#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d87 s TRP 2 N 0.00 0.57 -0.53 9.51 1.48 -0.67 -4.95 118.94 124.35 3d87 s TRP 2 Ca 0.00 -1.09 -0.20 0.00 -1.06 0.00 0.00 56.10 53.76 3d87 s TRP 2 Cb 0.00 -0.40 0.06 0.00 -1.16 0.00 0.00 33.47 31.98 3d87 s TRP 2 CO 0.00 -0.41 0.69 -2.00 -4.06 0.00 0.00 176.95 171.17 3d87 s GLU 3 N -3.94 3.13 0.35 3.25 2.12 -1.26 -0.44 118.70 121.91 3d87 s GLU 3 Ca 0.10 -0.88 0.15 0.00 0.36 0.00 0.00 54.97 54.70 3d87 s GLU 3 Cb 0.08 -4.13 0.62 0.00 0.26 0.00 0.00 34.13 30.96 3d87 s GLU 3 CO -0.08 -1.34 1.73 1.25 -0.54 0.00 0.00 175.26 176.28 3d87 h LEU 4 N 9.99 0.00 -7.00 2.70 6.46 -1.52 -3.46 115.31 122.47 3d87 h LEU 4 Ca -0.28 0.00 0.25 0.00 -0.12 0.00 0.00 57.88 57.73 3d87 h LEU 4 Cb 1.09 0.00 -0.19 0.00 -0.73 0.00 0.00 40.66 40.83 3d87 h LEU 4 CO 1.01 0.44 0.79 -1.59 -0.62 0.00 0.00 178.44 178.48 3d87 s LYS 5 N -3.73 0.34 -0.35 1.25 -2.85 -1.11 -5.03 119.74 108.25 3d87 s LYS 5 Ca -0.01 -0.12 -0.38 0.00 -1.00 0.00 0.00 55.97 54.45 3d87 s LYS 5 Cb 0.12 0.15 -0.17 0.00 -2.06 0.00 0.00 37.83 35.88 3d87 s LYS 5 CO 0.71 -0.15 1.27 1.17 0.10 0.00 0.00 175.35 178.45 3d87 n LYS 6 N -0.10 0.00 -1.12 1.78 3.00 -1.26 0.68 118.16 121.14 3d87 n LYS 6 Ca -0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.27 3d87 n LYS 6 Cb 0.58 -1.25 -0.02 0.00 0.00 0.00 0.00 35.03 34.35 3d87 n LYS 6 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3d87 n ASP 7 N 3.02 -5.07 -4.00 3.14 10.43 -1.26 -4.96 116.55 117.84 3d87 n ASP 7 Ca 0.24 0.10 -0.24 0.00 2.57 0.00 0.00 54.79 57.47 3d87 n ASP 7 Cb -0.03 -2.92 -0.16 0.00 1.84 0.00 0.00 41.12 39.84 3d87 n ASP 7 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3d87 s VAL 8 N -1.62 1.02 0.02 2.53 1.01 0.21 0.90 120.40 124.48 3d87 s VAL 8 Ca 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.58 3d87 s VAL 8 Cb 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 3d87 s VAL 8 CO 0.00 0.33 -0.05 -0.31 0.00 0.00 0.00 175.10 175.06 3d87 s TYR 9 N 0.68 0.47 -0.10 5.22 1.51 0.24 -1.28 117.35 124.10 3d87 s TYR 9 Ca -0.14 -0.36 -0.01 0.00 -1.01 0.00 0.00 57.07 55.55 3d87 s TYR 9 Cb -0.15 -0.29 -0.03 0.00 -0.11 0.00 0.00 41.96 41.37 3d87 s TYR 9 CO 0.03 -0.08 -0.05 0.08 -1.11 0.00 0.00 175.55 174.42 3d87 s VAL 10 N -0.97 3.86 -0.19 0.71 1.01 0.41 0.11 120.40 125.33 3d87 s VAL 10 Ca -0.08 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 3d87 s VAL 10 Cb -0.07 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 3d87 s VAL 10 CO -0.00 0.56 -0.08 -0.69 0.00 0.00 0.00 175.10 174.89 3d87 s VAL 11 N -0.37 3.16 -0.51 2.92 1.01 0.73 -1.67 120.40 125.67 3d87 s VAL 11 Ca 0.06 -0.58 -0.24 0.00 0.00 0.00 0.00 61.98 61.22 3d87 s VAL 11 Cb -0.12 -2.40 0.03 0.00 0.00 0.00 0.00 36.38 33.89 3d87 s VAL 11 CO 0.02 0.46 0.91 -1.61 0.00 0.00 0.00 175.10 174.88 3d87 s GLU 12 N 1.19 3.40 -0.42 2.72 0.41 -1.26 -0.47 118.70 124.27 3d87 s GLU 12 Ca 0.02 -0.11 -0.13 0.00 -0.41 0.00 0.00 54.97 54.34 3d87 s GLU 12 Cb -0.14 -4.00 0.05 0.00 -1.78 0.00 0.00 34.13 28.26 3d87 s GLU 12 CO -0.03 -1.34 0.30 -0.51 -0.49 0.00 0.00 175.26 173.19 3d87 s LEU 13 N 3.76 5.19 0.36 1.80 2.01 -0.37 -4.92 118.68 126.52 3d87 s LEU 13 Ca 0.32 -1.20 -0.07 0.00 0.01 0.00 0.00 54.13 53.19 3d87 s LEU 13 Cb -0.12 -2.09 -0.05 0.00 0.01 0.00 0.00 46.19 43.94 3d87 s LEU 13 CO 0.22 -0.52 0.66 -1.81 1.01 0.00 0.00 176.35 175.91 3d87 s ASP 14 N 2.05 6.44 0.00 2.29 1.11 -1.26 -1.67 116.67 125.63 3d87 s ASP 14 Ca 0.03 0.88 0.00 0.00 0.18 0.00 0.00 52.55 53.64 3d87 s ASP 14 Cb -0.22 -2.21 0.00 0.00 1.07 0.00 0.00 42.92 41.56 3d87 s ASP 14 CO 0.06 -0.32 0.00 -2.67 1.18 0.00 0.00 175.17 173.42 3d87 n TRP 15 N -1.28 0.00 0.00 4.23 2.14 -1.26 -4.81 117.44 116.45 3d87 n TRP 15 Ca -0.00 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.57 3d87 n TRP 15 Cb 0.54 -0.51 0.00 0.00 -0.81 0.00 0.00 31.31 30.53 3d87 n TRP 15 CO 0.00 0.00 0.00 0.98 2.07 0.00 0.00 177.69 180.74 3d87 n TYR 16 N -2.00 0.00 -3.29 -2.67 9.36 -1.23 -3.45 117.16 113.87 3d87 n TYR 16 Ca 0.00 0.00 -0.26 0.00 3.32 0.00 0.00 57.90 60.96 3d87 n TYR 16 Cb 0.00 0.00 0.03 0.00 -0.63 0.00 0.00 39.34 38.74 3d87 n TYR 16 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 3d87 n PRO 17 N 0.14 -1.89 0.00 2.98 -0.02 -1.26 -4.99 135.00 129.97 3d87 n PRO 17 Ca 0.00 1.56 0.00 0.00 -2.02 0.00 0.00 63.50 63.04 3d87 n PRO 17 Cb 0.00 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 30.65 3d87 n PRO 17 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3d87 n ASP 18 N 0.03 0.00 0.00 2.55 2.03 -1.22 -5.15 116.55 114.79 3d87 n ASP 18 Ca -0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.28 3d87 n ASP 18 Cb 0.58 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 3d87 n ASP 18 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3d87 n ALA 19 N -0.33 0.00 1.10 -1.67 0.00 -1.26 -3.37 120.51 114.97 3d87 n ALA 19 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 3d87 n ALA 19 Cb 0.00 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.59 3d87 n ALA 19 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3d87 n PRO 20 N 0.00 1.11 0.00 0.00 -0.04 -1.26 -5.04 135.00 129.77 3d87 n PRO 20 Ca 0.00 -0.84 0.00 0.00 -0.04 0.00 0.00 63.50 62.62 3d87 n PRO 20 Cb 0.00 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 3d87 n PRO 20 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3d87 n GLY 21 N 1.39 2.52 3.21 0.55 0.00 -1.22 -4.52 105.19 107.12 3d87 n GLY 21 Ca 0.11 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.75 3d87 n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3d87 s GLU 22 N 0.00 0.51 -0.50 1.61 2.12 -0.90 -4.96 118.70 116.58 3d87 s GLU 22 Ca 0.00 0.10 -0.14 0.00 0.36 0.00 0.00 54.97 55.29 3d87 s GLU 22 Cb 0.00 0.23 0.11 0.00 0.26 0.00 0.00 34.13 34.73 3d87 s GLU 22 CO 0.00 -0.11 0.42 1.41 -0.54 0.00 0.00 175.26 176.44 3d87 s MET 23 N -0.60 2.85 0.15 4.30 -2.45 -1.26 -0.05 119.30 122.25 3d87 s MET 23 Ca -0.07 -1.60 -0.08 0.00 -1.25 0.00 0.00 55.69 52.68 3d87 s MET 23 Cb -0.04 -4.13 -0.06 0.00 1.25 0.00 0.00 34.83 31.85 3d87 s MET 23 CO 0.02 -1.19 0.45 0.08 1.05 0.00 0.00 175.02 175.44 3d87 s VAL 24 N 1.55 5.04 -0.11 10.11 1.01 0.06 -4.91 120.40 133.15 3d87 s VAL 24 Ca 0.04 0.35 0.01 0.00 0.00 0.00 0.00 61.98 62.39 3d87 s VAL 24 Cb -0.27 -3.64 0.02 0.00 0.00 0.00 0.00 36.38 32.49 3d87 s VAL 24 CO 0.03 0.09 -0.15 -0.69 0.00 0.00 0.00 175.10 174.38 3d87 s VAL 25 N -1.62 1.50 0.17 2.92 1.01 -1.26 0.14 120.40 123.25 3d87 s VAL 25 Ca 0.41 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.79 3d87 s VAL 25 Cb -0.13 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 3d87 s VAL 25 CO 0.21 0.44 0.26 -0.76 0.00 0.00 0.00 175.10 175.26 3d87 s LEU 26 N 1.07 4.22 -0.07 3.92 1.43 0.56 -4.90 118.68 124.89 3d87 s LEU 26 Ca -0.05 0.08 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 3d87 s LEU 26 Cb -0.15 -2.79 0.02 0.00 0.03 0.00 0.00 46.19 43.30 3d87 s LEU 26 CO -0.03 0.03 -0.10 -0.89 0.23 0.00 0.00 176.35 175.60 3d87 s THR 27 N -1.79 0.99 0.07 5.49 2.01 -1.26 -1.31 115.64 119.83 3d87 s THR 27 Ca 0.34 -0.37 -0.31 0.00 0.31 0.00 0.00 61.69 61.67 3d87 s THR 27 Cb -0.10 -0.95 -0.06 0.00 0.01 0.00 0.00 72.50 71.40 3d87 s THR 27 CO 0.27 0.33 1.23 0.00 -0.69 0.00 0.00 174.62 175.77 3d87 s ASP 29 N 1.07 6.18 -0.20 0.00 2.15 -1.26 -4.93 116.67 119.68 3d87 s ASP 29 Ca 0.60 -1.62 -0.33 0.00 0.43 0.00 0.00 52.55 51.63 3d87 s ASP 29 Cb -0.31 -2.20 0.15 0.00 -0.30 0.00 0.00 42.92 40.26 3d87 s ASP 29 CO 0.29 -0.79 1.21 0.28 -0.17 0.00 0.00 175.17 175.99 3d87 s THR 30 N 1.62 0.00 0.09 1.71 -1.32 -1.26 -4.53 115.64 111.95 3d87 s THR 30 Ca 0.03 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.26 3d87 s THR 30 Cb -0.28 -1.00 -0.15 0.00 -1.51 0.00 0.00 72.50 69.56 3d87 s THR 30 CO 0.04 0.00 1.71 1.55 -2.21 0.00 0.00 174.62 175.71 3d87 h PRO 31 N 2.10 -0.24 -3.12 7.08 0.13 -1.98 -3.44 132.00 132.52 3d87 h PRO 31 Ca -0.10 0.02 -0.42 0.00 -0.87 0.00 0.00 66.00 64.62 3d87 h PRO 31 Cb 1.17 0.05 0.02 0.00 0.13 0.00 0.00 31.00 32.38 3d87 h PRO 31 CO 0.24 -0.16 0.12 0.39 -0.23 0.00 0.00 178.00 178.36 3d87 n GLU 32 N -5.21 0.00 -0.00 0.86 -0.58 -1.26 -4.90 120.64 109.55 3d87 n GLU 32 Ca -0.08 0.00 0.03 0.00 -0.42 0.00 0.00 57.16 56.69 3d87 n GLU 32 Cb 0.13 -0.78 -0.05 0.00 -0.57 0.00 0.00 31.44 30.17 3d87 n GLU 32 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 3d87 n GLU 33 N 1.13 0.75 -4.94 3.49 0.28 -1.26 -4.97 120.64 115.11 3d87 n GLU 33 Ca 0.12 -0.05 -0.33 0.00 -0.16 0.00 0.00 57.16 56.74 3d87 n GLU 33 Cb 0.02 -1.12 -0.14 0.00 1.43 0.00 0.00 31.44 31.63 3d87 n GLU 33 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3d87 s ASP 34 N -2.64 3.85 -0.97 -1.84 1.01 -1.26 -4.77 116.67 110.04 3d87 s ASP 34 Ca -0.02 -0.27 -0.00 0.00 0.71 0.00 0.00 52.55 52.97 3d87 s ASP 34 Cb 0.04 -0.94 -0.00 0.00 1.01 0.00 0.00 42.92 43.03 3d87 s ASP 34 CO 0.28 0.30 0.81 0.61 0.21 0.00 0.00 175.17 177.38 3d87 n GLY 35 N 2.59 -0.21 3.84 0.21 0.00 -1.26 -4.92 105.19 105.44 3d87 n GLY 35 Ca -0.17 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 3d87 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d87 s ILE 36 N -3.29 5.02 0.11 -0.61 1.09 -1.26 -4.17 121.20 118.09 3d87 s ILE 36 Ca 0.00 0.75 0.03 0.00 -1.10 0.00 0.00 60.65 60.33 3d87 s ILE 36 Cb -0.00 -3.70 -0.04 0.00 -1.06 0.00 0.00 42.46 37.66 3d87 s ILE 36 CO 0.59 0.46 -0.09 0.42 -0.10 0.00 0.00 174.94 176.22 3d87 s THR 37 N -1.21 0.95 -0.04 2.92 -4.23 -0.57 -3.15 115.64 110.31 3d87 s THR 37 Ca 0.28 -1.86 0.06 0.00 -1.18 0.00 0.00 61.69 58.99 3d87 s THR 37 Cb -0.16 -1.61 -0.01 0.00 1.34 0.00 0.00 72.50 72.06 3d87 s THR 37 CO 0.16 -0.71 -0.21 0.26 -0.54 0.00 0.00 174.62 173.57 3d87 s TRP 38 N -3.06 2.02 0.05 3.99 0.52 -0.76 -1.14 118.94 120.55 3d87 s TRP 38 Ca 0.11 -0.53 0.02 0.00 0.02 0.00 0.00 56.10 55.72 3d87 s TRP 38 Cb 0.01 -1.33 -0.03 0.00 -1.15 0.00 0.00 33.47 30.98 3d87 s TRP 38 CO -0.01 -0.14 -0.06 0.95 0.02 0.00 0.00 176.95 177.71 3d87 s THR 39 N -0.21 0.46 -0.20 2.01 -4.23 -0.54 -0.05 115.64 112.88 3d87 s THR 39 Ca 0.00 -1.21 -0.02 0.00 -1.18 0.00 0.00 61.69 59.29 3d87 s THR 39 Cb -0.11 -0.74 0.00 0.00 1.34 0.00 0.00 72.50 72.99 3d87 s THR 39 CO 0.02 -0.51 -0.11 -0.22 -0.54 0.00 0.00 174.62 173.25 3d87 s LEU 40 N -1.84 2.58 0.00 4.79 2.96 -1.26 -0.41 118.68 125.49 3d87 s LEU 40 Ca -0.07 -0.49 0.00 0.00 -0.22 0.00 0.00 54.13 53.35 3d87 s LEU 40 Cb -0.07 -1.63 0.00 0.00 0.50 0.00 0.00 46.19 45.00 3d87 s LEU 40 CO -0.01 -0.00 0.00 0.47 -1.32 0.00 0.00 176.35 175.49 3d87 n ASP 41 N 4.65 0.00 0.00 3.68 10.43 0.27 -4.02 116.55 131.55 3d87 n ASP 41 Ca -0.19 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.17 3d87 n ASP 41 Cb 0.51 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.47 3d87 n ASP 41 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3d87 n GLN 42 N 14.00 0.00 -0.68 -1.24 3.00 -1.26 -4.90 117.38 126.30 3d87 n GLN 42 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3d87 n GLN 42 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 3d87 n GLN 42 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 3d87 n SER 43 N 0.00 0.00 0.03 1.08 2.88 -1.26 -4.71 113.62 111.65 3d87 n SER 43 Ca 0.00 0.36 0.04 0.00 -1.33 0.00 0.00 58.87 57.94 3d87 n SER 43 Cb 0.00 -0.55 0.19 0.00 -0.75 0.00 0.00 64.21 63.11 3d87 n SER 43 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3d87 n SER 44 N 1.45 0.13 -4.64 -3.46 3.41 -1.26 -4.41 113.62 104.84 3d87 n SER 44 Ca 0.00 0.55 -0.45 0.00 -0.26 0.00 0.00 58.87 58.71 3d87 n SER 44 Cb 0.00 -0.57 -0.04 0.00 -0.26 0.00 0.00 64.21 63.34 3d87 n SER 44 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3d87 n GLU 45 N -1.66 2.31 -2.57 4.33 2.13 -1.26 -4.94 120.64 118.99 3d87 n GLU 45 Ca 0.01 0.81 -0.43 0.00 0.66 0.00 0.00 57.16 58.21 3d87 n GLU 45 Cb 0.06 -2.88 -0.02 0.00 0.27 0.00 0.00 31.44 28.86 3d87 n GLU 45 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3d87 s VAL 46 N 5.28 4.51 -0.91 6.31 1.01 -1.26 -4.29 120.40 131.06 3d87 s VAL 46 Ca 0.94 1.81 0.22 0.00 0.00 0.00 0.00 61.98 64.96 3d87 s VAL 46 Cb -0.54 -4.16 -0.16 0.00 0.00 0.00 0.00 36.38 31.51 3d87 s VAL 46 CO 0.45 -0.05 1.03 0.18 0.00 0.00 0.00 175.10 176.71 3d87 n LEU 47 N 5.51 0.78 0.00 3.92 4.77 0.93 -4.98 117.00 127.93 3d87 n LEU 47 Ca 0.11 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 3d87 n LEU 47 Cb 0.47 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 3d87 n LEU 47 CO 0.54 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 3d87 n GLY 48 N 1.47 1.65 0.00 -0.72 0.00 -1.26 -4.98 105.19 101.36 3d87 n GLY 48 Ca 0.04 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.99 3d87 n GLY 48 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d87 n SER 49 N 0.00 0.26 -0.65 1.61 7.64 -1.26 -1.84 113.62 119.38 3d87 n SER 49 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.96 3d87 n SER 49 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 3d87 n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d87 n GLY 50 N 4.65 -2.79 0.00 0.23 0.00 -1.19 -4.28 105.19 101.82 3d87 n GLY 50 Ca 0.00 -1.28 0.11 0.00 0.00 0.00 0.00 46.02 44.85 3d87 n GLY 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d87 n LYS 51 N -3.13 0.26 -4.39 1.61 5.02 -1.26 -4.62 118.16 111.64 3d87 n LYS 51 Ca -0.04 0.08 -0.21 0.00 -2.02 0.00 0.00 58.31 56.12 3d87 n LYS 51 Cb 0.31 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.66 3d87 n LYS 51 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3d87 s THR 52 N -2.66 0.81 -0.10 -0.18 -4.23 -1.26 0.80 115.64 108.82 3d87 s THR 52 Ca 0.20 -0.34 -0.01 0.00 -1.18 0.00 0.00 61.69 60.36 3d87 s THR 52 Cb 0.15 -0.75 -0.03 0.00 1.34 0.00 0.00 72.50 73.21 3d87 s THR 52 CO 0.37 0.27 -0.06 -0.22 -0.54 0.00 0.00 174.62 174.44 3d87 s LEU 53 N 0.47 3.20 -0.15 4.79 2.96 -0.43 -4.83 118.68 124.68 3d87 s LEU 53 Ca -0.08 -0.06 -0.01 0.00 -0.22 0.00 0.00 54.13 53.77 3d87 s LEU 53 Cb -0.12 -1.72 -0.01 0.00 0.50 0.00 0.00 46.19 44.84 3d87 s LEU 53 CO 0.01 0.30 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.33 3d87 s THR 54 N -0.42 3.00 0.34 3.68 2.01 -1.26 0.21 115.64 123.20 3d87 s THR 54 Ca 0.06 -0.66 0.04 0.00 0.31 0.00 0.00 61.69 61.44 3d87 s THR 54 Cb -0.12 -2.28 -0.03 0.00 0.01 0.00 0.00 72.50 70.07 3d87 s THR 54 CO 0.02 0.50 0.16 0.27 -0.69 0.00 0.00 174.62 174.88 3d87 s ILE 55 N 0.70 0.44 0.06 1.82 -4.36 0.36 -4.98 121.20 115.25 3d87 s ILE 55 Ca -0.06 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.41 3d87 s ILE 55 Cb -0.15 -2.47 -0.03 0.00 1.25 0.00 0.00 42.46 41.05 3d87 s ILE 55 CO 0.02 0.00 -0.18 -1.58 0.24 0.00 0.00 174.94 173.43 3d87 s GLN 56 N -3.74 1.98 -0.15 0.37 0.74 -1.26 -0.76 119.66 116.83 3d87 s GLN 56 Ca 0.32 -1.04 -0.00 0.00 0.05 0.00 0.00 55.36 54.69 3d87 s GLN 56 Cb 0.04 -2.16 0.04 0.00 1.10 0.00 0.00 33.01 32.03 3d87 s GLN 56 CO 0.17 0.52 -0.06 0.08 -0.55 0.00 0.00 175.29 175.46 3d87 s VAL 57 N -0.98 1.09 0.02 1.34 1.01 0.93 -4.91 120.40 118.90 3d87 s VAL 57 Ca 0.15 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.58 3d87 s VAL 57 Cb -0.10 -1.23 0.00 0.00 0.00 0.00 0.00 36.38 35.05 3d87 s VAL 57 CO 0.06 0.18 0.00 0.29 0.00 0.00 0.00 175.10 175.64 3d87 n LYS 58 N 4.89 0.00 -2.18 2.72 5.02 -1.26 -2.12 118.16 125.23 3d87 n LYS 58 Ca -0.12 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.07 3d87 n LYS 58 Cb 0.48 -0.09 0.01 0.00 -0.02 0.00 0.00 35.03 35.42 3d87 n LYS 58 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3d87 n GLU 59 N -2.69 0.99 -0.13 1.97 0.00 -1.26 -4.10 120.64 115.43 3d87 n GLU 59 Ca 0.00 -1.40 0.01 0.00 0.00 0.00 0.00 57.16 55.77 3d87 n GLU 59 Cb 0.00 0.03 0.29 0.00 0.00 0.00 0.00 31.44 31.76 3d87 n GLU 59 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.13 177.87 3d87 h PHE 60 N 0.31 0.78 0.00 4.31 -1.00 -2.00 0.76 116.94 120.10 3d87 h PHE 60 Ca -0.13 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.64 3d87 h PHE 60 Cb 0.54 -0.26 0.00 0.00 3.61 0.00 0.00 35.95 39.84 3d87 h PHE 60 CO 0.00 0.54 0.16 0.41 -1.61 0.00 0.00 178.31 177.81 3d87 n GLY 61 N -1.29 -0.47 0.10 -1.45 0.00 -1.26 -0.11 105.19 100.72 3d87 n GLY 61 Ca 0.05 0.05 0.03 0.00 0.00 0.00 0.00 46.02 46.16 3d87 n GLY 61 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3d87 h ASP 62 N 0.00 0.00 -0.81 1.61 3.45 -1.19 -3.47 116.42 116.00 3d87 h ASP 62 Ca 0.00 0.00 -0.50 0.00 0.43 0.00 0.00 57.03 56.96 3d87 h ASP 62 Cb 0.32 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.10 3d87 h ASP 62 CO 0.00 0.42 -0.17 0.00 -1.57 0.00 0.00 179.24 177.93 3d87 s ALA 63 N -3.04 4.62 0.00 3.45 0.00 0.85 -4.91 121.76 122.72 3d87 s ALA 63 Ca -0.02 -1.91 0.00 0.00 0.00 0.00 0.00 51.96 50.04 3d87 s ALA 63 Cb 0.09 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 21.92 3d87 s ALA 63 CO 0.80 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 176.27 3d87 n GLY 64 N -2.08 0.95 3.65 0.00 0.00 -0.99 -4.96 105.19 101.76 3d87 n GLY 64 Ca 0.11 -1.88 -0.40 0.00 0.00 0.00 0.00 46.02 43.85 3d87 n GLY 64 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3d87 s GLN 65 N -2.00 4.16 -0.03 1.61 0.74 -1.26 -0.30 119.66 122.58 3d87 s GLN 65 Ca 0.00 0.54 -0.14 0.00 0.05 0.00 0.00 55.36 55.81 3d87 s GLN 65 Cb 0.00 -3.60 -0.05 0.00 1.10 0.00 0.00 33.01 30.45 3d87 s GLN 65 CO 0.00 -0.29 0.37 0.71 -0.55 0.00 0.00 175.29 175.53 3d87 s TYR 66 N 2.10 3.69 0.01 1.67 1.51 -0.91 0.95 117.35 126.37 3d87 s TYR 66 Ca 0.27 0.91 0.03 0.00 -1.01 0.00 0.00 57.07 57.27 3d87 s TYR 66 Cb -0.16 -2.26 -0.01 0.00 -0.11 0.00 0.00 41.96 39.42 3d87 s TYR 66 CO 0.09 0.62 -0.11 0.99 -1.11 0.00 0.00 175.55 176.03 3d87 s THR 67 N -0.92 0.84 0.01 -0.71 2.01 0.45 -1.94 115.64 115.38 3d87 s THR 67 Ca 0.22 -0.64 0.05 0.00 0.31 0.00 0.00 61.69 61.64 3d87 s THR 67 Cb -0.16 -0.74 -0.03 0.00 0.01 0.00 0.00 72.50 71.58 3d87 s THR 67 CO 0.12 0.10 -0.12 0.00 -0.69 0.00 0.00 174.62 174.03 3d87 s HIS 69 N -0.93 0.84 -0.07 0.00 3.76 -0.30 -0.21 115.29 118.39 3d87 s HIS 69 Ca 0.15 -0.66 -0.03 0.00 -0.15 0.00 0.00 55.06 54.36 3d87 s HIS 69 Cb -0.11 -0.49 0.04 0.00 1.11 0.00 0.00 32.58 33.13 3d87 s HIS 69 CO 0.06 -0.08 0.16 0.21 -0.85 0.00 0.00 174.74 174.24 3d87 s LYS 70 N -2.56 0.12 -1.54 1.40 2.36 -0.96 -1.51 119.74 117.04 3d87 s LYS 70 Ca 0.01 0.39 -0.07 0.00 -2.55 0.00 0.00 55.97 53.74 3d87 s LYS 70 Cb -0.04 -0.16 0.06 0.00 -1.05 0.00 0.00 37.83 36.65 3d87 s LYS 70 CO -0.01 -0.16 0.50 0.41 1.55 0.00 0.00 175.35 177.64 3d87 n GLY 71 N 4.15 -0.29 2.64 5.54 0.00 -1.26 -0.50 105.19 115.46 3d87 n GLY 71 Ca -0.26 0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3d87 n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d87 n GLY 72 N -1.84 0.34 3.90 -0.02 0.00 -1.26 -5.00 105.19 101.31 3d87 n GLY 72 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 3d87 n GLY 72 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d87 s GLU 73 N -0.79 3.39 -0.00 1.61 0.41 0.35 -5.07 118.70 118.60 3d87 s GLU 73 Ca 0.00 -0.39 -0.23 0.00 -0.41 0.00 0.00 54.97 53.94 3d87 s GLU 73 Cb 0.00 -3.05 -0.05 0.00 -1.78 0.00 0.00 34.13 29.25 3d87 s GLU 73 CO 0.00 0.65 0.69 0.54 -0.49 0.00 0.00 175.26 176.64 3d87 s VAL 74 N -1.39 4.88 -0.25 2.63 0.11 -1.26 -2.27 120.40 122.85 3d87 s VAL 74 Ca 0.30 1.45 -0.10 0.00 -2.93 0.00 0.00 61.98 60.70 3d87 s VAL 74 Cb -0.13 -4.03 -0.16 0.00 -1.53 0.00 0.00 36.38 30.53 3d87 s VAL 74 CO 0.22 0.35 -0.18 0.18 -3.33 0.00 0.00 175.10 172.34 3d87 n LEU 75 N 3.04 2.31 -3.65 2.54 4.77 0.70 -4.93 117.00 121.79 3d87 n LEU 75 Ca -0.04 0.19 -0.02 0.00 -0.03 0.00 0.00 56.01 56.12 3d87 n LEU 75 Cb 0.51 -0.89 -0.01 0.00 -2.33 0.00 0.00 43.42 40.69 3d87 n LEU 75 CO 0.46 0.67 0.92 -0.94 -1.33 0.00 0.00 177.39 177.17 3d87 s SER 76 N -7.09 -0.13 0.00 -1.43 1.04 -1.24 -4.84 113.70 100.01 3d87 s SER 76 Ca -0.35 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 55.89 3d87 s SER 76 Cb 0.11 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.51 3d87 s SER 76 CO 0.56 -0.50 0.00 1.41 0.98 0.00 0.00 173.24 175.69 3d87 n HIS 77 N -0.41 