#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q2a n SER 12 N 0.00 1.04 0.00 4.04 7.64 -1.26 -1.30 113.62 123.78 2q2a n SER 12 Ca 0.00 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.04 2q2a n SER 12 Cb 0.00 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 61.97 2q2a n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2q2a n GLY 13 N 1.59 2.18 0.46 0.23 0.00 -1.26 -5.00 105.19 103.39 2q2a n GLY 13 Ca 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.11 2q2a n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q2a n GLY 14 N -2.00 3.96 1.52 -0.02 0.00 -0.42 -5.08 105.19 103.15 2q2a n GLY 14 Ca 0.00 -1.88 0.08 0.00 0.00 0.00 0.00 46.02 44.21 2q2a n GLY 14 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2q2a n ASP 15 N -2.19 5.00 -1.22 1.61 5.75 -1.26 -4.72 116.55 119.52 2q2a n ASP 15 Ca -0.00 -2.89 -0.14 0.00 -0.01 0.00 0.00 54.79 51.75 2q2a n ASP 15 Cb 0.08 -0.62 -0.06 0.00 -1.03 0.00 0.00 41.12 39.50 2q2a n ASP 15 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2q2a n GLY 16 N 0.31 1.29 1.14 6.12 0.00 -1.26 -2.16 105.19 110.63 2q2a n GLY 16 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2q2a n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q2a n GLY 17 N -0.11 0.91 0.23 -0.02 0.00 -1.26 -4.92 105.19 100.02 2q2a n GLY 17 Ca -0.14 -0.55 -0.01 0.00 0.00 0.00 0.00 46.02 45.33 2q2a n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q2a h ALA 18 N 0.00 1.29 -3.58 4.61 0.00 -1.86 -3.42 119.26 116.29 2q2a h ALA 18 Ca 0.00 -0.29 -0.29 0.00 0.00 0.00 0.00 54.91 54.33 2q2a h ALA 18 Cb 0.36 -0.10 -0.32 0.00 0.00 0.00 0.00 17.79 17.72 2q2a h ALA 18 CO 0.00 0.48 -0.73 0.99 0.00 0.00 0.00 179.25 179.99 2q2a s THR 19 N -4.56 -0.02 -0.07 0.00 2.01 -1.26 -5.12 115.64 106.62 2q2a s THR 19 Ca -0.06 0.15 -0.30 0.00 0.31 0.00 0.00 61.69 61.79 2q2a s THR 19 Cb 0.14 -0.08 -0.04 0.00 0.01 0.00 0.00 72.50 72.53 2q2a s THR 19 CO 0.76 0.07 1.50 -0.75 -0.69 0.00 0.00 174.62 175.51 2q2a s LYS 20 N 0.79 4.21 0.61 4.92 2.47 -1.26 -4.98 119.74 126.49 2q2a s LYS 20 Ca -0.07 2.01 -0.17 0.00 -1.56 0.00 0.00 55.97 56.18 2q2a s LYS 20 Cb -0.10 -3.84 -0.03 0.00 -1.46 0.00 0.00 37.83 32.41 2q2a s LYS 20 CO -0.02 -0.76 1.11 -1.59 0.16 0.00 0.00 175.35 174.26 2q2a s LYS 21 N 3.55 3.05 0.37 4.03 -2.85 -1.26 -5.02 119.74 121.60 2q2a s LYS 21 Ca 0.66 1.47 -0.13 0.00 -1.00 0.00 0.00 55.97 56.97 2q2a s LYS 21 Cb -0.30 -1.98 -0.08 0.00 -2.06 0.00 0.00 37.83 33.42 2q2a s LYS 21 CO 0.25 -1.07 0.76 0.15 0.10 0.00 0.00 175.35 175.54 2q2a s LYS 22 N -3.77 3.89 0.15 1.78 1.02 -1.26 -4.95 119.74 116.60 2q2a s LYS 22 Ca 0.69 0.58 -0.31 0.00 0.02 0.00 0.00 55.97 56.95 2q2a s LYS 22 Cb -0.22 -2.40 -0.09 0.00 -0.52 0.00 0.00 37.83 34.60 2q2a s LYS 22 CO 0.35 0.05 1.43 0.08 -0.92 0.00 0.00 175.35 176.35 2q2a s VAL 23 N -2.18 3.05 -0.41 3.17 1.01 -0.08 -4.84 120.40 120.13 2q2a s VAL 23 Ca 0.53 0.77 -0.18 0.00 0.00 0.00 0.00 61.98 63.10 2q2a s VAL 23 Cb -0.10 -3.50 0.01 0.00 0.00 0.00 0.00 36.38 32.80 2q2a s VAL 23 CO 0.24 0.07 0.51 -0.69 0.00 0.00 0.00 175.10 175.24 2q2a s VAL 24 N 0.91 4.99 -0.14 2.92 1.01 -1.26 -0.67 120.40 128.16 2q2a s VAL 24 Ca 0.65 -0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.57 2q2a s VAL 24 Cb -0.39 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 31.90 2q2a s VAL 24 CO 0.32 -0.42 -0.06 -0.69 0.00 0.00 0.00 175.10 174.26 2q2a s VAL 25 N 2.40 3.73 0.17 2.92 1.01 -0.15 -1.09 120.40 129.40 2q2a s VAL 25 Ca 0.17 -0.42 0.06 0.00 0.00 0.00 0.00 61.98 61.79 2q2a s VAL 25 Cb -0.16 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 2q2a s VAL 25 CO 0.15 0.51 0.06 -0.83 0.00 0.00 0.00 175.10 175.00 2q2a s GLY 26 N 0.20 1.72 0.17 4.51 0.00 -0.12 -0.36 107.32 113.44 2q2a s GLY 26 Ca -0.03 -1.30 -0.15 0.00 0.00 0.00 0.00 44.72 43.24 2q2a s GLY 26 CO 0.03 -1.31 0.44 -1.08 0.00 0.00 0.00 173.10 171.18 2q2a s THR 27 N -1.74 0.05 -0.60 0.90 -1.32 -0.47 -2.22 115.64 110.22 2q2a s THR 27 Ca 0.29 -0.89 -0.04 0.00 -1.21 0.00 0.00 61.69 59.84 2q2a s THR 27 Cb -0.10 -1.56 0.16 0.00 -1.51 0.00 0.00 72.50 69.49 2q2a s THR 27 CO 0.21 -0.21 0.42 -0.62 -2.21 0.00 0.00 174.62 172.21 2q2a s ASP 28 N -2.88 5.35 -1.51 8.08 2.15 -1.26 -1.11 116.67 125.49 2q2a s ASP 28 Ca 0.10 -2.69 -0.10 0.00 0.43 0.00 0.00 52.55 50.29 2q2a s ASP 28 Cb 0.01 -1.88 -0.00 0.00 -0.30 0.00 0.00 42.92 40.75 2q2a s ASP 28 CO -0.04 -0.42 2.63 0.00 -0.17 0.00 0.00 175.17 177.17 2q2a n ALA 29 N 3.72 6.90 -2.75 3.66 0.00 -1.26 -4.04 120.51 126.75 2q2a n ALA 29 Ca 0.06 -3.78 -0.10 0.00 0.00 0.00 0.00 53.44 49.62 2q2a n ALA 29 Cb 0.39 -3.24 0.03 0.00 0.00 0.00 0.00 19.45 16.63 2q2a n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q2a n ALA 30 N 3.61 2.83 -2.75 0.00 0.00 -1.18 -3.75 120.51 119.27 2q2a n ALA 30 Ca 0.68 -2.91 -0.09 0.00 0.00 0.00 0.00 53.44 51.12 2q2a n ALA 30 Cb 0.27 -0.95 0.09 0.00 0.00 0.00 0.00 19.45 18.86 2q2a n ALA 30 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2q2a n PHE 31 N -0.06 -2.51 -1.92 0.00 7.35 0.04 -4.09 117.46 116.27 2q2a n PHE 31 Ca 0.10 -2.20 -0.41 0.00 -0.76 0.00 0.00 57.45 54.19 2q2a n PHE 31 Cb 0.80 1.46 -0.01 0.00 0.35 0.00 0.00 39.48 42.08 2q2a n PHE 31 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2q2a s ALA 32 N 0.01 3.49 -2.21 3.13 0.00 -1.17 -1.03 121.76 123.99 2q2a s ALA 32 Ca 0.23 1.44 0.19 0.00 0.00 0.00 0.00 51.96 53.82 2q2a s ALA 32 Cb 0.32 -3.56 0.74 0.00 0.00 0.00 0.00 23.12 20.62 2q2a s ALA 32 CO -0.06 -0.93 1.53 -0.35 0.00 0.00 0.00 175.76 175.95 2q2a n PRO 33 N 0.47 1.63 -0.03 0.00 -0.04 -1.26 -4.36 135.00 131.40 2q2a n PRO 33 Ca 0.01 -0.95 -0.14 0.00 -0.04 0.00 0.00 63.50 62.38 2q2a n PRO 33 Cb 0.41 -1.36 -0.11 0.00 -0.04 0.00 0.00 33.50 32.39 2q2a n PRO 33 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2q2a h PHE 34 N 1.86 0.13 -2.51 0.54 0.04 -1.41 0.59 116.94 116.18 2q2a h PHE 34 Ca 0.00 -0.06 -0.09 0.00 2.80 0.00 0.00 57.97 60.62 2q2a h PHE 34 Cb 0.41 -0.02 -0.24 0.00 2.20 0.00 0.00 35.95 38.30 2q2a h PHE 34 CO 0.10 0.81 -0.18 -1.83 -0.60 0.00 0.00 178.31 176.61 2q2a s GLU 35 N -3.32 0.52 0.21 1.51 1.03 -0.88 -1.39 118.70 116.38 2q2a s GLU 35 Ca -0.16 0.80 -0.23 0.00 0.03 0.00 0.00 54.97 55.41 2q2a s GLU 35 Cb 0.00 0.14 0.05 0.00 -0.80 0.00 0.00 34.13 33.52 2q2a s GLU 35 CO 0.71 -0.12 0.88 1.52 -1.33 0.00 0.00 175.26 176.92 2q2a s TYR 36 N 0.92 -0.13 -0.15 4.83 -0.85 0.02 -0.78 117.35 121.21 2q2a s TYR 36 Ca -0.05 -0.24 -0.08 0.00 -0.52 0.00 0.00 57.07 56.17 2q2a s TYR 36 Cb -0.06 0.67 -0.04 0.00 0.38 0.00 0.00 41.96 42.91 2q2a s TYR 36 CO -0.08 -1.00 0.14 -1.64 -1.52 0.00 0.00 175.55 171.46 2q2a s MET 37 N -3.42 3.75 -0.18 -3.49 -1.94 -1.25 -0.32 119.30 112.45 2q2a s MET 37 Ca 0.12 -0.15 -0.04 0.00 -1.71 0.00 0.00 55.69 53.91 2q2a s MET 37 Cb -0.03 -3.28 0.08 0.00 2.01 0.00 0.00 34.83 33.61 2q2a s MET 37 CO 0.04 0.59 0.24 -1.14 -0.01 0.00 0.00 175.02 174.74 2q2a s GLN 38 N -0.47 0.18 -1.58 2.03 0.74 0.07 -4.86 119.66 115.77 2q2a s GLN 38 Ca 0.13 0.41 -0.14 0.00 0.05 0.00 0.00 55.36 55.81 2q2a s GLN 38 Cb -0.12 -0.74 0.10 0.00 1.10 0.00 0.00 33.01 33.36 2q2a s GLN 38 CO 0.02 -0.52 0.87 1.63 -0.55 0.00 0.00 175.29 176.74 2q2a n LYS 39 N 5.33 -4.52 -0.99 1.67 4.76 -1.26 -1.70 118.16 121.45 2q2a n LYS 39 Ca -0.05 0.51 0.00 0.00 -2.87 0.00 0.00 58.31 55.89 2q2a n LYS 39 Cb 0.50 -5.28 0.00 0.00 -1.84 0.00 0.00 35.03 28.41 2q2a n LYS 39 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2q2a n GLY 40 N -1.60 0.51 3.51 0.72 0.00 -1.26 -5.02 105.19 102.05 2q2a n GLY 40 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 2q2a n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q2a s LYS 41 N -0.24 2.13 -0.13 1.61 -0.14 -0.69 -5.10 119.74 117.18 2q2a s LYS 41 Ca 0.00 -0.97 -0.29 0.00 -1.36 0.00 0.00 55.97 53.35 2q2a s LYS 41 Cb 0.00 -2.26 -0.01 0.00 -1.68 0.00 0.00 37.83 33.88 2q2a s LYS 41 CO 0.00 0.54 1.02 0.42 -0.76 0.00 0.00 175.35 176.57 2q2a s ILE 42 N -1.03 4.75 0.24 2.17 1.01 -1.26 -0.75 121.20 126.33 2q2a s ILE 42 Ca 0.17 2.03 0.04 0.00 0.00 0.00 0.00 60.65 62.89 2q2a s ILE 42 Cb -0.11 -4.31 -0.05 0.00 0.01 0.00 0.00 42.46 38.00 2q2a s ILE 42 CO 0.08 -0.04 -0.01 0.68 0.00 0.00 0.00 174.94 175.65 2q2a s VAL 43 N 2.30 1.13 0.00 2.92 -7.23 0.56 -4.96 120.40 115.13 2q2a s VAL 43 Ca 0.47 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 