55 3.41 -1.26 -4.85 113.62 107.01 2b3w n SER 82 Ca 0.57 -2.12 -0.24 0.00 -0.26 0.00 0.00 58.87 56.82 2b3w n SER 82 Cb 1.61 -0.51 0.05 0.00 -0.26 0.00 0.00 64.21 65.10 2b3w n SER 82 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2b3w s LYS 83 N -1.26 2.39 0.53 4.33 -0.14 -1.26 -4.98 119.74 119.36 2b3w s LYS 83 Ca 0.07 -0.50 0.18 0.00 -1.36 0.00 0.00 55.97 54.37 2b3w s LYS 83 Cb 0.06 -2.33 1.36 0.00 -1.68 0.00 0.00 37.83 35.24 2b3w s LYS 83 CO 0.02 -0.96 2.16 -1.00 -0.76 0.00 0.00 175.35 174.81 2b3w h PRO 84 N -0.26 0.00 0.00 -1.68 0.13 -1.99 -3.48 132.00 124.72 2b3w h PRO 84 Ca -0.43 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.80 2b3w h PRO 84 Cb 1.30 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 2b3w h PRO 84 CO 0.56 0.01 -0.13 1.28 -0.23 0.00 0.00 178.00 179.49 2b3w n LEU 85 N -4.40 0.00 -4.02 1.56 4.77 -1.26 -4.95 117.00 108.69 2b3w n LEU 85 Ca -0.03 0.39 -0.17 0.00 -0.03 0.00 0.00 56.01 56.17 2b3w n LEU 85 Cb 0.09 -1.11 -0.14 0.00 -2.33 0.00 0.00 43.42 39.94 2b3w n LEU 85 CO 0.33 -1.27 -0.42 -0.60 -1.33 0.00 0.00 177.39 174.10 2b3w s ARG 86 N -0.71 0.62 0.00 3.23 3.52 -1.26 -4.78 118.95 119.57 2b3w s ARG 86 Ca 0.00 -0.40 -0.05 0.00 -0.13 0.00 0.00 55.73 55.16 2b3w s ARG 86 Cb 0.00 -0.57 -0.03 0.00 -1.56 0.00 0.00 34.95 32.80 2b3w s ARG 86 CO 0.00 0.15 0.85 0.87 -0.81 0.00 0.00 175.30 176.36 2b3w h LYS 87 N 5.61 -0.16 -0.98 5.12 1.57 -1.96 -3.22 116.57 122.55 2b3w h LYS 87 Ca -0.31 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.45 2b3w h LYS 87 Cb 1.19 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.52 2b3w h LYS 87 CO 0.48 -0.11 0.04 0.09 -0.57 0.00 0.00 179.45 179.38 2b3w n ASN 88 N -2.55 2.42 0.06 0.86 4.13 -1.26 -3.98 115.26 114.94 2b3w n ASN 88 Ca -0.02 -2.13 0.04 0.00 1.68 0.00 0.00 54.58 54.15 2b3w n ASN 88 Cb 0.07 -0.53 0.44 0.00 -1.54 0.00 0.00 39.78 38.22 2b3w n ASN 88 CO 0.00 0.00 0.00 -0.25 0.28 0.00 0.00 177.26 177.29 2b3w h TRP 89 N 0.22 0.39 -0.75 3.10 2.91 -1.95 -2.52 115.95 117.35 2b3w h TRP 89 Ca 0.04 -0.00 0.10 0.00 1.13 0.00 0.00 58.89 60.16 2b3w h TRP 89 Cb 0.97 -0.13 -0.05 0.00 -0.51 0.00 0.00 29.16 29.44 2b3w h TRP 89 CO 0.14 0.30 0.50 1.49 -1.03 0.00 0.00 178.44 179.83 2b3w h GLU 90 N 0.41 0.61 -0.00 2.65 4.81 -1.85 -2.31 114.58 118.89 2b3w h GLU 90 Ca 0.10 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2b3w h GLU 90 Cb 0.05 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.29 2b3w h GLU 90 CO -0.01 0.40 -0.85 -1.13 -0.73 0.00 0.00 179.01 176.69 2b3w n SER 91 N -4.50 1.29 -0.58 1.04 3.41 -0.96 -4.30 113.62 109.01 2b3w n SER 91 Ca 0.13 -1.14 0.07 0.00 -0.26 0.00 0.00 58.87 57.66 2b3w n SER 91 Cb 0.36 0.85 0.08 0.00 -0.26 0.00 0.00 64.21 65.24 2b3w n SER 91 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2b3w n VAL 92 N -1.08 0.18 0.21 -3.33 0.24 -0.91 -4.42 118.33 109.23 2b3w n VAL 92 Ca 0.05 -0.59 -0.16 0.00 -2.04 0.00 0.00 64.34 61.61 2b3w n VAL 92 Cb 0.37 1.14 -0.08 0.00 -1.47 0.00 0.00 33.84 33.80 2b3w n VAL 92 