#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aw2 s HIS 3 N 0.00 3.50 0.50 -1.55 5.65 -1.26 -5.00 115.29 117.12 1aw2 s HIS 3 Ca 0.00 1.51 -0.21 0.00 0.25 0.00 0.00 55.06 56.61 1aw2 s HIS 3 Cb 0.00 -3.25 -0.07 0.00 -1.18 0.00 0.00 32.58 28.08 1aw2 s HIS 3 CO 0.00 -0.55 1.14 -1.25 -0.65 0.00 0.00 174.74 173.42 1aw2 s PRO 4 N 1.45 3.59 -0.11 2.88 0.04 -1.26 -4.91 135.00 136.69 1aw2 s PRO 4 Ca 0.53 1.66 0.01 0.00 0.04 0.00 0.00 61.00 63.25 1aw2 s PRO 4 Cb -0.23 -2.21 0.02 0.00 0.04 0.00 0.00 34.50 32.12 1aw2 s PRO 4 CO 0.25 -0.66 -0.12 0.08 0.04 0.00 0.00 177.00 176.59 1aw2 s VAL 5 N -1.68 1.29 -0.23 -0.36 1.01 -0.72 -0.93 120.40 118.78 1aw2 s VAL 5 Ca 0.68 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 1aw2 s VAL 5 Cb -0.25 -1.23 0.03 0.00 0.00 0.00 0.00 36.38 34.93 1aw2 s VAL 5 CO 0.30 0.41 -0.09 -0.69 0.00 0.00 0.00 175.10 175.02 1aw2 s VAL 6 N 1.27 2.67 -0.11 2.92 1.01 -0.45 -2.23 120.40 125.48 1aw2 s VAL 6 Ca -0.02 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 60.93 1aw2 s VAL 6 Cb -0.14 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 1aw2 s VAL 6 CO -0.05 0.25 -0.16 -0.32 0.00 0.00 0.00 175.10 174.82 1aw2 s MET 7 N 1.30 3.17 -0.32 2.72 1.75 -0.41 -1.27 119.30 126.24 1aw2 s MET 7 Ca 0.00 -0.74 -0.15 0.00 -1.25 0.00 0.00 55.69 53.56 1aw2 s MET 7 Cb -0.16 -2.51 -0.02 0.00 2.84 0.00 0.00 34.83 34.98 1aw2 s MET 7 CO -0.06 0.26 0.35 0.20 -0.65 0.00 0.00 175.02 175.12 1aw2 s GLY 8 N 0.20 1.90 -0.45 2.11 0.00 -0.76 0.68 107.32 110.99 1aw2 s GLY 8 Ca -0.10 -1.10 -0.20 0.00 0.00 0.00 0.00 44.72 43.32 1aw2 s GLY 8 CO 0.06 0.97 0.62 0.21 0.00 0.00 0.00 173.10 174.96 1aw2 s ASN 9 N 1.72 6.29 0.00 1.64 2.47 0.20 -1.65 114.94 125.61 1aw2 s ASN 9 Ca 0.12 -0.48 0.26 0.00 0.42 0.00 0.00 52.86 53.18 1aw2 s ASN 9 Cb -0.16 -2.31 1.25 0.00 -1.45 0.00 0.00 41.25 38.58 1aw2 s ASN 9 CO 0.11 -0.79 1.86 0.79 -3.72 0.00 0.00 177.10 175.35 1aw2 n TRP 10 N 6.20 0.00 -2.11 0.43 7.02 -1.08 -4.37 117.44 123.54 1aw2 n TRP 10 Ca -0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.45 1aw2 n TRP 10 Cb 0.47 -0.34 0.00 0.00 -2.42 0.00 0.00 31.31 29.02 1aw2 n TRP 10 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1aw2 n LYS 11 N -1.34 0.00 -1.44 -0.99 5.02 -1.26 -2.67 118.16 115.48 1aw2 n LYS 11 Ca 0.11 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 56.00 1aw2 n LYS 11 Cb 0.23 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.22 1aw2 n LYS 11 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1aw2 