2q2a s VAL 43 Cb -0.18 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.42 2q2a s VAL 43 CO 0.15 -0.33 0.00 0.61 -0.31 0.00 0.00 175.10 175.22 2q2a n GLY 44 N -0.44 1.40 0.19 2.32 0.00 -1.26 -0.80 105.19 106.60 2q2a n GLY 44 Ca -0.05 -1.98 -0.08 0.00 0.00 0.00 0.00 46.02 43.91 2q2a n GLY 44 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2q2a h PHE 45 N 0.00 0.55 -0.35 1.61 3.57 -0.64 -1.50 116.94 120.17 2q2a h PHE 45 Ca 0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 2q2a h PHE 45 Cb 0.00 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 2q2a h PHE 45 CO 0.00 0.37 0.08 -0.44 -2.23 0.00 0.00 178.31 176.09 2q2a h ASP 46 N 0.57 0.47 -0.25 0.41 3.32 -1.46 -0.42 116.42 119.06 2q2a h ASP 46 Ca 0.15 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.07 2q2a h ASP 46 Cb -0.03 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2q2a h ASP 46 CO -0.03 0.49 -0.11 0.58 -1.72 0.00 0.00 179.24 178.45 2q2a h VAL 47 N 0.51 1.30 -0.57 -1.35 2.07 -1.44 0.85 116.25 117.61 2q2a h VAL 47 Ca 0.12 -1.17 -0.08 0.00 0.82 0.00 0.00 66.70 66.39 2q2a h VAL 47 Cb 0.21 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 2q2a h VAL 47 CO -0.00 0.37 0.06 0.44 0.02 0.00 0.00 177.57 178.45 2q2a h ASP 48 N 0.25 0.94 -0.22 0.57 3.32 -1.06 -2.06 116.42 118.15 2q2a h ASP 48 Ca 0.06 -0.28 -0.05 0.00 0.02 0.00 0.00 57.03 56.78 2q2a h ASP 48 Cb 0.60 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 2q2a h ASP 48 CO 0.03 0.98 -0.07 0.25 -1.72 0.00 0.00 179.24 178.72 2q2a h LEU 49 N 0.86 0.44 -0.75 1.55 5.85 -0.98 -2.45 115.31 119.84 2q2a h LEU 49 Ca 0.17 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.55 2q2a h LEU 49 Cb 0.46 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 2q2a h LEU 49 CO 0.02 0.72 0.46 0.25 -0.34 0.00 0.00 178.44 179.55 2q2a h LEU 50 N 0.16 0.74 -0.60 2.25 5.85 -0.76 0.16 115.31 123.10 2q2a h LEU 50 Ca 0.05 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 2q2a h LEU 50 Cb 0.54 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 2q2a h LEU 50 CO 0.02 0.49 0.26 -0.78 -0.34 0.00 0.00 178.44 178.10 2q2a h ASP 51 N 0.87 0.81 -0.42 1.25 3.58 -1.25 0.68 116.42 121.95 2q2a h ASP 51 Ca 0.31 -0.15 -0.06 0.00 0.42 0.00 0.00 57.03 57.55 2q2a h ASP 51 Cb 0.09 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 2q2a h ASP 51 CO -0.14 0.74 0.03 0.00 -2.88 0.00 0.00 179.24 176.99 2q2a h ALA 52 N 1.10 0.56 0.22 -0.78 0.00 -1.13 -2.00 119.26 117.23 2q2a h ALA 52 Ca 0.20 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2q2a h ALA 52 Cb 0.16 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2q2a h ALA 52 CO -0.02 0.32 -0.11 0.28 0.00 0.00 0.00 179.25 179.73 2q2a h VAL 53 N 0.57 0.84 -0.88 0.00 2.07 -0.66 -1.49 116.25 116.70 2q2a h VAL 53 Ca 0.12 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 2q2a h VAL 53 Cb 0.44 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 2q2a h VAL 53 CO 0.02 0.08 0.52 0.24 0.02 0.00 0.00 177.57 178.45 2q2a h MET 54 N -0.48 1.19 -0.43 1.57 2.07 -0.92 0.12 114.93 118.05 2q2a h MET 54 Ca -0.03 -0.11 -0.04 0.00 -2.07 0.00 0.00 59.70 57.45 2q2a h MET 54 Cb 0.36 -0.25 -0.02 0.00 -1.87 0.00 0.00 31.60 29.82 2q2a h MET 54 CO 0.05 0.84 0.11 0.87 1.07 0.00 0.00 176.91 179.85 2q2a h LYS 55 N 1.21 0.69 0.00 1.72 1.57 -1.32 -0.02 116.57 120.41 2q2a h LYS 55 Ca 0.31 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.89 2q2a h LYS 55 Cb -0.04 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 2q2a h LYS 55 CO -0.06 0.69 -0.19 0.00 -0.57 0.00 0.00 179.45 179.32 2q2a h ALA 56 N 0.96 1.62 0.00 3.86 0.00 -0.83 -1.15 119.26 123.72 2q2a h ALA 56 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2q2a h ALA 56 Cb 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2q2a h ALA 56 CO 0.00 0.24 -0.11 0.00 0.00 0.00 0.00 179.25 179.38 2q2a n ALA 57 N -2.47 2.50 -2.67 0.00 0.00 0.38 -4.84 120.51 113.40 2q2a n ALA 57 Ca -0.02 -0.11 -0.15 0.00 0.00 0.00 0.00 53.44 53.15 2q2a n ALA 57 Cb 0.26 -1.40 0.02 0.00 0.00 0.00 0.00 19.45 18.32 2q2a n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q2a n GLY 58 N 1.42 -0.14 3.29 0.00 0.00 -0.25 -5.01 105.19 104.50 2q2a n GLY 58 Ca 0.06 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 2q2a n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q2a s LEU 59 N -4.51 3.07 0.29 0.99 1.43 -0.19 -5.03 118.68 114.73 2q2a s LEU 59 Ca 0.16 -0.53 -0.29 0.00 -1.03 0.00 0.00 54.13 52.45 2q2a s LEU 59 Cb -0.07 -1.74 -0.10 0.00 0.03 0.00 0.00 46.19 44.31 2q2a s LEU 59 CO 0.20 -0.06 1.16 -0.62 0.23 0.00 0.00 176.35 177.26 2q2a s ASP 60 N 1.45 7.14 0.19 2.29 2.15 -1.26 -4.50 116.67 124.13 2q2a s ASP 60 Ca 0.04 2.37 -0.09 0.00 0.43 0.00 0.00 52.55 55.31 2q2a s ASP 60 Cb -0.15 -2.63 -0.01 0.00 -0.30 0.00 0.00 42.92 39.83 2q2a s ASP 60 CO -0.03 -0.25 0.32 -0.72 -0.17 0.00 0.00 175.17 174.32 2q2a s TYR 61 N -1.10 0.48 0.02 -5.34 -0.85 -1.26 -0.90 117.35 108.40 2q2a s TYR 61 Ca 0.46 -0.82 0.04 0.00 -0.52 0.00 0.00 57.07 56.23 2q2a s TYR 61 Cb -0.34 -0.04 -0.02 0.00 0.38 0.00 0.00 41.96 41.94 2q2a s TYR 61 CO 0.44 -0.79 -0.13 -1.83 -1.52 0.00 0.00 175.55 171.72 2q2a s GLU 62 N -4.01 0.89 -0.23 -3.49 -1.05 0.16 -4.86 118.70 106.10 2q2a s GLU 62 Ca 0.21 -0.64 -0.06 0.00 -0.15 0.00 0.00 54.97 54.34 2q2a s GLU 62 Cb 0.03 -0.87 -0.02 0.00 -0.44 0.00 0.00 34.13 32.82 2q2a s GLU 62 CO 0.04 0.22 0.03 -1.17 0.95 0.00 0.00 175.26 175.33 2q2a s LEU 63 N -0.88 3.24 -0.19 1.83 2.96 -1.26 -0.97 118.68 123.42 2q2a s LEU 63 Ca 0.02 -0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 53.61 2q2a s LEU 63 Cb -0.07 -1.85 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 2q2a s LEU 63 CO 0.01 -0.02 0.02 -0.54 -1.32 0.00 0.00 176.35 174.50 2q2a s LYS 64 N 1.49 3.75 -1.17 1.98 -0.14 0.51 -5.00 119.74 121.16 2q2a s LYS 64 Ca 0.06 -0.46 -0.19 0.00 -1.36 0.00 0.00 55.97 54.01 2q2a s LYS 64 Cb -0.15 -3.10 0.08 0.00 -1.68 0.00 0.00 37.83 32.98 2q2a s LYS 64 CO 0.01 0.14 1.57 1.21 -0.76 0.00 0.00 175.35 177.51 2q2a s ASN 65 N 0.69 6.74 0.00 2.83 2.47 -1.26 -1.37 114.94 125.04 2q2a s ASN 65 Ca 0.01 -2.15 0.22 0.00 0.42 0.00 0.00 52.86 51.35 2q2a s ASN 65 Cb -0.14 -2.54 -0.18 0.00 -1.45 0.00 0.00 41.25 36.94 2q2a s ASN 65 CO 0.02 -1.23 0.83 0.00 -3.72 0.00 0.00 177.10 173.01 2q2a n ILE 66 N 6.30 0.03 0.00 -5.21 3.06 -0.27 -4.91 119.36 118.36 2q2a n ILE 66 Ca 0.41 -0.18 0.00 0.00 -2.50 0.00 0.00 62.75 60.48 2q2a n ILE 66 Cb 0.48 0.56 0.00 0.00 0.54 0.00 0.00 39.64 41.21 2q2a n ILE 66 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2q2a n GLY 67 N 1.41 1.38 0.12 4.50 0.00 -0.94 -4.55 105.19 107.11 2q2a n GLY 67 Ca 0.02 -1.86 -0.04 0.00 0.00 0.00 0.00 46.02 44.13 2q2a n GLY 67 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2q2a h TRP 68 N 0.00 -0.25 -0.71 1.61 2.91 -1.85 -1.20 115.95 116.46 2q2a h TRP 68 Ca 0.00 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.00 2q2a h TRP 68 Cb 0.00 0.08 -0.03 0.00 -0.51 0.00 0.00 29.16 28.70 2q2a h TRP 68 CO 0.00 -0.16 0.40 -0.44 -1.03 0.00 0.00 178.44 177.22 2q2a h ASP 69 N -0.62 0.88 -0.22 2.65 3.32 -1.91 -1.72 116.42 118.80 2q2a h ASP 69 Ca -0.03 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 2q2a h ASP 69 Cb 0.21 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2q2a h ASP 69 CO 0.05 0.72 0.12 -0.65 -1.72 0.00 0.00 179.24 177.75 2q2a h PRO 70 N 0.98 0.35 -0.16 3.56 0.11 -1.81 -1.91 132.00 133.11 2q2a h PRO 70 Ca 0.25 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.35 2q2a h PRO 70 Cb 0.02 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.04 2q2a h PRO 70 CO -0.04 0.27 0.03 1.25 -0.21 0.00 0.00 178.00 179.31 2q2a h LEU 71 N 0.35 0.01 -0.75 2.35 5.85 -0.29 -0.01 115.31 122.83 2q2a h LEU 71 Ca 0.09 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 2q2a h LEU 71 Cb 0.04 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2q2a h LEU 71 CO -0.01 0.03 -0.22 -0.26 -0.34 0.00 0.00 178.44 177.64 2q2a h PHE 72 N 0.10 0.81 -0.58 1.25 0.04 -1.12 -1.46 116.94 115.99 2q2a h PHE 72 Ca 0.07 -0.18 -0.03 0.00 2.80 0.00 0.00 57.97 60.63 2q2a h PHE 72 Cb 0.06 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 37.99 2q2a h PHE 72 CO -0.13 0.87 0.24 0.00 -0.60 0.00 0.00 178.31 178.69 2q2a h ALA 73 N 1.13 0.75 0.00 2.45 0.00 -1.17 -2.16 119.26 120.25 2q2a h ALA 73 Ca 0.09 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 2q2a h ALA 73 Cb 0.71 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2q2a h ALA 73 CO 0.05 0.36 -0.51 0.77 0.00 0.00 0.00 179.25 179.92 2q2a h SER 74 N 0.79 0.00 -0.35 0.00 0.02 -0.73 -1.86 113.55 111.42 2q2a h SER 74 Ca 0.19 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.02 2q2a h SER 74 Cb 0.19 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 2q2a h SER 74 CO -0.02 0.51 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.84 2q2a h LEU 75 N 0.00 0.85 -0.51 5.07 3.38 -1.15 -1.39 115.31 121.55 2q2a h LEU 75 Ca -0.01 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2q2a h LEU 75 Cb 1.