#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdi n VAL 3 N 0.00 -0.98 -3.18 0.00 0.31 -1.26 -4.97 118.33 108.25 2wdi n VAL 3 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.94 2wdi n VAL 3 Cb 0.00 -0.74 -0.05 0.00 -0.91 0.00 0.00 33.84 32.14 2wdi n VAL 3 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2wdi s LYS 4 N -4.51 4.34 0.26 5.55 1.02 0.39 -4.88 119.74 121.92 2wdi s LYS 4 Ca 0.00 0.76 0.10 0.00 0.02 0.00 0.00 55.97 56.85 2wdi s LYS 4 Cb 0.00 -3.36 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 2wdi s LYS 4 CO 0.00 0.32 -0.03 0.21 -0.92 0.00 0.00 175.35 174.93 2wdi s LYS 5 N -0.04 2.23 0.22 1.68 2.20 -1.26 -0.49 119.74 124.28 2wdi s LYS 5 Ca 0.32 -1.42 0.11 0.00 -0.36 0.00 0.00 55.97 54.61 2wdi s LYS 5 Cb -0.18 -2.13 -0.05 0.00 -1.51 0.00 0.00 37.83 33.96 2wdi s LYS 5 CO 0.17 0.37 -0.21 -0.06 -0.36 0.00 0.00 175.35 175.27 2wdi s PHE 6 N -2.27 2.16 0.82 4.03 0.40 -1.25 -5.00 117.98 116.87 2wdi s PHE 6 Ca 0.31 -0.39 -0.11 0.00 -0.60 0.00 0.00 56.93 56.14 2wdi s PHE 6 Cb -0.07 -1.02 0.08 0.00 0.51 0.00 0.00 43.02 42.53 2wdi s PHE 6 CO 0.19 0.54 1.09 0.15 0.70 0.00 0.00 175.22 177.89 2wdi s LYS 7 N -3.08 1.88 -0.09 0.44 1.02 -1.26 -4.73 119.74 113.92 2wdi s LYS 7 Ca 0.23 0.86 -0.03 0.00 0.02 0.00 0.00 55.97 57.05 2wdi s LYS 7 Cb -0.06 -1.88 -0.06 0.00 -0.52 0.00 0.00 37.83 35.31 2wdi s LYS 7 CO 0.11 -1.82 2.68 -0.35 -0.92 0.00 0.00 175.35 175.05 2wdi n PRO 8 N -3.60 1.63 0.00 -1.68 -0.04 -1.26 -4.53 135.00 125.52 2wdi n PRO 8 Ca 0.07 -0.84 0.00 0.00 -0.04 0.00 0.00 63.50 62.69 2wdi n PRO 8 Cb 0.55 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 2wdi n PRO 8 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2wdi n TYR 9 N 1.63 0.00 0.00 0.54 4.11 -1.26 -4.54 117.16 117.64 2wdi n TYR 9 Ca 0.25 -0.27 0.00 0.00 -0.00 0.00 0.00 57.90 57.88 2wdi n TYR 9 Cb 0.67 -0.17 0.00 0.00 -0.00 0.00 0.00 39.34 39.83 2wdi n TYR 9 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 2wdi n THR 10 N 0.52 0.00 -0.40 -3.48 5.66 -1.26 -5.09 114.28 110.22 2wdi n THR 10 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 2wdi n THR 10 Cb 0.31 0.00 0.09 0.00 -1.55 0.00 0.00 70.33 69.18 2wdi n THR 10 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2wdi n PRO 11 N -0.36 -2.29 0.00 1.09 -0.04 -1.26 -2.42 135.00 129.71 2wdi n PRO 11 Ca 0.00 -0.54 0.00 0.00 -0.04 0.00 0.00 63.50 62.92 2wdi n PRO 11 Cb 0.00 -0.58 0.00 0.00 -0.04 0.00 0.00 33.50 32.88 2wdi n PRO 11 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2wdi n SER 12 N -3.77 0.00 -0.14 3.54 3.41 -1.26 -4.22 113.62 111.17 2wdi n SER 12 Ca 0.05 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.73 2wdi n SER 12 Cb 0.20 -0.83 0.10 0.00 -0.26 0.00 0.00 64.21 63.41 2wdi n SER 12 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2wdi n ARG 13 N -1.18 1.17 0.00 4.33 0.63 -1.02 -3.61 116.66 116.99 2wdi n ARG 13 Ca 0.00 -2.12 0.05 0.00 -0.92 0.00 0.00 57.85 54.86 2wdi n ARG 13 Cb 0.00 -1.24 -0.01 0.00 0.45 0.00 0.00 32.46 31.66 2wdi n ARG 13 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 2wdi n ARG 14 N -1.04 2.42 -0.00 -0.14 1.85 -1.19 -4.34 116.66 114.22 2wdi n ARG 14 Ca 0.11 -0.49 0.00 0.00 -1.00 0.00 0.00 57.85 56.47 2wdi n ARG 14 Cb 0.61 -1.05 -0.00 0.00 -1.05 0.00 0.00 32.46 30.97 2wdi n ARG 14 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2wdi n PHE 15 N -0.42 0.00 -1.89 2.89 0.99 -1.26 -4.85 117.46 112.91 2wdi n PHE 15 Ca 0.04 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 57.09 2wdi n PHE 15 Cb 0.19 -0.01 0.00 0.00 -1.00 0.00 0.00 39.48 38.67 2wdi n PHE 15 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.76 178.17 2wdi s MET 16 N -2.02 3.93 -0.04 -1.08 1.75 -1.24 -4.67 119.30 115.93 2wdi s MET 16 Ca -0.00 2.38 -0.13 0.00 -1.25 0.00 0.00 55.69 56.68 2wdi s MET 16 Cb 0.00 -2.81 0.02 0.00 2.84 0.00 0.00 34.83 34.89 2wdi s MET 16 CO 0.01 -0.60 0.30 0.95 -0.65 0.00 0.00 175.02 175.03 2wdi s THR 17 N -1.19 0.04 0.13 10.11 -4.23 -0.88 -3.83 115.64 115.79 2wdi s THR 17 Ca 0.57 -0.37 0.02 0.00 -1.18 0.00 0.00 61.69 60.73 2wdi s THR 17 Cb -0.43 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 72.81 2wdi s THR 17 CO 0.56 -0.20 -0.05 0.68 -0.54 0.00 0.00 174.62 175.07 2wdi s VAL 18 N -0.94 0.76 0.54 2.29 -7.23 0.36 -3.96 120.40 112.21 2wdi s VAL 18 Ca -0.10 -1.97 -0.22 0.00 -1.81 0.00 0.00 61.98 57.89 2wdi s VAL 18 Cb -0.05 -1.82 -0.06 0.00 0.56 0.00 0.00 36.38 35.01 2wdi s VAL 18 CO 0.03 -0.75 1.24 0.00 -0.31 0.00 0.00 175.10 175.31 2wdi n ALA 19 N -0.12 1.13 -2.47 1.32 0.00 -1.26 0.15 120.51 119.26 2wdi n ALA 19 Ca -0.10 0.12 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 2wdi n ALA 19 Cb 0.61 -2.27 -0.03 0.00 0.00 0.00 0.00 19.45 17.76 2wdi n ALA 19 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2wdi s ASP 20 N -0.94 6.04 0.00 0.00 -1.08 -1.26 -4.60 116.67 114.83 2wdi s ASP 20 Ca 0.71 -0.28 0.07 0.00 -0.52 0.00 0.00 52.55 52.53 2wdi s ASP 20 Cb -0.44 -2.55 0.37 0.00 -1.46 0.00 0.00 42.92 38.84 2wdi s ASP 20 CO 0.50 -1.90 1.25 0.49 0.52 0.00 0.00 175.17 176.03 2wdi n PHE 21 N 9.85 0.06 -0.24 -5.34 0.99 -1.26 -3.67 117.46 117.85 2wdi n PHE 21 Ca 0.06 -0.03 -0.08 0.00 -0.00 0.00 0.00 57.45 57.40 2wdi n PHE 21 Cb 0.49 0.00 0.04 0.00 -1.00 0.00 0.00 39.48 39.01 2wdi n PHE 21 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 2wdi h SER 22 N 0.34 1.07 -0.84 4.37 4.64 -2.00 -2.19 113.55 118.93 2wdi h SER 22 Ca 0.00 -0.26 0.20 0.00 -0.47 0.00 0.00 61.79 61.26 2wdi h SER 22 Cb 0.08 -0.28 -0.15 0.00 -0.31 0.00 0.00 62.40 61.73 2wdi h SER 22 CO 0.00 1.05 -0.03 -0.33 -0.87 0.00 0.00 176.83 176.65 2wdi h GLU 23 N 1.04 0.06 0.00 4.77 4.39 -1.97 -3.25 114.58 119.61 2wdi h GLU 23 Ca 0.21 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2wdi h GLU 23 Cb 0.44 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2wdi h GLU 23 CO 0.01 0.04 0.00 1.51 -1.16 0.00 0.00 179.01 179.41 2wdi n ILE 24 N -5.43 0.00 -0.14 3.13 3.06 -0.84 -4.85 119.36 114.29 2wdi n ILE 24 Ca 0.16 0.16 0.01 0.00 -2.50 0.00 0.00 62.75 60.58 2wdi n ILE 24 Cb 0.54 -0.56 -0.00 0.00 0.54 0.00 0.00 39.64 40.17 2wdi n ILE 24 CO 0.00 0.00 0.00 0.41 -2.50 0.00 0.00 176.55 174.46 2wdi n THR 25 N 0.00 0.00 -0.69 9.51 -1.04 -1.10 -4.58 114.28 116.38 2wdi n THR 25 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2wdi n THR 25 Cb 0.00 -0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.49 2wdi n THR 25 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2wdi n LYS 26 N -0.56 -1.73 0.00 -2.82 2.85 -1.26 -4.55 118.16 110.09 2wdi n LYS 26 Ca 0.00 0.32 0.00 0.00 -1.05 0.00 0.00 58.31 57.58 2wdi n LYS 26 Cb 0.03 -4.24 0.00 0.00 -0.65 0.00 0.00 35.03 30.17 2wdi n LYS 26 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 2wdi n THR 27 N -1.44 0.00 -0.06 0.58 5.66 -1.26 -4.90 114.28 112.86 2wdi n THR 27 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 2wdi n THR 27 Cb 0.32 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.05 2wdi n THR 27 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2wdi n GLU 28 N 0.00 0.45 -2.22 1.09 4.71 -1.26 -4.44 120.64 118.98 2wdi n GLU 28 Ca 0.00 0.06 -0.42 0.00 -0.01 0.00 0.00 57.16 56.79 2wdi n GLU 28 Cb 0.00 -1.23 -0.03 0.00 -1.01 0.00 0.00 31.44 29.17 2wdi n GLU 28 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2wdi s PRO 29 N -2.23 4.36 0.80 3.49 0.04 -1.26 -4.82 135.00 135.38 2wdi s PRO 29 Ca -0.14 2.03 -0.11 0.00 0.04 0.00 0.00 61.00 62.82 2wdi s PRO 29 Cb 0.04 -3.23 0.07 0.00 0.04 0.00 0.00 34.50 31.42 2wdi s PRO 29 CO 0.27 -0.34 1.11 -1.21 0.04 0.00 0.00 177.00 176.88 2wdi s GLU 30 N 0.58 1.98 -1.50 4.56 0.41 -1.26 -4.86 118.70 118.61 2wdi s GLU 30 Ca 0.61 1.33 -0.09 0.00 -0.41 0.00 0.00 54.97 56.40 2wdi s GLU 30 Cb -0.36 -1.85 0.00 0.00 -1.78 0.00 0.00 34.13 30.14 2wdi s GLU 30 CO 0.33 -1.87 2.63 1.17 -0.49 0.00 0.00 175.26 177.03 2wdi n LYS 31 N -3.55 3.80 0.00 1.61 3.00 -1.26 -4.80 118.16 116.96 2wdi n LYS 31 Ca 0.10 -2.68 0.00 0.00 -0.00 0.00 0.00 58.31 55.73 2wdi n LYS 31 Cb 0.52 -2.84 0.00 0.00 0.00 0.00 0.00 35.03 32.71 2wdi n LYS 31 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2wdi n SER 32 N 3.51 0.00 -1.65 3.14 2.88 -1.26 -3.43 113.62 116.81 2wdi n SER 32 Ca 0.68 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 58.11 2wdi n SER 32 Cb 0.27 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.65 2wdi n SER 32 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2wdi n LEU 33 N -3.44 -0.33 -2.67 2.46 4.32 -1.26 0.36 117.00 116.44 2wdi n LEU 33 Ca 0.00 -0.11 -0.15 0.00 -0.02 0.00 0.00 56.01 55.73 2wdi n LEU 33 Cb 0.00 -0.24 -0.03 0.00 -1.62 0.00 0.00 43.42 41.53 2wdi n LEU 33 CO 0.00 -0.44 -0.07 0.55 -1.22 0.00 0.00 177.39 176.21 2wdi n VAL 34 N 2.27 -0.05 -0.09 4.08 3.14 -1.26 -4.69 118.33 121.73 2wdi n VAL 34 Ca 0.25 -0.02 -0.12 0.00 -2.96 0.00 0.00 64.34 61.48 2wdi n VAL 34 Cb 0.04 -0.20 -0.10 0.00 -1.06 0.00 0.00 33.84 32.52 2wdi n VAL 34 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2wdi n LYS 35 N -1.85 0.75 -4.17 1.45 4.76 0.16 -4.89 118.16 114.37 2wdi n LYS 35 Ca 0.02 0.08 -0.24 0.00 -2.87 0.00 0.00 58.31 55.31 2wdi n LYS 35 Cb 0.17 -1.39 -0.06 0.00 -1.84 