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2b3w h LYS 93 N 2.62 -0.76 0.00 7.34 1.57 -1.65 0.17 116.57 125.86 2b3w h LYS 93 Ca 0.00 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2b3w h LYS 93 Cb 0.60 0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.08 2b3w h LYS 93 CO 0.00 -0.50 0.00 -0.85 -0.57 0.00 0.00 179.45 177.53 2b3w n GLU 94 N -5.49 0.26 0.01 3.15 0.00 -1.26 -2.35 120.64 114.96 2b3w n GLU 94 Ca -0.10 0.26 -0.12 0.00 0.00 0.00 0.00 57.16 57.21 2b3w n GLU 94 Cb 0.40 -1.83 -0.09 0.00 0.00 0.00 0.00 31.44 29.91 2b3w n GLU 94 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 2b3w h GLN 95 N 0.00 -0.11 -0.88 3.44 4.15 -1.60 -0.86 115.11 119.25 2b3w h GLN 95 Ca 0.00 0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.47 2b3w h GLN 95 Cb 0.68 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 28.34 2b3w h GLN 95 CO 0.00 0.43 0.56 0.28 -1.93 0.00 0.00 178.83 178.17 2b3w h VAL 96 N -0.77 1.13 -0.88 2.39 2.07 -0.69 -1.00 116.25 118.50 2b3w h VAL 96 Ca -0.01 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.14 2b3w h VAL 96 Cb 0.59 -0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 2b3w h VAL 96 CO 0.02 0.20 0.56 0.24 0.02 0.00 0.00 177.57 178.60 2b3w h MET 97 N 1.09 1.18 -0.77 1.57 2.86 -1.50 -1.26 114.93 118.10 2b3w h MET 97 Ca 0.36 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.89 2b3w h MET 97 Cb 0.03 -0.26 -0.04 0.00 0.06 0.00 0.00 31.60 31.40 2b3w h MET 97 CO -0.13 0.81 0.41 -0.09 1.06 0.00 0.00 176.91 178.97 2b3w h ARG 98 N 1.21 1.07 -0.06 1.72 2.43 0.21 0.43 114.38 121.40 2b3w h ARG 98 Ca 0.32 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 2b3w h ARG 98 Cb -0.09 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.25 2b3w h ARG 98 CO -0.06 0.79 -0.10 0.87 -1.51 0.00 0.00 179.97 179.96 2b3w h LYS 99 N 1.08 0.16 -0.62 0.20 6.56 -1.11 -2.51 116.57 120.33 2b3w h LYS 99 Ca 0.27 -0.10 -0.02 0.00 -1.06 0.00 0.00 60.65 59.74 2b3w h LYS 99 Cb 0.04 0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 31.68 2b3w h LYS 99 CO -0.04 0.67 0.31 0.00 -2.06 0.00 0.00 179.45 178.33 2b3w h ALA 100 N 0.49 0.80 -0.45 3.86 0.00 -0.84 -1.37 119.26 121.75 2b3w h ALA 100 Ca 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 2b3w h ALA 100 Cb 0.66 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2b3w h ALA 100 CO 0.02 0.35 -0.18 -0.07 0.00 0.00 0.00 179.25 179.37 2b3w h LEU 101 N 0.85 0.90 -0.15 0.00 3.38 -0.23 -0.77 115.31 119.28 2b3w h LEU 101 Ca 0.21 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2b3w h LEU 101 Cb 0.10 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2b3w h LEU 101 CO -0.03 1.06 0.06 -0.09 0.09 0.00 0.00 178.44 179.53 2b3w h ARG 102 N 0.78 0.22 -0.83 1.13 2.43 -1.12 -0.26 114.38 116.73 2b3w h ARG 102 Ca 0.11 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.27 2b3w h ARG 102 Cb 0.72 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.19 2b3w h ARG 102 CO 0.06 0.31 0.55 0.00 -1.51 0.00 0.00 179.97 179.37 2b3w h ALA 103 N 0.90 1.48 0.22 2.80 0.00 -1.15 0.59 