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 2q2a h LEU 75 CO 0.07 1.12 0.32 -0.61 0.09 0.00 0.00 178.44 179.42 2q2a h GLN 76 N 0.60 0.69 0.00 1.13 5.75 -1.05 -2.30 115.11 119.92 2q2a h GLN 76 Ca 0.07 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2q2a h GLN 76 Cb 0.84 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 29.25 2q2a h GLN 76 CO 0.07 0.48 0.00 0.66 -2.65 0.00 0.00 178.83 177.40 2q2a h SER 77 N 0.69 0.00 0.00 -0.69 4.64 -1.37 -3.47 113.55 113.35 2q2a h SER 77 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2q2a h SER 77 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2q2a h SER 77 CO -0.04 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.21 2q2a n LYS 78 N -2.71 -0.94 0.11 4.77 5.02 -0.62 -4.90 118.16 118.89 2q2a n LYS 78 Ca 0.01 0.24 0.04 0.00 -2.02 0.00 0.00 58.31 56.58 2q2a n LYS 78 Cb 0.27 -3.95 0.45 0.00 -0.02 0.00 0.00 35.03 31.78 2q2a n LYS 78 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2q2a h GLU 79 N 0.54 0.29 -5.67 1.97 4.81 -1.59 -3.39 114.58 111.54 2q2a h GLU 79 Ca 0.00 -0.04 -0.66 0.00 -0.13 0.00 0.00 59.36 58.53 2q2a h GLU 79 Cb 0.47 -0.05 -0.19 0.00 0.63 0.00 0.00 28.75 29.61 2q2a h GLU 79 CO 0.00 0.29 -0.66 0.08 -0.73 0.00 0.00 179.01 178.00 2q2a s VAL 80 N -5.04 4.00 -0.12 0.32 1.01 -0.86 -4.93 120.40 114.78 2q2a s VAL 80 Ca -0.06 -0.34 0.16 0.00 0.00 0.00 0.00 61.98 61.74 2q2a s VAL 80 Cb 0.16 -2.71 -0.10 0.00 0.00 0.00 0.00 36.38 33.74 2q2a s VAL 80 CO 0.72 0.55 0.98 0.44 0.00 0.00 0.00 175.10 177.78 2q2a h ASP 81 N 5.97 0.00 -5.00 3.32 3.32 -1.31 -3.39 116.42 119.33 2q2a h ASP 81 Ca -0.40 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.58 2q2a h ASP 81 Cb 1.19 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.55 2q2a h ASP 81 CO 0.59 0.58 0.11 -0.32 -1.72 0.00 0.00 179.24 178.48 2q2a s MET 82 N -2.92 1.00 0.02 3.56 1.75 -1.00 -4.29 119.30 117.42 2q2a s MET 82 Ca -0.01 0.15 0.04 0.00 -1.25 0.00 0.00 55.69 54.61 2q2a s MET 82 Cb 0.08 0.47 -0.02 0.00 2.84 0.00 0.00 34.83 38.21 2q2a s MET 82 CO 0.80 -0.31 -0.12 0.20 -0.65 0.00 0.00 175.02 174.93 2q2a s GLY 83 N -1.28 0.64 -0.05 2.11 0.00 0.38 -0.95 107.32 108.17 2q2a s GLY 83 Ca -0.11 -0.65 -0.00 0.00 0.00 0.00 0.00 44.72 43.96 2q2a s GLY 83 CO 0.08 -0.60 0.00 -1.50 0.00 0.00 0.00 173.10 171.08 2q2a s ILE 84 N -0.60 0.26 -0.12 0.90 2.07 -0.94 -0.90 121.20 121.87 2q2a s ILE 84 Ca 0.02 0.11 0.04 0.00 -1.41 0.00 0.00 60.65 59.41 2q2a s ILE 84 Cb -0.06 -0.39 0.14 0.00 0.13 0.00 0.00 42.46 42.28 2q2a s ILE 84 CO 0.00 0.20 0.86 -0.24 -1.91 0.00 0.00 174.94 173.85 2q2a n SER 85 N 4.61 -0.68 -3.41 4.50 2.88 -1.26 -4.38 113.62 115.88 2q2a n SER 85 Ca -0.17 -1.43 -0.23 0.00 -1.33 0.00 0.00 58.87 55.72 2q2a n SER 85 Cb 0.50 0.29 0.07 0.00 -0.75 0.00 0.00 64.21 64.32 2q2a n SER 85 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2q2a n GLY 86 N -0.53 -0.50 3.65 0.46 0.00 -1.26 -4.87 105.19 102.14 2q2a n GLY 86 Ca -0.11 0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 2q2a n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2q2a s ILE 87 N -3.29 4.98 0.12 -0.61 1.01 -1.26 -4.97 121.20 117.18 2q2a s ILE 87 Ca 0.53 1.25 -0.30 0.00 0.00 0.00 0.00 60.65 62.13 2q2a s ILE 87 Cb -0.23 -3.98 -0.07 0.00 0.01 0.00 0.00 42.46 38.19 2q2a s ILE 87 CO 0.66 0.07 1.14 -0.89 0.00 0.00 0.00 174.94 175.92 2q2a s THR 88 N 2.15 3.97 -0.08 2.92 2.01 -1.26 -1.05 115.64 124.29 2q2a s THR 88 Ca 0.30 1.55 -0.30 0.00 0.31 0.00 0.00 61.69 63.55 2q2a s THR 88 Cb -0.16 -3.99 -0.04 0.00 0.01 0.00 0.00 72.50 68.32 2q2a s THR 88 CO 0.10 0.20 1.48 -0.63 -0.69 0.00 0.00 174.62 175.07 2q2a s ILE 89 N 0.39 3.84 0.05 1.82 1.01 0.24 -4.88 121.20 123.67 2q2a s ILE 89 Ca 0.54 1.05 0.00 0.00 0.00 0.00 0.00 60.65 62.24 2q2a s ILE 89 Cb -0.29 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.47 2q2a s ILE 89 CO 0.32 -0.08 -0.04 0.42 0.00 0.00 0.00 174.94 175.56 2q2a s THR 90 N 3.58 0.34 0.20 2.92 -4.23 -1.26 -4.74 115.64 112.45 2q2a s THR 90 Ca 0.65 -1.50 -0.09 0.00 -1.18 0.00 0.00 61.69 59.57 2q2a s THR 90 Cb -0.29 -1.11 0.13 0.00 1.34 0.00 0.00 72.50 72.57 2q2a s THR 90 CO 0.24 -0.76 1.77 0.44 -0.54 0.00 0.00 174.62 175.77 2q2a h ASP 91 N 3.68 1.00 -0.77 3.99 3.32 -1.99 -1.80 116.42 123.86 2q2a h ASP 91 Ca -0.34 -0.17 0.06 0.00 0.02 0.00 0.00 57.03 56.60 2q2a h ASP 91 Cb 1.17 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 40.41 2q2a h ASP 91 CO 0.56 0.89 0.45 -0.08 -1.72 0.00 0.00 179.24 179.34 2q2a h GLU 92 N 1.04 0.81 -0.05 3.56 4.81 -2.01 -2.14 114.58 120.60 2q2a h GLU 92 Ca 0.24 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.33 2q2a h GLU 92 Cb 0.20 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2q2a h GLU 92 CO -0.02 0.53 -0.41 0.00 -0.73 0.00 0.00 179.01 178.38 2q2a h ARG 93 N 0.83 0.11 0.00 1.92 3.08 -1.82 -2.68 114.38 115.82 2q2a h ARG 93 Ca 0.34 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2q2a h ARG 93 Cb 0.18 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2q2a h ARG 93 CO -0.18 0.51 0.00 0.87 -1.07 0.00 0.00 179.97 180.10 2q2a h LYS 94 N 0.09 0.00 -0.89 0.04 1.57 -0.66 -0.58 116.57 116.15 2q2a h LYS 94 Ca 0.01 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.89 2q2a h LYS 94 Cb 0.77 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.01 2q2a h LYS 94 CO 0.06 0.00 0.53 1.96 -0.57 0.00 0.00 179.45 181.43 2q2a h GLN 95 N 0.00 0.84 0.00 3.15 4.20 -1.34 -3.32 115.11 118.65 2q2a h GLN 95 Ca 0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2q2a h GLN 95 Cb 0.13 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.72 2q2a h GLN 95 CO 0.00 0.56 -0.69 0.43 -0.67 0.00 0.00 178.83 178.46 2q2a n SER 96 N -4.70 2.74 -4.31 1.46 7.64 -0.89 -5.06 113.62 110.50 2q2a n SER 96 Ca 0.15 -0.22 -0.17 0.00 1.01 0.00 0.00 58.87 59.65 2q2a n SER 96 Cb 0.30 1.05 -0.10 0.00 -1.01 0.00 0.00 64.21 64.46 2q2a n SER 96 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2q2a s TYR 97 N -1.75 1.50 0.17 1.43 2.02 -0.28 -3.09 117.35 117.36 2q2a s TYR 97 Ca -0.00 -0.76 0.07 0.00 -0.37 0.00 0.00 57.07 56.01 2q2a s TYR 97 Cb 0.01 -0.79 -0.04 0.00 -0.40 0.00 0.00 41.96 40.74 2q2a s TYR 97 CO 0.08 0.13 0.01 -0.51 -1.57 0.00 0.00 175.55 173.69 2q2a s ASP 98 N -3.26 4.81 0.14 2.29 1.01 -0.01 -4.19 116.67 117.46 2q2a s ASP 98 Ca 0.22 -0.38 0.10 0.00 0.71 0.00 0.00 52.55 53.21 2q2a s ASP 98 Cb 0.03 -1.04 -0.04 0.00 1.01 0.00 0.00 42.92 42.88 2q2a s ASP 98 CO 0.05 0.09 -0.22 -0.36 0.21 0.00 0.00 175.17 174.94 2q2a s PHE 99 N -1.72 2.40 1.03 4.23 0.08 -1.26 -1.04 117.98 121.70 2q2a s PHE 99 Ca 0.28 -0.33 -0.12 0.00 0.12 0.00 0.00 56.93 56.87 2q2a s PHE 99 Cb -0.09 -1.26 0.21 0.00 -0.57 0.00 0.00 43.02 41.31 2q2a s PHE 99 CO 0.19 0.40 1.08 -1.54 -0.10 0.00 0.00 175.22 175.25 2q2a s SER 100 N -2.27 2.31 0.65 1.36 1.04 0.39 -4.97 113.70 112.19 2q2a s SER 100 Ca 0.17 1.28 -0.17 0.00 0.48 0.00 0.00 55.95 57.72 2q2a s SER 100 Cb -0.10 -1.97 -0.04 0.00 0.10 0.00 0.00 66.02 64.01 2q2a s SER 100 CO 0.09 -3.34 0.83 0.47 0.98 0.00 0.00 173.24 172.27 2q2a n ASP 101 N -4.32 0.13 -4.76 7.02 8.00 -1.26 -4.65 116.55 116.70 2q2a n ASP 101 Ca 0.05 0.73 -0.38 0.00 0.71 0.00 0.00 54.79 55.89 2q2a n ASP 101 Cb 0.56 -1.34 0.01 0.00 -0.02 0.00 0.00 41.12 40.34 2q2a n ASP 101 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2q2a s PRO 102 N -2.81 3.52 0.00 -0.24 0.04 -1.26 -4.62 135.00 129.63 2q2a s PRO 102 Ca 0.73 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.84 2q2a s PRO 102 Cb -0.39 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 31.74 2q2a s PRO 102 CO 0.50 -0.84 0.41 2.48 0.04 0.00 0.00 177.00 179.59 2q2a n TYR 103 N -0.61 0.00 -3.53 0.56 0.18 0.05 -4.89 117.16 108.92 2q2a n TYR 103 Ca 0.08 -0.03 -0.15 0.00 1.88 0.00 0.00 57.90 59.68 2q2a n TYR 103 Cb 0.46 -0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 39.36 2q2a n TYR 103 CO 0.00 0.00 0.00 0.12 -2.08 0.00 0.00 176.86 174.90 2q2a s PHE 104 N -0.06 -0.56 0.05 -3.48 5.36 -1.24 -4.97 117.98 113.08 2q2a s PHE 104 Ca 0.00 0.90 0.09 0.00 -0.96 0.00 0.00 56.93 56.96 2q2a s PHE 104 Cb 0.00 0.44 -0.03 0.00 -0.34 0.00 0.00 43.02 43.09 2q2a s PHE 104 CO 0.00 -0.55 -0.26 -2.00 -1.46 0.00 0.00 175.22 170.95 2q2a s GLU 105 N -1.43 1.74 0.36 10.12 2.12 -1.26 -0.82 118.70 129.52 2q2a s GLU 105 Ca -0.07 -1.12 -0.05 0.00 0.36 0.00 0.00 54.97 54.09 2q2a s GLU 105 Cb -0.00 -1.94 0.02 0.00 0.26 0.00 0.00 34.13 32.46 2q2a s GLU 105 CO 0.05 0.50 0.55 0.00 -0.54 0.00 0.00 175.26 175.82 2q2a s ALA 106 N -0.83 0.42 0.06 6.30 0.00 0.31 -4.97 121.76 123.05 2q2a s ALA 106 Ca 0.12 -1.34 -0.15 0.00 0.00 0.00 0.00 51.96 50.58 2q2a s ALA 106 Cb -0.10 1.04 0.03 0.00 0.00 0.00 0.00 23.12 24.09 2q2a s ALA 106 CO 0.02 -0.84 0.35 -0.08 0.00 0.00 0.00 175.76 175.21 2q2a s THR 107 N -2.85 0.07 0.53 0.00 -1.32 -1.26 -1.32 115.64 109.49 2q2a s THR 107 Ca 0.27 -0.62 -0.19 0.00 -1.21 0.00 0.00 61.69 59.94 2q2a s THR 107 Cb -0.02 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.91 2q2a s THR 107 CO 0.18 -0.34 1.08 -1.10 -2.21 0.00 0.00 174.62 172.24 2q2a s GLN 108 N -2.78 3.51 0.23 7.08 -1.52 -1.26 -0.96 119.66 123.96 2q2a s GLN 108 Ca -0.03 1.45 0.00 0.00 -1.95 0.00 0.00 55.36 54.83 2q2a s GLN 108 Cb -0.00 -2.04 -0.04 0.00 -0.22 0.00 0.00 33.01 30.70 2q2a s GLN 108 CO -0.05 -0.69 0.13 0.14 -0.25 0.00 0.00 175.29 174.57 2q2a s VAL 109 N -1.96 0.17 -0.23 1.09 -7.23 0.47 -4.74 120.40 107.98 2q2a s VAL 109 Ca 0.69 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.80 2q2a s VAL 109 Cb -0.20 -2.54 -0.02 0.00 0.56 0.00 0.00 36.38 34.18 2q2a s VAL 109 CO 0.26 0.00 0.02 -0.63 -0.31 0.00 0.00 175.10 174.44 2q2a s ILE 110 N -3.98 3.96 -0.23 -0.62 1.01 -0.25 -2.40 121.20 118.69 2q2a s ILE 110 Ca 0.39 -0.29 -0.10 0.00 0.00 0.00 0.00 60.65 60.64 2q2a s ILE 110 Cb 0.07 -2.83 -0.05 0.00 0.01 0.00 0.00 42.46 39.66 2q2a s ILE 110 CO 0.13 0.38 0.14 -0.22 0.00 0.00 0.00 174.94 175.37 2q2a s LEU 111 N 1.49 4.06 0.18 2.97 2.96 0.72 0.21 118.68 131.27 2q2a s LEU 111 Ca 0.06 0.10 -0.00 0.00 -0.22 0.00 0.00 54.13 54.06 2q2a s LEU 111 Cb -0.15 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 2q2a s LEU 111 CO 0.01 0.08 0.09 0.68 -1.32 0.00 0.00 176.35 175.90 2q2a s VAL 112 N 0.94 0.16 0.54 1.68 -7.23 -0.63 -1.39 120.40 114.47 2q2a s VAL 112 Ca 0.07 -1.97 -0.20 0.00 -1.81 0.00 0.00 61.98 58.07 2q2a s VAL 112 Cb -0.13 -2.34 -0.05 0.00 0.56 0.00 0.00 36.38 34.42 2q2a s VAL 112 CO 0.03 -0.19 1.19 -0.54 -0.31 0.00 0.00 175.10 175.28 2q2a s LYS 113 N -4.09 3.30 0.55 4.82 1.02 -1.26 -0.74 119.74 123.34 2q2a s LYS 113 Ca 0.33 1.79 0.31 0.00 0.02 0.00 0.00 55.97 58.42 2q2a s LYS 113 Cb 0.07 -2.10 1.47 0.00 -0.52 0.00 0.00 37.83 36.75 2q2a s LYS 113 CO 0.08 -0.93 1.88 1.96 -0.92 0.00 0.00 175.35 177.42 2q2a h GLN 114 N 1.33 0.00 -0.00 1.68 4.20 -0.85 -0.83 115.11 120.64 2q2a h GLN 114 Ca -0.50 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.21 2q2a h GLN 114 Cb 1.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.05 2q2a h GLN 114 CO 0.57 0.00 -0.00 0.41 -0.67 0.00 0.00 178.83 179.14 2q2a n GLY 115 N -1.68 -0.83 3.77 3.46 0.00 -1.26 -4.95 105.19 103.70 2q2a n GLY 115 Ca 0.17 -0.24 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 2q2a n GLY 115 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2q2a s SER 116 N -2.01 6.15 0.00 1.61 0.15 -0.32 -4.92 113.70 114.36 2q2a s SER 116 Ca 0.46 2.91 0.30 0.00 0.70 0.00 0.00 55.95 60.32 2q2a s SER 116 Cb 0.22 -2.66 1.41 0.00 -1.71 0.00 0.00 66.02 63.29 2q2a s SER 116 CO 0.37 -0.99 1.97 -0.81 1.20 0.00 0.00 173.24 174.98 2q2a n PRO 117 N 0.13 0.66 -1.80 5.44 -0.04 -1.26 -4.88 135.00 133.24 2q2a n PRO 117 Ca 0.03 -0.14 -0.42 0.00 -0.04 0.00 0.00 63.50 62.93 2q2a n PRO 117 Cb 0.41 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 2q2a n PRO 117 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2q2a s VAL 118 N -2.44 2.92 -0.07 0.52 1.01 -1.26 -4.88 120.40 116.21 2q2a s VAL 118 Ca 0.31 0.25 0.05 0.00 0.00 0.00 0.00 61.98 62.60 2q2a s VAL 118 Cb 0.20 -3.16 -0.07 0.00 0.00 0.00 0.00 36.38 33.35 2q2a s VAL 118 CO 0.45 -0.01 0.14 0.29 0.00 0.00 0.00 175.10 175.98 2q2a n LYS 119 N 6.26 1.48 -3.91 2.72 5.02 -1.26 -5.00 118.16 123.47 2q2a n LYS 119 Ca 0.18 -0.04 -0.09 0.00 -2.02 0.00 0.00 58.31 56.34 2q2a n LYS 119 Cb 0.40 -1.03 -0.02 0.00 -0.02 0.00 0.00 35.03 34.36 2q2a n LYS 119 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2q2a s ASN 120 N -2.32 -0.04 0.36 4.39 2.20 -1.26 -4.88 114.94 113.40 2q2a s ASN 120 Ca -0.01 -0.91 0.03 0.00 -0.94 0.00 0.00 52.86 51.03 2q2a s ASN 120 Cb 0.03 0.71 0.67 0.00 -2.00 0.00 0.00 41.25 40.67 2q2a s ASN 120 CO 0.21 -1.36 2.01 0.00 -2.94 0.00 0.00 177.10 175.03 2q2a h ALA 121 N 2.09 1.56 0.00 3.54 0.00 -1.94 -2.49 119.26 122.03 2q2a h ALA 121 Ca -0.25 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 2q2a h ALA 121 Cb 1.25 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2q2a h ALA 121 CO 0.32 0.39 -0.20 -0.07 0.00 0.00 0.00 179.25 179.69 2q2a h LEU 122 N 0.78 0.00 -0.09 0.00 3.38 -1.99 -1.63 115.31 115.75 2q2a h LEU 122 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2q2a h LEU 122 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2q2a h LEU 122 CO -0.04 0.20 0.00 0.47 0.09 0.00 0.00 178.44 179.16 2q2a n ASP 123 N -3.48 0.05 0.00 -0.43 8.00 -0.93 -2.07 116.55 117.68 2q2a n ASP 123 Ca -0.01 0.52 0.15 0.00 0.71 0.00 0.00 54.79 56.16 2q2a n ASP 123 Cb 0.37 -0.53 0.83 0.00 -0.02 0.00 0.00 41.12 41.77 2q2a n ASP 123 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2q2a n LEU 124 N -1.56 0.00 -4.66 0.64 4.77 -0.61 -4.86 117.00 110.72 2q2a n LEU 124 Ca 0.01 0.13 -0.47 0.00 -0.03 0.00 0.00 56.01 55.65 2q2a n LEU 124 Cb 0.08 -0.13 -0.05 0.00 -2.33 0.00 0.00 43.42 40.99 2q2a n LEU 124 CO 0.06 -0.01 1.19 1.17 -1.33 0.00 0.00 177.39 178.48 2q2a n LYS 125 N -1.13 1.99 -0.87 3.23 4.81 -0.88 -0.81 118.16 124.50 2q2a n LYS 125 Ca 0.19 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 2q2a n LYS 125 Cb 0.16 -2.48 0.00 0.00 0.02 0.00 0.00 35.03 32.74 2q2a n LYS 125 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2q2a n GLY 126 N 3.43 1.00 3.91 3.14 0.00 -1.26 -5.02 105.19 110.39 2q2a n GLY 126 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 2q2a n GLY 126 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q2a s LYS 127 N -0.12 3.22 -0.12 1.61 1.02 0.01 -5.08 119.74 120.28 2q2a s LYS 127 Ca 0.00 -0.89 -0.19 0.00 0.02 0.00 0.00 55.97 54.91 2q2a s LYS 127 Cb 0.00 -2.76 -0.04 0.00 -0.52 0.00 0.00 37.83 34.51 2q2a s LYS 127 CO 0.00 0.40 0.52 0.99 -0.92 0.00 0.00 175.35 176.34 2q2a s THR 128 N -2.05 5.16 -0.14 2.17 2.01 -1.26 -4.82 115.64 116.71 2q2a s THR 128 Ca 0.34 1.03 0.02 0.00 0.31 0.00 0.00 61.69 63.40 2q2a s THR 128 Cb -0.09 -3.86 0.01 0.00 0.01 0.00 0.00 72.50 68.58 2q2a s THR 128 CO 0.27 0.30 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.66 2q2a s ILE 129 N 0.74 2.17 -0.05 1.82 1.01 0.17 -0.66 121.20 126.41 2q2a s ILE 129 Ca 0.28 -0.95 -0.17 0.00 0.00 0.00 0.00 60.65 59.81 2q2a s ILE 129 Cb -0.16 -1.87 -0.05 0.00 0.01 0.00 0.00 42.46 40.40 2q2a s ILE 129 CO 0.11 0.55 0.46 -0.83 0.00 0.00 0.00 174.94 175.23 2q2a s GLY 130 N 0.73 2.46 0.09 6.18 0.00 0.10 -0.78 107.32 116.10 2q2a s GLY 130 Ca -0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 44.72 44.45 2q2a s GLY 130 CO 0.00 0.48 -0.00 -1.34 0.00 0.00 0.00 173.10 172.24 2q2a s VAL 131 N -0.26 0.24 0.18 1.40 -7.23 0.00 -2.27 120.40 112.46 2q2a s VAL 131 Ca 0.25 -1.86 -0.30 0.00 -1.81 0.00 0.00 61.98 58.26 2q2a s VAL 131 Cb -0.16 -1.73 -0.08 0.00 0.56 0.00 0.00 36.38 34.97 2q2a s VAL 131 CO 0.12 -0.79 0.98 -1.58 -0.31 0.00 0.00 175.10 173.52 2q2a s GLN 132 N -3.96 4.74 0.38 4.82 0.74 -1.26 -0.90 119.66 124.23 2q2a s GLN 132 Ca 0.14 1.53 -0.26 0.00 0.05 0.00 0.00 55.36 56.82 2q2a s GLN 132 Cb 0.08 -3.31 -0.11 0.00 1.10 0.00 0.00 33.01 30.76 2q2a s GLN 132 CO -0.05 0.32 1.08 -1.71 -0.55 0.00 0.00 175.29 174.38 2q2a n ASN 133 N 