0.00 0.00 35.03 31.91 2wdi n LYS 35 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2wdi s PRO 36 N -2.39 2.66 0.04 1.97 0.04 -1.25 0.91 135.00 136.98 2wdi s PRO 36 Ca -0.21 -1.12 -0.00 0.00 0.04 0.00 0.00 61.00 59.70 2wdi s PRO 36 Cb 0.06 -2.44 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 2wdi s PRO 36 CO 0.50 0.42 -0.03 -0.51 0.04 0.00 0.00 177.00 177.41 2wdi s LEU 37 N -3.47 2.35 0.25 -3.56 1.43 0.19 -4.94 118.68 110.94 2wdi s LEU 37 Ca 0.31 -0.73 -0.31 0.00 -1.03 0.00 0.00 54.13 52.37 2wdi s LEU 37 Cb -0.08 0.12 -0.12 0.00 0.03 0.00 0.00 46.19 46.14 2wdi s LEU 37 CO 0.22 -0.42 1.65 -0.75 0.23 0.00 0.00 176.35 177.28 2wdi s LYS 38 N -2.57 4.13 -0.18 1.70 2.20 -1.26 -2.17 119.74 121.58 2wdi s LYS 38 Ca -0.05 2.58 -0.00 0.00 -0.36 0.00 0.00 55.97 58.14 2wdi s LYS 38 Cb -0.02 -3.05 0.01 0.00 -1.51 0.00 0.00 37.83 33.25 2wdi s LYS 38 CO -0.05 -0.69 -0.15 0.21 -0.36 0.00 0.00 175.35 174.32 2wdi s LYS 39 N 0.35 3.15 -0.00 4.03 2.20 -1.26 -4.86 119.74 123.34 2wdi s LYS 39 Ca 0.69 -0.76 -0.30 0.00 -0.36 0.00 0.00 55.97 55.24 2wdi s LYS 39 Cb -0.49 -2.70 -0.04 0.00 -1.51 0.00 0.00 37.83 33.10 2wdi s LYS 39 CO 0.40 -0.15 1.19 0.99 -0.36 0.00 0.00 175.35 177.43 2wdi s THR 40 N 1.21 4.19 0.82 3.43 2.01 -1.26 -4.92 115.64 121.11 2wdi s THR 40 Ca 0.02 1.55 -0.06 0.00 0.31 0.00 0.00 61.69 63.51 2wdi s THR 40 Cb -0.14 -3.99 0.16 0.00 0.01 0.00 0.00 72.50 68.54 2wdi s THR 40 CO -0.07 0.05 1.12 -0.83 -0.69 0.00 0.00 174.62 174.21 2wdi s GLY 41 N 1.30 1.77 0.00 4.40 0.00 -1.26 -5.07 107.32 108.45 2wdi s GLY 41 Ca 0.57 -1.56 0.00 0.00 0.00 0.00 0.00 44.72 43.73 2wdi s GLY 41 CO 0.25 -0.91 0.00 0.61 0.00 0.00 0.00 173.10 173.06 2wdi n GLY 42 N -3.20 3.06 0.00 0.20 0.00 -1.26 -5.00 105.19 99.00 2wdi n GLY 42 Ca 0.15 -0.33 0.10 0.00 0.00 0.00 0.00 46.02 45.94 2wdi n GLY 42 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2wdi n ARG 43 N 0.00 0.36 -4.70 1.61 -4.01 -1.26 -4.88 116.66 103.78 2wdi n ARG 43 Ca 0.00 0.08 -0.31 0.00 -1.04 0.00 0.00 57.85 56.57 2wdi n ARG 43 Cb 0.00 -1.50 -0.08 0.00 -3.04 0.00 0.00 32.46 27.84 2wdi n ARG 43 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 2wdi s ASN 44 N -2.45 3.82 0.00 2.89 4.22 -1.26 -3.69 114.94 118.47 2wdi s ASN 44 Ca 0.21 -1.66 0.00 0.00 -2.14 0.00 0.00 52.86 49.27 2wdi s ASN 44 Cb 0.14 0.52 0.00 0.00 1.28 0.00 0.00 41.25 43.19 2wdi s ASN 44 CO 0.29 -0.87 0.00 -0.46 -2.04 0.00 0.00 177.10 174.02 2wdi n ASN 45 N -1.28 0.00 -3.78 3.54 6.94 -1.15 -4.91 115.26 114.62 2wdi n ASN 45 Ca -0.16 0.00 -0.38 0.00 -0.02 0.00 0.00 54.58 54.02 2wdi n ASN 45 Cb 0.66 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 38.07 2wdi n ASN 45 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wdi n GLN 46 N 0.00 4.01 0.00 -3.83 3.00 -1.26 -4.85 117.38 114.45 2wdi n GLN 46 Ca 0.00 -4.61 0.00 0.00 -0.01 0.00 0.00 57.00 52.38 2wdi n GLN 46 Cb 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 30.24 27.81 2wdi n GLN 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2wdi n GLY 47 N 1.02 2.00 3.77 1.08 0.00 -1.26 -5.05 105.19 106.74 2wdi n GLY 47 Ca 0.29 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 2wdi n GLY 47 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdi s ARG 48 N 0.00 4.43 0.18 1.61 1.81 -1.26 -4.92 118.95 120.81 2wdi s ARG 48 Ca 0.00 1.82 -0.30 0.00 -1.72 0.00 0.00 55.73 55.53 2wdi s ARG 48 Cb 0.00 -2.99 -0.08 0.00 -0.45 0.00 0.00 34.95 31.43 2wdi s ARG 48 CO 0.00 0.02 1.19 -1.50 -0.68 0.00 0.00 175.30 174.33 2wdi s ILE 49 N -1.27 3.58 -0.05 1.52 2.07 -1.26 -2.94 121.20 122.86 2wdi s ILE 49 Ca 0.49 1.34 0.07 0.00 -1.41 0.00 0.00 60.65 61.13 2wdi s ILE 49 Cb -0.31 -3.85 0.10 0.00 0.13 0.00 0.00 42.46 38.52 2wdi s ILE 49 CO 0.40 0.21 0.98 0.35 -1.91 0.00 0.00 174.94 174.98 2wdi n THR 50 N 2.49 1.03 -3.62 4.00 -2.24 -1.24 -4.91 114.28 109.79 2wdi n THR 50 Ca 0.04 -1.16 -0.07 0.00 -2.27 0.00 0.00 64.05 60.59 2wdi n THR 50 Cb 0.45 0.31 -0.08 0.00 -2.10 0.00 0.00 70.33 68.91 2wdi n THR 50 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2wdi s VAL 51 N -1.38 -0.71 0.66 2.28 1.01 -1.26 -5.09 120.40 115.92 2wdi s VAL 51 Ca 0.11 0.12 -0.11 0.00 0.00 0.00 0.00 61.98 62.10 2wdi s VAL 51 Cb 0.10 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.73 2wdi s VAL 51 CO 0.01 0.04 1.05 -0.13 0.00 0.00 0.00 175.10 176.07 2wdi s ARG 52 N 2.66 3.18 -1.80 2.72 0.52 -1.26 -4.33 118.95 120.64 2wdi s ARG 52 Ca -0.01 0.90 0.00 0.00 -0.52 0.00 0.00 55.73 56.10 2wdi s ARG 52 Cb -0.12 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 33.32 2wdi s ARG 52 CO -0.14 -0.91 0.00 1.19 0.02 0.00 0.00 175.30 175.46 2wdi n PHE 53 N -2.95 -0.53 -4.02 -0.53 3.72 -1.26 -4.99 117.46 106.91 2wdi n PHE 53 Ca 0.07 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.23 2wdi n PHE 53 Cb 0.54 -3.36 -0.04 0.00 -0.94 0.00 0.00 39.48 35.68 2wdi n PHE 53 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2wdi s ARG 54 N -4.15 3.21 0.00 -1.08 1.81 -1.26 0.15 118.95 117.63 2wdi s ARG 54 Ca 0.00 -0.80 0.00 0.00 -1.72 0.00 0.00 55.73 53.21 2wdi s ARG 54 Cb 0.00 -2.79 0.00 0.00 -0.45 0.00 0.00 34.95 31.71 2wdi s ARG 54 CO 0.00 0.46 0.00 0.41 -0.68 0.00 0.00 175.30 175.49 2wdi n GLY 55 N -0.89 3.65 7.00 -3.53 0.00 -0.67 -4.71 105.19 106.04 2wdi n GLY 55 Ca -0.08 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.37 2wdi n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdi n GLY 56 N -1.91 0.73 0.24 -0.02 0.00 -1.26 -4.21 105.19 98.76 2wdi n GLY 56 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2wdi n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdi n GLY 57 N 0.00 -2.23 1.29 -0.02 0.00 -1.20 -4.45 105.19 98.57 2wdi n GLY 57 Ca 0.00 -0.96 -0.17 0.00 0.00 0.00 0.00 46.02 44.90 2wdi n GLY 57 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2wdi n HIS 58 N 0.65 -0.76 -1.73 1.61 -0.00 -0.74 -4.77 115.22 109.49 2wdi n HIS 58 Ca 0.00 0.26 -0.39 0.00 -0.00 0.00 0.00 57.72 57.58 2wdi n HIS 58 Cb 0.00 -0.70 0.03 0.00 -0.00 0.00 0.00 29.99 29.32 2wdi n HIS 58 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 2wdi n LYS 59 N 0.51 1.89 -3.77 1.57 3.00 -1.26 -4.98 118.16 115.11 2wdi n LYS 59 Ca 0.05 0.68 -0.14 0.00 -0.00 0.00 0.00 58.31 58.90 2wdi n LYS 59 Cb 0.15 -2.53 -0.15 0.00 0.00 0.00 0.00 35.03 32.50 2wdi n LYS 59 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 2wdi s ARG 60 N -2.59 0.03 -0.04 1.64 3.52 -1.26 -5.13 118.95 115.12 2wdi s ARG 60 Ca 0.66 0.25 -0.13 0.00 -0.13 0.00 0.00 55.73 56.39 2wdi s ARG 60 Cb -0.45 -0.18 -0.05 0.00 -1.56 0.00 0.00 34.95 32.71 2wdi s ARG 60 CO 0.54 -0.14 0.33 -1.17 -0.81 0.00 0.00 175.30 174.04 2wdi s LEU 61 N 0.97 4.44 -0.29 -0.88 1.98 -1.26 -4.33 118.68 119.30 2wdi s LEU 61 Ca -0.08 0.81 -0.11 0.00 -2.89 0.00 0.00 54.13 51.86 2wdi s LEU 61 Cb -0.11 -2.44 -0.04 0.00 0.66 0.00 0.00 46.19 44.27 2wdi s LEU 61 CO -0.04 0.33 0.18 -0.47 -1.89 0.00 0.00 176.35 174.47 2wdi s TYR 62 N -0.95 3.20 -0.12 5.38 6.14 -0.92 -4.74 117.35 125.33 2wdi s TYR 62 Ca 0.21 -0.04 -0.25 0.00 0.64 0.00 0.00 57.07 57.63 2wdi s TYR 62 Cb -0.15 -2.38 -0.02 0.00 0.42 0.00 0.00 41.96 39.82 2wdi s TYR 62 CO 0.10 -0.24 0.79 1.03 0.64 0.00 0.00 175.55 177.87 2wdi s ARG 63 N 1.73 4.36 -0.23 4.97 3.00 -1.26 -0.64 118.95 130.87 2wdi s ARG 63 Ca 0.07 0.98 -0.21 0.00 0.00 0.00 0.00 55.73 56.56 2wdi s ARG 63 Cb -0.16 -3.53 -0.02 0.00 0.00 0.00 0.00 34.95 31.24 2wdi s ARG 63 CO 0.10 -0.18 0.67 -1.50 0.00 0.00 0.00 175.30 174.39 2wdi s ILE 64 N 1.61 4.97 0.24 1.52 2.07 0.26 -4.98 121.20 126.90 2wdi s ILE 64 Ca 0.38 1.23 0.08 0.00 -1.41 0.00 0.00 60.65 60.93 2wdi s ILE 64 Cb -0.17 -3.97 -0.04 0.00 0.13 0.00 0.00 42.46 38.41 2wdi s ILE 64 CO 0.15 0.03 0.04 0.27 -1.91 0.00 0.00 174.94 173.53 2wdi s ILE 65 N 2.39 3.75 -0.40 2.00 -0.00 -1.26 -4.46 121.20 123.21 2wdi s ILE 65 Ca 0.28 -1.67 -0.24 0.00 -0.00 0.00 0.00 60.65 59.02 2wdi s ILE 65 Cb -0.16 -2.98 0.02 0.00 -0.00 0.00 0.00 42.46 39.34 2wdi s ILE 65 CO 0.09 -0.30 0.82 -0.62 -0.00 0.00 0.00 174.94 174.92 2wdi s ASP 66 N -3.53 6.52 0.00 4.36 2.15 0.11 -4.90 116.67 121.38 2wdi s ASP 66 Ca 0.31 0.21 0.10 0.00 0.43 0.00 0.00 52.55 53.60 2wdi s ASP 66 Cb -0.07 -2.41 0.27 0.00 -0.30 0.00 0.00 42.92 40.41 2wdi s ASP 66 CO 0.21 -0.84 1.21 0.49 -0.17 0.00 0.00 175.17 176.07 2wdi n PHE 67 N 6.65 0.41 -3.49 -5.34 0.99 -1.26 -4.74 117.46 110.68 2wdi n PHE 67 Ca 0.04 -0.47 -0.21 0.00 -0.00 0.00 0.00 57.45 56.80 2wdi n PHE 67 Cb 0.48 -0.03 -0.13 0.00 -1.00 0.00 0.00 39.48 38.81 2wdi n PHE 67 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.76 175.17 2wdi s LYS 68 N -0.99 0.21 0.00 -1.08 -2.85 -1.26 0.11 119.74 113.88 2wdi s LYS 68 Ca 0.21 -0.08 0.26 0.00 -1.00 0.00 0.00 55.97 55.35 2wdi s LYS 68 Cb 0.11 -1.13 0.54 0.00 -2.06 0.00 0.00 37.83 35.29 2wdi s LYS 68 CO 0.15 -0.84 1.45 -2.13 0.10 0.00 0.00 175.35 174.08 2wdi n ARG 69 N 5.30 1.80 0.00 1.78 0.63 -1.26 -4.18 116.66 120.72 2wdi n ARG 69 Ca -0.05 -1.32 0.03 0.00 -0.92 0.00 0.00 57.85 55.59 2wdi n ARG 69 Cb 0.47 -1.47 0.16 0.00 0.45 0.00 0.00 32.46 32.07 2wdi n ARG 69 CO 0.00 0.00 0.00 -2.67 -2.51 0.00 0.00 177.63 172.45 2wdi n TRP 70 N 0.55 0.00 0.30 -0.14 2.14 -1.26 -3.06 