0.00 0.00 5.02 8.25 -1.26 -1.88 115.22 124.94 3d87 n HIS 77 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 3d87 n HIS 77 Cb 0.61 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.72 3d87 n HIS 77 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3d87 n SER 78 N 0.00 0.00 -4.68 0.41 7.64 -0.82 -4.83 113.62 111.34 3d87 n SER 78 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 3d87 n SER 78 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 3d87 n SER 78 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3d87 s LEU 79 N 0.00 4.25 -0.21 -3.43 2.96 0.26 -2.13 118.68 120.38 3d87 s LEU 79 Ca 0.00 1.82 -0.06 0.00 -0.22 0.00 0.00 54.13 55.67 3d87 s LEU 79 Cb 0.00 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.11 3d87 s LEU 79 CO 0.00 -0.66 0.03 -0.76 -1.32 0.00 0.00 176.35 173.64 3d87 s LEU 80 N 2.66 3.46 0.26 -0.68 1.43 0.58 0.82 118.68 127.21 3d87 s LEU 80 Ca 0.57 -0.12 0.09 0.00 -1.03 0.00 0.00 54.13 53.63 3d87 s LEU 80 Cb -0.25 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 3d87 s LEU 80 CO 0.20 0.07 0.05 -0.76 0.23 0.00 0.00 176.35 176.15 3d87 s LEU 81 N 0.98 3.37 0.07 1.79 1.43 0.30 -2.34 118.68 124.27 3d87 s LEU 81 Ca 0.03 -0.53 0.05 0.00 -1.03 0.00 0.00 54.13 52.65 3d87 s LEU 81 Cb -0.14 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 3d87 s LEU 81 CO 0.02 -0.01 -0.06 -0.76 0.23 0.00 0.00 176.35 175.77 3d87 s LEU 82 N -3.69 3.19 -0.21 1.79 1.43 -0.45 -0.19 118.68 120.55 3d87 s LEU 82 Ca 0.32 -0.26 -0.00 0.00 -1.03 0.00 0.00 54.13 53.16 3d87 s LEU 82 Cb -0.07 -1.93 0.02 0.00 0.03 0.00 0.00 46.19 44.24 3d87 s LEU 82 CO 0.21 0.21 -0.13 -2.28 0.23 0.00 0.00 176.35 174.59 3d87 s HIS 83 N -1.18 2.93 -0.17 0.29 5.65 0.38 -0.55 115.29 122.65 3d87 s HIS 83 Ca 0.21 -1.58 -0.02 0.00 0.25 0.00 0.00 55.06 53.92 3d87 s HIS 83 Cb -0.11 -1.99 -0.01 0.00 -1.18 0.00 0.00 32.58 29.29 3d87 s HIS 83 CO 0.13 -0.75 -0.08 -1.59 -0.65 0.00 0.00 174.74 171.80 3d87 s LYS 84 N 1.31 3.43 -0.77 2.88 -2.85 -1.26 -1.23 119.74 121.25 3d87 s LYS 84 Ca 0.02 -0.63 -0.20 0.00 -1.00 0.00 0.00 55.97 54.16 3d87 s LYS 84 Cb -0.15 -2.82 0.11 0.00 -2.06 0.00 0.00 37.83 32.91 3d87 s LYS 84 CO -0.08 0.06 0.98 0.21 0.10 0.00 0.00 175.35 176.62 3d87 s LYS 85 N 0.77 3.34 -0.25 1.78 2.20 -0.67 -2.53 119.74 124.37 3d87 s LYS 85 Ca -0.03 -1.40 -0.22 0.00 -0.36 0.00 0.00 55.97 53.96 3d87 s LYS 85 Cb -0.15 -4.55 -0.01 0.00 -1.51 0.00 0.00 37.83 31.61 3d87 s LYS 85 CO 0.02 -1.73 0.72 -1.21 -0.36 0.00 0.00 175.35 172.78 3d87 s GLU 86 N 3.06 4.12 -1.62 4.03 2.02 0.38 -3.54 118.70 127.15 3d87 s GLU 86 Ca 0.25 0.70 -0.09 0.00 0.02 0.00 0.00 54.97 55.84 3d87 s GLU 86 Cb -0.13 -3.65 0.09 0.00 0.10 0.00 0.00 34.13 30.54 3d87 s GLU 86 CO -0.00 -0.47 0.40 -0.25 0.02 0.00 0.00 175.26 174.95 3d87 n ASP 87 N 5.86 -0.86 0.00 -0.19 8.00 -1.26 -0.77 116.55 127.33 3d87 n ASP 87 Ca 0.02 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.37 3d87 n ASP 87 Cb 0.48 -2.19 0.00 0.00 -0.02 0.00 0.00 41.12 39.39 3d87 n ASP 87 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d87 n GLY 88 N -1.86 0.64 2.84 0.44 0.00 -1.26 -5.02 105.19 100.96 3d87 n GLY 88 Ca -0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.75 3d87 n GLY 88 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3d87 s ILE 89 N -2.54 -0.02 1.12 -0.61 2.07 0.05 -5.09 121.20 116.18 3d87 s ILE 89 Ca 0.00 0.09 -0.17 0.00 -1.41 0.00 0.00 60.65 59.16 3d87 s ILE 89 Cb 0.00 -0.05 0.14 0.00 0.13 0.00 0.00 42.46 42.69 3d87 s ILE 89 CO 0.00 0.04 0.27 0.79 -1.91 0.00 0.00 174.94 174.12 3d87 n TRP 90 N 3.53 -1.37 -3.19 3.50 5.03 -1.26 -0.47 117.44 123.21 3d87 n TRP 90 Ca -0.19 0.08 -0.27 0.00 3.03 0.00 0.00 57.50 60.16 3d87 n TRP 90 Cb 0.56 -1.61 -0.02 0.00 -1.03 0.00 0.00 31.31 29.21 3d87 n TRP 90 CO 0.00 0.00 0.00 -1.54 -0.03 0.00 0.00 177.69 176.12 3d87 s SER 91 N -1.98 6.36 0.00 -0.99 1.04 -1.05 -4.59 113.70 112.49 3d87 s SER 91 Ca 0.59 0.68 0.00 0.00 0.48 0.00 0.00 55.95 57.70 3d87 s SER 91 Cb -0.16 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 63.83 3d87 s SER 91 CO 0.66 -0.32 0.21 0.35 0.98 0.00 0.00 173.24 175.13 3d87 n THR 92 N -1.53 0.03 -0.20 2.02 -2.24 -1.26 -4.75 114.28 106.34 3d87 n THR 92 Ca -0.02 -0.05 0.21 0.00 -2.27 0.00 0.00 64.05 61.92 3d87 n THR 92 Cb 0.55 1.59 0.33 0.00 -2.10 0.00 0.00 70.33 70.69 3d87 n THR 92 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3d87 n ASP 93 N -0.01 0.00 0.00 3.42 8.00 -1.26 -3.03 116.55 123.67 3d87 n ASP 93 Ca 0.00 0.52 0.00 0.00 0.71 0.00 0.00 54.79 56.02 3d87 n ASP 93 Cb 0.32 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 3d87 n ASP 93 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3d87 n ILE 94 N -2.67 0.00 -2.56 0.53 5.41 -1.26 -4.92 119.36 113.89 3d87 n ILE 94 Ca 0.18 0.61 -0.35 0.00 1.00 0.00 0.00 62.75 64.19 3d87 n ILE 94 Cb 1.05 -1.45 -0.04 0.00 -0.71 0.00 0.00 39.64 38.49 3d87 n ILE 94 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3d87 s LEU 95 N -3.39 3.94 0.12 1.39 1.43 -1.17 -4.50 118.68 116.50 3d87 s LEU 95 Ca 0.00 1.95 -0.27 0.00 -1.03 0.00 0.00 54.13 54.78 3d87 s LEU 95 Cb 0.00 -4.44 -0.07 0.00 0.03 0.00 0.00 46.19 41.71 3d87 s LEU 95 CO 0.00 -0.67 0.85 -0.75 0.23 0.00 0.00 176.35 176.01 3d87 s LYS 96 N -3.00 4.63 -0.10 1.70 2.20 1.44 -4.94 119.74 121.67 3d87 s LYS 96 Ca 0.64 1.27 -0.03 0.00 -0.36 0.00 0.00 55.97 57.49 3d87 s LYS 96 Cb -0.18 -3.33 -0.11 0.00 -1.51 0.00 0.00 37.83 32.71 3d87 s LYS 96 CO 0.22 0.37 1.87 -3.47 -0.36 0.00 0.00 175.35 173.97 3d87 n ASP 97 N 2.32 2.50 0.00 1.43 2.03 -1.26 -3.79 116.55 119.78 3d87 n ASP 97 Ca -0.02 -1.97 0.00 0.00 0.52 0.00 0.00 54.79 53.32 3d87 n ASP 97 Cb 0.49 -0.67 0.00 0.00 -0.72 0.00 0.00 41.12 40.22 3d87 n ASP 97 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 3d87 n GLN 98 N 3.00 0.00 -0.59 -0.67 7.27 -1.26 -2.31 117.38 122.82 3d87 n GLN 98 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.28 3d87 n GLN 98 Cb 0.36 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.01 3d87 n GLN 98 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 3d87 n LYS 99 N 0.00 -0.37 -2.95 3.69 4.81 -1.26 -3.30 118.16 118.78 3d87 n LYS 99 Ca 0.00 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.14 3d87 n LYS 99 Cb 0.00 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.08 3d87 n LYS 99 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 3d87 n GLU 100 N -0.20 -1.44 -2.60 1.64 -0.00 -0.98 -4.74 120.64 112.32 3d87 n GLU 100 Ca 0.00 1.08 -0.32 0.00 -0.00 0.00 0.00 57.16 57.92 3d87 n GLU 100 Cb 0.00 -1.51 -0.00 0.00 -0.00 0.00 0.00 31.44 29.92 3d87 n GLU 100 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 3d87 n PRO 101 N -0.08 3.69 -4.69 3.44 -0.04 -1.21 -2.69 135.00 133.43 3d87 n PRO 101 Ca -0.07 -4.53 -0.28 0.00 -0.04 0.00 0.00 63.50 58.58 3d87 n PRO 101 Cb 0.53 -2.30 -0.17 0.00 -0.04 0.00 0.00 33.50 31.53 3d87 n PRO 101 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3d87 s LYS 102 N -3.77 2.30 0.20 0.54 -0.14 -1.26 -5.09 119.74 112.52 3d87 s LYS 102 Ca 0.47 -0.61 0.00 0.00 -1.36 0.00 0.00 55.97 54.47 3d87 s LYS 102 Cb 0.32 -1.87 0.00 0.00 -1.68 0.00 0.00 37.83 34.59 3d87 s LYS 102 CO -0.19 0.02 0.00 0.09 -0.76 0.00 0.00 175.35 174.51 3d87 n ASN 103 N 3.92 -8.86 -2.51 2.83 4.13 -1.10 -4.89 115.26 108.79 3d87 n ASN 103 Ca -0.20 1.44 -0.02 0.00 1.68 0.00 0.00 54.58 57.48 3d87 n ASN 103 Cb 0.52 -5.08 0.00 0.00 -1.54 0.00 0.00 39.78 33.68 3d87 n ASN 103 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3d87 n LYS 104 N 1.97 -1.13 -0.01 3.52 5.02 -1.26 -4.98 118.16 121.29 3d87 n LYS 104 Ca 0.00 1.31 -0.02 0.00 -2.02 0.00 0.00 58.31 57.58 3d87 n LYS 104 Cb 0.00 -4.36 -0.01 0.00 -0.02 0.00 0.00 35.03 30.64 3d87 n LYS 104 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3d87 n THR 105 N -1.15 0.42 0.00 -0.18 -1.04 -1.26 -4.94 114.28 106.14 3d87 n THR 105 Ca 0.03 0.31 0.00 0.00 -2.04 0.00 0.00 64.05 62.34 3d87 n THR 105 Cb 0.44 -1.57 0.00 0.00 -1.82 0.00 0.00 70.33 67.38 3d87 n THR 105 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3d87 n PHE 106 N -2.99 0.00 -4.06 -1.42 3.72 -1.25 -4.67 117.46 106.80 3d87 n PHE 106 Ca -0.03 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.05 3d87 n PHE 106 Cb 0.11 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.49 3d87 n PHE 106 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3d87 s LEU 107 N 0.00 2.61 -0.27 4.37 1.02 -1.26 -4.06 118.68 121.08 3d87 s LEU 107 Ca 0.00 -0.98 0.03 0.00 0.02 0.00 0.00 54.13 53.20 3d87 s LEU 107 Cb 0.00 -1.41 0.07 0.00 0.02 0.00 0.00 46.19 44.87 3d87 s LEU 107 CO 0.00 -0.12 -0.08 -0.60 0.02 0.00 0.00 176.35 175.58 3d87 s ARG 108 N 1.27 2.08 0.30 1.70 3.52 -0.86 -4.95 118.95 122.01 3d87 s ARG 108 Ca -0.02 -1.44 0.08 0.00 -0.13 0.00 0.00 55.73 54.22 3d87 s ARG 108 Cb -0.16 -2.94 -0.04 0.00 -1.56 0.00 0.00 34.95 30.25 3d87 s ARG 108 CO -0.09 -0.64 0.18 0.00 -0.81 0.00 0.00 175.30 173.94 3d87 s GLU 110 N -3.86 0.98 -0.01 0.00 -1.05 -0.34 -4.83 118.70 109.57 3d87 s GLU 110 Ca 0.36 -0.31 0.04 0.00 -0.15 0.00 0.00 54.97 54.91 3d87 s GLU 110 Cb -0.06 0.45 -0.01 0.00 -0.44 0.00 0.00 34.13 34.08 3d87 s GLU 110 CO 0.24 -0.42 -0.13 0.00 0.95 0.00 0.00 175.26 175.90 3d87 s ALA 111 N -3.14 1.11 -2.02 -0.84 0.00 0.55 -1.77 121.76 115.66 3d87 s ALA 111 Ca 0.02 -0.56 0.20 0.00 0.00 0.00 0.00 51.96 51.63 3d87 s ALA 111 Cb -0.01 -0.30 1.19 0.00 0.00 0.00 0.00 23.12 24.00 3d87 s ALA 111 CO -0.09 0.26 1.77 1.63 0.00 0.00 0.00 175.76 179.33 3d87 n LYS 112 N 2.82 1.04 0.00 0.00 5.02 -1.25 -0.90 118.16 124.89 3d87 n LYS 112 Ca -0.15 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.08 3d87 n LYS 112 Cb 0.55 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 3d87 n LYS 112 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3d87 n ASN 113 N -0.75 0.00 -0.03 4.39 0.23 -1.26 -4.32 115.26 113.51 3d87 n ASN 113 Ca 0.15 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.20 3d87 n ASN 113 Cb 0.08 