119.26 124.09 2b3w h ALA 103 Ca 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2b3w h ALA 103 Cb 0.18 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2b3w h ALA 103 CO -0.00 0.45 -0.10 -0.22 0.00 0.00 0.00 179.25 179.37 2b3w h LYS 104 N 1.04 -0.28 0.20 0.00 3.64 -0.69 -2.36 116.57 118.12 2b3w h LYS 104 Ca 0.32 0.02 -0.30 0.00 -1.27 0.00 0.00 60.65 59.43 2b3w h LYS 104 Cb 0.00 0.06 0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2b3w h LYS 104 CO -0.09 -0.11 -1.37 0.74 -2.27 0.00 0.00 179.45 176.36 2b3w h PHE 105 N -0.40 0.75 -0.03 1.91 0.04 -0.69 -3.05 116.94 115.48 2b3w h PHE 105 Ca -0.03 -0.55 -0.26 0.00 2.80 0.00 0.00 57.97 59.94 2b3w h PHE 105 Cb 0.30 -0.03 0.02 0.00 2.20 0.00 0.00 35.95 38.44 2b3w h PHE 105 CO -0.03 1.53 -0.99 1.49 -0.60 0.00 0.00 178.31 179.71 2b3w h GLU 106 N -0.05 0.70 -0.01 1.51 4.81 0.06 -2.35 114.58 119.24 2b3w h GLU 106 Ca -0.25 -0.71 -0.16 0.00 -0.13 0.00 0.00 59.36 58.10 2b3w h GLU 106 Cb 1.97 0.19 -0.02 0.00 0.63 0.00 0.00 28.75 31.53 2b3w h GLU 106 CO 0.20 1.30 -0.75 0.37 -0.73 0.00 0.00 179.01 179.39 2b3w h GLN 107 N 0.41 0.09 -4.03 1.92 4.15 -1.53 -3.37 115.11 112.74 2b3w h GLN 107 Ca -0.11 -0.08 -0.77 0.00 0.77 0.00 0.00 58.65 58.46 2b3w h GLN 107 Cb 1.63 0.02 -0.25 0.00 0.21 0.00 0.00 27.48 29.10 2b3w h GLN 107 CO 0.19 0.80 -0.15 -1.01 -1.93 0.00 0.00 178.83 176.74 2b3w s HIS 108 N -3.37 3.38 0.39 3.99 3.76 -1.15 -4.94 115.29 117.35 2b3w s HIS 108 Ca -0.02 -1.48 0.11 0.00 -0.15 0.00 0.00 55.06 53.52 2b3w s HIS 108 Cb 0.11 -3.80 0.90 0.00 1.11 0.00 0.00 32.58 30.91 2b3w s HIS 108 CO 0.80 -1.01 1.94 0.00 -0.85 0.00 0.00 174.74 175.61 2b3w h ALA 109 N 8.60 1.91 -0.12 -1.40 0.00 -1.74 0.00 119.26 126.51 2b3w h ALA 109 Ca -0.20 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 2b3w h ALA 109 Cb 1.08 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2b3w h ALA 109 CO 0.96 -0.07 -0.36 1.05 0.00 0.00 0.00 179.25 180.83 2b3w h GLU 110 N 0.57 0.25 -0.07 0.00 9.09 -1.92 -0.99 114.58 121.50 2b3w h GLU 110 Ca 0.35 -0.11 -0.22 0.00 0.05 0.00 0.00 59.36 59.43 2b3w h GLU 110 Cb 0.57 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 2b3w h GLU 110 CO -0.12 0.58 -0.83 -0.07 0.05 0.00 0.00 179.01 178.62 2b3w h LEU 111 N 0.21 0.68 -0.06 3.06 3.38 -1.26 -1.91 115.31 119.40 2b3w h LEU 111 Ca 0.02 -0.48 0.02 0.00 0.09 0.00 0.00 57.88 57.53 2b3w h LEU 111 Cb 0.74 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2b3w h LEU 111 CO 0.06 1.26 -0.03 -0.09 0.09 0.00 0.00 178.44 179.72 2b3w h ARG 112 N 0.35 -0.03 -0.81 1.13 2.43 -0.76 0.43 114.38 117.12 2b3w h ARG 112 Ca -0.06 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 2b3w h ARG 112 Cb 1.45 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.97 2b3w h ARG 112 CO 0.15 -0.02 0.35 0.00 -1.51 0.00 0.00 179.97 178.94 2b3w h ALA 113 N 1.03 1.07 -0.14 2.80 0.00 -1.20 0.39 119.26 123.22 2b3w h ALA 113 Ca 0.04 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2b3w h ALA 113 Cb 0.09 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2b3w