2.10 1.64 -3.76 6.67 2.85 0.82 -3.29 115.26 122.30 2q2a n ASN 133 Ca 0.00 1.10 -0.23 0.00 -0.11 0.00 0.00 54.58 55.34 2q2a n ASN 133 Cb 0.48 -1.38 0.03 0.00 1.24 0.00 0.00 39.78 40.15 2q2a n ASN 133 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2q2a n ALA 134 N -0.18 -1.88 -2.52 5.20 0.00 -1.26 -4.93 120.51 114.95 2q2a n ALA 134 Ca 0.08 -0.11 -0.24 0.00 0.00 0.00 0.00 53.44 53.17 2q2a n ALA 134 Cb 0.37 -2.39 -0.11 0.00 0.00 0.00 0.00 19.45 17.33 2q2a n ALA 134 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2q2a s THR 135 N -3.62 1.84 0.45 0.00 -4.23 -1.21 -5.03 115.64 103.85 2q2a s THR 135 Ca 0.13 -2.10 0.22 0.00 -1.18 0.00 0.00 61.69 58.76 2q2a s THR 135 Cb -0.06 -2.70 0.25 0.00 1.34 0.00 0.00 72.50 71.33 2q2a s THR 135 CO 0.82 -0.15 2.06 0.71 -0.54 0.00 0.00 174.62 177.52 2q2a h THR 136 N 2.05 0.81 -0.28 3.99 1.35 -1.94 -1.52 112.91 117.36 2q2a h THR 136 Ca -0.42 -0.52 -0.02 0.00 -0.55 0.00 0.00 66.41 64.91 2q2a h THR 136 Cb 1.24 1.30 -0.01 0.00 -1.73 0.00 0.00 68.15 68.95 2q2a h THR 136 CO 0.72 0.13 0.11 1.23 -0.25 0.00 0.00 175.52 177.46 2q2a h GLY 137 N 0.62 0.45 0.94 5.82 0.00 -1.90 -0.48 103.07 108.52 2q2a h GLY 137 Ca -0.00 -0.25 0.02 0.00 0.00 0.00 0.00 47.33 47.10 2q2a h GLY 137 CO 0.02 0.23 0.49 -1.61 0.00 0.00 0.00 176.54 175.67 2q2a h GLN 138 N 0.30 0.96 -0.46 4.80 4.15 -1.57 -0.46 115.11 122.82 2q2a h GLN 138 Ca 0.09 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 2q2a h GLN 138 Cb 0.19 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 2q2a h GLN 138 CO -0.01 0.63 0.15 1.49 -1.93 0.00 0.00 178.83 179.17 2q2a h GLU 139 N 0.99 0.71 -0.83 1.69 4.81 -1.17 -1.43 114.58 119.34 2q2a h GLU 139 Ca 0.29 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.34 2q2a h GLU 139 Cb -0.05 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.18 2q2a h GLU 139 CO -0.08 0.67 0.37 0.00 -0.73 0.00 0.00 179.01 179.23 2q2a h ALA 140 N 1.00 1.09 -0.38 2.92 0.00 -0.77 -0.88 119.26 122.24 2q2a h ALA 140 Ca 0.15 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2q2a h ALA 140 Cb 0.25 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2q2a h ALA 140 CO -0.01 0.67 0.17 0.00 0.00 0.00 0.00 179.25 180.08 2q2a h ALA 141 N 1.21 0.50 -0.15 0.00 0.00 -0.68 -2.88 119.26 117.25 2q2a h ALA 141 Ca 0.28 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2q2a h ALA 141 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2q2a h ALA 141 CO -0.03 0.08 -0.35 0.93 0.00 0.00 0.00 179.25 179.88 2q2a h GLU 142 N 0.48 0.30 -0.66 0.00 5.08 -1.00 -2.78 114.58 116.00 2q2a h GLU 142 Ca 0.13 -0.13 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2q2a h GLU 142 Cb 0.16 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 2q2a h GLU 142 CO -0.01 0.62 0.43 -0.22 -1.00 0.00 0.00 179.01 178.83 2q2a h LYS 143 N 0.26 0.74 0.46 2.33 3.64 -0.95 0.14 116.57 123.20 2q2a h LYS 143 Ca 0.03 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 2q2a h LYS 143 Cb 0.74 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2q2a h LYS 143 CO 0.06 0.49 -0.22 -0.07 -2.27 0.00 0.00 179.45 177.44 2q2a h LEU 144 N 0.77 -0.53 -1.60 5.20 3.38 -1.39 -3.37 115.31 117.77 2q2a h LEU 144 Ca 0.27 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2q2a h LEU 144 Cb 0.10 0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2q2a h LEU 144 CO -0.08 -0.33 -0.08 0.49 0.09 0.00 0.00 178.44 178.53 2q2a n PHE 145 N -5.33 0.00 0.00 1.13 3.72 -1.24 -5.11 117.46 110.62 2q2a n PHE 145 Ca -0.11 -0.13 0.00 0.00 -0.05 0.00 0.00 57.45 57.15 2q2a n PHE 145 Cb 0.28 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 2q2a n PHE 145 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2q2a n GLY 146 N -0.15 -0.27 3.78 1.37 0.00 0.49 -4.97 105.19 105.44 2q2a n GLY 146 Ca 0.01 -1.77 -0.34 0.00 0.00 0.00 0.00 46.02 43.92 2q2a n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q2a s LYS 147 N -1.84 3.10 0.00 1.61 1.02 -1.26 -4.64 119.74 117.73 2q2a s LYS 147 Ca 0.00 1.44 0.00 0.00 0.02 0.00 0.00 55.97 57.43 2q2a s LYS 147 Cb 0.00 -1.99 0.00 0.00 -0.52 0.00 0.00 37.83 35.32 2q2a s LYS 147 CO 0.00 -1.02 0.00 0.41 -0.92 0.00 0.00 175.35 173.82 2q2a n GLY 148 N -0.34 1.78 0.31 -3.33 0.00 -1.26 -4.99 105.19 97.36 2q2a n GLY 148 Ca 0.11 -1.07 0.21 0.00 0.00 0.00 0.00 46.02 45.26 2q2a n GLY 148 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2q2a h PRO 149 N 0.00 0.00 0.00 1.61 0.11 -2.02 -2.07 132.00 129.63 2q2a h PRO 149 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2q2a h PRO 149 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2q2a h PRO 149 CO 0.00 0.00 0.00 1.12 -0.21 0.00 0.00 178.00 178.91 2q2a h HIS 150 N 0.00 0.00 -3.62 0.65 2.07 -1.94 -3.39 115.15 108.93 2q2a h HIS 150 Ca 0.00 0.00 -0.66 0.00 -2.85 0.00 0.00 60.37 56.86 2q2a h HIS 150 Cb 0.13 0.00 -0.16 0.00 2.57 0.00 0.00 27.41 29.94 2q2a h HIS 150 CO 0.00 0.00 -0.17 0.42 -3.07 0.00 0.00 177.93 175.11 2q2a s ILE 151 N -3.96 5.08 -0.24 6.12 -1.09 -0.78 -0.65 121.20 125.68 2q2a s ILE 151 Ca -0.03 0.10 -0.13 0.00 -2.23 0.00 0.00 60.65 58.37 2q2a s ILE 151 Cb 0.11 -3.93 -0.05 0.00 -1.58 0.00 0.00 42.46 37.02 2q2a s ILE 151 CO 0.45 -0.21 0.26 -0.54 -1.23 0.00 0.00 174.94 173.67 2q2a s LYS 152 N 2.21 4.06 -0.17 2.79 -0.14 0.04 -4.92 119.74 123.62 2q2a s LYS 152 Ca 0.15 -0.12 -0.04 0.00 -1.36 0.00 0.00 55.97 54.60 2q2a s LYS 152 Cb -0.16 -3.58 -0.02 0.00 -1.68 0.00 0.00 37.83 32.39 2q2a s LYS 152 CO 0.13 -0.06 -0.04 0.15 -0.76 0.00 0.00 175.35 174.76 2q2a s LYS 153 N 1.42 3.59 0.15 1.68 1.02 -1.26 -0.82 119.74 125.52 2q2a s LYS 153 Ca 0.11 -0.55 0.10 0.00 0.02 0.00 0.00 55.97 55.65 2q2a s LYS 153 Cb -0.15 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.20 2q2a s LYS 153 CO 0.07 0.14 -0.23 -0.06 -0.92 0.00 0.00 175.35 174.36 2q2a s PHE 154 N 0.62 2.06 -0.01 3.18 0.08 -0.08 -4.79 117.98 119.05 2q2a s PHE 154 Ca -0.03 -0.40 0.22 0.00 0.12 0.00 0.00 56.93 56.84 2q2a s PHE 154 Cb -0.14 -1.07 0.64 0.00 -0.57 0.00 0.00 43.02 41.87 2q2a s PHE 154 CO 0.02 0.35 1.71 1.49 -0.10 0.00 0.00 175.22 178.69 2q2a h GLU 155 N 3.60 0.00 -5.83 0.44 4.57 -1.95 0.23 114.58 115.64 2q2a h GLU 155 Ca -0.46 0.00 -0.50 0.00 -1.18 0.00 0.00 59.36 57.22 2q2a h GLU 155 Cb 1.19 0.00 -0.20 0.00 -0.16 0.00 0.00 28.75 29.58 2q2a h GLU 155 CO 0.44 0.26 -0.79 0.95 -1.18 0.00 0.00 179.01 178.69 2q2a s THR 156 N -3.41 1.57 0.41 0.32 -4.23 -1.26 -4.58 115.64 104.45 2q2a s THR 156 Ca 0.02 -1.63 0.11 0.00 -1.18 0.00 0.00 61.69 59.01 2q2a s THR 156 Cb 0.09 -1.55 0.17 0.00 1.34 0.00 0.00 72.50 72.55 2q2a s THR 156 CO 0.67 -0.22 1.95 0.74 -0.54 0.00 0.00 174.62 177.22 2q2a h THR 157 N 3.79 1.16 -0.47 3.99 2.02 -1.84 -2.60 112.91 118.96 2q2a h THR 157 Ca -0.43 -0.68 0.05 0.00 0.77 0.00 0.00 66.41 66.12 2q2a h THR 157 Cb 1.19 1.19 -0.05 0.00 -1.74 0.00 0.00 68.15 68.74 2q2a h THR 157 CO 0.45 0.21 0.21 0.58 0.37 0.00 0.00 175.52 177.33 2q2a h VAL 158 N 0.19 0.91 -0.37 3.16 2.07 -1.96 -1.47 116.25 118.78 2q2a h VAL 158 Ca 0.04 -0.14 -0.14 0.00 0.82 0.00 0.00 66.70 67.28 2q2a h VAL 158 Cb 0.32 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 2q2a h VAL 158 CO 0.02 0.07 -0.31 0.58 0.02 0.00 0.00 177.57 177.96 2q2a h VAL 159 N 0.41 1.28 -0.65 2.57 2.07 -1.87 -2.06 116.25 117.99 2q2a h VAL 159 Ca 0.21 -1.47 0.13 0.00 0.82 0.00 0.00 66.70 66.40 2q2a h VAL 159 Cb 0.17 1.40 -0.10 0.00 -1.52 0.00 0.00 31.29 31.23 2q2a h VAL 159 CO -0.18 0.49 0.09 0.00 0.02 0.00 0.00 177.57 177.99 2q2a h ALA 160 N 0.77 0.75 -0.51 1.67 0.00 -1.12 -0.32 119.26 120.50 2q2a h ALA 160 Ca 0.07 0.17 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2q2a h ALA 160 Cb 0.89 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 2q2a h ALA 160 CO 0.08 -0.35 -0.04 0.82 0.00 0.00 0.00 179.25 179.75 2q2a h ILE 161 N 0.20 1.26 -0.82 0.00 2.04 -0.90 -1.91 117.51 117.38 2q2a h ILE 161 Ca 0.35 -1.13 0.04 0.00 1.00 0.00 0.00 64.86 65.12 2q2a h ILE 161 Cb 0.57 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 2q2a h ILE 161 CO -0.49 0.40 0.52 0.24 0.00 0.00 0.00 178.15 178.82 2q2a h MET 162 N 0.82 0.97 0.00 2.37 2.86 -0.53 -0.15 114.93 121.27 2q2a h MET 162 Ca 0.15 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.69 2q2a h MET 162 Cb 0.55 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 2q2a h MET 162 CO 0.03 0.64 -0.19 1.49 1.06 0.00 