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.78 3d87 n ASN 113 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 3d87 n TYR 114 N -0.54 0.00 0.07 -2.53 4.02 -1.26 -3.77 117.16 113.15 3d87 n TYR 114 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 58.04 3d87 n TYR 114 Cb 0.00 -0.00 0.64 0.00 -0.02 0.00 0.00 39.34 39.95 3d87 n TYR 114 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3d87 h SER 115 N 0.03 0.07 0.00 7.72 4.64 -1.94 -3.25 113.55 120.82 3d87 h SER 115 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d87 h SER 115 Cb 0.02 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3d87 h SER 115 CO 0.00 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 3d87 n GLY 116 N -1.59 1.20 3.21 -0.77 0.00 -1.25 -4.80 105.19 101.19 3d87 n GLY 116 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 3d87 n GLY 116 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3d87 s ARG 117 N -0.32 3.09 0.23 1.61 3.52 -1.26 -0.68 118.95 125.15 3d87 s ARG 117 Ca 0.00 -0.79 0.03 0.00 -0.13 0.00 0.00 55.73 54.84 3d87 s ARG 117 Cb 0.00 -2.82 -0.05 0.00 -1.56 0.00 0.00 34.95 30.52 3d87 s ARG 117 CO 0.00 -0.25 0.01 -0.59 -0.81 0.00 0.00 175.30 173.66 3d87 s PHE 118 N 1.36 1.55 0.02 5.12 -0.71 -0.69 -4.42 117.98 120.22 3d87 s PHE 118 Ca 0.04 -0.95 0.05 0.00 -1.04 0.00 0.00 56.93 55.03 3d87 s PHE 118 Cb -0.14 -0.90 -0.02 0.00 -1.21 0.00 0.00 43.02 40.75 3d87 s PHE 118 CO -0.08 -0.08 -0.14 0.99 -1.34 0.00 0.00 175.22 174.58 3d87 s THR 119 N -3.46 1.12 -0.02 -4.49 2.01 -0.73 -1.00 115.64 109.08 3d87 s THR 119 Ca 0.29 -0.87 0.06 0.00 0.31 0.00 0.00 61.69 61.48 3d87 s THR 119 Cb 0.06 -0.99 -0.01 0.00 0.01 0.00 0.00 72.50 71.57 3d87 s THR 119 CO 0.09 0.11 -0.19 0.00 -0.69 0.00 0.00 174.62 173.94 3d87 s TRP 121 N -0.41 2.35 0.12 0.00 0.51 -0.76 -2.54 118.94 118.21 3d87 s TRP 121 Ca 0.06 -0.42 0.03 0.00 -2.12 0.00 0.00 56.10 53.65 3d87 s TRP 121 Cb -0.08 -1.51 -0.04 0.00 -0.81 0.00 0.00 33.47 31.03 3d87 s TRP 121 CO -0.00 -0.02 -0.09 1.67 -0.51 0.00 0.00 176.95 177.99 3d87 s TRP 122 N -0.62 1.10 -0.07 -1.98 -2.14 -1.19 -2.02 118.94 112.02 3d87 s TRP 122 Ca 0.10 -0.81 0.04 0.00 2.66 0.00 0.00 56.10 58.10 3d87 s TRP 122 Cb -0.10 -0.59 -0.01 0.00 -3.10 0.00 0.00 33.47 29.67 3d87 s TRP 122 CO -0.01 -0.02 -0.21 -0.51 -2.66 0.00 0.00 176.95 173.55 3d87 s LEU 123 N -3.05 2.33 0.01 -4.66 1.43 -1.26 -1.97 118.68 111.51 3d87 s LEU 123 Ca 0.14 -0.41 -0.05 0.00 -1.03 0.00 0.00 54.13 52.77 3d87 s LEU 123 Cb 0.03 -1.46 -0.00 0.00 0.03 0.00 0.00 46.19 44.79 3d87 s LEU 123 CO -0.02 0.25 0.09 0.28 0.23 0.00 0.00 176.35 177.19 3d87 s THR 124 N -0.18 0.09 -0.01 5.49 -1.32 -0.20 0.43 115.64 119.94 3d87 s THR 124 Ca -0.02 -0.76 -0.14 0.00 -1.21 0.00 0.00 61.69 59.56 3d87 s THR 124 Cb -0.14 -0.39 -0.33 0.00 -1.51 0.00 0.00 72.50 70.13 3d87 s THR 124 CO 0.03 -0.42 0.84 0.71 -2.21 0.00 0.00 174.62 173.58 3d87 h THR 125 N 4.37 1.13 -1.44 5.08 1.35 -1.79 2.09 112.91 123.70 3d87 h THR 125 Ca -0.31 -2.61 -0.74 0.00 -0.55 0.00 0.00 66.41 62.21 3d87 h THR 125 Cb 1.20 2.92 0.01 0.00 -1.73 0.00 0.00 68.15 70.55 3d87 h THR 125 CO 0.41 0.83 0.97 -0.38 -0.25 0.00 0.00 175.52 177.09 3d87 n ILE 126 N -3.69 0.29 0.02 6.82 -0.00 -1.26 -4.66 119.36 116.88 3d87 n ILE 126 Ca -0.20 -0.07 0.04 0.00 -0.00 0.00 0.00 62.75 62.51 3d87 n ILE 126 Cb 1.08 -1.24 -0.09 0.00 -0.00 0.00 0.00 39.64 39.39 3d87 n ILE 126 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 3d87 n SER 127 N 5.91 0.55 -3.93 4.38 3.41 -1.26 -4.85 113.62 117.82 3d87 n SER 127 Ca 0.29 0.23 -0.09 0.00 -0.26 0.00 0.00 58.87 59.04 3d87 n SER 127 Cb 0.13 0.75 -0.09 0.00 -0.26 0.00 0.00 64.21 64.74 3d87 n SER 127 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3d87 s THR 128 N -3.10 0.14 -0.69 6.66 -1.32 -1.26 -4.85 115.64 111.21 3d87 s THR 128 Ca -0.04 -1.17 -0.02 0.00 -1.21 0.00 0.00 61.69 59.24 3d87 s THR 128 Cb 0.10 -1.01 0.00 0.00 -1.51 0.00 0.00 72.50 70.08 3d87 s THR 128 CO 0.83 -0.65 0.59 0.47 -2.21 0.00 0.00 174.62 173.66 3d87 n ASP 129 N 0.60 -3.13 -4.10 8.08 8.00 -1.26 -4.84 116.55 119.90 3d87 n ASP 129 Ca -0.18 -0.32 -0.31 0.00 0.71 0.00 0.00 54.79 54.70 3d87 n ASP 129 Cb 0.59 -2.99 -0.17 0.00 -0.02 0.00 0.00 41.12 38.54 3d87 n ASP 129 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3d87 s LEU 130 N -4.39 1.91 0.03 0.64 1.43 -1.25 -1.86 118.68 115.19 3d87 s LEU 130 Ca 0.15 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 52.77 3d87 s LEU 130 Cb -0.07 -1.28 -0.02 0.00 0.03 0.00 0.00 46.19 44.86 3d87 s LEU 130 CO 0.40 0.03 -0.13 0.42 0.23 0.00 0.00 176.35 177.30 3d87 s THR 131 N 0.99 1.04 -0.24 5.49 -4.23 0.12 -4.99 115.64 113.83 3d87 s THR 131 Ca -0.05 -0.91 -0.04 0.00 -1.18 0.00 0.00 61.69 59.52 3d87 s THR 131 Cb -0.15 -0.94 0.10 0.00 1.34 0.00 0.00 72.50 72.85 3d87 s THR 131 CO -0.04 0.03 0.18 -0.36 -0.54 0.00 0.00 174.62 173.89 3d87 s PHE 132 N -0.78 -0.04 -0.18 3.99 0.08 -1.25 0.01 117.98 119.81 3d87 s PHE 132 Ca 0.01 -0.28 -0.10 0.00 0.12 0.00 0.00 56.93 56.68 3d87 s PHE 132 Cb -0.07 -0.60 -0.05 0.00 -0.57 0.00 0.00 43.02 41.73 3d87 s PHE 132 CO 0.01 -0.71 0.17 0.45 -0.10 0.00 0.00 175.22 175.04 3d87 s SER 133 N 2.23 6.30 -0.18 1.36 0.15 -0.24 -4.18 113.70 119.13 3d87 s SER 133 Ca 0.07 0.34 -0.02 0.00 0.70 0.00 0.00 55.95 57.03 3d87 s SER 133 Cb -0.16 -2.11 -0.01 0.00 -1.71 0.00 0.00 66.02 62.04 3d87 s SER 133 CO -0.22 0.20 -0.08 -0.69 1.20 0.00 0.00 173.24 173.65 3d87 s VAL 134 N 0.13 3.22 -0.09 4.45 1.01 -1.26 0.76 120.40 128.61 3d87 s VAL 134 Ca 0.11 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.56 3d87 s VAL 134 Cb -0.12 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.85 3d87 s VAL 134 CO 0.00 0.47 -0.22 -0.54 0.00 0.00 0.00 175.10 174.81 3d87 s LYS 135 N 1.00 2.78 0.03 2.72 1.02 -0.27 -4.71 119.74 122.31 3d87 s LYS 135 Ca -0.01 -0.80 0.01 0.00 0.02 0.00 0.00 55.97 55.20 3d87 s LYS 135 Cb -0.15 -2.14 -0.02 0.00 -0.52 0.00 0.00 37.83 35.01 3d87 s LYS 135 CO -0.01 0.17 -0.06 0.45 -0.92 0.00 0.00 175.35 174.99 3d87 s SER 136 N 0.35 0.62 0.20 2.83 0.15 -1.26 0.78 113.70 117.37 3d87 s SER 136 Ca -0.17 -0.41 -0.16 0.00 0.70 0.00 0.00 55.95 55.91 3d87 s SER 136 Cb -0.17 0.02 0.02 0.00 -1.71 0.00 0.00 66.02 64.18 3d87 s SER 136 CO 0.08 -0.15 0.50 -0.94 1.20 0.00 0.00 173.24 173.92 3d87 s SER 137 N -1.14 -0.21 -0.34 5.45 1.04 -0.80 -3.41 113.70 114.29 3d87 s SER 137 Ca -0.08 -0.56 -0.03 0.00 0.48 0.00 0.00 55.95 55.76 3d87 s SER 137 Cb -0.08 0.57 0.07 0.00 0.10 0.00 0.00 66.02 66.68 3d87 s SER 137 CO -0.00 -1.05 0.09 -0.60 0.98 0.00 0.00 173.24 172.66 3d87 s ARG 138 N -3.90 2.32 0.00 4.02 3.52 0.19 -1.04 118.95 124.07 3d87 s ARG 138 Ca 0.11 -1.43 0.00 0.00 -0.13 0.00 0.00 55.73 54.28 3d87 s ARG 138 Cb -0.01 -3.37 0.00 0.00 -1.56 0.00 0.00 34.95 30.02 3d87 s ARG 138 CO -0.01 -0.78 0.00 0.41 -0.81 0.00 0.00 175.30 174.11 3d87 n GLY 139 N 4.65 0.45 0.01 8.12 0.00 -0.45 -2.99 105.19 114.97 3d87 n GLY 139 Ca -0.09 -1.44 -0.00 0.00 0.00 0.00 0.00 46.02 44.48 3d87 n GLY 139 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d87 h SER 140 N 0.00 0.00 -0.53 1.61 4.64 -1.94 -3.21 113.55 114.13 3d87 h SER 140 Ca 0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 3d87 h SER 140 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 3d87 h SER 140 CO 0.00 0.07 0.86 -0.24 -0.87 0.00 0.00 176.83 176.66 3d87 n SER 141 N -2.49 1.21 -1.30 4.97 2.88 -1.26 -1.82 113.62 115.81 3d87 n SER 141 Ca -0.01 -0.99 0.00 0.00 -1.33 0.00 0.00 58.87 56.55 3d87 n SER 141 Cb 0.03 -1.39 0.00 0.00 -0.75 0.00 0.00 64.21 62.10 3d87 n SER 141 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3d87 n ASP 142 N 15.14 -1.73 -4.19 -3.46 -0.08 -1.26 -5.03 116.55 115.93 3d87 n ASP 142 Ca 0.50 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 53.43 3d87 n ASP 142 Cb 0.37 -0.87 0.12 0.00 2.34 0.00 0.00 41.12 43.08 3d87 n ASP 142 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 3d87 n PRO 143 N -0.76 -0.92 -3.66 -0.67 -0.02 -0.76 -4.79 135.00 123.42 3d87 n PRO 143 Ca 0.00 -0.25 -0.08 0.00 -2.02 0.00 0.00 63.50 61.14 3d87 n PRO 143 Cb 0.33 -1.46 -0.09 0.00 -0.02 0.00 0.00 33.50 32.26 3d87 n PRO 143 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3d87 s GLN 144 N -2.94 0.34 -0.26 -0.52 0.74 -1.16 -4.90 119.66 110.97 3d87 s GLN 144 Ca 0.49 1.03 -0.43 0.00 0.05 0.00 0.00 55.36 56.51 3d87 s GLN 144 Cb -0.06 0.33 -0.19 0.00 1.10 0.00 0.00 33.01 34.18 3d87 s GLN 144 CO 0.67 -0.24 1.43 0.41 -0.55 0.00 0.00 175.29 177.01 3d87 n GLY 145 N 5.30 0.16 2.80 2.59 0.00 -1.26 0.56 105.19 115.34 3d87 n GLY 145 Ca -0.10 0.89 -0.28 0.00 0.00 0.00 0.00 46.02 46.53 3d87 n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d87 s VAL 146 N 1.88 0.78 -0.28 1.61 1.01 -1.22 -1.14 120.40 123.05 3d87 s VAL 146 Ca 0.98 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 62.03 3d87 s VAL 146 Cb -1.32 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 33.90 3d87 s VAL 146 CO 0.69 -0.10 1.10 -0.89 0.00 0.00 0.00 175.10 175.89 3d87 s THR 147 N 1.75 4.50 -0.14 3.92 2.01 0.98 -4.32 115.64 124.34 3d87 s THR 147 Ca -0.01 1.76 -0.10 0.00 0.31 0.00 0.00 61.69 63.65 3d87 s THR 147 Cb -0.17 -4.34 -0.05 0.00 0.01 0.00 0.00 72.50 67.96 3d87 s THR 147 CO -0.07 -0.38 0.20 0.00 -0.69 0.00 0.00 174.62 173.68 3d87 n GLY 149 N 2.66 3.19 0.93 0.00 0.00 0.12 -4.99 105.19 107.10 3d87 n GLY 149 Ca -0.17 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.23 3d87 n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d87 n ALA 150 N -0.24 -2.59 -2.07 4.61 0.00 -1.26 -4.72 120.51 114.23 3d87 n ALA 150 Ca 0.31 0.20 -0.41 0.00 0.00 0.00 0.00 53.44 53.54 3d87 n ALA 150 Cb 1.10 -0.91 -0.03 0.00 0.00 0.00 0.00 19.45 19.61 3d87 n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d87 s ALA 151 N -1.01 2.65 0.84 0.00 0.00 -1.26 -4.60 121.76 118.38 3d87 s ALA 151 Ca 0.00 -0.12 -0.06 0.00 0.00 0.00 0.00 51.96 51.78 3d87 s ALA 151 Cb 0.00 -4.10 0.11 0.00 0.00 0.00 0.00 23.12 19.13 3d87 s ALA 151 CO 0.00 -3.03 