h ALA 113 CO -0.09 0.67 0.07 1.25 0.00 0.00 0.00 179.25 181.15 2b3w h LEU 114 N 1.18 0.11 -0.86 0.00 5.85 -0.98 0.86 115.31 121.47 2b3w h LEU 114 Ca 0.27 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 2b3w h LEU 114 Cb 0.19 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 2b3w h LEU 114 CO -0.03 0.09 0.33 0.25 -0.34 0.00 0.00 178.44 178.74 2b3w h LEU 115 N 0.16 1.07 -0.26 2.25 5.85 -0.55 -2.36 115.31 121.48 2b3w h LEU 115 Ca 0.06 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.62 2b3w h LEU 115 Cb 0.01 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.76 2b3w h LEU 115 CO -0.04 0.94 0.00 -0.07 -0.34 0.00 0.00 178.44 178.93 2b3w h LEU 116 N 1.14 0.00 0.00 2.25 3.38 -0.58 -2.99 115.31 118.52 2b3w h LEU 116 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2b3w h LEU 116 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2b3w h LEU 116 CO -0.03 0.00 -0.27 0.00 0.09 0.00 0.00 178.44 178.23 2b3w h ALA 117 N 2.41 0.85 -0.11 1.53 0.00 -0.28 -3.28 119.26 120.38 2b3w h ALA 117 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 2b3w h ALA 117 Cb 0.62 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2b3w h ALA 117 CO 0.00 0.00 -0.65 1.79 0.00 0.00 0.00 179.25 180.39 2b3w h THR 118 N 0.00 1.36 -2.33 0.00 1.35 -1.44 -3.46 112.91 108.39 2b3w h THR 118 Ca 0.00 -2.00 -0.62 0.00 -0.55 0.00 0.00 66.41 63.25 2b3w h THR 118 Cb 0.91 1.98 0.10 0.00 -1.73 0.00 0.00 68.15 69.41 2b3w h THR 118 CO 0.00 0.60 0.17 0.00 -0.25 0.00 0.00 175.52 176.05 2b3w n ALA 119 N -2.51 -0.34 -0.73 6.62 0.00 -1.24 -0.12 120.51 122.19 2b3w n ALA 119 Ca -0.04 0.41 -0.17 0.00 0.00 0.00 0.00 53.44 53.64 2b3w n ALA 119 Cb 0.66 -2.03 0.16 0.00 0.00 0.00 0.00 19.45 18.24 2b3w n ALA 119 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2b3w n PRO 120 N 1.03 2.16 -1.78 0.00 -0.04 -1.26 -4.89 135.00 130.22 2b3w n PRO 120 Ca 0.11 -2.38 -0.34 0.00 -0.04 0.00 0.00 63.50 60.85 2b3w n PRO 120 Cb 0.30 -1.94 0.05 0.00 -0.04 0.00 0.00 33.50 31.87 2b3w n PRO 120 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b3w s ALA 121 N -2.58 2.42 -0.05 0.55 0.00 0.83 -4.89 121.76 118.04 2b3w s ALA 121 Ca 0.45 0.74 -0.17 0.00 0.00 0.00 0.00 51.96 52.98 2b3w s ALA 121 Cb 0.37 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 20.06 2b3w s ALA 121 CO 0.09 -1.34 0.45 0.21 0.00 0.00 0.00 175.76 175.17 2b3w s LYS 122 N -3.81 4.17 -0.42 0.00 2.20 0.26 -4.91 119.74 117.21 2b3w s LYS 122 Ca 0.71 0.45 -0.16 0.00 -0.36 0.00 0.00 55.97 56.61 2b3w s LYS 122 Cb -0.25 -3.33 0.03 0.00 -1.51 0.00 0.00 37.83 32.77 2b3w s LYS 122 CO 0.39 0.41 0.37 -0.51 -0.36 0.00 0.00 175.35 175.66 2b3w s LEU 123 N -0.21 5.05 -0.04 5.43 1.43 -1.26 -0.24 118.68 128.84 2b3w s LEU 123 Ca 0.25 -0.85 -0.01 0.00 -1.03 0.00 0.00 54.13 52.49 2b3w s LEU 123 Cb -0.16 -2.26 0.03 0.00 0.03 0.00 0.00 46.19 43.83 2b3w s LEU 123 CO 0.12 -0.53 0.04 -0.69 0.23 0.00 0.00 176.35 175.52 2b3w s VAL 124 N 1.89 -0.03 -0.30 -1.59 1.01 -0.97 -4.36 120.40 116.04 2b3w s VAL 