0.00 176.91 179.94 2q2a h GLU 163 N 1.00 0.00 -0.12 1.72 4.57 -0.70 -0.96 114.58 120.09 2q2a h GLU 163 Ca 0.34 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.46 2q2a h GLU 163 Cb 0.04 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.63 2q2a h GLU 163 CO -0.13 0.19 -0.14 1.25 -1.18 0.00 0.00 179.01 179.01 2q2a h LEU 164 N 0.00 0.33 -0.78 1.64 5.85 -0.51 0.69 115.31 122.54 2q2a h LEU 164 Ca -0.00 -0.50 0.01 0.00 0.84 0.00 0.00 57.88 58.23 2q2a h LEU 164 Cb 0.77 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.66 2q2a h LEU 164 CO 0.03 0.76 0.51 -0.07 -0.34 0.00 0.00 178.44 179.33 2q2a h LEU 165 N -0.09 0.88 -0.83 2.25 3.38 -0.46 -2.57 115.31 117.87 2q2a h LEU 165 Ca 0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2q2a h LEU 165 Cb 0.67 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2q2a h LEU 165 CO 0.03 0.63 0.00 -0.46 0.09 0.00 0.00 178.44 178.73 2q2a n ASN 166 N -4.56 1.23 0.00 -0.43 0.23 -0.42 -4.92 115.26 106.39 2q2a n ASN 166 Ca 0.08 -1.72 0.00 0.00 -0.53 0.00 0.00 54.58 52.41 2q2a n ASN 166 Cb 0.03 -0.10 0.00 0.00 -2.08 0.00 0.00 39.78 37.63 2q2a n ASN 166 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2q2a n GLY 167 N 1.00 0.56 0.24 4.83 0.00 -0.97 -4.93 105.19 105.92 2q2a n GLY 167 Ca 0.14 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.21 2q2a n GLY 167 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2q2a h GLY 168 N 0.00 0.05 -3.91 -0.02 0.00 -1.14 -3.43 103.07 94.62 2q2a h GLY 168 Ca 0.00 -0.03 -0.34 0.00 0.00 0.00 0.00 47.33 46.96 2q2a h GLY 168 CO 0.00 0.03 -0.74 -1.34 0.00 0.00 0.00 176.54 174.48 2q2a s VAL 169 N -4.80 0.97 -0.16 4.60 -7.23 -0.80 -4.98 120.40 108.01 2q2a s VAL 169 Ca -0.05 -1.54 0.16 0.00 -1.81 0.00 0.00 61.98 58.74 2q2a s VAL 169 Cb 0.16 -1.26 0.02 0.00 0.56 0.00 0.00 36.38 35.86 2q2a s VAL 169 CO 0.70 -0.47 1.28 0.44 -0.31 0.00 0.00 175.10 176.74 2q2a h ASP 170 N 3.77 0.00 -5.01 4.85 3.32 -1.17 -3.41 116.42 118.77 2q2a h ASP 170 Ca -0.38 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.65 2q2a h ASP 170 Cb 1.19 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.63 2q2a h ASP 170 CO 0.49 0.49 0.19 0.00 -1.72 0.00 0.00 179.24 178.69 2q2a s ALA 171 N -2.97 -1.50 -0.03 3.45 0.00 -1.08 -4.65 121.76 114.97 2q2a s ALA 171 Ca 0.02 0.37 0.06 0.00 0.00 0.00 0.00 51.96 52.41 2q2a s ALA 171 Cb 0.08 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 24.06 2q2a s ALA 171 CO 0.76 -0.78 -0.23 0.08 0.00 0.00 0.00 175.76 175.59 2q2a s VAL 172 N -3.77 1.84 -0.29 0.00 1.01 -0.49 0.03 120.40 118.74 2q2a s VAL 172 Ca 0.02 -0.98 -0.08 0.00 0.00 0.00 0.00 61.98 60.95 2q2a s VAL 172 Cb -0.01 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 2q2a s VAL 172 CO -0.11 0.52 0.11 -0.63 0.00 0.00 0.00 175.10 174.99 2q2a s ILE 173 N -0.34 4.30 0.29 2.22 1.01 -0.96 -0.20 121.20 127.52 2q2a s ILE 173 Ca 0.03 -0.47 -0.00 0.00 0.00 0.00 0.00 60.65 60.21 2q2a s ILE 173 Cb -0.11 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.20 2q2a s ILE 173 CO 0.01 0.13 0.39 1.07 0.00 0.00 0.00 174.94 176.54 2q2a n THR 174 N 4.93 0.00 -2.50 2.92 5.66 -1.01 -4.63 114.28 119.65 2q2a n THR 174 Ca -0.15 -1.60 -0.37 0.00 -3.05 0.00 0.00 64.05 58.88 2q2a n THR 174 Cb 0.49 0.95 -0.04 0.00 -1.55 0.00 0.00 70.33 70.18 2q2a n THR 174 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2q2a s ASP 175 N -2.86 6.82 0.21 1.09 1.11 -1.26 -0.39 116.67 121.38 2q2a s ASP 175 Ca 0.26 2.12 -0.10 0.00 0.18 0.00 0.00 52.55 55.01 2q2a s ASP 175 Cb -0.00 -2.60 0.15 0.00 1.07 0.00 0.00 42.92 41.54 2q2a s ASP 175 CO 0.19 -0.45 1.87 -0.55 1.18 0.00 0.00 175.17 177.40 2q2a h ASN 176 N 2.77 0.86 0.37 0.27 -1.07 -1.36 -1.43 115.58 115.99 2q2a h ASN 176 Ca -0.48 -0.04 -0.10 0.00 0.07 0.00 0.00 56.30 55.75 2q2a h ASN 176 Cb 1.22 -0.22 -0.01 0.00 -2.07 0.00 0.00 38.32 37.24 2q2a h ASN 176 CO 0.63 0.64 -0.45 0.00 0.07 0.00 0.00 177.43 178.32 2q2a h ALA 177 N 1.26 1.18 -0.12 4.14 0.00 -1.93 0.99 119.26 124.78 2q2a h ALA 177 Ca 0.27 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 2q2a h ALA 177 Cb -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2q2a h ALA 177 CO -0.06 0.59 -0.28 0.28 0.00 0.00 0.00 179.25 179.77 2q2a h VAL 178 N 0.08 1.38 -0.37 0.00 2.07 -1.66 -0.94 116.25 116.80 2q2a h VAL 178 Ca 0.00 -1.58 -0.03 0.00 0.82 0.00 0.00 66.70 65.91 2q2a h VAL 178 Cb 0.82 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 2q2a h VAL 178 CO 0.06 0.46 0.11 0.00 0.02 0.00 0.00 177.57 178.23 2q2a h ALA 179 N 0.52 0.49 -0.36 1.67 0.00 -1.06 -1.20 119.26 119.32 2q2a h ALA 179 Ca -0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2q2a h ALA 179 Cb 0.89 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2q2a h ALA 179 CO 0.06 0.14 0.22 -0.91 0.00 0.00 0.00 179.25 178.76 2q2a h ASN 180 N 0.46 0.43 -0.73 0.00 2.35 -0.85 -2.06 115.58 115.18 2q2a h ASN 180 Ca 0.12 -0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.76 2q2a h ASN 180 Cb 0.26 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 2q2a h ASN 180 CO -0.00 0.35 0.20 -0.08 -1.65 0.00 0.00 177.43 176.24 2q2a h GLU 181 N 0.47 1.16 -0.06 0.81 4.57 -1.09 -1.23 114.58 119.20 2q2a h GLU 181 Ca 0.13 -0.27 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 2q2a h GLU 181 Cb -0.01 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 28.42 2q2a h GLU 181 CO -0.03 1.00 0.04 -0.92 -1.18 0.00 0.00 179.01 177.93 2q2a h TYR 182 N 1.10 0.08 -0.06 0.92 3.20 -0.99 -0.50 116.97 120.72 2q2a h TYR 182 Ca 0.23 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.10 2q2a h TYR 182 Cb 0.35 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 2q2a h TYR 182 CO 0.03 0.08 0.04 0.28 -1.64 0.00 0.00 178.16 176.95 2q2a h VAL 183 N 0.06 1.03 -0.93 1.81 2.07 -1.25 -0.54 116.25 118.50 2q2a h VAL 183 Ca 0.02 -0.07 0.07 0.00 0.82 0.00 0.00 66.70 67.55 2q2a h VAL 183 Cb 0.02 0.96 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 2q2a h VAL 183 CO -0.00 0.03 0.58 0.50 0.02 0.00 0.00 177.57 178.69 2q2a h LYS 184 N 0.07 1.00 0.00 1.57 1.63 -1.09 -2.45 116.57 117.30 2q2a h LYS 184 Ca 0.02 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2q2a h LYS 184 Cb 0.01 -0.23 0.00 0.00 -0.60 0.00 0.00 32.23 31.41 2q2a h LYS 184 CO -0.00 0.66 -0.26 0.09 -3.45 0.00 0.00 179.45 176.48 2q2a n ASN 185 N -4.59 0.30 -3.15 4.20 3.02 -0.21 -4.43 115.26 110.40 2q2a n ASN 185 Ca 0.14 0.15 -0.21 0.00 -0.03 0.00 0.00 54.58 54.64 2q2a n ASN 185 Cb 0.21 -0.14 -0.04 0.00 -0.61 0.00 0.00 39.78 39.20 2q2a n ASN 185 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2q2a n ASN 186 N -1.58 1.59 0.07 6.41 4.13 -0.23 -4.93 115.26 120.71 2q2a n ASN 186 Ca 0.06 -3.12 0.03 0.00 1.68 0.00 0.00 54.58 53.23 2q2a n ASN 186 Cb 0.35 -0.61 0.42 0.00 -1.54 0.00 0.00 39.78 38.40 2q2a n ASN 186 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2q2a h PRO 187 N 3.15 0.39 0.00 3.52 0.13 -1.76 -1.78 132.00 135.64 2q2a h PRO 187 Ca 0.11 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2q2a h PRO 187 Cb 0.85 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2q2a h PRO 187 CO 0.57 0.35 0.00 0.09 -0.23 0.00 0.00 178.00 178.78 2q2a n ASN 188 N -4.40 0.57 0.03 1.44 3.02 -1.26 -1.58 115.26 113.08 2q2a n ASN 188 Ca 0.01 0.69 0.13 0.00 -0.03 0.00 0.00 54.58 55.38 2q2a n ASN 188 Cb 0.15 -0.79 0.36 0.00 -0.61 0.00 0.00 39.78 38.88 2q2a n ASN 188 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2q2a n LYS 189 N -2.19 0.10 -3.65 3.52 4.76 -0.67 -4.97 118.16 115.06 2q2a n LYS 189 Ca 0.01 0.04 -0.21 0.00 -2.87 0.00 0.00 58.31 55.28 2q2a n LYS 189 Cb 0.13 -1.58 0.04 0.00 -1.84 0.00 0.00 35.03 31.79 2q2a n LYS 189 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2q2a n LYS 190 N -1.73 -5.00 -3.50 1.97 5.02 -0.61 -4.86 118.16 109.45 2q2a n LYS 190 Ca 0.05 0.65 -0.20 0.00 -2.02 0.00 0.00 58.31 56.80 2q2a n LYS 190 Cb 0.37 -5.27 -0.02 0.00 -0.02 0.00 0.00 35.03 30.09 2q2a n LYS 190 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2q2a s LEU 191 N -6.59 3.58 0.05 -0.35 1.43 -1.26 -0.20 118.68 115.33 2q2a s LEU 191 Ca 0.02 -0.54 -0.13 0.00 -1.03 0.00 0.00 54.13 52.45 2q2a s LEU 191 Cb -0.01 -2.31 0.02 0.00 0.03 0.00 0.00 46.19 43.92 2q2a s LEU 191 CO 0.80 -0.57 0.30 0.00 0.23 0.00 0.00 176.35 177.11 2q2a s GLN 192 N -4.14 0.82 -0.19 1.70 -2.07 0.08 -4.63 119.66 111.23 