117.44 115.97 2wdi n TRP 70 Ca 0.15 0.00 -0.16 0.00 2.07 0.00 0.00 57.50 59.57 2wdi n TRP 70 Cb 0.47 0.00 -0.08 0.00 -0.81 0.00 0.00 31.31 30.89 2wdi n TRP 70 CO 0.00 0.00 0.00 -0.44 2.07 0.00 0.00 177.69 179.32 2wdi h ASP 71 N 0.00 -0.65 -2.73 -0.67 3.32 -1.98 -3.33 116.42 110.37 2wdi h ASP 71 Ca 0.00 -0.04 -0.78 0.00 0.02 0.00 0.00 57.03 56.24 2wdi h ASP 71 Cb 0.00 0.17 -0.30 0.00 0.22 0.00 0.00 39.33 39.42 2wdi h ASP 71 CO 0.00 -0.34 0.59 0.29 -1.72 0.00 0.00 179.24 178.06 2wdi n LYS 72 N -5.35 4.29 -2.21 3.56 5.02 -1.17 -5.02 118.16 117.28 2wdi n LYS 72 Ca -0.12 -4.59 -0.42 0.00 -2.02 0.00 0.00 58.31 51.15 2wdi n LYS 72 Cb 0.34 -2.47 -0.03 0.00 -0.02 0.00 0.00 35.03 32.86 2wdi n LYS 72 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wdi s VAL 73 N -2.95 3.77 0.00 -0.18 1.01 -1.25 -2.73 120.40 118.07 2wdi s VAL 73 Ca 0.33 1.08 0.00 0.00 0.00 0.00 0.00 61.98 63.40 2wdi s VAL 73 Cb 0.08 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.76 2wdi s VAL 73 CO 0.07 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2wdi n GLY 74 N 3.74 2.87 3.62 4.51 0.00 0.04 -4.96 105.19 115.01 2wdi n GLY 74 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2wdi n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wdi s ILE 75 N -1.13 3.93 0.75 -0.61 1.01 -1.10 -4.95 121.20 119.09 2wdi s ILE 75 Ca 0.00 1.02 -0.10 0.00 0.00 0.00 0.00 60.65 61.57 2wdi s ILE 75 Cb 0.00 -4.03 0.05 0.00 0.01 0.00 0.00 42.46 38.49 2wdi s ILE 75 CO 0.00 -0.50 1.11 -2.16 0.00 0.00 0.00 174.94 173.38 2wdi s PRO 76 N 4.58 2.31 0.01 2.79 0.04 -1.26 -4.63 135.00 138.84 2wdi s PRO 76 Ca 0.63 0.12 -0.19 0.00 0.04 0.00 0.00 61.00 61.60 2wdi s PRO 76 Cb -0.18 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.36 2wdi s PRO 76 CO 0.28 -1.32 0.41 0.00 0.04 0.00 0.00 177.00 176.41 2wdi s ALA 77 N -3.41 -1.02 0.19 8.56 0.00 -0.12 -1.23 121.76 124.73 2wdi s ALA 77 Ca 0.60 0.45 -0.03 0.00 0.00 0.00 0.00 51.96 52.98 2wdi s ALA 77 Cb -0.11 0.18 -0.05 0.00 0.00 0.00 0.00 23.12 23.14 2wdi s ALA 77 CO 0.49 -0.36 0.40 0.21 0.00 0.00 0.00 175.76 176.50 2wdi s LYS 78 N -1.82 3.58 -0.74 0.00 2.20 0.64 -0.57 119.74 123.02 2wdi s LYS 78 Ca -0.09 -0.18 -0.21 0.00 -0.36 0.00 0.00 55.97 55.12 2wdi s LYS 78 Cb -0.02 -2.82 0.09 0.00 -1.51 0.00 0.00 37.83 33.57 2wdi s LYS 78 CO 0.02 0.41 0.99 0.08 -0.36 0.00 0.00 175.35 176.49 2wdi s VAL 79 N -1.80 4.52 0.16 4.02 1.01 -0.48 -1.77 120.40 126.05 2wdi s VAL 79 Ca 0.40 -0.85 -0.16 0.00 0.00 0.00 0.00 61.98 61.37 2wdi s VAL 79 Cb -0.11 -4.69 0.03 0.00 0.00 0.00 0.00 36.38 31.60 2wdi s VAL 79 CO 0.27 -1.44 1.76 0.00 0.00 0.00 0.00 175.10 175.69 2wdi h ALA 80 N 9.28 0.44 -2.63 5.51 0.00 -0.99 -2.58 119.26 128.29 2wdi h ALA 80 Ca -0.14 0.04 0.12 0.00 0.00 0.00 0.00 54.91 54.93 2wdi h ALA 80 Cb 1.06 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 2wdi h ALA 80 CO 1.15 -0.25 0.44 0.00 0.00 0.00 0.00 179.25 180.59 2wdi s ALA 81 N -6.16 -1.39 -0.31 0.00 0.00 -0.67 -4.86 121.76 108.38 2wdi s ALA 81 Ca -0.13 -0.26 -0.00 0.00 0.00 0.00 0.00 51.96 51.57 2wdi s ALA 81 Cb 0.12 0.71 0.10 0.00 0.00 0.00 0.00 23.12 24.05 2wdi s ALA 81 CO 0.71 -1.04 0.08 0.42 0.00 0.00 0.00 175.76 175.94 2wdi s ILE 82 N -2.83 1.12 0.56 0.00 1.01 -1.26 0.44 121.20 120.24 2wdi s ILE 82 Ca 0.16 -1.52 0.06 0.00 0.00 0.00 0.00 60.65 59.35 2wdi s ILE 82 Cb -0.03 -1.82 0.10 0.00 0.01 0.00 0.00 42.46 40.72 2wdi s ILE 82 CO 0.06 -0.63 0.77 -0.62 0.00 0.00 0.00 174.94 174.52 2wdi n GLU 83 N 4.75 0.45 -3.79 2.79 1.02 -0.42 -4.22 120.64 121.22 2wdi n GLU 83 Ca -0.02 -2.69 -0.37 0.00 -0.02 0.00 0.00 57.16 54.06 2wdi n GLU 83 Cb 0.42 -0.32 -0.06 0.00 -0.02 0.00 0.00 31.44 31.46 2wdi n GLU 83 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2wdi s TYR 84 N -2.37 3.61 -0.13 -0.32 5.04 -1.26 -2.79 117.35 119.12 2wdi s TYR 84 Ca 0.56 0.60 0.01 0.00 -2.44 0.00 0.00 57.07 55.81 2wdi s TYR 84 Cb -0.04 -2.03 0.02 0.00 0.35 0.00 0.00 41.96 40.25 2wdi s TYR 84 CO 0.36 0.67 -0.16 0.34 -1.34 0.00 0.00 175.55 175.42 2wdi s ASP 85 N -0.89 2.63 0.30 4.32 -1.08 -1.26 -4.88 116.67 115.81 2wdi s ASP 85 Ca 0.16 -0.48 0.13 0.00 -0.52 0.00 0.00 52.55 51.84 2wdi s ASP 85 Cb -0.13 -1.18 0.43 0.00 -1.46 0.00 0.00 42.92 40.58 2wdi s ASP 85 CO 0.05 -0.00 1.64 1.55 0.52 0.00 0.00 175.17 178.93 2wdi h PRO 86 N 7.65 0.00 0.00 4.34 0.13 -1.94 -3.20 132.00 138.98 2wdi h PRO 86 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2wdi h PRO 86 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2wdi h PRO 86 CO 0.52 0.56 0.00 0.09 -0.23 0.00 0.00 178.00 178.93 2wdi n ASN 87 N -3.73 0.00 -3.93 1.44 3.02 -1.26 -4.89 115.26 105.91 2wdi n ASN 87 Ca -0.01 -1.17 -0.08 0.00 -0.03 0.00 0.00 54.58 53.28 2wdi n ASN 87 Cb 0.59 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.72 2wdi n ASN 87 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wdi s ARG 88 N -2.00 1.62 0.03 3.52 1.70 -1.21 -5.02 118.95 117.60 2wdi s ARG 88 Ca 0.25 -1.13 -0.10 0.00 -0.47 0.00 0.00 55.73 54.28 2wdi s ARG 88 Cb 0.12 0.52 -0.32 0.00 -0.57 0.00 0.00 34.95 34.70 2wdi s ARG 88 CO 0.19 -0.70 1.00 0.66 -1.08 0.00 0.00 175.30 175.37 2wdi h SER 89 N 2.16 0.64 -4.30 -2.89 4.64 -1.90 -3.45 113.55 108.44 2wdi h SER 89 Ca -0.24 -0.72 -0.51 0.00 -0.47 0.00 0.00 61.79 59.85 2wdi h SER 89 Cb 1.25 -0.21 0.12 0.00 -0.31 0.00 0.00 62.40 63.26 2wdi h SER 89 CO 0.31 1.57 0.33 0.00 -0.87 0.00 0.00 176.83 178.17 2wdi s ALA 90 N -2.62 2.32 0.15 5.18 0.00 -1.26 -4.59 121.76 120.93 2wdi s ALA 90 Ca -0.08 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.08 2wdi s ALA 90 Cb 0.05 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 2wdi s ALA 90 CO 0.91 -1.66 0.17 1.03 0.00 0.00 0.00 175.76 176.21 2wdi s ARG 91 N -4.96 3.07 0.41 0.00 1.81 -1.26 -4.56 118.95 113.46 2wdi s ARG 91 Ca 0.60 -0.76 0.08 0.00 -1.72 0.00 0.00 55.73 53.93 2wdi s ARG 91 Cb -0.16 -2.76 -0.02 0.00 -0.45 0.00 0.00 34.95 31.56 2wdi s ARG 91 CO 0.56 0.51 0.36 0.96 -0.68 0.00 0.00 175.30 177.01 2wdi s ILE 92 N -1.70 2.65 -0.04 1.52 -0.00 -1.12 0.03 121.20 122.55 2wdi s ILE 92 Ca 0.32 -1.37 0.03 0.00 -0.00 0.00 0.00 60.65 59.62 2wdi s ILE 92 Cb -0.11 -3.00 0.01 0.00 -0.00 0.00 0.00 42.46 39.36 2wdi s ILE 92 CO 0.25 -0.00 -0.10 0.00 -0.00 0.00 0.00 174.94 175.08 2wdi s ALA 93 N -2.48 1.00 -0.32 2.27 0.00 0.13 -1.30 121.76 121.06 2wdi s ALA 93 Ca 0.47 -0.37 -0.18 0.00 0.00 0.00 0.00 51.96 51.89 2wdi s ALA 93 Cb -0.03 -0.40 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 2wdi s ALA 93 CO 0.27 0.14 0.52 -1.17 0.00 0.00 0.00 175.76 175.52 2wdi s LEU 94 N 0.32 4.23 -0.12 0.00 0.20 0.17 -1.34 118.68 122.14 2wdi s LEU 94 Ca -0.06 0.17 0.02 0.00 0.69 0.00 0.00 54.13 54.95 2wdi s LEU 94 Cb -0.11 -2.62 0.01 0.00 -0.43 0.00 0.00 46.19 43.04 2wdi s LEU 94 CO 0.01 -0.42 -0.18 -1.48 -0.29 0.00 0.00 176.35 173.99 2wdi s LEU 95 N 2.39 1.86 0.02 -0.68 0.05 0.00 -0.30 118.68 122.02 2wdi s LEU 95 Ca 0.20 -0.49 -0.30 0.00 0.05 0.00 0.00 54.13 53.59 2wdi s LEU 95 Cb -0.15 -1.22 -0.03 0.00 -2.05 0.00 0.00 46.19 42.73 2wdi s LEU 95 CO 0.12 0.04 0.97 -1.00 -0.55 0.00 0.00 176.35 175.92 2wdi s HIS 96 N 0.94 3.68 0.34 3.48 3.76 -0.73 -2.11 115.29 124.65 2wdi s HIS 96 Ca -0.06 1.70 -0.02 0.00 -0.15 0.00 0.00 55.06 56.52 2wdi s HIS 96 Cb -0.15 -3.10 -0.04 0.00 1.11 0.00 0.00 32.58 30.40 2wdi s HIS 96 CO -0.02 0.03 0.58 0.71 -0.85 0.00 0.00 174.74 175.19 2wdi s TYR 97 N 0.83 3.50 0.50 1.40 1.51 0.31 -0.26 117.35 125.14 2wdi s TYR 97 Ca 0.51 0.52 0.20 0.00 -1.01 0.00 0.00 57.07 57.29 2wdi s TYR 97 Cb -0.21 -2.03 1.32 0.00 -0.11 0.00 0.00 41.96 40.93 2wdi s TYR 97 CO 0.28 0.09 2.11 0.28 -1.11 0.00 0.00 175.55 177.20 2wdi h VAL 98 N 0.91 0.89 -0.96 0.71 2.07 -1.47 -0.12 116.25 118.28 2wdi h VAL 98 Ca -0.49 -0.27 0.15 0.00 0.82 0.00 0.00 66.70 66.92 2wdi h VAL 98 Cb 1.21 1.15 -0.08 0.00 -1.52 0.00 0.00 31.29 32.04 2wdi h VAL 98 CO 0.63 0.07 0.61 -0.78 0.02 0.00 0.00 177.57 178.12 2wdi h ASP 99 N 0.00 0.77 0.00 0.57 -0.00 -1.92 -3.45 116.42 112.38 2wdi h ASP 99 Ca -0.00 0.06 0.00 0.00 -0.00 0.00 0.00 57.03 57.09 2wdi h ASP 99 Cb 0.15 -0.09 0.00 0.00 -0.00 0.00 0.00 39.33 39.38 2wdi h ASP 99 CO 0.01 0.36 0.00 0.61 -0.00 0.00 0.00 179.24 180.22 2wdi n GLY 100 N -1.38 2.28 3.74 -0.78 0.00 -0.06 -5.08 105.19 103.91 2wdi n GLY 100 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2wdi n GLY 100 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wdi s GLU 101 N -0.33 4.73 0.01 1.61 2.12 -1.26 -4.72 118.70 120.87 2wdi s GLU 101 Ca 0.00 1.54 0.02 0.00 0.36 0.00 0.00 54.97 56.89 2wdi s GLU 101 Cb 0.00 -3.31 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 2wdi s GLU 101 CO 0.00 0.30 0.00 0.15 -0.54 0.00 0.00 175.26 175.17 2wdi s LYS 102 N -0.59 2.78 0.26 4.30 1.02 -1.26 -0.53 119.74 125.71 2wdi s LYS 102 Ca 0.45 -0.62 -0.07 0.00 0.02 0.00 0.00 55.97 55.75 2wdi s LYS 102 Cb -0.26 -2.67 -0.01 0.00 -0.52 0.00 0.00 37.83 34.37 2wdi s LYS 102 CO 0.32 0.62 0.40 1.03 -0.92 0.00 0.00 175.35 176.80 2wdi s ARG 103 N -1.61 1.57 0.10 1.68 0.52 -0.90 -4.99 118.95 115.31 2wdi s ARG 103 Ca 0.20 -1.48 0.09 0.00 -0.52 0.00 0.00 55.73 54.02 2wdi s ARG 103 Cb -0.12 0.42 -0.04 0.00 0.52 0.00 0.00 34.95 35.73 2wdi