124 Ca 0.08 0.33 -0.11 0.00 0.00 0.00 0.00 61.98 62.29 2b3w s VAL 124 Cb -0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.98 2b3w s VAL 124 CO 0.11 0.17 0.18 -0.70 0.00 0.00 0.00 175.10 174.86 2b3w s GLU 125 N 1.85 3.71 -1.16 2.72 2.12 -1.26 -3.65 118.70 123.03 2b3w s GLU 125 Ca 0.01 -0.48 -0.14 0.00 0.36 0.00 0.00 54.97 54.72 2b3w s GLU 125 Cb -0.12 -3.65 0.17 0.00 0.26 0.00 0.00 34.13 30.79 2b3w s GLU 125 CO -0.03 -0.28 1.38 -1.58 -0.54 0.00 0.00 175.26 174.20 2b3w s HIS 126 N 1.71 3.46 0.03 5.30 5.65 -1.25 -0.04 115.29 130.16 2b3w s HIS 126 Ca 0.06 -2.03 0.09 0.00 0.25 0.00 0.00 55.06 53.43 2b3w s HIS 126 Cb -0.16 -4.30 -0.03 0.00 -1.18 0.00 0.00 32.58 26.91 2b3w s HIS 126 CO 0.09 -1.40 -0.25 -0.08 -0.65 0.00 0.00 174.74 172.45 2b3w s THR 127 N 1.68 2.03 -0.15 0.89 -1.32 -1.26 -4.83 115.64 112.69 2b3w s THR 127 Ca 0.41 -1.29 0.02 0.00 -1.21 0.00 0.00 61.69 59.61 2b3w s THR 127 Cb -0.03 -1.73 0.04 0.00 -1.51 0.00 0.00 72.50 69.27 2b3w s THR 127 CO -0.02 0.38 0.99 1.21 -2.21 0.00 0.00 174.62 174.98 2b3w n GLU 128 N 1.93 2.62 0.05 7.08 2.13 -1.26 -1.50 120.64 131.69 2b3w n GLU 128 Ca -0.17 -1.49 0.03 0.00 0.66 0.00 0.00 57.16 56.19 2b3w n GLU 128 Cb 0.52 -1.04 0.40 0.00 0.27 0.00 0.00 31.44 31.59 2b3w n GLU 128 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 2b3w h ASN 129 N 0.32 0.37 -2.21 4.31 2.35 -1.94 -3.40 115.58 115.38 2b3w h ASN 129 Ca 0.00 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.68 2b3w h ASN 129 Cb 0.49 -0.10 -0.24 0.00 0.05 0.00 0.00 38.32 38.52 2b3w h ASN 129 CO 0.00 0.39 -0.28 -0.62 -1.65 0.00 0.00 177.43 175.27 2b3w s ASP 130 N -6.78 -0.63 -1.14 5.81 -1.08 -1.26 -5.09 116.67 106.50 2b3w s ASP 130 Ca -0.07 1.17 -0.20 0.00 -0.52 0.00 0.00 52.55 52.93 2b3w s ASP 130 Cb 0.16 1.75 0.07 0.00 -1.46 0.00 0.00 42.92 43.44 2b3w s ASP 130 CO 0.74 -0.23 1.56 0.00 0.52 0.00 0.00 175.17 177.75 2b3w s ALA 131 N 2.73 3.03 0.00 3.66 0.00 -1.26 -4.72 121.76 125.21 2b3w s ALA 131 Ca -0.02 -2.59 0.00 0.00 0.00 0.00 0.00 51.96 49.35 2b3w s ALA 131 Cb -0.12 -4.55 0.00 0.00 0.00 0.00 0.00 23.12 18.45 2b3w s ALA 131 CO -0.16 -3.43 0.00 0.98 0.00 0.00 0.00 175.76 173.15 2b3w n TYR 132 N 8.48 0.00 0.00 0.00 9.36 -1.16 -4.82 117.16 129.02 2b3w n TYR 132 Ca 0.39 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.61 2b3w n TYR 132 Cb 0.49 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.20 2b3w n TYR 132 CO 0.00 0.00 0.00 0.91 0.22 0.00 0.00 176.86 177.99 2b3w n TRP 133 N -0.05 0.00 -2.28 2.98 7.02 -0.42 -4.82 117.44 119.87 2b3w n TRP 133 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2b3w n TRP 133 Cb 0.00 -0.03 0.00 0.00 -2.42 0.00 0.00 31.31 28.86 2b3w n TRP 133 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2b3w n GLY 134 N -1.94 5.42 0.24 6.99 0.00 -0.83 -1.67 105.19 113.40 2b3w n GLY 134 Ca 0.00 -1.29 0.11 0.00 0.00 0.00 0.00 46.02 44.84 2b3w n GLY 134 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2b3w h ASP 135 N 0.00 0.00 0.00 1.61 3.58 -0.72 -1.33 116.42 119.56 2b3w