0.71 2.41 0.00 0.00 0.00 175.76 175.85 3d87 n THR 152 N 7.29 0.00 -3.99 0.00 -1.04 -0.43 -4.86 114.28 111.25 3d87 n THR 152 Ca 0.21 -0.72 -0.31 0.00 -2.04 0.00 0.00 64.05 61.19 3d87 n THR 152 Cb 0.49 -1.46 -0.15 0.00 -1.82 0.00 0.00 70.33 67.38 3d87 n THR 152 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 3d87 s LEU 153 N 0.00 3.66 0.30 -4.42 2.96 -1.26 -2.58 118.68 117.34 3d87 s LEU 153 Ca 0.42 -1.67 0.03 0.00 -0.22 0.00 0.00 54.13 52.70 3d87 s LEU 153 Cb -0.02 -1.44 0.49 0.00 0.50 0.00 0.00 46.19 45.73 3d87 s LEU 153 CO 0.29 -0.29 1.79 0.77 -1.32 0.00 0.00 176.35 177.59 3d87 h SER 154 N 7.78 0.49 -4.49 3.68 4.64 0.50 -3.47 113.55 122.68 3d87 h SER 154 Ca -0.12 -0.13 0.22 0.00 -0.47 0.00 0.00 61.79 61.28 3d87 h SER 154 Cb 1.04 -0.13 -0.17 0.00 -0.31 0.00 0.00 62.40 62.82 3d87 h SER 154 CO 0.47 0.66 0.72 0.00 -0.87 0.00 0.00 176.83 177.82 3d87 s ALA 155 N -4.71 -2.01 -0.04 5.18 0.00 -1.02 -5.07 121.76 114.09 3d87 s ALA 155 Ca -0.07 1.34 0.01 0.00 0.00 0.00 0.00 51.96 53.24 3d87 s ALA 155 Cb 0.14 0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.36 3d87 s ALA 155 CO 0.78 -0.67 -0.05 -1.83 0.00 0.00 0.00 175.76 173.99 3d87 s GLU 156 N -2.62 0.88 0.33 0.00 -1.05 -1.26 -1.55 118.70 113.43 3d87 s GLU 156 Ca 0.09 -0.13 0.03 0.00 -0.15 0.00 0.00 54.97 54.81 3d87 s GLU 156 Cb -0.01 -0.86 -0.04 0.00 -0.44 0.00 0.00 34.13 32.79 3d87 s GLU 156 CO -0.05 -0.06 0.14 -0.98 0.95 0.00 0.00 175.26 175.26 3d87 s ARG 157 N 0.84 1.68 -0.08 -4.83 1.70 -1.03 -5.01 118.95 112.21 3d87 s ARG 157 Ca -0.12 -1.97 -0.08 0.00 -0.47 0.00 0.00 55.73 53.09 3d87 s ARG 157 Cb -0.14 -0.28 -0.04 0.00 -0.57 0.00 0.00 34.95 33.91 3d87 s ARG 157 CO 0.01 -0.43 0.20 0.08 -1.08 0.00 0.00 175.30 174.08 3d87 s VAL 158 N -3.48 5.39 -0.31 4.99 1.01 -1.26 -1.28 120.40 125.46 3d87 s VAL 158 Ca 0.33 0.32 0.08 0.00 0.00 0.00 0.00 61.98 62.71 3d87 s VAL 158 Cb 0.05 -3.48 0.54 0.00 0.00 0.00 0.00 36.38 33.48 3d87 s VAL 158 CO 0.17 0.58 1.54 -2.11 0.00 0.00 0.00 175.10 175.28 3d87 n ARG 159 N 1.84 1.96 0.00 2.72 0.00 -1.12 -4.89 116.66 117.16 3d87 n ARG 159 Ca -0.18 -3.15 0.00 0.00 -0.00 0.00 0.00 57.85 54.52 3d87 n ARG 159 Cb 0.54 -1.88 0.00 0.00 -0.00 0.00 0.00 32.46 31.12 3d87 n ARG 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3d87 n GLY 160 N -1.10 2.28 0.00 2.89 0.00 -1.26 -4.45 105.19 103.56 3d87 n GLY 160 Ca 0.37 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.43 3d87 n GLY 160 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3d87 n ASP 161 N 4.61 0.00 -4.44 1.61 2.03 -1.26 -4.88 116.55 114.22 3d87 n ASP 161 Ca 0.00 0.37 -0.21 0.00 0.52 0.00 0.00 54.79 55.47 3d87 n ASP 161 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 3d87 n ASP 161 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 3d87 s ASN 162 N -2.44 2.58 0.50 1.67 0.01 -1.26 -5.13 114.94 110.86 3d87 s ASN 162 Ca 0.00 -1.29 -0.23 0.00 -0.71 0.00 0.00 52.86 50.63 3d87 s ASN 162 Cb 0.00 -0.13 -0.06 0.00 0.41 0.00 0.00 41.25 41.47 3d87 s ASN 162 CO 0.00 -0.48 1.32 -0.54 -1.51 0.00 0.00 177.10 175.89 3d87 s LYS 163 N -3.81 3.46 -0.17 -0.60 1.02 -1.26 -2.80 119.74 115.58 3d87 s LYS 163 Ca 0.33 2.15 -0.01 0.00 0.02 0.00 0.00 55.97 58.45 3d87 s LYS 163 Cb 0.07 -2.41 -0.01 0.00 -0.52 0.00 0.00 37.83 34.96 3d87 s LYS 163 CO 0.14 -0.91 -0.11 -2.00 -0.92 0.00 0.00 175.35 171.55 3d87 s GLU 164 N -2.71 3.33 -0.27 1.68 2.12 -0.40 -4.52 118.70 117.93 3d87 s GLU 164 Ca 0.66 -0.69 -0.10 0.00 0.36 0.00 0.00 54.97 55.21 3d87 s GLU 164 Cb -0.38 -2.75 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 3d87 s GLU 164 CO 0.46 0.02 0.15 0.71 -0.54 0.00 0.00 175.26 176.06 3d87 s TYR 165 N 0.85 3.18 -0.37 5.30 1.51 0.71 -2.47 117.35 126.05 3d87 s TYR 165 Ca -0.03 -0.05 -0.11 0.00 -1.01 0.00 0.00 57.07 55.87 3d87 s TYR 165 Cb -0.15 -2.33 0.03 0.00 -0.11 0.00 0.00 41.96 39.39 3d87 s TYR 165 CO 0.00 -0.22 0.21 -2.00 -1.11 0.00 0.00 175.55 172.44 3d87 s GLU 166 N 1.69 2.83 0.64 -0.62 2.12 -0.60 -1.03 118.70 123.74 3d87 s GLU 166 Ca 0.07 -1.08 0.05 0.00 0.36 0.00 0.00 54.97 54.37 3d87 s GLU 166 Cb -0.16 -3.74 0.10 0.00 0.26 0.00 0.00 34.13 30.60 3d87 s GLU 166 CO 0.09 -0.70 0.88 0.71 -0.54 0.00 0.00 175.26 175.70 3d87 s TYR 167 N 1.56 1.54 -0.28 5.30 1.51 -0.83 0.11 117.35 126.25 3d87 s TYR 167 Ca 0.02 -0.50 -0.35 0.00 -1.01 0.00 0.00 57.07 55.23 3d87 s TYR 167 Cb -0.19 -2.58 0.17 0.00 -0.11 0.00 0.00 41.96 39.24 3d87 s TYR 167 CO 0.07 -1.39 1.36 -1.54 -1.11 0.00 0.00 175.55 172.94 3d87 s SER 168 N -4.69 -0.03 0.06 2.29 1.04 -1.07 -3.19 113.70 108.12 3d87 s SER 168 Ca 0.64 0.01 -0.04 0.00 0.48 0.00 0.00 55.95 57.04 3d87 s SER 168 Cb -0.06 0.03 -0.02 0.00 0.10 0.00 0.00 66.02 66.07 3d87 s SER 168 CO 0.41 -0.04 0.06 0.54 0.98 0.00 0.00 173.24 175.19 3d87 s VAL 169 N -1.69 0.18 0.14 5.02 0.11 -1.05 -1.32 120.40 121.79 3d87 s VAL 169 Ca 0.11 -1.49 0.07 0.00 -2.93 0.00 0.00 61.98 57.73 3d87 s VAL 169 Cb -0.01 -1.34 -0.04 0.00 -1.53 0.00 0.00 36.38 33.46 3d87 s VAL 169 CO -0.05 -0.82 -0.03 -1.61 -3.33 0.00 0.00 175.10 169.27 3d87 s GLU 170 N -3.65 2.36 -0.03 1.54 0.41 -1.26 -3.02 118.70 115.06 3d87 s GLU 170 Ca 0.04 -1.02 -0.06 0.00 -0.41 0.00 0.00 54.97 53.51 3d87 s GLU 170 Cb 0.05 -2.39 0.01 0.00 -1.78 0.00 0.00 34.13 30.02 3d87 s GLU 170 CO -0.09 0.49 0.15 0.00 -0.49 0.00 0.00 175.26 175.31 3d87 s GLN 172 N -0.72 2.21 -0.16 0.00 2.00 -0.60 -1.70 119.66 120.70 3d87 s GLN 172 Ca -0.08 -0.66 -0.29 0.00 -2.00 0.00 0.00 55.36 52.33 3d87 s GLN 172 Cb -0.05 -1.79 -0.00 0.00 0.80 0.00 0.00 33.01 31.97 3d87 s GLN 172 CO 0.01 0.17 1.06 -2.00 -0.50 0.00 0.00 175.29 174.03 3d87 s GLU 173 N 0.30 4.34 0.21 1.67 2.12 0.15 -0.02 118.70 127.47 3d87 s GLU 173 Ca -0.12 1.42 -0.14 0.00 0.36 0.00 0.00 54.97 56.50 3d87 s GLU 173 Cb -0.15 -3.60 0.22 0.00 0.26 0.00 0.00 34.13 30.87 3d87 s GLU 173 CO 0.05 -0.48 1.63 -0.44 -0.54 0.00 0.00 175.26 175.47 3d87 h ASP 174 N 7.35 -0.60 -3.63 -1.70 3.32 -1.48 -3.29 116.42 116.38 3d87 h ASP 174 Ca -0.26 0.19 -0.62 0.00 0.02 0.00 0.00 57.03 56.36 3d87 h ASP 174 Cb 1.11 0.39 -0.40 0.00 0.22 0.00 0.00 39.33 40.65 3d87 h ASP 174 CO 0.92 -0.21 -0.72 -0.44 -1.72 0.00 0.00 179.24 177.07 3d87 s SER 175 N -5.23 3.78 0.12 6.45 0.01 -1.26 -5.08 113.70 112.49 3d87 s SER 175 Ca -0.14 -2.76 0.03 0.00 1.31 0.00 0.00 55.95 54.40 3d87 s SER 175 Cb 0.19 -1.16 -0.04 0.00 0.21 0.00 0.00 66.02 65.22 3d87 s SER 175 CO 0.73 -0.25 0.15 0.00 0.41 0.00 0.00 173.24 174.28 3d87 s ALA 176 N 0.16 3.68 -0.34 1.44 0.00 -1.24 -5.07 121.76 120.37 3d87 s ALA 176 Ca 0.18 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.07 3d87 s ALA 176 Cb -0.23 -1.50 0.11 0.00 0.00 0.00 0.00 23.12 21.49 3d87 s ALA 176 CO -0.01 0.62 0.11 0.00 0.00 0.00 0.00 175.76 176.49 3d87 h PRO 178 N 7.71 0.92 -0.44 0.00 0.11 -1.87 -2.83 132.00 135.60 3d87 h PRO 178 Ca -0.09 -0.08 -0.15 0.00 0.11 0.00 0.00 66.00 65.79 3d87 h PRO 178 Cb 1.00 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.90 3d87 h PRO 178 CO 0.49 0.65 -0.29 0.00 -0.21 0.00 0.00 178.00 178.63 3d87 h ALA 179 N 1.22 0.64 -2.39 -0.75 0.00 -1.94 -3.47 119.26 112.57 3d87 h ALA 179 Ca 0.24 -0.42 -0.55 0.00 0.00 0.00 0.00 54.91 54.18 3d87 h ALA 179 Cb -0.04 -0.15 0.19 0.00 0.00 0.00 0.00 17.79 17.80 3d87 h ALA 179 CO -0.05 0.68 -0.40 0.00 0.00 0.00 0.00 179.25 179.48 3d87 n ALA 180 N -2.53 -1.70 -2.96 0.00 0.00 -1.07 -4.96 120.51 107.29 3d87 n ALA 180 Ca -0.01 -0.34 -0.45 0.00 0.00 0.00 0.00 53.44 52.64 3d87 n ALA 180 Cb 0.50 -1.86 -0.06 0.00 0.00 0.00 0.00 19.45 18.02 3d87 n ALA 180 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3d87 s GLU 181 N -3.06 3.02 0.46 0.00 2.12 -1.26 -5.05 118.70 114.93 3d87 s GLU 181 Ca 0.64 -1.32 -0.24 0.00 0.36 0.00 0.00 54.97 54.41 3d87 s GLU 181 Cb -0.31 -4.17 -0.08 0.00 0.26 0.00 0.00 34.13 29.82 3d87 s GLU 181 CO 0.60 -1.19 1.28 -0.85 -0.54 0.00 0.00 175.26 174.56 3d87 n GLU 182 N 5.55 1.85 0.00 4.30 0.28 -1.26 -4.89 120.64 126.47 3d87 n GLU 182 Ca -0.11 0.66 0.00 0.00 -0.16 0.00 0.00 57.16 57.55 3d87 n GLU 182 Cb 0.43 -2.43 0.00 0.00 1.43 0.00 0.00 31.44 30.88 3d87 n GLU 182 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 3d87 n SER 183 N -0.10 3.27 -4.29 -1.84 3.41 -1.26 -5.01 113.62 107.79 3d87 n SER 183 Ca 0.08 -0.06 -0.32 0.00 -0.26 0.00 0.00 58.87 58.30 3d87 n SER 183 Cb 0.41 0.78 -0.16 0.00 -0.26 0.00 0.00 64.21 64.99 3d87 n SER 183 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3d87 s LEU 184 N -2.22 2.32 0.46 1.04 1.43 -1.26 -5.12 118.68 115.33 3d87 s LEU 184 Ca 0.00 -0.45 -0.10 0.00 -1.03 0.00 0.00 54.13 52.54 3d87 s LEU 184 Cb 0.00 -1.47 -0.06 0.00 0.03 0.00 0.00 46.19 44.69 3d87 s LEU 184 CO 0.00 0.19 0.83 -2.16 0.23 0.00 0.00 176.35 175.45 3d87 s PRO 185 N 0.16 3.74 0.34 1.29 0.04 -1.26 -4.78 135.00 134.53 3d87 s PRO 185 Ca -0.11 0.52 -0.18 0.00 0.04 0.00 0.00 61.00 61.27 3d87 s PRO 185 Cb -0.16 -2.32 -0.10 0.00 0.04 0.00 0.00 34.50 31.97 3d87 s PRO 185 CO 0.06 -0.16 0.81 0.42 0.04 0.00 0.00 177.00 178.17 3d87 s ILE 186 N -2.56 4.56 0.00 0.56 -1.09 0.07 -1.35 121.20 121.40 3d87 s ILE 186 Ca 0.52 1.19 0.07 0.00 -2.23 0.00 0.00 60.65 60.20 3d87 s ILE 186 Cb -0.10 -3.65 -0.02 0.00 -1.58 0.00 0.00 42.46 37.10 3d87 s ILE 186 CO 0.36 -0.16 -0.22 -1.61 -1.23 0.00 0.00 174.94 172.08 3d87 s GLU 187 N -2.88 1.66 -0.13 2.79 2.02 -0.21 -1.33 118.70 120.62 3d87 s GLU 187 Ca 0.55 -0.85 0.03 0.00 0.02 0.00 0.00 54.97 54.72 3d87 s GLU 187 Cb -0.11 -1.67 0.01 0.00 0.10 0.00 0.00 34.13 32.46 3d87 s GLU 187 CO 0.17 0.45 -0.22 0.08 0.02 0.00 0.00 175.26 175.76 3d87 s VAL 188 N -0.61 2.11 -0.14 2.63 1.01 0.12 -1.91 120.40 123.61 3d87 s VAL 188 Ca 0.08 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 3d87 s VAL 188 Cb -0.09 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 3d87 s VAL 188 CO 0.00 0.55 -0.11 -0.04 0.00 0.00 0.00 175.10 175.50 3d87 s MET 189 N 0.72 3.43 -0.23 2.72 -1.94 0.23 -1.08 119.30 123.15 3d87 s MET 189 Ca -0.09 -0.66 -0.01 0.00 -1.71 0.00 0.00 55.69 