s ARG 103 CO 0.11 -0.62 -0.20 0.71 0.02 0.00 0.00 175.30 175.31 2wdi s TYR 104 N -3.79 2.48 -0.05 -0.53 4.12 -1.26 -0.82 117.35 117.51 2wdi s TYR 104 Ca 0.29 -0.29 -0.04 0.00 0.02 0.00 0.00 57.07 57.04 2wdi s TYR 104 Cb 0.01 -1.35 0.01 0.00 -1.52 0.00 0.00 41.96 39.12 2wdi s TYR 104 CO 0.13 0.34 0.13 -1.50 0.02 0.00 0.00 175.55 174.67 2wdi s ILE 105 N -1.07 -0.00 -0.31 2.71 1.10 -0.45 -0.72 121.20 122.46 2wdi s ILE 105 Ca 0.16 0.00 -0.28 0.00 -0.51 0.00 0.00 60.65 60.03 2wdi s ILE 105 Cb -0.10 -0.19 -0.05 0.00 0.15 0.00 0.00 42.46 42.27 2wdi s ILE 105 CO 0.08 0.00 2.16 -0.51 -2.11 0.00 0.00 174.94 174.56 2wdi s ILE 106 N 0.07 3.11 -0.26 2.00 2.07 -1.26 0.17 121.20 127.10 2wdi s ILE 106 Ca -0.00 0.11 -0.31 0.00 -1.41 0.00 0.00 60.65 59.04 2wdi s ILE 106 Cb -0.01 -3.17 -0.08 0.00 0.13 0.00 0.00 42.46 39.33 2wdi s ILE 106 CO 0.00 -0.13 2.20 0.00 -1.91 0.00 0.00 174.94 175.10 2wdi n ALA 107 N 12.34 1.52 -1.24 1.50 0.00 0.10 -4.86 120.51 129.87 2wdi n ALA 107 Ca 0.29 -0.16 -0.30 0.00 0.00 0.00 0.00 53.44 53.27 2wdi n ALA 107 Cb 0.48 -2.78 0.13 0.00 0.00 0.00 0.00 19.45 17.28 2wdi n ALA 107 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2wdi s PRO 108 N 6.22 1.33 -0.05 0.00 0.04 -1.26 -4.31 135.00 136.97 2wdi s PRO 108 Ca 1.04 0.79 -0.30 0.00 0.04 0.00 0.00 61.00 62.57 2wdi s PRO 108 Cb -0.53 -1.82 -0.02 0.00 0.04 0.00 0.00 34.50 32.17 2wdi s PRO 108 CO 0.41 -2.19 1.01 0.34 0.04 0.00 0.00 177.00 176.61 2wdi s ASP 109 N -3.48 7.29 0.00 6.66 3.68 0.11 -3.46 116.67 127.47 2wdi s ASP 109 Ca 0.63 1.62 0.00 0.00 2.13 0.00 0.00 52.55 56.93 2wdi s ASP 109 Cb -0.18 -2.56 0.00 0.00 -1.45 0.00 0.00 42.92 38.73 2wdi s ASP 109 CO 0.57 -0.37 0.00 0.61 0.13 0.00 0.00 175.17 176.11 2wdi n GLY 110 N 3.02 2.18 3.57 2.66 0.00 -1.26 -4.61 105.19 110.75 2wdi n GLY 110 Ca 0.08 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 2wdi n GLY 110 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2wdi n LEU 111 N 0.00 1.92 -3.98 0.99 -0.00 -1.22 -5.00 117.00 109.70 2wdi n LEU 111 Ca 0.00 1.02 -0.09 0.00 -0.00 0.00 0.00 56.01 56.93 2wdi n LEU 111 Cb 0.00 -1.29 -0.11 0.00 -0.00 0.00 0.00 43.42 42.02 2wdi n LEU 111 CO 0.00 -1.82 -0.36 -1.10 -0.00 0.00 0.00 177.39 174.11 2wdi s GLN 112 N -1.88 0.32 0.01 1.96 -0.21 -1.26 -5.01 119.66 113.59 2wdi s GLN 112 Ca 0.63 -0.60 -0.30 0.00 0.02 0.00 0.00 55.36 55.11 2wdi s GLN 112 Cb -0.58 0.08 -0.09 0.00 1.00 0.00 0.00 33.01 33.42 2wdi s GLN 112 CO 0.57 -0.04 2.00 1.33 -2.12 0.00 0.00 175.29 177.03 2wdi n VAL 113 N 1.63 0.73 0.00 1.09 0.24 -1.26 -1.97 118.33 118.79 2wdi n VAL 113 Ca -0.24 -0.17 0.00 0.00 -2.04 0.00 0.00 64.34 61.90 2wdi n VAL 113 Cb 0.55 -2.34 0.00 0.00 -1.47 0.00 0.00 33.84 30.58 2wdi n VAL 113 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wdi n GLY 114 N 4.67 3.59 3.28 7.63 0.00 -0.97 -5.02 105.19 118.36 2wdi n GLY 114 Ca 0.21 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 2wdi n GLY 114 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wdi n GLN 115 N 0.00 -0.20 -4.11 1.61 6.02 -0.83 -4.42 117.38 115.45 2wdi n GLN 115 Ca 0.00 -0.03 -0.22 0.00 -0.01 0.00 0.00 57.00 56.74 2wdi n GLN 115 Cb 0.00 -1.58 -0.05 0.00 1.02 0.00 0.00 30.24 29.63 2wdi n GLN 115 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2wdi s GLN 116 N -3.11 2.63 0.09 -1.09 0.74 -1.26 -1.39 119.66 116.27 2wdi s GLN 116 Ca 0.51 -1.27 -0.21 0.00 0.05 0.00 0.00 55.36 54.44 2wdi s GLN 116 Cb -0.20 -2.38 0.05 0.00 1.10 0.00 0.00 33.01 31.58 2wdi s GLN 116 CO 0.72 0.29 0.51 0.54 -0.55 0.00 0.00 175.29 176.81 2wdi s VAL 117 N -2.26 0.03 0.02 1.34 0.11 0.26 -4.93 120.40 114.97 2wdi s VAL 117 Ca 0.35 -0.26 -0.27 0.00 -2.93 0.00 0.00 61.98 58.86 2wdi s VAL 117 Cb -0.06 -1.02 0.09 0.00 -1.53 0.00 0.00 36.38 33.86 2wdi s VAL 117 CO 0.24 -0.14 0.80 0.54 -3.33 0.00 0.00 175.10 173.20 2wdi s VAL 118 N -3.02 0.00 0.04 2.04 0.11 -1.26 -0.94 120.40 117.36 2wdi s VAL 118 Ca -0.02 0.00 0.09 0.00 -2.93 0.00 0.00 61.98 59.12 2wdi s VAL 118 Cb -0.00 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 2wdi s VAL 118 CO -0.06 0.00 -0.26 0.00 -3.33 0.00 0.00 175.10 171.44 2wdi s ALA 119 N -2.98 2.23 0.00 1.54 0.00 -1.26 -2.93 121.76 118.36 2wdi s ALA 119 Ca 0.02 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2wdi s ALA 119 Cb -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.63 2wdi s ALA 119 CO -0.08 0.53 0.00 0.41 0.00 0.00 0.00 175.76 176.62 2wdi n GLY 120 N 1.88 1.28 0.19 0.00 0.00 -0.30 -0.78 105.19 107.46 2wdi n GLY 120 Ca -0.17 -1.31 -0.18 0.00 0.00 0.00 0.00 46.02 44.37 2wdi n GLY 120 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wdi h PRO 121 N 0.00 0.66 -0.54 1.61 0.11 -1.97 -3.10 132.00 128.76 2wdi h PRO 121 Ca 0.00 -0.58 0.05 0.00 0.11 0.00 0.00 66.00 65.58 2wdi h PRO 121 Cb 0.00 0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.21 2wdi h PRO 121 CO 0.00 1.19 0.36 0.38 -0.21 0.00 0.00 178.00 179.72 2wdi h ASP 122 N 0.32 0.48 -0.99 -2.05 3.04 -1.95 -3.46 116.42 111.81 2wdi h ASP 122 Ca -0.06 -0.00 -0.67 0.00 -3.24 0.00 0.00 57.03 53.05 2wdi h ASP 122 Cb 1.37 -0.11 0.11 0.00 -1.04 0.00 0.00 39.33 39.66 2wdi h ASP 122 CO 0.15 0.32 -0.50 0.00 -2.04 0.00 0.00 179.24 177.17 2wdi n ALA 123 N -2.48 -2.90 -1.87 4.15 0.00 -1.17 -4.93 120.51 111.30 2wdi n ALA 123 Ca 0.07 0.44 -0.40 0.00 0.00 0.00 0.00 53.44 53.55 2wdi n ALA 123 Cb 0.19 -1.61 -0.05 0.00 0.00 0.00 0.00 19.45 17.99 2wdi n ALA 123 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2wdi s PRO 124 N -0.95 4.71 -1.12 0.00 0.04 -1.26 -4.94 135.00 131.47 2wdi s PRO 124 Ca 0.65 1.65 -0.23 0.00 0.04 0.00 0.00 61.00 63.11 2wdi s PRO 124 Cb -0.94 -3.26 -0.05 0.00 0.04 0.00 0.00 34.50 30.30 2wdi s PRO 124 CO 0.56 0.28 1.88 0.42 0.04 0.00 0.00 177.00 180.18 2wdi s ILE 125 N -0.85 3.62 -0.02 0.56 -1.09 -1.26 -4.80 121.20 117.37 2wdi s ILE 125 Ca 0.45 -0.91 -0.21 0.00 -2.23 0.00 0.00 60.65 57.75 2wdi s ILE 125 Cb -0.29 -4.54 0.04 0.00 -1.58 0.00 0.00 42.46 36.09 2wdi s ILE 125 CO 0.36 -1.18 0.45 0.00 -1.23 0.00 0.00 174.94 173.34 2wdi s GLN 126 N 6.21 0.84 -0.18 2.79 -2.07 -1.26 -5.11 119.66 120.88 2wdi s GLN 126 Ca 0.65 -0.05 -0.30 0.00 -1.82 0.00 0.00 55.36 53.84 2wdi s GLN 126 Cb -0.02 0.38 -0.14 0.00 -1.09 0.00 0.00 33.01 32.15 2wdi s GLN 126 CO 0.08 -0.25 0.94 0.28 -1.32 0.00 0.00 175.29 175.01 2wdi n VAL 127 N 1.05 0.00 0.00 3.63 0.31 -1.26 -1.82 118.33 120.24 2wdi n VAL 127 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 2wdi n VAL 127 Cb 0.57 -0.18 0.00 0.00 -0.91 0.00 0.00 33.84 33.32 2wdi n VAL 127 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wdi n GLY 128 N 1.95 1.46 3.79 2.92 0.00 -0.80 -4.93 105.19 109.58 2wdi n GLY 128 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 2wdi n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wdi s ASN 129 N -1.86 6.72 0.08 1.61 0.01 -0.75 -4.52 114.94 116.22 2wdi s ASN 129 Ca 0.00 0.85 0.01 0.00 -0.71 0.00 0.00 52.86 53.01 2wdi s ASN 129 Cb 0.00 -2.25 -0.04 0.00 0.41 0.00 0.00 41.25 39.37 2wdi s ASN 129 CO 0.00 0.21 0.21 0.00 -1.51 0.00 0.00 177.10 176.01 2wdi s ALA 130 N -0.43 3.94 -0.03 0.60 0.00 -1.15 -0.95 121.76 123.75 2wdi s ALA 130 Ca 0.23 -0.90 -0.29 0.00 0.00 0.00 0.00 51.96 51.00 2wdi s ALA 130 Cb -0.16 -1.77 0.11 0.00 0.00 0.00 0.00 23.12 21.30 2wdi s ALA 130 CO 0.11 0.76 0.92 -0.51 0.00 0.00 0.00 175.76 177.05 2wdi s LEU 131 N -2.63 -0.34 0.44 0.00 1.02 -1.07 -1.14 118.68 114.95 2wdi s LEU 131 Ca 0.34 0.01 -0.25 0.00 0.02 0.00 0.00 54.13 54.25 2wdi s LEU 131 Cb -0.13 1.96 -0.08 0.00 0.02 0.00 0.00 46.19 47.96 2wdi s LEU 131 CO 0.27 -0.57 1.34 -2.84 0.02 0.00 0.00 176.35 174.57 2wdi s PRO 132 N -2.99 3.78 0.52 1.29 0.02 -1.26 -2.28 135.00 134.08 2wdi s PRO 132 Ca 0.05 2.22 0.27 0.00 0.02 0.00 0.00 61.00 63.56 2wdi s PRO 132 Cb -0.01 -2.65 1.40 0.00 0.02 0.00 0.00 34.50 33.26 2wdi s PRO 132 CO -0.08 -0.67 1.94 -0.07 -0.33 0.00 0.00 177.00 177.79 2wdi h LEU 133 N 2.40 0.04 -1.56 -5.54 3.38 -0.14 -0.71 115.31 113.19 2wdi h LEU 133 Ca -0.50 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.51 2wdi h LEU 133 Cb 1.26 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 2wdi h LEU 133 CO 0.61 0.02 0.34 0.08 0.09 0.00 0.00 178.44 179.58 2wdi h ARG 134 N 0.04 0.56 -0.64 1.13 0.11 -1.51 -1.00 114.38 113.07 2wdi h ARG 134 Ca 0.35 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.39 2wdi h ARG 134 Cb 1.32 -0.13 0.00 0.00 1.11 0.00 0.00 29.97 32.27 2wdi h ARG 134 CO -0.02 0.37 0.00 1.19 0.10 0.00 0.00 179.97 181.61 2wdi n PHE 135 N -4.47 1.10 -4.56 4.08 0.99 -0.28 -4.83 117.46 109.49 2wdi n PHE 135 Ca 0.06 -0.41 -0.34 0.00 -0.00 0.00 0.00 57.45 56.76 2wdi n PHE 135 Cb 0.15 -0.24 -0.12 0.00 -1.00 0.00 0.00 39.48 38.27 2wdi n PHE 135 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 2wdi s ILE 136 N -1.87 3.69 0.03 4.37 1.01 -0.38 -4.95 121.20 123.10 2wdi s ILE 136 Ca 0.34 -0.46 -0.31 0.00 0.00 0.00 0.00 60.65 60.23 2wdi s ILE 136 Cb 0.23 -2.56 -0.10 0.00 0.01 0.00 0.00 42.46 40.05 2wdi s ILE 136 CO 0.14 0.54 1.95 -2.65 0.00 0.00 0.00 174.94 174.92 2wdi n PRO 137 N 2.96 2.77 -1.66 2.79 -0.02 -1.26 -4.90 135.00 135.68 2wdi n PRO 137 Ca -0.18 1.02 -0.50 0.00 -2.02 