2q2a s GLN 192 Ca 0.47 -0.55 -0.06 0.00 -1.82 0.00 0.00 55.36 53.40 2q2a s GLN 192 Cb -0.06 0.35 -0.03 0.00 -1.09 0.00 0.00 33.01 32.18 2q2a s GLN 192 CO 0.29 -0.27 0.02 0.08 -1.32 0.00 0.00 175.29 174.10 2q2a s VAL 193 N -2.71 4.28 -0.29 3.63 1.01 -1.26 -1.60 120.40 123.47 2q2a s VAL 193 Ca -0.04 -0.21 -0.07 0.00 0.00 0.00 0.00 61.98 61.67 2q2a s VAL 193 Cb -0.00 -2.93 0.00 0.00 0.00 0.00 0.00 36.38 33.44 2q2a s VAL 193 CO -0.04 0.44 0.08 -0.63 0.00 0.00 0.00 175.10 174.95 2q2a s ILE 194 N 0.73 4.08 0.08 2.22 -1.09 0.13 -4.97 121.20 122.38 2q2a s ILE 194 Ca 0.01 -0.57 -0.08 0.00 -2.23 0.00 0.00 60.65 57.78 2q2a s ILE 194 Cb -0.14 -3.06 -0.06 0.00 -1.58 0.00 0.00 42.46 37.63 2q2a s ILE 194 CO 0.02 0.13 0.38 -1.61 -1.23 0.00 0.00 174.94 172.63 2q2a s GLU 195 N 1.53 3.71 -0.41 2.79 2.02 -1.26 -1.09 118.70 125.99 2q2a s GLU 195 Ca 0.04 0.09 0.05 0.00 0.02 0.00 0.00 54.97 55.16 2q2a s GLU 195 Cb -0.17 -2.98 0.19 0.00 0.10 0.00 0.00 34.13 31.28 2q2a s GLU 195 CO 0.03 0.55 0.39 -3.47 0.02 0.00 0.00 175.26 172.78 2q2a n ASP 196 N 0.77 -0.28 0.29 -0.19 -0.08 -1.26 -4.90 116.55 110.90 2q2a n ASP 196 Ca -0.07 -2.46 0.16 0.00 -1.51 0.00 0.00 54.79 50.91 2q2a n ASP 196 Cb 0.52 -0.58 0.85 0.00 2.34 0.00 0.00 41.12 44.26 2q2a n ASP 196 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2q2a h PRO 197 N 5.21 0.00 -0.32 -0.67 0.13 -1.94 -0.72 132.00 133.69 2q2a h PRO 197 Ca 0.22 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.24 2q2a h PRO 197 Cb 0.90 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 2q2a h PRO 197 CO 0.40 0.06 -0.24 -0.22 -0.23 0.00 0.00 178.00 177.77 2q2a h LYS 198 N 0.00 0.64 0.09 0.86 1.63 -2.02 -3.34 116.57 114.43 2q2a h LYS 198 Ca -0.00 -0.25 -0.34 0.00 -0.85 0.00 0.00 60.65 59.21 2q2a h LYS 198 Cb 0.27 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.84 2q2a h LYS 198 CO 0.01 0.82 -1.87 -0.97 -3.45 0.00 0.00 179.45 174.00 2q2a h ASN 199 N 0.56 0.31 -2.77 4.20 -0.73 -1.76 -3.48 115.58 111.91 2q2a h ASN 199 Ca 0.08 -0.65 -0.65 0.00 1.87 0.00 0.00 56.30 56.95 2q2a h ASN 199 Cb 0.71 -0.10 -0.06 0.00 0.27 0.00 0.00 38.32 39.14 2q2a h ASN 199 CO 0.05 1.58 -0.44 -0.36 -0.37 0.00 0.00 177.43 177.90 2q2a s PHE 200 N -2.58 3.59 0.51 0.67 0.08 -0.36 -5.09 117.98 114.80 2q2a s PHE 200 Ca -0.16 0.53 -0.18 0.00 0.12 0.00 0.00 56.93 57.24 2q2a s PHE 200 Cb 0.07 -1.95 -0.08 0.00 -0.57 0.00 0.00 43.02 40.49 2q2a s PHE 200 CO 0.80 0.68 0.99 0.00 -0.10 0.00 0.00 175.22 177.58 2q2a s ALA 201 N -1.18 3.01 0.24 5.36 0.00 -1.26 -4.75 121.76 123.18 2q2a s ALA 201 Ca 0.22 0.27 -0.30 0.00 0.00 0.00 0.00 51.96 52.15 2q2a s ALA 201 Cb -0.13 -3.15 -0.09 0.00 0.00 0.00 0.00 23.12 19.75 2q2a s ALA 201 CO 0.11 -0.24 1.29 -1.12 0.00 0.00 0.00 175.76 175.81 2q2a s SER 202 N -2.80 6.89 -0.00 0.00 0.01 -1.26 -4.43 113.70 112.10 2q2a s SER 202 Ca 0.61 2.48 0.06 0.00 1.31 0.00 0.00 55.95 60.40 2q2a s SER 202 Cb -0.11 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.48 2q2a s SER 202 CO 0.28 -0.50 -0.17 -1.61 0.41 0.00 0.00 173.24 171.65 2q2a s GLU 203 N -0.70 1.35 -0.06 12.44 2.02 -0.43 -5.01 118.70 128.31 2q2a s GLU 203 Ca 0.54 -0.67 0.05 0.00 0.02 0.00 0.00 54.97 54.90 2q2a s GLU 203 Cb -0.37 -1.33 -0.00 0.00 0.10 0.00 0.00 34.13 32.52 2q2a s GLU 203 CO 0.43 0.36 -0.20 0.71 0.02 0.00 0.00 175.26 176.58 2q2a s TYR 204 N -0.49 2.00 0.24 1.61 2.02 -1.26 -0.53 117.35 120.93 2q2a s TYR 204 Ca 0.06 -0.64 -0.18 0.00 -0.37 0.00 0.00 57.07 55.94 2q2a s TYR 204 Cb -0.07 -1.34 -0.08 0.00 -0.40 0.00 0.00 41.96 40.07 2q2a s TYR 204 CO -0.00 -0.23 0.71 0.71 -1.57 0.00 0.00 175.55 175.17 2q2a s TYR 205 N 0.09 3.59 0.05 2.71 2.02 -0.00 -0.59 117.35 125.22 2q2a s TYR 205 Ca -0.07 1.33 -0.02 0.00 -0.37 0.00 0.00 57.07 57.93 2q2a s TYR 205 Cb -0.13 -2.58 -0.03 0.00 -0.40 0.00 0.00 41.96 38.81 2q2a s TYR 205 CO 0.04 0.30 0.01 0.20 -1.57 0.00 0.00 175.55 174.53 2q2a s GLY 206 N -1.78 0.35 0.50 0.71 0.00 -0.22 -0.77 107.32 106.12 2q2a s GLY 206 Ca 0.45 -0.97 -0.19 0.00 0.00 0.00 0.00 44.72 44.01 2q2a s GLY 206 CO 0.20 -1.08 1.04 1.06 0.00 0.00 0.00 173.10 174.32 2q2a s MET 207 N -3.38 3.74 0.10 2.90 -1.94 -1.26 -4.35 119.30 115.11 2q2a s MET 207 Ca 0.02 1.31 0.09 0.00 -1.71 0.00 0.00 55.69 55.40 2q2a s MET 207 Cb 0.04 -2.09 -0.04 0.00 2.01 0.00 0.00 34.83 34.75 2q2a s MET 207 CO -0.08 -0.47 -0.22 -1.50 -0.01 0.00 0.00 175.02 172.73 2q2a s ILE 208 N -2.08 1.83 0.03 2.53 2.07 -0.07 -0.47 121.20 125.04 2q2a s ILE 208 Ca 0.66 -1.57 -0.06 0.00 -1.41 0.00 0.00 60.65 58.27 2q2a s ILE 208 Cb -0.16 -1.65 -0.01 0.00 0.13 0.00 0.00 42.46 40.77 2q2a s ILE 208 CO 0.23 -0.01 0.11 -0.36 -1.91 0.00 0.00 174.94 173.00 2q2a s PHE 209 N -1.12 0.17 0.84 3.50 0.08 -0.20 -0.47 117.98 120.79 2q2a s PHE 209 Ca 0.08 -0.44 -0.12 0.00 0.12 0.00 0.00 56.93 56.57 2q2a s PHE 209 Cb -0.10 -0.12 0.11 0.00 -0.57 0.00 0.00 43.02 42.33 2q2a s PHE 209 CO 0.04 -0.36 1.18 -2.14 -0.10 0.00 0.00 175.22 173.84 2q2a s PRO 210 N -2.42 1.44 0.16 0.24 0.02 -1.26 -0.83 135.00 132.34 2q2a s PRO 210 Ca -0.07 1.64 -0.34 0.00 0.02 0.00 0.00 61.00 62.26 2q2a s PRO 210 Cb -0.02 -1.77 -0.16 0.00 0.02 0.00 0.00 34.50 32.58 2q2a s PRO 210 CO -0.04 -2.34 1.22 1.63 -0.33 0.00 0.00 177.00 177.14 2q2a n LYS 211 N -3.66 1.22 -2.92 5.54 4.76 -1.18 -2.49 118.16 119.44 2q2a n LYS 211 Ca 0.13 0.44 -0.22 0.00 -2.87 0.00 0.00 58.31 55.79 2q2a n LYS 211 Cb 0.51 -1.98 0.03 0.00 -1.84 0.00 0.00 35.03 31.76 2q2a n LYS 211 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2q2a n ASN 212 N 2.15 -6.00 -4.75 4.39 3.02 -1.26 -4.97 115.26 107.83 2q2a n ASN 212 Ca 0.16 -0.25 -0.41 0.00 -0.03 0.00 0.00 54.58 54.05 2q2a n ASN 212 Cb 0.24 -4.84 -0.03 0.00 -0.61 0.00 0.00 39.78 34.54 2q2a n ASN 212 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2q2a s SER 213 N -2.64 7.01 0.00 6.41 0.15 -1.04 -4.96 113.70 118.64 2q2a s SER 213 Ca 0.26 2.40 0.31 0.00 0.70 0.00 0.00 55.95 59.62 2q2a s SER 213 Cb -0.11 -2.62 1.76 0.00 -1.71 0.00 0.00 66.02 63.33 2q2a s SER 213 CO 0.32 -0.38 2.15 -0.62 1.20 0.00 0.00 173.24 175.90 2q2a n GLU 214 N 1.69 1.06 0.08 5.44 1.02 -1.26 -3.54 120.64 125.12 2q2a n GLU 214 Ca 0.02 -0.14 -0.04 0.00 -0.02 0.00 0.00 57.16 56.99 2q2a n GLU 214 Cb 0.43 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.29 2q2a n GLU 214 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2q2a h LEU 215 N 0.33 0.00 -0.17 -4.62 3.38 -1.94 -3.40 115.31 108.88 2q2a h LEU 215 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 2q2a h LEU 215 Cb 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.78 2q2a h LEU 215 CO 0.00 0.80 -0.22 0.50 0.09 0.00 0.00 178.44 179.62 2q2a h LYS 216 N 0.00 -0.24 -0.66 1.13 3.64 -1.98 0.19 116.57 118.65 2q2a h LYS 216 Ca -0.05 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 2q2a h LYS 216 Cb 1.65 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 33.50 2q2a h LYS 216 CO 0.10 -0.16 0.33 0.00 -2.27 0.00 0.00 179.45 177.44 2q2a h ALA 217 N 0.77 0.85 -0.73 5.00 0.00 -1.82 -0.43 119.26 122.89 2q2a h ALA 217 Ca 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2q2a h ALA 217 Cb 0.42 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2q2a h ALA 217 CO -0.32 0.40 0.40 0.87 0.00 0.00 0.00 179.25 180.60 2q2a h LYS 218 N 0.91 1.01 -0.46 0.00 1.57 -1.64 -2.12 116.57 115.85 2q2a h LYS 218 Ca 0.23 -0.12 -0.11 0.00 -1.87 0.00 0.00 60.65 58.78 2q2a h LYS 218 Cb 0.10 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 2q2a h LYS 218 CO -0.03 0.76 -0.16 0.28 -0.57 0.00 0.00 179.45 179.73 2q2a h VAL 219 N 1.00 1.27 -0.68 0.50 2.07 0.04 -1.34 116.25 119.11 2q2a h VAL 219 Ca 0.26 -1.28 -0.08 0.00 0.82 0.00 0.00 66.70 66.41 2q2a h VAL 219 Cb 0.04 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 2q2a h VAL 219 CO -0.04 0.44 0.12 0.44 0.02 0.00 0.00 177.57 178.55 2q2a h ASP 220 N 0.78 1.07 -0.35 0.57 3.32 -0.89 0.24 116.42 121.15 2q2a h ASP 220 Ca 0.12 -0.25 -0.09 0.00 0.02 0.00 0.00 57.03 56.83 2q2a h ASP 220 Cb 0.69 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2q2a h ASP 220 CO 0.05 1.05 -0.12 -0.08 -1.72 0.00 0.00 179.24 178.42 2q2a h GLU 221 N 1.05 0.70 -0.68 3.56 4.57 -1.30 -2.21 114.58 120.27 2q2a h GLU 221 Ca 0.21 -0.28 -0.04 0.00 -1.18 0.00 0.00 59.36 58.06 2q2a h GLU 221 Cb 0.43 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 