53.22 3d87 s MET 189 Cb -0.16 -2.69 0.02 0.00 2.01 0.00 0.00 34.83 34.01 3d87 s MET 189 CO 0.00 0.20 -0.09 0.08 -0.01 0.00 0.00 175.02 175.20 3d87 s VAL 190 N 0.41 2.72 -0.71 -6.03 1.01 0.20 -1.11 120.40 116.88 3d87 s VAL 190 Ca -0.09 -1.01 -0.26 0.00 0.00 0.00 0.00 61.98 60.63 3d87 s VAL 190 Cb -0.16 -2.34 0.04 0.00 0.00 0.00 0.00 36.38 33.92 3d87 s VAL 190 CO 0.05 0.26 1.18 -1.81 0.00 0.00 0.00 175.10 174.78 3d87 s ASP 191 N 1.32 6.18 -0.70 3.32 1.01 0.23 -1.53 116.67 126.49 3d87 s ASP 191 Ca 0.01 -0.59 -0.19 0.00 0.71 0.00 0.00 52.55 52.49 3d87 s ASP 191 Cb -0.16 -2.52 0.11 0.00 1.01 0.00 0.00 42.92 41.37 3d87 s ASP 191 CO -0.06 -1.70 0.85 0.00 0.21 0.00 0.00 175.17 174.47 3d87 s ALA 192 N 5.20 3.41 -0.33 5.23 0.00 0.28 -1.08 121.76 134.46 3d87 s ALA 192 Ca 0.31 -2.38 -0.12 0.00 0.00 0.00 0.00 51.96 49.77 3d87 s ALA 192 Cb -0.11 -3.70 -0.02 0.00 0.00 0.00 0.00 23.12 19.29 3d87 s ALA 192 CO 0.14 -2.56 0.22 0.08 0.00 0.00 0.00 175.76 173.64 3d87 s VAL 193 N 2.71 5.16 -0.41 0.00 1.01 0.10 -2.22 120.40 126.75 3d87 s VAL 193 Ca 0.19 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.96 3d87 s VAL 193 Cb -0.17 -3.65 0.11 0.00 0.00 0.00 0.00 36.38 32.68 3d87 s VAL 193 CO 0.02 0.01 0.14 -2.28 0.00 0.00 0.00 175.10 172.99 3d87 s HIS 194 N 1.70 3.34 0.00 5.22 2.46 -0.70 0.13 115.29 127.44 3d87 s HIS 194 Ca 0.06 -2.97 0.00 0.00 0.47 0.00 0.00 55.06 52.62 3d87 s HIS 194 Cb -0.17 -2.77 0.00 0.00 -0.13 0.00 0.00 32.58 29.51 3d87 s HIS 194 CO 0.10 -0.86 0.00 1.63 -2.47 0.00 0.00 174.74 173.14 3d87 n LYS 195 N 3.82 0.00 -0.06 2.88 5.02 -0.78 -2.19 118.16 126.85 3d87 n LYS 195 Ca 0.04 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.30 3d87 n LYS 195 Cb 0.38 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.27 3d87 n LYS 195 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3d87 n LEU 196 N 0.00 0.00 -4.74 -0.35 7.99 -1.26 -4.98 117.00 113.66 3d87 n LEU 196 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 56.01 55.59 3d87 n LEU 196 Cb 0.00 0.27 -0.04 0.00 -0.11 0.00 0.00 43.42 43.54 3d87 n LEU 196 CO 0.00 0.27 0.80 -0.75 -1.51 0.00 0.00 177.39 176.20 3d87 s LYS 197 N -2.56 4.59 -0.05 3.23 2.20 -0.93 -1.34 119.74 124.88 3d87 s LYS 197 Ca -0.07 1.74 0.05 0.00 -0.36 0.00 0.00 55.97 57.33 3d87 s LYS 197 Cb 0.06 -3.26 -0.01 0.00 -1.51 0.00 0.00 37.83 33.11 3d87 s LYS 197 CO 0.63 0.08 -0.20 -0.47 -0.36 0.00 0.00 175.35 175.03 3d87 s TYR 198 N -0.33 1.95 -0.01 4.03 5.04 0.29 -1.73 117.35 126.58 3d87 s TYR 198 Ca 0.49 -0.56 -0.08 0.00 -2.44 0.00 0.00 57.07 54.48 3d87 s TYR 198 Cb -0.30 -1.30 0.00 0.00 0.35 0.00 0.00 41.96 40.72 3d87 s TYR 198 CO 0.36 -0.18 0.15 -1.21 -1.34 0.00 0.00 175.55 173.33 3d87 s GLU 199 N -0.03 0.46 -0.03 4.97 2.02 -0.94 -4.36 118.70 120.79 3d87 s GLU 199 Ca -0.04 -0.31 0.06 0.00 0.02 0.00 0.00 54.97 54.71 3d87 s GLU 199 Cb -0.12 0.20 -0.01 0.00 0.10 0.00 0.00 34.13 34.29 3d87 s GLU 199 CO 0.03 -0.11 -0.22 -1.14 0.02 0.00 0.00 175.26 173.84 3d87 s GLN 200 N -1.20 1.96 0.01 1.61 2.00 -1.26 0.98 119.66 123.76 3d87 s GLN 200 Ca -0.13 -0.79 0.06 0.00 -2.00 0.00 0.00 55.36 52.50 3d87 s GLN 200 Cb -0.07 -1.80 -0.02 0.00 0.80 0.00 0.00 33.01 31.93 3d87 s GLN 200 CO 0.02 0.42 -0.18 0.71 -0.50 0.00 0.00 175.29 175.76 3d87 s TYR 201 N -0.35 1.56 0.09 1.67 1.51 -0.58 -4.94 117.35 116.31 3d87 s TYR 201 Ca 0.04 -0.33 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 3d87 s TYR 201 Cb -0.10 -0.96 -0.03 0.00 -0.11 0.00 0.00 41.96 40.75 3d87 s TYR 201 CO 0.01 0.02 -0.12 0.95 -1.11 0.00 0.00 175.55 175.30 3d87 s THR 202 N -0.61 1.03 -0.05 -0.71 -4.23 -1.26 0.58 115.64 110.39 3d87 s THR 202 Ca 0.06 -1.55 -0.04 0.00 -1.18 0.00 0.00 61.69 58.99 3d87 s THR 202 Cb -0.07 -1.28 0.02 0.00 1.34 0.00 0.00 72.50 72.51 3d87 s THR 202 CO 0.00 -0.45 0.13 -0.55 -0.54 0.00 0.00 174.62 173.21 3d87 s SER 203 N -2.24 -0.11 -0.04 3.99 0.15 -0.24 -4.85 113.70 110.36 3d87 s SER 203 Ca 0.03 0.26 0.03 0.00 0.70 0.00 0.00 55.95 56.97 3d87 s SER 203 Cb -0.05 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 3d87 s SER 203 CO 0.01 -0.08 -0.12 -0.44 1.20 0.00 0.00 173.24 173.81 3d87 s SER 204 N 0.49 1.56 -0.01 5.45 0.01 -1.25 0.13 113.70 120.07 3d87 s SER 204 Ca -0.03 -0.25 -0.30 0.00 1.31 0.00 0.00 55.95 56.68 3d87 s SER 204 Cb -0.05 -0.47 0.10 0.00 0.21 0.00 0.00 66.02 65.82 3d87 s SER 204 CO -0.02 0.09 1.05 0.72 0.41 0.00 0.00 173.24 175.48 3d87 s PHE 205 N 0.22 -0.19 -0.08 2.43 -0.12 -0.44 -4.96 117.98 114.84 3d87 s PHE 205 Ca -0.05 0.04 -0.04 0.00 -0.05 0.00 0.00 56.93 56.83 3d87 s PHE 205 Cb -0.10 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 3d87 s PHE 205 CO 0.01 -0.49 0.11 -0.06 -0.05 0.00 0.00 175.22 174.74 3d87 s PHE 206 N -2.87 3.44 0.49 3.49 0.40 -1.26 -0.75 117.98 120.92 3d87 s PHE 206 Ca 0.09 0.38 0.23 0.00 -0.60 0.00 0.00 56.93 57.03 3d87 s PHE 206 Cb -0.00 -1.86 1.28 0.00 0.51 0.00 0.00 43.02 42.95 3d87 s PHE 206 CO -0.04 0.64 1.93 0.82 0.70 0.00 0.00 175.22 179.26 3d87 h ILE 207 N 3.73 0.70 -0.01 0.64 1.08 -1.98 0.58 117.51 122.26 3d87 h ILE 207 Ca -0.52 -0.06 -0.08 0.00 -0.39 0.00 0.00 64.86 63.81 3d87 h ILE 207 Cb 1.21 0.52 -0.01 0.00 -3.07 0.00 0.00 36.82 35.46 3d87 h ILE 207 CO 0.59 0.03 -0.37 0.08 -0.69 0.00 0.00 178.15 177.79 3d87 h ARG 208 N 0.17 0.01 -0.01 2.37 0.11 -1.98 -1.71 114.38 113.35 3d87 h ARG 208 Ca 0.35 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.43 3d87 h ARG 208 Cb 1.14 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.22 3d87 h ARG 208 CO -0.06 0.38 -0.05 -0.25 0.10 0.00 0.00 179.97 180.10 3d87 n ASP 209 N -4.09 0.58 0.00 0.08 8.00 0.20 -3.64 116.55 117.68 3d87 n ASP 209 Ca -0.02 -0.94 0.00 0.00 0.71 0.00 0.00 54.79 54.54 3d87 n ASP 209 Cb 0.41 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.48 3d87 n ASP 209 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 3d87 n ILE 210 N -0.68 0.25 -1.89 0.53 -5.35 -0.72 -4.87 119.36 106.62 3d87 n ILE 210 Ca 0.19 -0.58 -0.42 0.00 -0.27 0.00 0.00 62.75 61.66 3d87 n ILE 210 Cb 0.24 0.94 -0.03 0.00 -1.74 0.00 0.00 39.64 39.05 3d87 n ILE 210 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3d87 s ILE 211 N -0.25 2.58 -0.15 7.28 -1.09 -0.74 -0.33 121.20 128.50 3d87 s ILE 211 Ca 0.00 0.37 -0.04 0.00 -2.23 0.00 0.00 60.65 58.75 3d87 s ILE 211 Cb 0.00 -3.24 0.07 0.00 -1.58 0.00 0.00 42.46 37.72 3d87 s ILE 211 CO 0.00 0.02 0.24 -0.75 -1.23 0.00 0.00 174.94 173.23 3d87 s LYS 212 N 1.40 0.16 0.64 2.79 2.47 -0.07 -1.72 119.74 125.40 3d87 s LYS 212 Ca 0.72 0.54 -0.11 0.00 -1.56 0.00 0.00 55.97 55.56 3d87 s LYS 212 Cb -0.44 -0.46 -0.03 0.00 -1.46 0.00 0.00 37.83 35.44 3d87 s LYS 212 CO 0.32 -0.42 1.04 -2.14 0.16 0.00 0.00 175.35 174.30 3d87 s PRO 213 N 2.38 3.43 0.74 4.03 0.02 -1.26 -3.91 135.00 140.44 3d87 s PRO 213 Ca 0.04 0.77 -0.12 0.00 0.02 0.00 0.00 61.00 61.71 3d87 s PRO 213 Cb -0.13 -2.06 0.04 0.00 0.02 0.00 0.00 34.50 32.37 3d87 s PRO 213 CO -0.10 -0.69 1.09 -0.51 -0.33 0.00 0.00 177.00 176.46 3d87 s ASP 214 N -4.13 4.70 0.68 2.53 1.01 -1.26 -4.06 116.67 116.15 3d87 s ASP 214 Ca 0.56 1.85 -0.16 0.00 0.71 0.00 0.00 52.55 55.51 3d87 s ASP 214 Cb -0.12 -2.53 0.01 0.00 1.01 0.00 0.00 42.92 41.30 3d87 s ASP 214 CO 0.54 -1.90 1.19 -2.16 0.21 0.00 0.00 175.17 173.04 3d87 s PRO 215 N -4.71 2.48 0.20 8.23 0.04 -1.26 -4.72 135.00 135.25 3d87 s PRO 215 Ca 0.62 1.70 -0.32 0.00 0.04 0.00 0.00 61.00 63.04 3d87 s PRO 215 Cb -0.18 -1.88 -0.15 0.00 0.04 0.00 0.00 34.50 32.33 3d87 s PRO 215 CO 0.52 -1.56 1.18 -2.30 0.04 0.00 0.00 177.00 174.88 3d87 n PRO 216 N -2.39 1.34 -2.74 0.56 -0.02 -1.26 -4.49 135.00 126.00 3d87 n PRO 216 Ca 0.13 0.47 -0.38 0.00 -2.02 0.00 0.00 63.50 61.70 3d87 n PRO 216 Cb 0.50 -1.98 -0.06 0.00 -0.02 0.00 0.00 33.50 31.95 3d87 n PRO 216 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3d87 s LYS 217 N -0.56 4.69 -1.35 -0.52 2.20 -0.51 -4.38 119.74 119.31 3d87 s LYS 217 Ca 0.70 1.44 -0.07 0.00 -0.36 0.00 0.00 55.97 57.68 3d87 s LYS 217 Cb -0.79 -3.02 0.02 0.00 -1.51 0.00 0.00 37.83 32.53 3d87 s LYS 217 CO 0.53 0.36 1.05 -1.71 -0.36 0.00 0.00 175.35 175.21 3d87 n ASN 218 N 0.97 -4.41 -4.67 1.43 5.15 -1.26 -0.11 115.26 112.36 3d87 n ASN 218 Ca 0.00 -0.64 -0.42 0.00 -0.60 0.00 0.00 54.58 52.92 3d87 n ASN 218 Cb 0.48 -4.73 -0.03 0.00 -0.53 0.00 0.00 39.78 34.98 3d87 n ASN 218 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3d87 s LEU 219 N -7.00 4.42 0.05 1.20 2.96 -1.26 -4.42 118.68 114.63 3d87 s LEU 219 Ca 0.39 2.72 0.08 0.00 -0.22 0.00 0.00 54.13 57.10 3d87 s LEU 219 Cb -0.18 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 3d87 s LEU 219 CO 0.76 -1.04 -0.22 -1.10 -1.32 0.00 0.00 176.35 173.43 3d87 s GLN 220 N 3.82 1.47 0.19 1.98 -1.52 0.11 -4.89 119.66 120.82 3d87 s GLN 220 Ca 0.86 -1.00 0.09 0.00 -1.95 0.00 0.00 55.36 53.36 3d87 s GLN 220 Cb -0.44 -1.61 -0.04 0.00 -0.22 0.00 0.00 33.01 30.69 3d87 s GLN 220 CO 0.40 0.41 -0.07 -0.51 -0.25 0.00 0.00 175.29 175.27 3d87 s LEU 221 N -1.25 3.06 -0.29 2.90 1.43 -1.26 -1.63 118.68 121.64 3d87 s LEU 221 Ca 0.09 -0.55 0.06 0.00 -1.03 0.00 0.00 54.13 52.69 3d87 s LEU 221 Cb -0.09 -1.72 0.20 0.00 0.03 0.00 0.00 46.19 44.60 3d87 s LEU 221 CO 0.02 0.09 0.58 -0.75 0.23 0.00 0.00 176.35 176.52 3d87 s LYS 222 N -2.92 0.55 0.68 1.70 2.36 -0.77 -4.93 119.74 116.42 3d87 s LYS 222 Ca 0.26 0.54 -0.16 0.00 -2.55 0.00 0.00 55.97 54.06 3d87 s LYS 222 Cb -0.09 0.23 0.01 0.00 -1.05 0.00 0.00 37.83 36.93 3d87 s LYS 222 CO 0.16 -1.04 1.20 -2.14 1.55 0.00 0.00 175.35 175.08 3d87 s PRO 223 N 2.81 2.46 0.28 4.03 0.02 -1.26 0.14 135.00 143.49 3d87 s PRO 223 Ca 0.10 1.74 0.24 0.00 0.02 0.00 0.00 61.00 63.11 3d87 s PRO 223 Cb -0.10 -1.87 0.50 0.00 0.02 0.00 0.00 34.50 33.04 3d87 s PRO 223 CO -0.26 -1.58 1.58 -0.07 -0.33 0.00 0.00 177.00 176.34 3d87 h LEU 224 N 0.09 0.00 0.00 -5.54 -0.00 -1.32 -3.46 115.31 105.09 3d87 h LEU 224 Ca -0.48 -0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.37 3d87 h LEU 224 