0.00 0.00 63.50 61.82 2wdi n PRO 137 Cb 0.53 -2.95 -0.05 0.00 -0.02 0.00 0.00 33.50 31.00 2wdi n PRO 137 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2wdi n VAL 138 N 5.40 0.20 0.00 -1.45 3.14 -1.26 -1.37 118.33 122.99 2wdi n VAL 138 Ca 0.20 -0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.55 2wdi n VAL 138 Cb 0.39 -1.42 0.00 0.00 -1.06 0.00 0.00 33.84 31.75 2wdi n VAL 138 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2wdi n GLY 139 N 3.60 0.79 3.76 7.55 0.00 -0.62 -4.99 105.19 115.28 2wdi n GLY 139 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 2wdi n GLY 139 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wdi s THR 140 N -1.27 2.85 0.06 2.61 -4.23 -0.47 -4.57 115.64 110.61 2wdi s THR 140 Ca 0.00 0.59 -0.15 0.00 -1.18 0.00 0.00 61.69 60.95 2wdi s THR 140 Cb 0.00 -3.28 -0.06 0.00 1.34 0.00 0.00 72.50 70.50 2wdi s THR 140 CO 0.00 -0.05 0.47 0.68 -0.54 0.00 0.00 174.62 175.18 2wdi s VAL 141 N -1.55 4.94 0.11 2.29 -7.23 -1.26 -2.41 120.40 115.29 2wdi s VAL 141 Ca 0.69 0.87 -0.05 0.00 -1.81 0.00 0.00 61.98 61.68 2wdi s VAL 141 Cb -0.30 -3.75 -0.02 0.00 0.56 0.00 0.00 36.38 32.87 2wdi s VAL 141 CO 0.35 0.47 0.14 0.54 -0.31 0.00 0.00 175.10 176.29 2wdi s VAL 142 N -1.20 0.13 0.25 1.32 0.11 0.14 -0.88 120.40 120.27 2wdi s VAL 142 Ca 0.29 -1.54 0.02 0.00 -2.93 0.00 0.00 61.98 57.81 2wdi s VAL 142 Cb -0.17 -1.69 -0.04 0.00 -1.53 0.00 0.00 36.38 32.96 2wdi s VAL 142 CO 0.16 -0.57 0.17 -1.38 -3.33 0.00 0.00 175.10 170.15 2wdi s HIS 143 N -3.95 1.38 -1.42 1.54 -3.43 0.50 -0.40 115.29 109.51 2wdi s HIS 143 Ca 0.13 -1.44 -0.10 0.00 -0.80 0.00 0.00 55.06 52.85 2wdi s HIS 143 Cb 0.06 -0.65 0.03 0.00 -1.43 0.00 0.00 32.58 30.59 2wdi s HIS 143 CO -0.05 -0.67 1.10 0.00 -2.00 0.00 0.00 174.74 173.12 2wdi n ALA 144 N -0.40 -1.28 -1.69 -1.38 0.00 -0.06 -1.31 120.51 114.39 2wdi n ALA 144 Ca 0.03 0.35 -0.34 0.00 0.00 0.00 0.00 53.44 53.48 2wdi n ALA 144 Cb 0.65 -5.16 0.01 0.00 0.00 0.00 0.00 19.45 14.95 2wdi n ALA 144 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wdi s VAL 145 N -3.30 3.29 0.31 0.00 1.01 -0.91 -4.17 120.40 116.63 2wdi s VAL 145 Ca 0.59 0.72 -0.01 0.00 0.00 0.00 0.00 61.98 63.29 2wdi s VAL 145 Cb -0.27 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 2wdi s VAL 145 CO 0.73 -0.25 0.52 -1.61 0.00 0.00 0.00 175.10 174.49 2wdi s GLU 146 N -3.59 3.52 -0.20 2.72 2.02 -1.07 -0.44 118.70 121.66 2wdi s GLU 146 Ca 0.70 -0.27 -0.16 0.00 0.02 0.00 0.00 54.97 55.26 2wdi s GLU 146 Cb -0.22 -2.69 -0.08 0.00 0.10 0.00 0.00 34.13 31.24 2wdi s GLU 146 CO 0.31 0.21 -0.28 -0.11 0.02 0.00 0.00 175.26 175.42 2wdi n LEU 147 N -1.41 1.92 -4.65 1.80 7.94 -1.25 -4.85 117.00 116.49 2wdi n LEU 147 Ca -0.04 0.39 -0.27 0.00 -1.11 0.00 0.00 56.01 54.98 2wdi n LEU 147 Cb 0.55 -0.80 -0.08 0.00 0.53 0.00 0.00 43.42 43.62 2wdi n LEU 147 CO 0.48 -0.01 -0.34 -1.61 -1.11 0.00 0.00 177.39 174.80 2wdi s GLU 148 N -2.64 2.37 0.52 1.96 2.02 -1.26 -4.36 118.70 117.31 2wdi s GLU 148 Ca -0.30 -1.12 -0.21 0.00 0.02 0.00 0.00 54.97 53.36 2wdi s GLU 148 Cb 0.07 -2.34 -0.06 0.00 0.10 0.00 0.00 34.13 31.90 2wdi s GLU 148 CO 0.43 0.45 1.22 -1.25 0.02 0.00 0.00 175.26 176.13 2wdi s PRO 149 N -2.93 3.37 0.00 0.39 0.04 -1.26 -2.71 135.00 131.89 2wdi s PRO 149 Ca 0.27 1.89 0.00 0.00 0.04 0.00 0.00 61.00 63.20 2wdi s PRO 149 Cb -0.09 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.24 2wdi s PRO 149 CO 0.18 -0.90 0.00 1.63 0.04 0.00 0.00 177.00 177.95 2wdi n LYS 150 N -0.97 0.00 0.00 4.56 4.76 -1.26 -4.78 118.16 120.47 2wdi n LYS 150 Ca 0.10 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.67 2wdi n LYS 150 Cb 0.48 -3.98 0.41 0.00 -1.84 0.00 0.00 35.03 30.09 2wdi n LYS 150 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2wdi n LYS 151 N -2.00 0.60 0.00 1.97 5.02 -1.10 -5.05 118.16 117.59 2wdi n LYS 151 Ca 0.00 -0.32 0.00 0.00 -2.02 0.00 0.00 58.31 55.97 2wdi n LYS 151 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 2wdi n LYS 151 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wdi n GLY 152 N 1.37 -0.15 3.77 0.72 0.00 -1.26 -4.98 105.19 104.66 2wdi n GLY 152 Ca 0.11 -1.65 -0.40 0.00 0.00 0.00 0.00 46.02 44.09 2wdi n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdi s ALA 153 N -2.99 3.27 0.00 4.61 0.00 0.31 -3.95 121.76 123.00 2wdi s ALA 153 Ca 0.00 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.36 2wdi s ALA 153 Cb 0.00 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.56 2wdi s ALA 153 CO 0.00 -1.07 0.00 1.63 0.00 0.00 0.00 175.76 176.32 2wdi n LYS 154 N -0.05 0.00 -4.32 0.00 5.02 0.42 -4.92 118.16 114.30 2wdi n LYS 154 Ca 0.04 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.06 2wdi n LYS 154 Cb 0.42 -0.07 -0.10 0.00 -0.02 0.00 0.00 35.03 35.26 2wdi n LYS 154 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wdi s LEU 155 N 0.00 2.83 -0.68 -0.35 1.02 -0.57 -4.85 118.68 116.08 2wdi s LEU 155 Ca 0.00 -0.65 -0.12 0.00 0.02 0.00 0.00 54.13 53.38 2wdi s LEU 155 Cb 0.00 -1.54 0.02 0.00 0.02 0.00 0.00 46.19 44.69 2wdi s LEU 155 CO 0.00 0.11 0.63 0.00 0.02 0.00 0.00 176.35 177.11 2wdi n ALA 156 N 0.12 -2.64 -0.01 4.21 0.00 -1.26 -2.09 120.51 118.84 2wdi n ALA 156 Ca -0.11 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2wdi n ALA 156 Cb 0.55 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.57 2wdi n ALA 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wdi n ARG 157 N -1.68 3.26 -2.51 0.00 1.74 -1.26 -0.89 116.66 115.33 2wdi n ARG 157 Ca -0.19 -0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.55 2wdi n ARG 157 Cb 0.66 -0.25 -0.03 0.00 -1.02 0.00 0.00 32.46 31.82 2wdi n ARG 157 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wdi s ALA 158 N -0.47 2.89 0.16 7.54 0.00 -1.26 -4.53 121.76 126.08 2wdi s ALA 158 Ca 0.00 0.53 -0.25 0.00 0.00 0.00 0.00 51.96 52.23 2wdi s ALA 158 Cb 0.00 -3.23 -0.15 0.00 0.00 0.00 0.00 23.12 19.74 2wdi s ALA 158 CO 0.00 -0.32 0.50 0.00 0.00 0.00 0.00 175.76 175.94 2wdi n ALA 159 N -1.10 -2.70 -1.53 0.00 0.00 -1.26 -0.65 120.51 113.26 2wdi n ALA 159 Ca 0.09 0.40 -0.08 0.00 0.00 0.00 0.00 53.44 53.85 2wdi n ALA 159 Cb 0.53 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 2wdi n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdi n GLY 160 N 1.70 0.44 3.96 0.00 0.00 -0.64 -4.84 105.19 105.81 2wdi n GLY 160 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 2wdi n GLY 160 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wdi s THR 161 N -1.85 2.43 -0.19 2.61 -4.23 0.17 -4.67 115.64 109.92 2wdi s THR 161 Ca 0.00 -0.49 -0.34 0.00 -1.18 0.00 0.00 61.69 59.69 2wdi s THR 161 Cb 0.00 -2.95 0.14 0.00 1.34 0.00 0.00 72.50 71.04 2wdi s THR 161 CO 0.00 0.00 1.19 -0.94 -0.54 0.00 0.00 174.62 174.33 2wdi s SER 162 N -4.51 -0.16 0.12 3.99 1.04 -1.26 -0.66 113.70 112.25 2wdi s SER 162 Ca 0.60 0.04 0.08 0.00 0.48 0.00 0.00 55.95 57.15 2wdi s SER 162 Cb -0.10 0.15 -0.04 0.00 0.10 0.00 0.00 66.02 66.14 2wdi s SER 162 CO 0.42 -0.23 -0.18 0.00 0.98 0.00 0.00 173.24 174.22 2wdi s ALA 163 N -2.13 1.74 -0.02 5.32 0.00 0.47 -3.36 121.76 123.77 2wdi s ALA 163 Ca 0.08 -1.29 0.06 0.00 0.00 0.00 0.00 51.96 50.81 2wdi s ALA 163 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 2wdi s ALA 163 CO -0.05 0.27 -0.19 -1.14 0.00 0.00 0.00 175.76 174.65 2wdi s GLN 164 N -2.23 1.58 -0.07 0.00 0.74 -1.12 0.27 119.66 118.83 2wdi s GLN 164 Ca 0.08 -0.69 -0.30 0.00 0.05 0.00 0.00 55.36 54.50 2wdi s GLN 164 Cb -0.08 -1.52 -0.02 0.00 1.10 0.00 0.00 33.01 32.49 2wdi s GLN 164 CO 0.04 0.41 1.03 0.42 -0.55 0.00 0.00 175.29 176.65 2wdi s ILE 165 N -0.45 4.70 -0.70 -2.34 -1.09 -1.01 -1.89 121.20 118.42 2wdi s ILE 165 Ca 0.07 1.96 0.22 0.00 -2.23 0.00 0.00 60.65 60.68 2wdi s ILE 165 Cb -0.08 -4.26 -0.18 0.00 -1.58 0.00 0.00 42.46 36.37 2wdi s ILE 165 CO -0.01 0.04 0.94 1.67 -1.23 0.00 0.00 174.94 176.36 2wdi n GLN 166 N 4.75 0.21 0.00 2.79 -0.06 0.34 -1.58 117.38 123.83 2wdi n GLN 166 Ca 0.08 -0.03 0.00 0.00 -2.00 0.00 0.00 57.00 55.05 2wdi n GLN 166 Cb 0.49 -1.54 0.00 0.00 -4.06 0.00 0.00 30.24 25.13 2wdi n GLN 166 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2wdi n GLY 167 N 1.41 4.30 3.88 1.69 0.00 -1.22 -4.90 105.19 110.35 2wdi n GLY 167 Ca 0.02 -1.40 -0.30 0.00 0.00 0.00 0.00 46.02 44.34 2wdi n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdi s ARG 168 N -3.88 0.67 0.00 1.61 1.81 -1.26 0.13 118.95 118.02 2wdi s ARG 168 Ca 0.00 -0.23 0.00 0.00 -1.72 0.00 0.00 55.73 53.78 2wdi s ARG 168 Cb 0.00 -1.83 0.00 0.00 -0.45 0.00 0.00 34.95 32.67 2wdi s ARG 168 CO 0.00 -2.42 0.00 -1.91 -0.68 0.00 0.00 175.30 170.29 2wdi n GLU 169 N -3.81 0.00 0.00 3.54 2.13 0.46 -4.76 120.64 118.19 2wdi n GLU 169 Ca 0.13 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.95 2wdi n GLU 169 Cb 0.60 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.31 2wdi n GLU 169 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wdi n GLY 170 N 0.00 0.58 0.04 8.31 0.00 -1.26 -3.66 105.19 109.20 2wdi n GLY 170 Ca 0.00 -1.49 0.14 0.00 0.00 0.00 0.00 46.02 44.67 2wdi n GLY 170 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wdi n ASP 171 N 0.89 0.33 -4.95 1.61 8.00 -1.26 -4.84 