h ASP 135 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2b3w h ASP 135 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2b3w h ASP 135 CO 0.00 0.18 0.00 0.61 -2.88 0.00 0.00 179.24 177.15 2b3w n GLY 136 N -0.36 0.37 1.81 -0.78 0.00 -1.11 -0.41 105.19 104.72 2b3w n GLY 136 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2b3w n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b3w n GLY 137 N -1.59 1.87 1.00 -0.02 0.00 -0.56 -4.63 105.19 101.27 2b3w n GLY 137 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2b3w n GLY 137 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2b3w n HIS 138 N -2.00 -0.02 0.00 1.61 -0.00 -1.13 -4.98 115.22 108.69 2b3w n HIS 138 Ca 0.00 -0.50 0.00 0.00 -0.00 0.00 0.00 57.72 57.22 2b3w n HIS 138 Cb 0.00 0.50 0.00 0.00 -0.00 0.00 0.00 29.99 30.49 2b3w n HIS 138 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2b3w n GLY 139 N -0.02 1.80 2.30 -1.39 0.00 0.46 -4.79 105.19 103.55 2b3w n GLY 139 Ca -0.27 -0.16 -0.21 0.00 0.00 0.00 0.00 46.02 45.38 2b3w n GLY 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b3w n LYS 140 N 0.00 2.26 0.00 1.61 5.02 -1.23 -3.74 118.16 122.09 2b3w n LYS 140 Ca 0.00 -1.34 0.00 0.00 -2.02 0.00 0.00 58.31 54.95 2b3w n LYS 140 Cb 0.00 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 32.73 2b3w n LYS 140 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b3w n GLY 141 N 3.19 -0.05 2.70 0.72 0.00 -1.06 -4.81 105.19 105.88 2b3w n GLY 141 Ca 0.48 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.46 2b3w n GLY 141 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b3w n LYS 142 N -0.39 -2.67 0.00 1.61 4.01 -0.94 -1.58 118.16 118.20 2b3w n LYS 142 Ca 0.00 2.28 0.03 0.00 -0.51 0.00 0.00 58.31 60.11 2b3w n LYS 142 Cb 0.02 -5.28 0.16 0.00 -0.51 0.00 0.00 35.03 29.43 2b3w n LYS 142 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2b3w n ASN 143 N 0.09 0.00 -0.44 4.39 5.15 -0.55 -1.30 115.26 122.61 2b3w n ASN 143 Ca 0.06 -0.63 0.34 0.00 -0.60 0.00 0.00 54.58 53.75 2b3w n ASN 143 Cb 0.25 0.00 0.53 0.00 -0.53 0.00 0.00 39.78 40.02 2b3w n ASN 143 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 2b3w n ARG 144 N -0.71 -0.00 -0.02 1.20 3.00 -1.25 -0.14 116.66 118.74 2b3w n ARG 144 Ca 0.04 0.73 -0.13 0.00 -0.00 0.00 0.00 57.85 58.50 2b3w n ARG 144 Cb 0.02 -1.64 -0.09 0.00 0.00 0.00 0.00 32.46 30.75 2b3w n ARG 144 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2b3w h LEU 145 N 0.00 0.08 -1.61 6.15 5.85 -1.47 0.32 115.31 124.62 2b3w h LEU 145 Ca 0.61 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 2b3w h LEU 145 Cb 2.39 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 43.38 2b3w h LEU 145 CO -0.06 0.47 0.07 1.23 -0.34 0.00 0.00 178.44 179.82 2b3w h GLY 146 N -0.31 0.35 0.94 3.75 0.00 -0.59 0.23 103.07 107.43 2b3w h GLY 146 Ca 0.01 -0.15 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 2b3w h GLY 146 CO 0.01 0.15 -0.20 -1.82 0.00 0.00 0.00 176.54 174.67 2b3w h TYR 147 N 0.33 0.77 -0.28 5.60 3.20 -1.25 -0.30 