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.95 3d87 h LEU 224 CO 0.52 0.02 0.00 0.29 -0.00 0.00 0.00 178.44 179.26 3d87 n LYS 225 N -2.58 0.00 -1.72 1.13 4.76 -1.26 -4.78 118.16 113.71 3d87 n LYS 225 Ca 0.04 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.16 3d87 n LYS 225 Cb 0.48 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.64 3d87 n LYS 225 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3d87 n ASN 226 N 0.00 7.08 -3.87 4.39 4.13 -1.26 -4.80 115.26 120.93 3d87 n ASN 226 Ca 0.00 -3.23 -0.22 0.00 1.68 0.00 0.00 54.58 52.81 3d87 n ASN 226 Cb 0.00 -1.27 -0.17 0.00 -1.54 0.00 0.00 39.78 36.81 3d87 n ASN 226 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3d87 s SER 227 N 0.23 1.36 -0.20 6.41 0.15 -1.26 -5.00 113.70 115.39 3d87 s SER 227 Ca 0.56 -0.15 -0.02 0.00 0.70 0.00 0.00 55.95 57.04 3d87 s SER 227 Cb 0.31 -0.53 0.04 0.00 -1.71 0.00 0.00 66.02 64.14 3d87 s SER 227 CO -0.19 -0.10 2.42 -2.11 1.20 0.00 0.00 173.24 174.47 3d87 n ARG 228 N 4.46 1.71 -3.77 5.44 0.00 -1.26 -3.96 116.66 119.28 3d87 n ARG 228 Ca -0.18 -1.16 -0.14 0.00 -0.00 0.00 0.00 57.85 56.37 3d87 n ARG 228 Cb 0.51 -1.60 -0.15 0.00 -0.00 0.00 0.00 32.46 31.22 3d87 n ARG 228 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 3d87 s GLN 229 N -0.80 0.06 0.08 2.89 0.74 -1.26 -1.63 119.66 119.74 3d87 s GLN 229 Ca 0.33 0.28 0.08 0.00 0.05 0.00 0.00 55.36 56.10 3d87 s GLN 229 Cb 0.21 -0.16 -0.03 0.00 1.10 0.00 0.00 33.01 34.13 3d87 s GLN 229 CO -0.04 -0.14 -0.21 0.14 -0.55 0.00 0.00 175.29 174.49 3d87 s VAL 230 N 0.97 1.71 -0.58 1.34 -7.23 0.19 -1.29 120.40 115.50 3d87 s VAL 230 Ca -0.08 -1.44 -0.23 0.00 -1.81 0.00 0.00 61.98 58.43 3d87 s VAL 230 Cb -0.10 -1.53 0.05 0.00 0.56 0.00 0.00 36.38 35.36 3d87 s VAL 230 CO -0.04 0.02 0.89 -1.83 -0.31 0.00 0.00 175.10 173.83 3d87 s GLU 231 N -1.69 3.22 0.20 4.82 1.03 0.12 -1.00 118.70 125.41 3d87 s GLU 231 Ca 0.07 -0.58 -0.20 0.00 0.03 0.00 0.00 54.97 54.29 3d87 s GLU 231 Cb -0.10 -4.12 -0.08 0.00 -0.80 0.00 0.00 34.13 29.03 3d87 s GLU 231 CO 0.04 -1.54 0.71 0.08 -1.33 0.00 0.00 175.26 173.21 3d87 s VAL 232 N 3.72 4.57 0.01 1.83 1.01 0.10 -1.85 120.40 129.80 3d87 s VAL 232 Ca 0.25 1.30 -0.15 0.00 0.00 0.00 0.00 61.98 63.37 3d87 s VAL 232 Cb -0.15 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.37 3d87 s VAL 232 CO 0.15 0.27 0.33 -0.94 0.00 0.00 0.00 175.10 174.90 3d87 s SER 233 N -1.56 -0.19 0.00 3.32 1.04 -0.64 -1.24 113.70 114.42 3d87 s SER 233 Ca 0.41 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.82 3d87 s SER 233 Cb -0.17 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.29 3d87 s SER 233 CO 0.21 -0.54 0.00 -2.67 0.98 0.00 0.00 173.24 171.22 3d87 n TRP 234 N 0.90 -0.38 -4.10 5.02 2.14 -1.03 0.07 117.44 120.06 3d87 n TRP 234 Ca -0.20 0.00 -0.10 0.00 2.07 0.00 0.00 57.50 59.27 3d87 n TRP 234 Cb 0.58 0.00 -0.09 0.00 -0.81 0.00 0.00 31.31 30.99 3d87 n TRP 234 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 3d87 s GLU 235 N -1.31 1.15 0.37 -2.67 2.02 0.84 -4.79 118.70 114.32 3d87 s GLU 235 Ca 0.00 -1.42 -0.26 0.00 0.02 0.00 0.00 54.97 53.31 3d87 s GLU 235 Cb 0.00 0.31 -0.09 0.00 0.10 0.00 0.00 34.13 34.45 3d87 s GLU 235 CO 0.00 -0.39 1.17 0.71 0.02 0.00 0.00 175.26 176.76 3d87 s TYR 236 N -4.06 3.16 0.66 1.61 1.51 -1.26 -1.43 117.35 117.54 3d87 s TYR 236 Ca 0.27 1.57 -0.17 0.00 -1.01 0.00 0.00 57.07 57.73 3d87 s TYR 236 Cb 0.05 -3.39 0.00 0.00 -0.11 0.00 0.00 41.96 38.51 3d87 s TYR 236 CO 0.06 -1.21 1.20 -2.14 -1.11 0.00 0.00 175.55 172.35 3d87 s PRO 237 N -2.12 2.58 0.23 -1.71 0.02 -1.26 -4.34 135.00 128.39 3d87 s PRO 237 Ca 0.54 1.77 -0.07 0.00 0.02 0.00 0.00 61.00 63.26 3d87 s PRO 237 Cb -0.31 -1.88 0.36 0.00 0.02 0.00 0.00 34.50 32.68 3d87 s PRO 237 CO 0.40 -1.50 1.73 -0.44 -0.33 0.00 0.00 177.00 176.86 3d87 h ASP 238 N 0.29 0.23 0.81 2.53 3.32 -1.93 -2.59 116.42 119.08 3d87 h ASP 238 Ca -0.49 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.66 3d87 h ASP 238 Cb 1.30 0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.92 3d87 h ASP 238 CO 0.53 0.11 0.00 0.71 -1.72 0.00 0.00 179.24 178.87 3d87 h THR 239 N 0.42 0.00 -3.62 0.35 1.35 -1.91 -3.46 112.91 106.03 3d87 h THR 239 Ca 0.36 -0.30 -0.57 0.00 -0.55 0.00 0.00 66.41 65.35 3d87 h THR 239 Cb 0.49 1.10 0.17 0.00 -1.73 0.00 0.00 68.15 68.18 3d87 h THR 239 CO -0.36 0.00 0.10 1.87 -0.25 0.00 0.00 175.52 176.88 3d87 n TRP 240 N -2.43 0.72 -1.88 4.73 -0.00 -0.98 -4.67 117.44 112.93 3d87 n TRP 240 Ca 0.02 0.42 -0.40 0.00 -0.00 0.00 0.00 57.50 57.54 3d87 n TRP 240 Cb 0.25 -2.12 0.01 0.00 -0.00 0.00 0.00 31.31 29.45 3d87 n TRP 240 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 177.69 176.57 3d87 s SER 241 N -1.35 6.03 0.00 5.87 0.01 -1.26 -5.01 113.70 118.00 3d87 s SER 241 Ca 0.76 2.85 0.06 0.00 1.31 0.00 0.00 55.95 60.92 3d87 s SER 241 Cb -0.40 -2.65 -0.03 0.00 0.21 0.00 0.00 66.02 63.15 3d87 s SER 241 CO 0.47 -1.06 -0.17 0.42 0.41 0.00 0.00 173.24 173.31 3d87 s THR 242 N -1.22 2.83 0.26 1.44 -4.23 -1.26 -4.07 115.64 109.41 3d87 s THR 242 Ca 0.59 -1.02 -0.07 0.00 -1.18 0.00 0.00 61.69 60.02 3d87 s THR 242 Cb -0.42 -2.15 -0.06 0.00 1.34 0.00 0.00 72.50 71.21 3d87 s THR 242 CO 0.54 0.44 0.55 -2.16 -0.54 0.00 0.00 174.62 173.46 3d87 s PRO 243 N -1.13 3.70 0.14 3.99 0.04 -1.26 -4.94 135.00 135.53 3d87 s PRO 243 Ca 0.13 0.12 0.16 0.00 0.04 0.00 0.00 61.00 61.45 3d87 s PRO 243 Cb -0.10 -2.65 0.70 0.00 0.04 0.00 0.00 34.50 32.49 3d87 s PRO 243 CO 0.03 0.25 1.48 0.72 0.04 0.00 0.00 177.00 179.53 3d87 n HIS 244 N -0.60 0.38 0.13 0.56 8.25 -1.26 0.76 115.22 123.44 3d87 n HIS 244 Ca -0.01 0.17 -0.02 0.00 -0.26 0.00 0.00 57.72 57.60 3d87 n HIS 244 Cb 0.53 -0.77 0.19 0.00 1.12 0.00 0.00 29.99 31.07 3d87 n HIS 244 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3d87 h SER 245 N 0.00 0.09 0.00 0.41 4.64 -1.98 -3.22 113.55 113.49 3d87 h SER 245 Ca 0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 3d87 h SER 245 Cb 0.19 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3d87 h SER 245 CO 0.00 0.63 -0.37 0.00 -0.87 0.00 0.00 176.83 176.22 3d87 n TYR 246 N -3.89 0.12 -2.49 4.77 9.36 -0.27 -4.68 117.16 120.08 3d87 n TYR 246 Ca -0.02 0.05 -0.40 0.00 3.32 0.00 0.00 57.90 60.86 3d87 n TYR 246 Cb 0.57 -0.30 -0.01 0.00 -0.63 0.00 0.00 39.34 38.97 3d87 n TYR 246 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 3d87 s PHE 247 N -1.75 2.60 0.27 2.98 0.40 0.23 -4.93 117.98 117.79 3d87 s PHE 247 Ca -0.11 -1.16 -0.02 0.00 -0.60 0.00 0.00 56.93 55.04 3d87 s PHE 247 Cb 0.01 -4.62 -0.04 0.00 0.51 0.00 0.00 43.02 38.88 3d87 s PHE 247 CO 0.16 -1.73 0.49 -1.12 0.70 0.00 0.00 175.22 173.72 3d87 s SER 248 N 4.75 6.38 0.19 1.36 0.01 -1.22 -4.10 113.70 121.08 3d87 s SER 248 Ca 0.56 0.52 0.09 0.00 1.31 0.00 0.00 55.95 58.43 3d87 s SER 248 Cb 0.03 -2.06 -0.04 0.00 0.21 0.00 0.00 66.02 64.15 3d87 s SER 248 CO 0.07 -0.16 -0.18 -0.76 0.41 0.00 0.00 173.24 172.62 3d87 s LEU 249 N -3.65 2.49 0.07 2.44 1.43 -1.26 -1.30 118.68 118.89 3d87 s LEU 249 Ca 0.41 -0.92 0.07 0.00 -1.03 0.00 0.00 54.13 52.66 3d87 s LEU 249 Cb -0.10 -0.82 -0.03 0.00 0.03 0.00 0.00 46.19 45.26 3d87 s LEU 249 CO 0.31 -0.06 -0.20 0.28 0.23 0.00 0.00 176.35 176.91 3d87 s THR 250 N -2.33 1.63 0.25 5.49 -1.32 0.86 -4.60 115.64 115.62 3d87 s THR 250 Ca 0.19 -1.32 0.10 0.00 -1.21 0.00 0.00 61.69 59.46 3d87 s THR 250 Cb -0.04 -1.45 -0.05 0.00 -1.51 0.00 0.00 72.50 69.45 3d87 s THR 250 CO 0.08 0.08 -0.11 -0.36 -2.21 0.00 0.00 174.62 172.09 3d87 s PHE 251 N -0.96 2.51 -0.23 9.09 0.40 -0.87 -0.82 117.98 127.10 3d87 s PHE 251 Ca 0.06 -0.27 -0.00 0.00 -0.60 0.00 0.00 56.93 56.12 3d87 s PHE 251 Cb -0.09 -1.14 0.06 0.00 0.51 0.00 0.00 43.02 42.37 3d87 s PHE 251 CO 0.03 0.63 -0.01 0.00 0.70 0.00 0.00 175.22 176.56 3d87 s VAL 253 N 1.52 5.08 -0.15 0.00 1.01 0.19 -2.04 120.40 126.00 3d87 s VAL 253 Ca -0.03 -1.10 -0.05 0.00 0.00 0.00 0.00 61.98 60.80 3d87 s VAL 253 Cb -0.18 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 3d87 s VAL 253 CO -0.08 -0.82 0.02 0.00 0.00 0.00 0.00 175.10 174.22 3d87 s GLN 254 N 2.00 3.68 0.00 2.72 -2.07 -0.33 -1.10 119.66 124.56 3d87 s GLN 254 Ca 0.07 -0.40 0.00 0.00 -1.82 0.00 0.00 55.36 53.21 3d87 s GLN 254 Cb -0.25 -3.04 0.00 0.00 -1.09 0.00 0.00 33.01 28.63 3d87 s GLN 254 CO 0.06 0.36 0.00 1.33 -1.32 0.00 0.00 175.29 175.72 3d87 n VAL 255 N 3.22 0.00 -1.06 3.63 0.24 -1.26 -1.53 118.33 121.57 3d87 n VAL 255 Ca -0.17 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.20 3d87 n VAL 255 Cb 0.53 -0.33 -0.04 0.00 -1.47 0.00 0.00 33.84 32.52 3d87 n VAL 255 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 3d87 n GLN 256 N -0.37 -2.59 -1.93 7.34 7.27 -1.26 -4.26 117.38 121.58 3d87 n GLN 256 Ca 0.00 2.07 -0.02 0.00 0.07 0.00 0.00 57.00 59.12 3d87 n GLN 256 Cb 0.00 -2.80 -0.02 0.00 2.41 0.00 0.00 30.24 29.83 3d87 n GLN 256 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 3d87 n ASP 265 N -3.14 -2.39 -4.72 1.69 3.85 -1.26 -3.73 116.55 106.85 3d87 n ASP 265 Ca -0.04 0.73 -0.23 0.00 -0.71 0.00 0.00 54.79 54.54 3d87 n ASP 265 Cb 0.43 -3.09 -0.06 0.00 -1.35 0.00 0.00 41.12 37.05 3d87 n ASP 265 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 3d87 s ARG 266 N -0.97 2.40 0.05 0.11 0.52 -1.26 -4.56 118.95 115.22 3d87 s ARG 266 Ca -0.11 -1.49 0.02 0.00 -0.52 0.00 0.00 55.73 53.63 3d87 s ARG 266 Cb 0.01 -2.20 -0.03 0.00 0.52 0.00 0.00 34.95 33.25 3d87 s ARG 266 CO 0.28 0.18 -0.07 0.14 0.02 0.00 0.00 175.30 175.85 3d87 s VAL 267 N -2.39 0.48 -0.06 3.52 -7.23 -0.26 -4.95 120.40 109.52 3d87 s VAL 267 Ca 0.36 -1.24 0.05 0.00 -1.81 0.00 0.00 61.98 59.34 3d87 s VAL 267 Cb -0.04 -0.79 -0.02 0.00 0.56 0.00 0.00 36.38 36.10 3d87 s VAL 267 CO 0.22 -0.52 -0.20 -0.36 -0.31 0.00 0.00 175.10 173.93 3d87 s PHE 268 N -1.91 2.55 -0.24 2.82 0.40 -1.26 0.54 117.98 120.88 3d87 s PHE 268 Ca -0.06 -0.47 -0.14 0.00 -0.60 0.00 0.00 56.93 55.66 3d87 s PHE 268 Cb -0.06 -1.62 0.07 0.00 0.51 0.00 0.00 43.02 41.92 3d87 s PHE 268 CO -0.01 -0.05 