116.55 116.33 2wdi n ASP 171 Ca 0.00 0.53 -0.23 0.00 0.71 0.00 0.00 54.79 55.80 2wdi n ASP 171 Cb 0.00 -0.62 -0.02 0.00 -0.02 0.00 0.00 41.12 40.46 2wdi n ASP 171 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2wdi s TYR 172 N -3.04 3.48 -0.01 1.24 2.02 -1.24 0.41 117.35 120.21 2wdi s TYR 172 Ca 0.12 0.21 0.04 0.00 -0.37 0.00 0.00 57.07 57.07 2wdi s TYR 172 Cb 0.16 -1.77 -0.01 0.00 -0.40 0.00 0.00 41.96 39.94 2wdi s TYR 172 CO 0.55 0.25 -0.12 0.54 -1.57 0.00 0.00 175.55 175.19 2wdi s VAL 173 N -2.18 0.99 -0.30 0.71 0.11 0.73 -0.41 120.40 120.06 2wdi s VAL 173 Ca 0.38 -0.53 -0.22 0.00 -2.93 0.00 0.00 61.98 58.68 2wdi s VAL 173 Cb -0.09 -0.83 -0.01 0.00 -1.53 0.00 0.00 36.38 33.92 2wdi s VAL 173 CO 0.33 0.28 0.71 -0.63 -3.33 0.00 0.00 175.10 172.47 2wdi s ILE 174 N -0.24 4.87 -0.00 7.04 1.01 0.12 -0.75 121.20 133.24 2wdi s ILE 174 Ca 0.04 1.07 0.01 0.00 0.00 0.00 0.00 60.65 61.77 2wdi s ILE 174 Cb -0.05 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.31 2wdi s ILE 174 CO -0.00 -0.17 0.02 -0.76 0.00 0.00 0.00 174.94 174.03 2wdi s LEU 175 N 2.77 3.61 -0.36 2.97 1.43 0.08 0.13 118.68 129.30 2wdi s LEU 175 Ca 0.29 0.03 -0.07 0.00 -1.03 0.00 0.00 54.13 53.35 2wdi s LEU 175 Cb -0.15 -2.08 0.05 0.00 0.03 0.00 0.00 46.19 44.05 2wdi s LEU 175 CO 0.12 0.28 0.15 -0.60 0.23 0.00 0.00 176.35 176.52 2wdi s ARG 176 N -1.61 2.57 0.79 1.70 3.52 -0.79 -1.08 118.95 124.05 2wdi s ARG 176 Ca 0.20 -1.30 -0.11 0.00 -0.13 0.00 0.00 55.73 54.40 2wdi s ARG 176 Cb -0.12 -3.55 0.07 0.00 -1.56 0.00 0.00 34.95 29.79 2wdi s ARG 176 CO 0.11 -0.77 1.09 -0.51 -0.81 0.00 0.00 175.30 174.41 2wdi s LEU 177 N 1.39 2.73 0.20 -0.88 1.43 -0.22 -2.79 118.68 120.54 2wdi s LEU 177 Ca 0.00 1.53 -0.17 0.00 -1.03 0.00 0.00 54.13 54.47 2wdi s LEU 177 Cb -0.21 -4.18 0.18 0.00 0.03 0.00 0.00 46.19 42.01 2wdi s LEU 177 CO 0.02 -2.02 1.61 -0.65 0.23 0.00 0.00 176.35 175.54 2wdi h PRO 178 N -1.12 -0.08 -0.97 1.29 0.11 -1.89 0.66 132.00 129.99 2wdi h PRO 178 Ca -0.46 0.01 0.17 0.00 0.11 0.00 0.00 66.00 65.82 2wdi h PRO 178 Cb 1.25 0.02 -0.09 0.00 0.11 0.00 0.00 31.00 32.29 2wdi h PRO 178 CO 0.56 -0.05 0.61 0.66 -0.21 0.00 0.00 178.00 179.56 2wdi h SER 179 N -0.08 0.74 0.00 -2.05 4.64 -1.93 -3.45 113.55 111.41 2wdi h SER 179 Ca 0.26 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 2wdi h SER 179 Cb 0.49 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2wdi h SER 179 CO -0.63 0.32 0.00 0.61 -0.87 0.00 0.00 176.83 176.26 2wdi n GLY 180 N -1.38 1.10 3.75 -0.77 0.00 0.23 -4.98 105.19 103.13 2wdi n GLY 180 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 2wdi n GLY 180 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wdi s GLU 181 N 0.00 2.76 -0.42 1.61 2.12 -1.25 -4.60 118.70 118.92 2wdi s GLU 181 Ca 0.00 1.71 -0.07 0.00 0.36 0.00 0.00 54.97 56.97 2wdi s GLU 181 Cb 0.00 -1.91 0.09 0.00 0.26 0.00 0.00 34.13 32.57 2wdi s GLU 181 CO 0.00 -1.35 0.24 -0.51 -0.54 0.00 0.00 175.26 173.10 2wdi s LEU 182 N -4.47 5.18 0.01 2.70 1.43 -1.23 -1.05 118.68 121.25 2wdi s LEU 182 Ca 0.74 -1.70 0.06 0.00 -1.03 0.00 0.00 54.13 52.20 2wdi s LEU 182 Cb -0.28 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 43.98 2wdi s LEU 182 CO 0.37 -0.55 -0.15 -0.60 0.23 0.00 0.00 176.35 175.65 2wdi s ARG 183 N 1.33 2.26 -0.16 1.70 3.52 -0.24 -0.94 118.95 126.42 2wdi s ARG 183 Ca 0.04 -0.87 -0.22 0.00 -0.13 0.00 0.00 55.73 54.55 2wdi s ARG 183 Cb -0.23 -2.28 -0.03 0.00 -1.56 0.00 0.00 34.95 30.85 2wdi s ARG 183 CO -0.00 0.57 0.69 0.15 -0.81 0.00 0.00 175.30 175.89 2wdi s LYS 184 N -1.26 4.29 -0.01 5.12 1.02 0.92 -0.74 119.74 129.08 2wdi s LYS 184 Ca 0.14 0.77 0.06 0.00 0.02 0.00 0.00 55.97 56.96 2wdi s LYS 184 Cb -0.11 -3.54 -0.02 0.00 -0.52 0.00 0.00 37.83 33.65 2wdi s LYS 184 CO 0.05 -0.17 -0.20 0.08 -0.92 0.00 0.00 175.35 174.18 2wdi s VAL 185 N 1.66 1.59 0.52 3.17 1.01 0.07 -4.90 120.40 123.52 2wdi s VAL 185 Ca 0.33 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 61.21 2wdi s VAL 185 Cb -0.16 -1.33 -0.08 0.00 0.00 0.00 0.00 36.38 34.80 2wdi s VAL 185 CO 0.13 0.42 0.83 1.57 0.00 0.00 0.00 175.10 178.04 2wdi n HIS 186 N 2.49 0.42 0.26 5.22 -0.00 -1.26 -0.19 115.22 122.16 2wdi n HIS 186 Ca -0.15 0.49 0.15 0.00 0.46 0.00 0.00 57.72 58.67 2wdi n HIS 186 Cb 0.53 -2.10 0.60 0.00 -0.12 0.00 0.00 29.99 28.89 2wdi n HIS 186 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 2wdi h GLY 187 N 0.76 0.00 1.79 1.57 0.00 -0.35 -2.92 103.07 103.92 2wdi h GLY 187 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2wdi h GLY 187 CO 0.52 0.00 -0.13 1.18 0.00 0.00 0.00 176.54 178.11 2wdi n GLU 188 N -3.16 0.11 -2.13 4.80 -0.58 -1.26 -1.38 120.64 117.04 2wdi n GLU 188 Ca 0.01 0.07 -0.42 0.00 -0.42 0.00 0.00 57.16 56.40 2wdi n GLU 188 Cb 0.35 -1.61 -0.03 0.00 -0.57 0.00 0.00 31.44 29.58 2wdi n GLU 188 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wdi n TYR 190 N 5.32 -3.78 0.00 0.00 4.02 -1.26 -0.77 117.16 120.69 2wdi n TYR 190 Ca 0.14 -0.87 0.00 0.00 -0.01 0.00 0.00 57.90 57.16 2wdi n TYR 190 Cb 0.43 -1.02 0.00 0.00 -0.02 0.00 0.00 39.34 38.72 2wdi n TYR 190 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wdi n ALA 191 N -4.75 0.00 -2.63 -0.72 0.00 -0.97 -2.59 120.51 108.86 2wdi n ALA 191 Ca -0.18 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.88 2wdi n ALA 191 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.91 2wdi n ALA 191 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2wdi s THR 192 N 0.00 5.14 0.31 0.00 -1.32 -0.43 -2.60 115.64 116.73 2wdi s THR 192 Ca 0.00 0.83 -0.29 0.00 -1.21 0.00 0.00 61.69 61.02 2wdi s THR 192 Cb 0.00 -3.74 -0.11 0.00 -1.51 0.00 0.00 72.50 67.14 2wdi s THR 192 CO 0.00 0.45 1.52 0.54 -2.21 0.00 0.00 174.62 174.92 2wdi s VAL 193 N -0.14 2.21 0.00 5.08 0.11 -0.13 -0.37 120.40 127.16 2wdi s VAL 193 Ca 0.23 0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.47 2wdi s VAL 193 Cb -0.15 -3.12 0.00 0.00 -1.53 0.00 0.00 36.38 31.58 2wdi s VAL 193 CO 0.10 0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.52 2wdi n GLY 194 N 1.69 0.87 3.98 6.54 0.00 -0.05 -1.91 105.19 116.30 2wdi n GLY 194 Ca 0.06 -2.26 -0.20 0.00 0.00 0.00 0.00 46.02 43.62 2wdi n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdi s ALA 195 N -1.08 4.11 0.49 4.61 0.00 -1.26 -1.67 121.76 126.97 2wdi s ALA 195 Ca 0.00 -1.38 0.29 0.00 0.00 0.00 0.00 51.96 50.87 2wdi s ALA 195 Cb 0.00 -1.68 1.64 0.00 0.00 0.00 0.00 23.12 23.08 2wdi s ALA 195 CO 0.00 0.07 2.16 0.28 0.00 0.00 0.00 175.76 178.27 2wdi h VAL 196 N 1.01 0.52 -0.80 0.00 2.07 -1.16 0.31 116.25 118.20 2wdi h VAL 196 Ca -0.48 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.74 2wdi h VAL 196 Cb 1.25 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2wdi h VAL 196 CO 0.56 0.06 -0.21 0.61 0.02 0.00 0.00 177.57 178.61 2wdi n GLY 197 N -0.95 -3.06 2.36 2.17 0.00 -1.26 -3.92 105.19 100.53 2wdi n GLY 197 Ca -0.02 -1.21 -0.04 0.00 0.00 0.00 0.00 46.02 44.75 2wdi n GLY 197 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wdi n ASN 198 N -1.75 -4.78 -0.11 1.61 4.05 -1.26 -1.63 115.26 111.39 2wdi n ASN 198 Ca -0.00 -0.19 0.12 0.00 0.45 0.00 0.00 54.58 54.96 2wdi n ASN 198 Cb 0.10 -3.14 0.23 0.00 1.23 0.00 0.00 39.78 38.21 2wdi n ASN 198 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2wdi n ALA 199 N -1.86 3.54 0.46 5.20 0.00 -1.26 -3.10 120.51 123.49 2wdi n ALA 199 Ca -0.02 -0.42 0.11 0.00 0.00 0.00 0.00 53.44 53.12 2wdi n ALA 199 Cb 0.53 -1.06 0.45 0.00 0.00 0.00 0.00 19.45 19.37 2wdi n ALA 199 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wdi n ASP 200 N -1.12 0.53 -0.14 0.00 8.00 -1.26 -3.68 116.55 118.88 2wdi n ASP 200 Ca 0.08 0.62 -0.06 0.00 0.71 0.00 0.00 54.79 56.14 2wdi n ASP 200 Cb 0.35 -0.73 0.01 0.00 -0.02 0.00 0.00 41.12 40.72 2wdi n ASP 200 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 2wdi h HIS 201 N 0.00 -0.72 0.00 1.24 2.76 -1.96 0.20 115.15 116.67 2wdi h HIS 201 Ca 0.00 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 2wdi h HIS 201 Cb 0.38 0.39 0.00 0.00 1.55 0.00 0.00 27.41 29.73 2wdi h HIS 201 CO 0.00 -0.34 0.08 0.36 -1.30 0.00 0.00 177.93 176.73 2wdi n LYS 202 N -5.41 0.00 -0.00 5.26 2.85 -1.24 -1.72 118.16 117.89 2wdi n LYS 202 Ca 0.03 0.24 0.09 0.00 -1.05 0.00 0.00 58.31 57.61 2wdi n LYS 202 Cb 0.33 -1.58 -0.11 0.00 -0.65 0.00 0.00 35.03 33.01 2wdi n LYS 202 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2wdi n ASN 203 N -1.19 0.84 -4.72 -5.58 3.02 0.71 -4.96 115.26 103.38 2wdi n ASN 203 Ca 0.00 -0.59 -0.42 0.00 -0.03 0.00 0.00 54.58 53.54 2wdi n ASN 203 Cb 0.08 1.29 -0.03 0.00 -0.61 0.00 0.00 39.78 40.52 2wdi n ASN 203 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2wdi s ILE 204 N -2.87 3.01 -0.46 2.41 -4.36 -0.70 -4.96 121.20 113.27 2wdi s ILE 204 Ca 0.02 0.74 -0.17 0.00 -0.26 0.00 0.00 60.65 60.98 2wdi s ILE 204 Cb 0.13 -3.47 0.05 0.00 1.25 0.00 0.00 42.46 40.42 2wdi s ILE 204 CO 0.73 0.06 0.44 -0.69 0.24 0.00 0.00 174.94 175.73 2wdi s VAL 205 N 0.99 5.13 0.26 8.37 1.01 -1.25 -4.97 120.40 129.94 2wdi s VAL 205 Ca 0.66 -0.77 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 2wdi s VAL 205 Cb -0.40 -4.12 0.42 0.00 0.00 0.00 0.00 