116.97 125.05 2b3w h TYR 147 Ca 0.08 -0.21 0.04 0.00 3.14 0.00 0.00 58.73 61.78 2b3w h TYR 147 Cb 0.10 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.16 2b3w h TYR 147 CO 0.00 0.92 0.04 1.25 -1.64 0.00 0.00 178.16 178.73 2b3w h LEU 148 N 0.41 -0.02 -0.81 2.82 7.12 0.65 0.27 115.31 125.75 2b3w h LEU 148 Ca 0.06 0.05 0.03 0.00 0.13 0.00 0.00 57.88 58.15 2b3w h LEU 148 Cb 0.75 0.07 -0.05 0.00 -0.53 0.00 0.00 40.66 40.90 2b3w h LEU 148 CO 0.06 0.02 0.52 -0.07 -0.13 0.00 0.00 178.44 178.84 2b3w h LEU 149 N 0.14 0.87 -0.60 2.25 3.38 -0.49 -0.39 115.31 120.47 2b3w h LEU 149 Ca 0.13 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 2b3w h LEU 149 Cb 0.14 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2b3w h LEU 149 CO -0.18 0.60 -0.34 0.24 0.09 0.00 0.00 178.44 178.85 2b3w h MET 150 N 1.02 0.73 0.16 1.13 2.86 -0.34 0.23 114.93 120.72 2b3w h MET 150 Ca 0.32 -0.35 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2b3w h MET 150 Cb -0.01 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.65 2b3w h MET 150 CO -0.11 0.96 -0.08 0.93 1.06 0.00 0.00 176.91 179.68 2b3w h GLU 151 N 0.61 -0.21 -0.69 1.72 5.08 0.00 -0.77 114.58 120.32 2b3w h GLU 151 Ca 0.06 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2b3w h GLU 151 Cb 0.87 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 2b3w h GLU 151 CO 0.08 -0.12 0.46 1.25 -1.00 0.00 0.00 179.01 179.68 2b3w h LEU 152 N -0.25 0.80 0.01 1.33 5.85 -0.96 0.12 115.31 122.22 2b3w h LEU 152 Ca -0.02 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.70 2b3w h LEU 152 Cb 0.19 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 2b3w h LEU 152 CO 0.04 0.59 -0.40 -0.09 -0.34 0.00 0.00 178.44 178.23 2b3w h ARG 153 N 0.94 -0.54 0.00 1.25 2.43 -0.33 0.28 114.38 118.40 2b3w h ARG 153 Ca 0.25 0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.42 2b3w h ARG 153 Cb -0.10 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2b3w h ARG 153 CO -0.05 -0.36 -0.19 0.93 -1.51 0.00 0.00 179.97 178.78 2b3w h GLU 154 N -0.56 0.00 -0.43 0.20 5.08 -0.94 -2.43 114.58 115.50 2b3w h GLU 154 Ca 0.05 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 2b3w h GLU 154 Cb 0.64 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2b3w h GLU 154 CO -0.30 0.19 -0.27 0.37 -1.00 0.00 0.00 179.01 178.00 2b3w h GLN 155 N 0.00 0.91 -0.06 2.33 5.75 -0.03 -1.07 115.11 122.94 2b3w h GLN 155 Ca -0.00 -0.41 -0.09 0.00 -0.15 0.00 0.00 58.65 58.00 2b3w h GLN 155 Cb 0.79 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.31 2b3w h GLN 155 CO 0.02 1.06 -0.37 -0.07 -2.65 0.00 0.00 178.83 176.83 2b3w h LEU 156 N 0.77 0.13 -0.21 -2.39 3.38 -0.02 0.20 115.31 117.17 2b3w h LEU 156 Ca 0.09 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 2b3w h LEU 156 Cb 0.84 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2b3w h LEU 156 CO 0.07 0.50 -0.05 0.00 0.09 0.00 0.00 178.44 179.05 2b3w h ALA 157 N 1.51 0.29 -0.28 1.53 0.00 -1.24 -2.57 119.26 118.51 2b3w h ALA 157 Ca 0.01 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2b3w