0.60 -0.08 0.70 0.00 0.00 175.22 176.37 3d87 s THR 269 N -0.37 -0.03 -0.10 0.64 -1.32 -0.66 -4.99 115.64 108.81 3d87 s THR 269 Ca 0.03 0.03 0.01 0.00 -1.21 0.00 0.00 61.69 60.55 3d87 s THR 269 Cb -0.12 -0.87 0.15 0.00 -1.51 0.00 0.00 72.50 70.15 3d87 s THR 269 CO 0.02 0.01 1.21 0.47 -2.21 0.00 0.00 174.62 174.12 3d87 n ASP 270 N 4.33 3.17 -4.54 8.08 10.43 -1.26 -2.06 116.55 134.70 3d87 n ASP 270 Ca -0.21 -2.36 -0.24 0.00 2.57 0.00 0.00 54.79 54.55 3d87 n ASP 270 Cb 0.58 -0.58 -0.09 0.00 1.84 0.00 0.00 41.12 42.87 3d87 n ASP 270 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 3d87 s LYS 271 N -0.74 1.94 -0.75 -1.24 1.02 -1.26 -4.95 119.74 113.77 3d87 s LYS 271 Ca 0.13 -1.57 -0.03 0.00 0.02 0.00 0.00 55.97 54.52 3d87 s LYS 271 Cb 0.11 -1.96 0.24 0.00 -0.52 0.00 0.00 37.83 35.70 3d87 s LYS 271 CO 0.02 0.36 2.28 0.25 -0.92 0.00 0.00 175.35 177.34 3d87 n THR 272 N -0.60 3.74 0.00 2.17 -2.24 -1.26 -4.75 114.28 111.35 3d87 n THR 272 Ca -0.07 -3.98 0.00 0.00 -2.27 0.00 0.00 64.05 57.73 3d87 n THR 272 Cb 0.59 -1.41 0.00 0.00 -2.10 0.00 0.00 70.33 67.41 3d87 n THR 272 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3d87 n SER 273 N 0.05 0.00 -3.63 3.42 3.41 -1.26 -2.46 113.62 113.15 3d87 n SER 273 Ca 0.52 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 59.07 3d87 n SER 273 Cb 0.34 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.27 3d87 n SER 273 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d87 s ALA 274 N -2.00 -1.75 -0.17 7.33 0.00 -0.37 -4.95 121.76 119.85 3d87 s ALA 274 Ca 0.00 0.56 0.01 0.00 0.00 0.00 0.00 51.96 52.53 3d87 s ALA 274 Cb 0.00 0.53 0.02 0.00 0.00 0.00 0.00 23.12 23.67 3d87 s ALA 274 CO 0.00 -0.87 -0.17 0.95 0.00 0.00 0.00 175.76 175.67 3d87 s THR 275 N -3.19 1.87 0.50 0.00 -4.23 -1.26 0.01 115.64 109.35 3d87 s THR 275 Ca 0.09 -0.87 0.02 0.00 -1.18 0.00 0.00 61.69 59.75 3d87 s THR 275 Cb -0.01 -1.74 0.02 0.00 1.34 0.00 0.00 72.50 72.11 3d87 s THR 275 CO -0.03 0.47 0.18 1.33 -0.54 0.00 0.00 174.62 176.02 3d87 n VAL 276 N 4.67 0.00 -3.95 2.29 0.24 -0.17 -4.94 118.33 116.48 3d87 n VAL 276 Ca -0.19 -2.20 -0.34 0.00 -2.04 0.00 0.00 64.34 59.57 3d87 n VAL 276 Cb 0.49 0.23 -0.14 0.00 -1.47 0.00 0.00 33.84 32.96 3d87 n VAL 276 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3d87 s ILE 277 N -2.68 2.80 0.09 1.34 1.09 -1.26 0.52 121.20 123.10 3d87 s ILE 277 Ca 0.13 -1.41 -0.31 0.00 -1.10 0.00 0.00 60.65 57.96 3d87 s ILE 277 Cb -0.01 -2.60 -0.08 0.00 -1.06 0.00 0.00 42.46 38.71 3d87 s ILE 277 CO 0.08 -0.06 1.43 0.00 -0.10 0.00 0.00 174.94 176.29 3d87 n ARG 279 N 4.39 2.78 -0.11 0.00 1.85 -1.26 -4.69 116.66 119.62 3d87 n ARG 279 Ca 0.12 -3.45 0.00 0.00 -1.00 0.00 0.00 57.85 53.52 3d87 n ARG 279 Cb 0.42 -2.28 0.00 0.00 -1.05 0.00 0.00 32.46 29.55 3d87 n ARG 279 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 177.63 177.98 3d87 n LYS 280 N -0.76 0.00 0.00 2.89 0.00 -1.26 -3.77 118.16 115.25 3d87 n LYS 280 Ca 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.89 3d87 n LYS 280 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.56 3d87 n LYS 280 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 3d87 n ASN 281 N 0.56 0.00 -2.54 -5.58 5.15 -1.26 -5.08 115.26 106.50 3d87 n ASN 281 Ca 0.00 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 53.97 3d87 n ASN 281 Cb 0.00 0.00 0.01 0.00 -0.53 0.00 0.00 39.78 39.26 3d87 n ASN 281 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3d87 n ALA 282 N 0.00 -0.13 -3.24 5.20 0.00 -1.25 -4.61 120.51 116.49 3d87 n ALA 282 Ca 0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.27 3d87 n ALA 282 Cb 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.41 3d87 n ALA 282 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3d87 s SER 283 N -1.62 -0.34 -0.13 0.00 1.04 -1.24 -1.07 113.70 110.34 3d87 s SER 283 Ca 0.03 -0.28 -0.14 0.00 0.48 0.00 0.00 55.95 56.04 3d87 s SER 283 Cb -0.00 0.55 -0.05 0.00 0.10 0.00 0.00 66.02 66.62 3d87 s SER 283 CO 0.02 -0.96 0.31 -0.63 0.98 0.00 0.00 173.24 172.95 3d87 s ILE 284 N -3.81 5.28 0.06 -1.02 1.09 -0.42 -4.43 121.20 117.95 3d87 s ILE 284 Ca 0.05 0.58 0.09 0.00 -1.10 0.00 0.00 60.65 60.27 3d87 s ILE 284 Cb -0.00 -3.63 -0.03 0.00 -1.06 0.00 0.00 42.46 37.73 3d87 s ILE 284 CO -0.09 0.43 -0.25 -0.94 -0.10 0.00 0.00 174.94 173.99 3d87 s SER 285 N 0.14 3.30 0.00 3.58 1.04 -0.58 -0.47 113.70 120.72 3d87 s SER 285 Ca 0.18 -0.60 0.03 0.00 0.48 0.00 0.00 55.95 56.03 3d87 s SER 285 Cb -0.13 -0.32 -0.01 0.00 0.10 0.00 0.00 66.02 65.65 3d87 s SER 285 CO 0.05 0.24 -0.08 -0.69 0.98 0.00 0.00 173.24 173.74 3d87 s VAL 286 N -0.88 0.64 0.03 5.02 1.01 0.19 -1.19 120.40 125.22 3d87 s VAL 286 Ca 0.13 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 3d87 s VAL 286 Cb -0.10 -0.56 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 3d87 s VAL 286 CO 0.03 0.09 -0.00 0.00 0.00 0.00 0.00 175.10 175.22 3d87 s ARG 287 N -0.44 0.45 0.22 2.72 1.70 -0.87 -0.29 118.95 122.45 3d87 s ARG 287 Ca 0.01 -0.81 0.10 0.00 -0.47 0.00 0.00 55.73 54.56 3d87 s ARG 287 Cb -0.04 0.16 -0.04 0.00 -0.57 0.00 0.00 34.95 34.46 3d87 s ARG 287 CO -0.00 -0.09 -0.12 0.00 -1.08 0.00 0.00 175.30 174.01 3d87 s ALA 288 N -2.40 2.89 0.15 7.88 0.00 -1.26 -0.68 121.76 128.34 3d87 s ALA 288 Ca -0.07 -1.62 -0.01 0.00 0.00 0.00 0.00 51.96 50.26 3d87 s ALA 288 Cb -0.03 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.47 3d87 s ALA 288 CO -0.04 0.38 0.08 -1.14 0.00 0.00 0.00 175.76 175.04 3d87 s GLN 289 N -3.12 1.00 0.35 0.00 0.74 0.00 -0.11 119.66 118.52 3d87 s GLN 289 Ca 0.27 -1.48 -0.29 0.00 0.05 0.00 0.00 55.36 53.91 3d87 s GLN 289 Cb -0.07 0.25 -0.11 0.00 1.10 0.00 0.00 33.01 34.18 3d87 s GLN 289 CO 0.15 -0.30 1.53 0.34 -0.55 0.00 0.00 175.29 176.46 3d87 s ASP 290 N -3.07 6.35 0.36 6.67 2.15 -1.26 -0.10 116.67 127.77 3d87 s ASP 290 Ca 0.27 3.02 0.17 0.00 0.43 0.00 0.00 52.55 56.44 3d87 s ASP 290 Cb 0.07 -2.66 0.66 0.00 -0.30 0.00 0.00 42.92 40.69 3d87 s ASP 290 CO 0.04 -0.89 1.73 -0.09 -0.17 0.00 0.00 175.17 175.79 3d87 h ARG 291 N 3.66 0.00 -0.14 4.34 2.43 -1.45 -3.35 114.38 119.86 3d87 h ARG 291 Ca -0.49 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 3d87 h ARG 291 Cb 1.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 3d87 h ARG 291 CO 0.70 0.41 0.00 0.66 -1.51 0.00 0.00 179.97 180.22 3d87 n TYR 292 N -3.63 0.18 -3.67 2.20 4.02 -1.26 -4.88 117.16 110.11 3d87 n TYR 292 Ca -0.01 -0.19 -0.10 0.00 -0.01 0.00 0.00 57.90 57.59 3d87 n TYR 292 Cb 0.51 -0.01 -0.09 0.00 -0.02 0.00 0.00 39.34 39.73 3d87 n TYR 292 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 3d87 s TYR 293 N -0.95 -0.81 -0.82 -0.72 6.14 -1.26 -5.05 117.35 113.89 3d87 s TYR 293 Ca 0.17 1.72 -0.15 0.00 0.64 0.00 0.00 57.07 59.45 3d87 s TYR 293 Cb 0.10 0.40 -0.11 0.00 0.42 0.00 0.00 41.96 42.78 3d87 s TYR 293 CO 0.14 -0.41 1.98 0.43 0.64 0.00 0.00 175.55 178.34 3d87 n SER 294 N 3.84 3.45 -2.31 4.32 7.64 -1.26 -4.18 113.62 125.12 3d87 n SER 294 Ca -0.19 -2.52 0.00 0.00 1.01 0.00 0.00 58.87 57.17 3d87 n SER 294 Cb 0.57 -1.10 0.00 0.00 -1.01 0.00 0.00 64.21 62.67 3d87 n SER 294 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3d87 n SER 295 N 6.09 0.00 -4.72 6.43 7.64 -1.26 -5.02 113.62 122.77 3d87 n SER 295 Ca 0.46 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 60.01 3d87 n SER 295 Cb 0.28 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.40 3d87 n SER 295 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3d87 s SER 296 N -1.43 5.34 0.25 6.43 0.01 -0.70 -4.95 113.70 118.64 3d87 s SER 296 Ca 0.00 0.07 -0.30 0.00 1.31 0.00 0.00 55.95 57.03 3d87 s SER 296 Cb 0.00 -1.46 -0.09 0.00 0.21 0.00 0.00 66.02 64.68 3d87 s SER 296 CO 0.00 0.29 1.08 0.26 0.41 0.00 0.00 173.24 175.28 3d87 s TRP 297 N -1.10 3.63 0.47 2.43 0.52 -1.26 -4.06 118.94 119.56 3d87 s TRP 297 Ca 0.20 1.70 -0.08 0.00 0.02 0.00 0.00 56.10 57.94 3d87 s TRP 297 Cb -0.12 -3.25 0.12 0.00 -1.15 0.00 0.00 33.47 29.07 3d87 s TRP 297 CO 0.11 -0.45 0.36 -1.13 0.02 0.00 0.00 176.95 175.86 3d87 n SER 298 N 1.54 -1.87 -4.90 2.95 3.41 0.84 -4.76 113.62 110.84 3d87 n SER 298 Ca -0.00 -0.59 -0.29 0.00 -0.26 0.00 0.00 58.87 57.73 3d87 n SER 298 Cb 0.45 -0.36 0.03 0.00 -0.26 0.00 0.00 64.21 64.08 3d87 n SER 298 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3d87 s GLU 299 N -3.83 3.02 0.43 4.33 2.56 -1.26 -4.69 118.70 119.26 3d87 s GLU 299 Ca 0.25 0.27 -0.24 0.00 0.00 0.00 0.00 54.97 55.26 3d87 s GLU 299 Cb -0.03 -2.16 -0.08 0.00 2.00 0.00 0.00 34.13 33.86 3d87 s GLU 299 CO 0.20 -0.78 1.12 -1.58 -0.56 0.00 0.00 175.26 173.65 3d87 s TRP 300 N -3.14 3.06 -0.20 5.30 0.52 -1.26 -4.09 118.94 119.13 3d87 s TRP 300 Ca 0.55 1.58 -0.05 0.00 0.02 0.00 0.00 56.10 58.20 3d87 s TRP 300 Cb -0.11 -3.27 -0.03 0.00 -1.15 0.00 0.00 33.47 28.91 3d87 s TRP 300 CO 0.49 -1.11 0.01 0.00 0.02 0.00 0.00 176.95 176.35 3d87 s ALA 301 N -1.58 3.06 0.01 0.98 0.00 0.60 -4.88 121.76 119.95 3d87 s ALA 301 Ca 0.60 -0.98 0.07 0.00 0.00 0.00 0.00 51.96 51.65 3d87 s ALA 301 Cb -0.26 -1.79 -0.02 0.00 0.00 0.00 0.00 23.12 21.05 3d87 s ALA 301 CO 0.32 -0.15 -0.21 -1.12 0.00 0.00 0.00 175.76 174.60 3d87 s SER 302 N 0.99 2.47 -0.04 0.00 0.01 -1.26 0.52 113.70 116.39 3d87 s SER 302 Ca 0.02 -0.45 -0.02 0.00 1.31 0.00 0.00 55.95 56.81 3d87 s SER 302 Cb -0.14 -0.24 0.03 0.00 0.21 0.00 0.00 66.02 65.88 3d87 s SER 302 CO 0.02 0.21 0.07 0.54 0.41 0.00 0.00 173.24 174.49 3d87 s VAL 303 N -0.65 -0.12 0.12 3.43 0.11 0.38 -4.98 120.40 118.69 3d87 s VAL 303 Ca 0.08 0.38 -0.35 0.00 -2.93 0.00 0.00 61.98 59.16 3d87 s VAL 303 Cb -0.08 -0.16 -0.16 0.00 -1.53 0.00 0.00 36.38 34.44 3d87 s VAL 303 CO 0.01 0.16 1.31 -0.81 -3.33 0.00 0.00 175.10 172.43 3d87 n PRO 304 N 5.10 1.25 -1.97 1.54 -0.04 -1.26 -1.30 135.00 138.31 3d87 n PRO 304 Ca -0.08 0.45 -0.41 0.00 -0.04 0.00 0.00 63.50 63.42 3d87 n PRO 304 Cb 0.50 -2.06 -0.01 0.00 -0.04 0.00 0.00 33.50 31.89 3d87 n PRO 304 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46