36.38 32.28 2wdi s VAL 205 CO 0.32 -0.57 1.47 0.18 0.00 0.00 0.00 175.10 176.50 2wdi n LEU 206 N 5.48 -0.35 0.00 3.92 4.77 -1.26 -2.08 117.00 127.47 2wdi n LEU 206 Ca -0.10 1.62 0.00 0.00 -0.03 0.00 0.00 56.01 57.50 2wdi n LEU 206 Cb 0.45 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2wdi n LEU 206 CO 0.48 -1.55 0.00 0.61 -1.33 0.00 0.00 177.39 175.60 2wdi n GLY 207 N -1.58 1.90 3.77 -0.72 0.00 -1.26 -4.66 105.19 102.63 2wdi n GLY 207 Ca 0.15 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.39 2wdi n GLY 207 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wdi s LYS 208 N 0.00 2.25 0.17 1.61 -2.85 -1.24 -4.68 119.74 115.00 2wdi s LYS 208 Ca 0.00 -1.88 -0.14 0.00 -1.00 0.00 0.00 55.97 52.96 2wdi s LYS 208 Cb 0.00 -1.99 0.06 0.00 -2.06 0.00 0.00 37.83 33.84 2wdi s LYS 208 CO 0.00 -0.19 1.80 0.00 0.10 0.00 0.00 175.35 177.06 2wdi h ALA 209 N 1.32 0.69 -3.00 0.59 0.00 -1.94 -3.38 119.26 113.54 2wdi h ALA 209 Ca -0.42 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2wdi h ALA 209 Cb 1.26 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2wdi h ALA 209 CO 0.68 0.18 0.00 0.41 0.00 0.00 0.00 179.25 180.52 2wdi n GLY 210 N -1.10 -1.83 4.29 0.00 0.00 -1.26 -3.49 105.19 101.80 2wdi n GLY 210 Ca 0.03 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2wdi n GLY 210 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wdi n ARG 211 N -1.21 0.00 0.19 1.61 3.00 -1.26 -4.00 116.66 114.98 2wdi n ARG 211 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.85 57.92 2wdi n ARG 211 Cb 0.00 -0.11 0.17 0.00 0.00 0.00 0.00 32.46 32.52 2wdi n ARG 211 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2wdi h SER 212 N 0.00 0.00 0.09 6.15 0.87 -1.73 -2.60 113.55 116.33 2wdi h SER 212 Ca 0.00 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.44 2wdi h SER 212 Cb 0.00 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2wdi h SER 212 CO 0.00 0.27 -0.52 0.03 -0.53 0.00 0.00 176.83 176.08 2wdi h ARG 213 N 0.00 0.19 -0.57 2.24 2.47 -1.67 -2.27 114.38 114.77 2wdi h ARG 213 Ca -0.00 -0.33 0.16 0.00 -1.26 0.00 0.00 59.98 58.55 2wdi h ARG 213 Cb 1.12 0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 29.54 2wdi h ARG 213 CO 0.04 1.16 0.41 -1.49 0.56 0.00 0.00 179.97 180.64 2wdi h TRP 214 N -0.60 0.01 -0.10 3.04 6.55 -1.83 0.58 115.95 123.60 2wdi h TRP 214 Ca -0.09 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.75 2wdi h TRP 214 Cb 1.41 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.70 2wdi h TRP 214 CO 0.23 0.01 0.00 1.28 -1.05 0.00 0.00 178.44 178.90 2wdi n LEU 215 N -4.37 1.05 -0.21 -4.49 4.77 -0.99 -1.79 117.00 110.96 2wdi n LEU 215 Ca 0.11 -0.53 -0.03 0.00 -0.03 0.00 0.00 56.01 55.53 2wdi n LEU 215 Cb 0.63 -0.26 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 2wdi n LEU 215 CO 0.37 0.21 -0.03 0.61 -1.33 0.00 0.00 177.39 177.23 2wdi n GLY 216 N 0.43 0.56 3.40 -0.72 0.00 0.20 -4.94 105.19 104.12 2wdi n GLY 216 Ca 0.04 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 2wdi n GLY 216 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdi s ARG 217 N -1.42 3.01 0.67 1.61 0.52 -0.86 -1.67 118.95 120.81 2wdi s ARG 217 Ca 0.00 -0.95 -0.09 0.00 -0.52 0.00 0.00 55.73 54.17 2wdi s ARG 217 Cb 0.00 -3.69 0.02 0.00 0.52 0.00 0.00 34.95 31.80 2wdi s ARG 217 CO 0.00 -0.61 1.03 1.03 0.02 0.00 0.00 175.30 176.77 2wdi s ARG 218 N 1.58 2.76 0.30 3.54 0.52 0.12 -3.77 118.95 124.01 2wdi s ARG 218 Ca 0.03 0.21 -0.30 0.00 -0.52 0.00 0.00 55.73 55.16 2wdi s ARG 218 Cb -0.18 -2.12 -0.12 0.00 0.52 0.00 0.00 34.95 33.05 2wdi s ARG 218 CO 0.07 -0.97 1.47 -0.35 0.02 0.00 0.00 175.30 175.54 2wdi n PRO 219 N -2.87 2.43 -3.47 3.54 -0.04 -1.26 -4.80 135.00 128.53 2wdi n PRO 219 Ca 0.06 0.86 -0.43 0.00 -0.04 0.00 0.00 63.50 63.95 2wdi n PRO 219 Cb 0.58 -2.56 -0.10 0.00 -0.04 0.00 0.00 33.50 31.37 2wdi n PRO 219 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2wdi s HIS 220 N -0.42 3.24 -0.00 0.54 2.46 -1.26 -4.78 115.29 115.06 2wdi s HIS 220 Ca 0.61 -0.53 -0.17 0.00 0.47 0.00 0.00 55.06 55.45 2wdi s HIS 220 Cb -0.54 -2.58 -0.06 0.00 -0.13 0.00 0.00 32.58 29.27 2wdi s HIS 220 CO 0.54 -0.56 0.48 0.54 -2.47 0.00 0.00 174.74 173.28 2wdi s VAL 221 N 1.70 4.96 0.56 0.89 0.11 -1.26 -5.05 120.40 122.31 2wdi s VAL 221 Ca 0.05 1.01 -0.20 0.00 -2.93 0.00 0.00 61.98 59.91 2wdi s VAL 221 Cb -0.19 -3.80 -0.05 0.00 -1.53 0.00 0.00 36.38 30.81 2wdi s VAL 221 CO 0.10 0.51 1.20 -0.13 -3.33 0.00 0.00 175.10 173.45 2wdi s ARG 222 N -0.69 3.17 0.00 1.54 0.52 -1.26 -4.99 118.95 117.24 2wdi s ARG 222 Ca 0.26 1.82 0.00 0.00 -0.52 0.00 0.00 55.73 57.29 2wdi s ARG 222 Cb -0.17 -2.04 0.00 0.00 0.52 0.00 0.00 34.95 33.25 2wdi s ARG 222 CO 0.15 -1.05 0.76 0.41 0.02 0.00 0.00 175.30 175.59 2wdi n GLY 223 N 0.46 -2.84 3.61 -3.53 0.00 -1.26 -3.93 105.19 97.71 2wdi n GLY 223 Ca 0.12 0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 2wdi n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdi s ALA 224 N -2.73 2.93 0.00 4.61 0.00 -1.26 -0.47 121.76 124.84 2wdi s ALA 224 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 51.96 52.80 2wdi s ALA 224 Cb 0.00 -4.02 0.00 0.00 0.00 0.00 0.00 23.12 19.10 2wdi s ALA 224 CO 0.00 -2.50 0.00 0.00 0.00 0.00 0.00 175.76 173.26 2wdi n ALA 225 N 10.63 0.00 -2.34 0.00 0.00 -1.25 -4.91 120.51 122.63 2wdi n ALA 225 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2wdi n ALA 225 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 2wdi n ALA 225 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2wdi n MET 226 N 0.00 1.88 -4.45 0.00 2.81 0.38 -4.97 117.12 112.76 2wdi n MET 226 Ca 0.00 0.00 -0.24 0.00 -1.81 0.00 0.00 57.70 55.65 2wdi n MET 226 Cb 0.00 0.00 -0.10 0.00 -0.71 0.00 0.00 33.22 32.41 2wdi n MET 226 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2wdi s ASN 227 N -1.00 3.47 0.21 7.83 -0.87 -1.26 -2.08 114.94 121.24 2wdi s ASN 227 Ca 0.00 -1.01 0.11 0.00 -1.57 0.00 0.00 52.86 50.38 2wdi s ASN 227 Cb 0.00 -0.28 0.74 0.00 -0.02 0.00 0.00 41.25 41.70 2wdi s ASN 227 CO 0.00 0.03 0.92 -2.65 -2.57 0.00 0.00 177.10 172.82 2wdi n PRO 228 N -0.52 -0.04 -0.06 -0.60 -0.02 -1.22 0.61 135.00 133.15 2wdi n PRO 228 Ca -0.06 0.81 -0.14 0.00 -2.02 0.00 0.00 63.50 62.09 2wdi n PRO 228 Cb 0.60 -1.43 -0.06 0.00 -0.02 0.00 0.00 33.50 32.58 2wdi n PRO 228 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wdi h VAL 229 N 0.00 1.34 -0.27 -1.45 2.07 -1.94 -3.32 116.25 112.68 2wdi h VAL 229 Ca 0.48 -1.48 -0.14 0.00 0.82 0.00 0.00 66.70 66.37 2wdi h VAL 229 Cb 1.24 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.86 2wdi h VAL 229 CO -0.46 0.45 -0.40 0.44 0.02 0.00 0.00 177.57 177.62 2wdi h ASP 230 N 0.16 0.70 -5.05 0.57 3.32 -0.21 -3.47 116.42 112.43 2wdi h ASP 230 Ca 0.02 -0.31 -0.06 0.00 0.02 0.00 0.00 57.03 56.70 2wdi h ASP 230 Cb 0.85 -0.20 -0.14 0.00 0.22 0.00 0.00 39.33 40.06 2wdi h ASP 230 CO 0.06 1.02 -0.04 -2.28 -1.72 0.00 0.00 179.24 176.28 2wdi s HIS 231 N -4.27 -0.28 0.30 4.55 2.46 -0.98 -4.94 115.29 112.13 2wdi s HIS 231 Ca -0.08 0.07 0.15 0.00 0.47 0.00 0.00 55.06 55.67 2wdi s HIS 231 Cb 0.12 0.29 0.69 0.00 -0.13 0.00 0.00 32.58 33.55 2wdi s HIS 231 CO 0.84 -0.68 1.78 -1.00 -2.47 0.00 0.00 174.74 173.20 2wdi h PRO 232 N 2.52 0.00 -0.18 2.88 0.13 -1.80 -3.11 132.00 132.44 2wdi h PRO 232 Ca -0.33 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.64 2wdi h PRO 232 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2wdi h PRO 232 CO 0.45 0.41 -0.57 0.45 -0.23 0.00 0.00 178.00 178.50 2wdi h HIS 233 N 0.00 0.70 -2.96 1.56 3.86 -1.88 -3.47 115.15 112.97 2wdi h HIS 233 Ca -0.00 -0.26 -0.56 0.00 -1.16 0.00 0.00 60.37 58.39 2wdi h HIS 233 Cb 0.79 -0.13 0.20 0.00 1.06 0.00 0.00 27.41 29.33 2wdi h HIS 233 CO 0.00 0.99 -0.69 0.41 0.86 0.00 0.00 177.93 179.51 2wdi n GLY 234 N 0.30 -2.18 0.00 2.45 0.00 -1.17 -4.47 105.19 100.11 2wdi n GLY 234 Ca -0.03 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2wdi n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdi n GLY 235 N 1.95 -0.38 1.91 -0.02 0.00 -0.88 -3.43 105.19 104.33 2wdi n GLY 235 Ca 0.08 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 44.00 2wdi n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdi n GLY 236 N 0.00 -5.21 3.64 -0.02 0.00 -1.26 -4.78 105.19 97.56 2wdi n GLY 236 Ca 0.00 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 2wdi n GLY 236 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wdi s GLU 237 N -1.06 3.84 -0.30 1.61 0.41 -1.26 -4.25 118.70 117.69 2wdi s GLU 237 Ca 0.00 1.99 -0.06 0.00 -0.41 0.00 0.00 54.97 56.49 2wdi s GLU 237 Cb 0.00 -4.10 0.01 0.00 -1.78 0.00 0.00 34.13 28.26 2wdi s GLU 237 CO 0.00 -1.26 0.23 0.41 -0.49 0.00 0.00 175.26 174.15 2wdi n GLY 238 N 4.69 -2.71 1.80 -1.39 0.00 -1.26 -4.87 105.19 101.44 2wdi n GLY 238 Ca 0.20 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.88 2wdi n GLY 238 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wdi n ARG 239 N 0.15 -3.61 -4.07 1.61 3.00 -1.26 -5.07 116.66 107.42 2wdi n ARG 239 Ca 0.05 2.60 -0.12 0.00 -0.00 0.00 0.00 57.85 60.38 2wdi n ARG 239 Cb 0.18 -3.03 -0.06 0.00 0.00 0.00 0.00 32.46 29.55 2wdi n ARG 