2q2a h GLU 221 CO 0.01 0.88 0.27 0.00 -1.18 0.00 0.00 179.01 178.99 2q2a h ALA 222 N 0.81 0.89 -0.40 2.92 0.00 -0.91 -1.03 119.26 121.54 2q2a h ALA 222 Ca 0.09 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2q2a h ALA 222 Cb 0.64 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2q2a h ALA 222 CO 0.04 0.52 0.24 1.25 0.00 0.00 0.00 179.25 181.29 2q2a h LEU 223 N 0.97 0.39 -0.37 0.00 5.85 -0.43 -0.11 115.31 121.61 2q2a h LEU 223 Ca 0.23 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.98 2q2a h LEU 223 Cb 0.22 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 2q2a h LEU 223 CO -0.02 0.28 0.17 0.11 -0.34 0.00 0.00 178.44 178.64 2q2a h LYS 224 N 0.48 0.33 -0.42 1.25 1.57 -1.23 -0.84 116.57 117.71 2q2a h LYS 224 Ca 0.16 -0.02 0.08 0.00 -1.87 0.00 0.00 60.65 59.00 2q2a h LYS 224 Cb 0.00 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 32.15 2q2a h LYS 224 CO -0.07 0.22 -0.13 -0.97 -0.57 0.00 0.00 179.45 177.93 2q2a h ASN 225 N 0.34 -0.47 -0.65 0.86 -0.73 -0.72 0.17 115.58 114.38 2q2a h ASN 225 Ca 0.16 0.13 -0.05 0.00 1.87 0.00 0.00 56.30 58.42 2q2a h ASN 225 Cb 0.10 0.29 -0.03 0.00 0.27 0.00 0.00 38.32 38.95 2q2a h ASN 225 CO -0.13 -0.17 0.21 0.58 -0.37 0.00 0.00 177.43 177.56 2q2a h VAL 226 N -0.04 1.25 0.01 2.57 2.07 -0.78 -1.15 116.25 120.17 2q2a h VAL 226 Ca 0.20 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 2q2a h VAL 226 Cb 0.35 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2q2a h VAL 226 CO -0.45 0.32 -0.00 0.40 0.02 0.00 0.00 177.57 177.86 2q2a h ILE 227 N 0.93 1.21 -0.27 4.57 2.04 -0.81 -1.61 117.51 123.57 2q2a h ILE 227 Ca 0.21 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.41 2q2a h ILE 227 Cb 0.28 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 2q2a h ILE 227 CO -0.01 0.17 0.18 0.78 0.00 0.00 0.00 178.15 179.27 2q2a h ASN 228 N -0.30 0.32 1.16 1.72 2.35 -0.52 -2.71 115.58 117.60 2q2a h ASN 228 Ca -0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2q2a h ASN 228 Cb 0.29 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.58 2q2a h ASN 228 CO 0.00 0.23 -0.06 -1.54 -1.65 0.00 0.00 177.43 174.41 2q2a n SER 229 N -4.49 0.40 0.00 5.81 3.41 -0.45 -4.90 113.62 113.39 2q2a n SER 229 Ca 0.01 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 2q2a n SER 229 Cb 0.07 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 2q2a n SER 229 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q2a n GLY 230 N 1.41 0.81 0.13 5.00 0.00 -1.02 -4.98 105.19 106.55 2q2a n GLY 230 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 2q2a n GLY 230 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2q2a h LYS 231 N 3.90 0.35 -0.66 1.61 1.63 -1.62 -1.25 116.57 120.53 2q2a h LYS 231 Ca 0.00 -0.14 0.14 0.00 -0.85 0.00 0.00 60.65 59.80 2q2a h LYS 231 Cb 0.00 -0.02 -0.11 0.00 -0.60 0.00 0.00 32.23 31.51 2q2a h LYS 231 CO 0.00 0.63 0.04 -0.92 -3.45 0.00 0.00 179.45 175.75 2q2a h TYR 232 N 0.05 0.03 -0.64 1.91 3.20 -1.59 -1.17 116.97 118.77 2q2a h TYR 232 Ca 0.04 0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.89 2q2a h TYR 232 Cb 0.51 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.84 2q2a h TYR 232 CO 0.06 -0.15 0.13 1.15 -1.64 0.00 0.00 178.16 177.71 2q2a h THR 233 N 0.15 1.25 -0.06 1.81 2.02 -1.75 0.31 112.91 116.65 2q2a h THR 233 Ca 0.35 -0.95 0.02 0.00 0.77 0.00 0.00 66.41 66.60 2q2a h THR 233 Cb 0.58 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2q2a h THR 233 CO -0.54 0.36 -0.07 -0.33 0.37 0.00 0.00 175.52 175.31 2q2a h GLU 234 N 0.97 -0.10 -0.45 6.66 5.08 -0.58 -0.47 114.58 125.68 2q2a h GLU 234 Ca 0.20 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.56 2q2a h GLU 234 Cb 0.38 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 2q2a h GLU 234 CO 0.01 -0.06 0.24 0.82 -1.00 0.00 0.00 179.01 179.01 2q2a h ILE 235 N -0.10 1.17 -0.36 3.13 2.04 -0.87 -1.60 117.51 120.93 2q2a h ILE 235 Ca 0.05 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 2q2a h ILE 235 Cb 0.17 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 2q2a h ILE 235 CO -0.12 0.18 0.21 0.22 0.00 0.00 0.00 178.15 178.64 2q2a h TYR 236 N 0.59 0.48 -0.84 1.37 3.20 -0.76 -1.91 116.97 119.10 2q2a h TYR 236 Ca 0.16 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 2q2a h TYR 236 Cb 0.08 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 2q2a h TYR 236 CO -0.02 0.36 0.40 0.87 -1.64 0.00 0.00 178.16 178.14 2q2a h LYS 237 N 0.46 1.21 -0.74 1.82 1.57 -1.01 0.46 116.57 120.35 2q2a h LYS 237 Ca 0.13 -0.18 0.06 0.00 -1.87 0.00 0.00 60.65 58.79 2q2a h LYS 237 Cb 0.03 -0.22 -0.06 0.00 0.08 0.00 0.00 32.23 32.06 2q2a h LYS 237 CO -0.02 0.94 0.43 -0.22 -0.57 0.00 0.00 179.45 180.00 2q2a h LYS 238 N 1.20 0.76 0.00 3.15 3.64 -0.85 0.20 116.57 124.68 2q2a h LYS 238 Ca 0.29 -0.05 -0.26 0.00 -1.27 0.00 0.00 60.65 59.36 2q2a h LYS 238 Cb 0.12 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 31.73 2q2a h LYS 238 CO -0.04 0.51 -1.65 0.91 -2.27 0.00 0.00 179.45 176.91 2q2a n TRP 239 N -4.73 0.97 0.12 1.91 7.02 -0.76 -4.55 117.44 117.42 2q2a n TRP 239 Ca 0.10 0.35 0.01 0.00 -1.02 0.00 0.00 57.50 56.94 2q2a n TRP 239 Cb 0.17 -1.16 -0.01 0.00 -2.42 0.00 0.00 31.31 27.90 2q2a n TRP 239 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 2q2a n PHE 240 N -3.00 0.00 -1.00 -5.99 3.72 0.16 -5.03 117.46 106.31 2q2a n PHE 240 Ca -0.15 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.25 2q2a n PHE 240 Cb 1.00 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.54 2q2a n PHE 240 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2q2a n GLY 241 N 0.75 0.28 3.24 1.37 0.00 0.06 -4.97 105.19 105.92 2q2a n GLY 241 Ca 0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2q2a n GLY 241 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q2a s LYS 242 N -0.98 0.94 0.37 1.61 -2.85 -1.26 -5.04 119.74 112.53 2q2a s LYS 242 Ca 0.00 -1.08 -0.27 0.00 -1.00 0.00 0.00 55.97 53.62 2q2a s LYS 242 Cb 0.00 0.34 -0.09 0.00 -2.06 0.00 0.00 37.83 36.02 2q2a s LYS 242 CO 0.00 -0.31 1.23 -1.21 0.10 0.00 0.00 175.35 175.16 2q2a s GLU 243 N -3.91 4.17 0.62 1.78 0.41 -1.26 -4.12 118.70 116.39 2q2a s GLU 243 Ca 0.11 2.01 -0.14 0.00 -0.41 0.00 0.00 54.97 56.53 2q2a s GLU 243 Cb 0.05 -2.85 -0.02 0.00 -1.78 0.00 0.00 34.13 29.52 2q2a s GLU 243 CO -0.06 -0.27 1.05 -1.25 -0.49 0.00 0.00 175.26 174.24 2q2a s PRO 244 N -2.06 3.25 -0.68 0.39 0.04 -1.26 -5.02 135.00 129.66 2q2a s PRO 244 Ca 0.54 1.09 -0.15 0.00 0.04 0.00 0.00 61.00 62.52 2q2a s PRO 244 Cb -0.35 -2.03 0.17 0.00 0.04 0.00 0.00 34.50 32.33 2q2a s PRO 244 CO 0.45 -0.86 0.63 0.15 0.04 0.00 0.00 177.00 177.41 2q2a s LYS 245 N -4.42 3.28 0.39 4.56 1.02 -1.26 -4.93 119.74 118.38 2q2a s LYS 245 Ca 0.61 -2.05 0.28 0.00 0.02 0.00 0.00 55.97 54.83 2q2a s LYS 245 Cb -0.15 -4.36 1.28 0.00 -0.52 0.00 0.00 37.83 34.08 2q2a s LYS 245 CO 0.43 -1.32 1.85 -0.07 -0.92 0.00 0.00 175.35 175.32 2q2a h LEU 246 N 8.40 0.00 -1.33 3.17 3.38 -2.03 -1.83 115.31 125.08 2q2a h LEU 246 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2q2a h LEU 246 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2q2a h LEU 246 CO 0.91 0.00 0.00 -2.24 0.09 0.00 0.00 178.44 177.20 2q2a h ASP 247 N 0.00 0.00 0.35 -0.43 3.04 -2.01 -0.46 116.42 116.91 2q2a h ASP 247 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 2q2a h ASP 247 Cb 0.29 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.58 2q2a h ASP 247 CO 0.00 0.00 0.00 0.03 -2.04 0.00 0.00 179.24 177.23 2q2a h ARG 248 N 0.00 0.00 -0.20 4.15 3.08 -1.76 -3.00 114.38 116.65 2q2a h ARG 248 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2q2a h ARG 248 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2q2a h ARG 248 CO 0.00 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 2q2a n LEU 249 N -2.75 2.71 -0.07 3.04 4.77 -0.18 -4.00 117.00 120.51 2q2a n LEU 249 Ca -0.01 -1.07 0.08 0.00 -0.03 0.00 0.00 56.01 54.99 2q2a n LEU 249 Cb 0.14 -0.12 0.12 0.00 -2.33 0.00 0.00 43.42 41.22 2q2a n LEU 249 CO 0.19 0.53 0.55 0.29 -1.33 0.00 0.00 177.39 177.62 2q2a n LYS 250 N 1.04 1.48 0.00 3.23 4.76 -1.13 -4.69 118.16 122.84 2q2a n LYS 250 Ca 0.17 -2.39 0.09 0.00 -2.87 0.00 0.00 58.31 53.32 2q2a n LYS 250 Cb 0.51 -1.41 0.56 0.00 -1.84 0.00 0.00 35.03 32.86 2q2a n LYS 250 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07