h ALA 157 Cb 0.71 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2b3w h ALA 157 CO 0.05 0.07 -0.14 0.82 0.00 0.00 0.00 179.25 180.06 2b3w h ILE 158 N 0.14 1.23 -0.46 0.00 2.04 -0.76 -1.43 117.51 118.27 2b3w h ILE 158 Ca 0.05 -1.04 0.01 0.00 1.00 0.00 0.00 64.86 64.89 2b3w h ILE 158 Cb 0.50 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 2b3w h ILE 158 CO 0.02 0.34 0.30 -0.08 0.00 0.00 0.00 178.15 178.73 2b3w h GLU 159 N 0.45 0.57 0.00 2.37 4.57 -0.54 -0.25 114.58 121.75 2b3w h GLU 159 Ca 0.08 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 2b3w h GLU 159 Cb 0.51 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 2b3w h GLU 159 CO 0.03 0.38 0.00 -0.22 -1.18 0.00 0.00 179.01 178.02 2b3w h LYS 160 N 0.59 0.00 0.00 1.92 3.64 -0.87 -2.99 116.57 118.86 2b3w h LYS 160 Ca 0.17 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 2b3w h LYS 160 Cb -0.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2b3w h LYS 160 CO -0.04 0.00 -0.47 -0.07 -2.27 0.00 0.00 179.45 176.60 2b3w h LEU 161 N 0.00 0.00 -0.68 5.20 4.07 -0.34 -3.02 115.31 120.54 2b3w h LEU 161 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2b3w h LEU 161 Cb 0.90 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.64 2b3w h LEU 161 CO 0.00 0.47 0.00 -0.62 -1.08 0.00 0.00 178.44 177.21 2b3w n GLU 162 N -3.27 1.41 -1.63 1.13 -0.58 -0.76 -4.76 120.64 112.17 2b3w n GLU 162 Ca 0.02 -0.56 -0.23 0.00 -0.42 0.00 0.00 57.16 55.97 2b3w n GLU 162 Cb 0.69 -1.19 -0.05 0.00 -0.57 0.00 0.00 31.44 30.32 2b3w n GLU 162 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2b3w s HIS 163 N -1.74 1.20 -0.62 -0.32 3.76 -1.14 -4.78 115.29 111.64 2b3w s HIS 163 Ca 0.10 1.69 -0.00 0.00 -0.15 0.00 0.00 55.06 56.70 2b3w s HIS 163 Cb 0.06 -3.56 0.44 0.00 1.11 0.00 0.00 32.58 30.62 2b3w s HIS 163 CO 0.06 -1.92 1.88 1.58 -0.85 0.00 0.00 174.74 175.49 2b3w n HIS 164 N 17.14 3.14 1.35 1.40 -0.00 -1.26 -4.63 115.22 132.36 2b3w n HIS 164 Ca 0.42 -2.84 0.00 0.00 0.46 0.00 0.00 57.72 55.76 2b3w n HIS 164 Cb 0.48 -1.22 0.00 0.00 -0.12 0.00 0.00 29.99 29.13 2b3w n HIS 164 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2b3w n HIS 165 N -0.84 0.00 -3.78 1.57 -0.00 -1.26 -4.98 115.22 105.94 2b3w n HIS 165 Ca 0.58 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.79 2b3w n HIS 165 Cb 0.67 -0.04 -0.01 0.00 -0.12 0.00 0.00 29.99 30.49 2b3w n HIS 165 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2b3w n HIS 166 N -0.23 -1.88 -3.46 1.57 8.25 -1.26 -4.83 115.22 113.38 2b3w n HIS 166 Ca 0.00 0.23 -0.20 0.00 -0.26 0.00 0.00 57.72 57.49 2b3w n HIS 166 Cb 0.11 -0.29 -0.12 0.00 1.12 0.00 0.00 29.99 30.81 2b3w n HIS 166 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2b3w s HIS 167 N -0.37 -0.26 0.00 4.41 -3.43 -1.26 -5.19 115.29 109.19 2b3w s HIS 167 Ca 0.00 -0.14 0.00 0.00 -0.80 0.00 0.00 55.06 54.12 2b3w s HIS 167 Cb 0.00 -0.50 0.00 0.00 -1.43 0.00 0.00 32.58 30.65 2b3w s HIS 167 CO 0.00 -0.78 0.11 1.58 -2.00 0.00 0.00 174.74 173.64