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2wdi s ALA 240 N -1.64 0.38 -0.94 5.13 0.00 -1.26 -5.05 121.76 118.38 2wdi s ALA 240 Ca 0.00 -1.26 -0.03 0.00 0.00 0.00 0.00 51.96 50.67 2wdi s ALA 240 Cb 0.00 1.15 0.24 0.00 0.00 0.00 0.00 23.12 24.52 2wdi s ALA 240 CO 0.00 -0.79 0.92 -0.35 0.00 0.00 0.00 175.76 175.54 2wdi n PRO 241 N -0.44 2.99 0.00 0.00 -0.04 -1.26 -4.96 135.00 131.30 2wdi n PRO 241 Ca -0.00 -4.50 0.00 0.00 -0.04 0.00 0.00 63.50 58.96 2wdi n PRO 241 Cb 0.62 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 2wdi n PRO 241 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2wdi n ARG 242 N 2.16 0.00 0.00 0.54 3.00 -1.26 -3.99 116.66 117.11 2wdi n ARG 242 Ca 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 58.07 2wdi n ARG 242 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.83 2wdi n ARG 242 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2wdi n GLY 243 N 0.00 -0.20 0.72 -0.13 0.00 -1.26 -4.86 105.19 99.46 2wdi n GLY 243 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wdi n GLY 243 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wdi n ARG 244 N 0.00 -1.27 -4.22 1.61 0.63 -1.26 -5.06 116.66 107.10 2wdi n ARG 244 Ca 0.00 1.16 -0.26 0.00 -0.92 0.00 0.00 57.85 57.83 2wdi n ARG 244 Cb 0.00 -0.98 -0.17 0.00 0.45 0.00 0.00 32.46 31.76 2wdi n ARG 244 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2wdi s PRO 245 N -2.83 1.59 0.00 -0.14 0.04 -1.26 -5.02 135.00 127.39 2wdi s PRO 245 Ca 0.00 -0.32 0.00 0.00 0.04 0.00 0.00 61.00 60.72 2wdi s PRO 245 Cb 0.00 -1.49 0.00 0.00 0.04 0.00 0.00 34.50 33.05 2wdi s PRO 245 CO 0.00 -0.13 0.00 -2.30 0.04 0.00 0.00 177.00 174.61 2wdi n PRO 246 N 4.40 0.00 -4.08 0.56 -0.02 -1.26 -4.74 135.00 129.86 2wdi n PRO 246 Ca -0.18 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.22 2wdi n PRO 246 Cb 0.51 0.00 -0.10 0.00 -0.02 0.00 0.00 33.50 33.88 2wdi n PRO 246 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wdi s ALA 247 N 0.00 0.50 0.70 3.55 0.00 -1.26 -1.39 121.76 123.86 2wdi s ALA 247 Ca 0.00 -1.08 -0.09 0.00 0.00 0.00 0.00 51.96 50.79 2wdi s ALA 247 Cb 0.00 0.22 0.04 0.00 0.00 0.00 0.00 23.12 23.37 2wdi s ALA 247 CO 0.00 -0.29 1.06 -1.54 0.00 0.00 0.00 175.76 174.99 2wdi s SER 248 N -2.56 5.16 0.59 0.00 1.04 -0.06 -4.82 113.70 113.05 2wdi s SER 248 Ca 0.02 0.84 0.39 0.00 0.48 0.00 0.00 55.95 57.67 2wdi s SER 248 Cb 0.03 -1.58 2.11 0.00 0.10 0.00 0.00 66.02 66.68 2wdi s SER 248 CO -0.07 -1.45 2.19 1.55 0.98 0.00 0.00 173.24 176.44 2wdi h PRO 249 N -0.62 0.00 -0.01 4.02 0.13 -1.92 0.42 132.00 134.03 2wdi h PRO 249 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2wdi h PRO 249 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2wdi h PRO 249 CO 0.63 0.00 -0.35 0.91 -0.23 0.00 0.00 178.00 178.96 2wdi n TRP 250 N -2.88 0.00 -0.01 1.56 8.01 -1.26 -4.56 117.44 118.29 2wdi n TRP 250 Ca -0.03 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.16 2wdi n TRP 250 Cb 0.09 -0.15 0.00 0.00 -2.01 0.00 0.00 31.31 29.23 2wdi n TRP 250 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2wdi n GLY 251 N 1.39 0.37 3.85 6.99 0.00 0.15 -5.07 105.19 112.86 2wdi n GLY 251 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 2wdi n GLY 251 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2wdi s TRP 252 N -2.03 3.48 0.26 1.61 1.48 -1.26 -4.71 118.94 117.76 2wdi s TRP 252 Ca 0.00 1.16 -0.31 0.00 -1.06 0.00 0.00 56.10 55.89 2wdi s TRP 252 Cb 0.00 -2.47 -0.12 0.00 -1.16 0.00 0.00 33.47 29.72 2wdi s TRP 252 CO 0.00 0.24 1.65 1.04 -4.06 0.00 0.00 176.95 175.81 2wdi n GLN 253 N 0.10 2.72 -0.06 3.25 6.02 -1.26 -0.88 117.38 127.26 2wdi n GLN 253 Ca 0.00 0.97 0.07 0.00 -0.01 0.00 0.00 57.00 58.03 2wdi n GLN 253 Cb 0.52 -2.78 0.09 0.00 1.02 0.00 0.00 30.24 29.10 2wdi n GLN 253 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2wdi n THR 254 N 2.89 0.29 -3.93 5.09 5.66 -0.48 -4.58 114.28 119.22 2wdi n THR 254 Ca 0.12 -0.65 -0.34 0.00 -3.05 0.00 0.00 64.05 60.13 2wdi n THR 254 Cb 0.36 1.05 -0.14 0.00 -1.55 0.00 0.00 70.33 70.05 2wdi n THR 254 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2wdi s LYS 255 N -1.09 1.96 0.00 1.09 -0.14 -1.26 -4.78 119.74 115.52 2wdi s LYS 255 Ca 0.19 -1.65 0.00 0.00 -1.36 0.00 0.00 55.97 53.16 2wdi s LYS 255 Cb 0.12 -3.27 0.00 0.00 -1.68 0.00 0.00 37.83 33.01 2wdi s LYS 255 CO 0.18 -0.85 0.00 0.41 -0.76 0.00 0.00 175.35 174.32 2wdi n GLY 256 N 4.46 3.17 3.61 -3.33 0.00 -1.26 -5.01 105.19 106.82 2wdi n GLY 256 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 2wdi n GLY 256 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wdi s LEU 257 N 0.00 3.62 0.44 0.99 0.20 -1.26 -4.96 118.68 117.71 2wdi s LEU 257 Ca 0.00 1.72 -0.25 0.00 0.69 0.00 0.00 54.13 56.30 2wdi s LEU 257 Cb 0.00 -3.52 -0.08 0.00 -0.43 0.00 0.00 46.19 42.16 2wdi s LEU 257 CO 0.00 -1.69 1.28 -0.54 -0.29 0.00 0.00 176.35 175.11 2wdi s LYS 258 N 5.69 3.79 0.00 1.98 1.02 -1.26 -4.96 119.74 125.99 2wdi s LYS 258 Ca 0.88 2.08 0.00 0.00 0.02 0.00 0.00 55.97 58.95 2wdi s LYS 258 Cb -0.29 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 2wdi s LYS 258 CO 0.34 -0.62 0.00 -2.37 -0.92 0.00 0.00 175.35 171.78 2wdi n THR 259 N -0.20 0.00 -1.74 2.17 5.66 -1.26 -5.06 114.28 113.85 2wdi n THR 259 Ca 0.06 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.68 2wdi n THR 259 Cb 0.45 -0.11 0.05 0.00 -1.55 0.00 0.00 70.33 69.17 2wdi n THR 259 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 2wdi n ARG 260 N -1.66 1.51 -1.74 1.09 -4.01 -1.26 -4.89 116.66 105.71 2wdi n ARG 260 Ca 0.00 0.57 -0.42 0.00 -1.04 0.00 0.00 57.85 56.96 2wdi n ARG 260 Cb 0.20 -2.57 -0.02 0.00 -3.04 0.00 0.00 32.46 27.02 2wdi n ARG 260 CO 0.00 0.00 0.00 1.17 -3.04 0.00 0.00 177.63 175.76 2wdi n LYS 261 N -1.32 2.71 0.31 2.89 4.81 -1.26 -4.97 118.16 121.33 2wdi n LYS 261 Ca 0.12 0.97 -0.13 0.00 -0.87 0.00 0.00 58.31 58.40 2wdi n LYS 261 Cb 0.46 -2.77 -0.06 0.00 0.02 0.00 0.00 35.03 32.68 2wdi n LYS 261 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2wdi h ARG 262 N 5.33 -0.81 -0.73 1.64 2.43 -2.02 -3.28 114.38 116.95 2wdi h ARG 262 Ca -0.46 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 2wdi h ARG 262 Cb 1.22 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 2wdi h ARG 262 CO 0.84 -0.54 0.00 0.54 -1.51 0.00 0.00 179.97 179.30 2wdi n ARG 263 N -5.24 0.77 -2.00 0.20 1.74 -1.26 -4.88 116.66 106.00 2wdi n ARG 263 Ca -0.10 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.55 2wdi n ARG 263 Cb 0.33 -1.36 -0.03 0.00 -1.02 0.00 0.00 32.46 30.38 2wdi n ARG 263 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2wdi s LYS 264 N -1.06 4.18 0.65 5.56 2.20 -1.24 -4.85 119.74 125.19 2wdi s LYS 264 Ca 0.00 2.20 0.37 0.00 -0.36 0.00 0.00 55.97 58.18 2wdi s LYS 264 Cb 0.00 -3.98 2.06 0.00 -1.51 0.00 0.00 37.83 34.40 2wdi s LYS 264 CO 0.00 -0.84 2.21 -1.00 -0.36 0.00 0.00 175.35 175.35 2wdi h PRO 265 N 9.52 0.00 -0.62 4.03 0.13 -1.94 -2.07 132.00 141.05 2wdi h PRO 265 Ca -0.39 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 64.92 2wdi h PRO 265 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 2wdi h PRO 265 CO 0.95 0.00 0.49 1.03 -0.23 0.00 0.00 178.00 180.25 2wdi h SER 266 N 0.00 0.00 0.00 1.44 0.87 -1.97 -3.40 113.55 110.49 2wdi h SER 266 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2wdi h SER 266 Cb 0.25 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2wdi h SER 266 CO -0.00 0.00 0.00 -1.20 -0.53 0.00 0.00 176.83 175.10 2wdi n SER 267 N -4.13 0.00 0.00 6.23 7.64 -0.78 -3.71 113.62 118.87 2wdi n SER 267 Ca 0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.00 2wdi n SER 267 Cb 0.74 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.94 2wdi n SER 267 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2wdi n ARG 268 N 0.00 0.00 -0.03 1.43 1.74 -1.26 -4.10 116.66 114.43 2wdi n ARG 268 Ca 0.00 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.10 2wdi n ARG 268 Cb 0.00 -3.04 0.03 0.00 -1.02 0.00 0.00 32.46 28.44 2wdi n ARG 268 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2wdi n PHE 269 N -0.91 0.00 -4.48 -1.55 3.72 -1.24 -4.98 117.46 108.01 2wdi n PHE 269 Ca 0.00 -0.57 -0.24 0.00 -0.05 0.00 0.00 57.45 56.60 2wdi n PHE 269 Cb 0.00 -0.07 -0.10 0.00 -0.94 0.00 0.00 39.48 38.37 2wdi n PHE 269 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 2wdi s ILE 270 N -1.35 1.95 -0.34 4.37 -5.25 -1.26 -0.06 121.20 119.27 2wdi s ILE 270 Ca 0.08 -2.17 0.00 0.00 -0.99 0.00 0.00 60.65 57.57 2wdi s ILE 270 Cb 0.07 -2.54 0.29 0.00 2.95 0.00 0.00 42.46 43.23 2wdi s ILE 270 CO 0.01 -0.25 1.28 2.30 -1.79 0.00 0.00 174.94 176.48 2wdi n ILE 271 N -0.69 0.00 -3.30 8.37 -5.35 -0.11 -4.95 119.36 113.33 2wdi n ILE 271 Ca -0.05 -0.71 0.00 0.00 -0.27 0.00 0.00 62.75 61.72 2wdi n ILE 271 Cb 0.63 1.11 0.00 0.00 -1.74 0.00 0.00 39.64 39.64 2wdi n ILE 271 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wdi n ALA 272 N 1.15 0.00 0.00 -1.28 0.00 -1.26 -3.56 120.51 115.56 2wdi n ALA 272 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2wdi n ALA 272 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.17 2wdi n ALA 272 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37