n LEU 12 N 0.00 8.19 -3.84 -0.35 7.94 -1.26 -4.42 117.00 123.26 1aw2 n LEU 12 Ca 0.00 -4.30 -0.14 0.00 -1.11 0.00 0.00 56.01 50.47 1aw2 n LEU 12 Cb 0.00 -1.59 -0.15 0.00 0.53 0.00 0.00 43.42 42.21 1aw2 n LEU 12 CO 0.00 1.78 -0.36 0.20 -1.11 0.00 0.00 177.39 177.90 1aw2 s ASN 13 N 2.49 0.10 0.00 1.96 0.01 -1.09 -5.14 114.94 113.27 1aw2 s ASN 13 Ca 0.63 0.01 0.00 0.00 -0.71 0.00 0.00 52.86 52.78 1aw2 s ASN 13 Cb 0.17 -0.05 0.00 0.00 0.41 0.00 0.00 41.25 41.78 1aw2 s ASN 13 CO -0.07 -0.05 0.00 0.61 -1.51 0.00 0.00 177.10 176.08 1aw2 n GLY 14 N 3.56 3.41 3.55 0.66 0.00 -1.26 -4.41 105.19 110.69 1aw2 n GLY 14 Ca -0.19 -0.93 -0.07 0.00 0.00 0.00 0.00 46.02 44.83 1aw2 n GLY 14 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aw2 s SER 15 N 0.00 -0.28 0.17 1.61 0.15 -1.26 -4.99 113.70 109.10 1aw2 s SER 15 Ca 0.00 0.07 -0.14 0.00 0.70 0.00 0.00 55.95 56.58 1aw2 s SER 15 Cb 0.00 0.28 0.12 0.00 -1.71 0.00 0.00 66.02 64.70 1aw2 s SER 15 CO 0.00 -0.42 1.77 0.11 1.20 0.00 0.00 173.24 175.90 1aw2 h LYS 16 N 2.10 0.39 -0.32 5.44 1.57 -2.01 -0.62 116.57 123.12 1aw2 h LYS 16 Ca -0.17 -0.02 -0.17 0.00 -1.87 0.00 0.00 60.65 58.42 1aw2 h LYS 16 Cb 1.20 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.42 1aw2 h LYS 16 CO 0.28 0.26 -0.46 0.93 -0.57 0.00 0.00 179.45 179.88 1aw2 h GLU 17 N 0.40 0.85 -0.45 3.15 3.07 -2.01 -3.17 114.58 116.42 1aw2 h GLU 17 Ca 0.21 -0.49 -0.08 0.00 -0.50 0.00 0.00 59.36 58.50 1aw2 h GLU 17 Cb 0.16 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 1aw2 h GLU 17 CO -0.17 1.13 -0.02 1.98 -1.40 0.00 0.00 179.01 180.52 1aw2 h MET 18 N 0.68 0.82 -0.65 2.33 -1.53 -1.88 -2.28 114.93 112.42 1aw2 h MET 18 Ca 0.04 -0.27 0.06 0.00 -3.44 0.00 0.00 59.70 56.08 1aw2 h MET 18 Cb 1.05 -0.07 -0.05 0.00 -0.55 0.00 0.00 31.60 31.98 1aw2 h MET 18 CO 0.10 0.89 0.36 0.28 0.14 0.00 0.00 176.91 178.68 1aw2 h VAL 19 N 0.66 0.97 0.03 -5.77 2.07 -1.09 -0.21 116.25 112.92 1aw2 h VAL 19 Ca 0.13 -0.23 -0.23 0.00 0.82 0.00 0.00 66.70 67.19 1aw2 h VAL 19 Cb 0.53 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1aw2 h VAL 19 CO 0.03 0.12 -0.99 -0.37 0.02 0.00 0.00 177.57 176.37 1aw2 h VAL 20 N 0.67 1.46 -0.26 2.57 -1.51 -1.53 -2.27 116.25 115.38 1aw2 h VAL 20 Ca 0.29 -2.65 -0.02 0.00 -1.23 0.00 0.00 66.70 63.08 1aw2 h VAL 20 Cb 0.17 2.56 -0.01 0.00 -2.13 0.00 0.00 31.29 31.88 1aw2 h VAL 20 CO -0.18 0.78 0.08 0.44 -1.23 0.00 0.00 177.57 177.47 1aw2 h ASP 21 N 0.16 0.37 -0.22 4.19 3.32 -1.10 -1.92 116.42 121.22 1aw2 h ASP 21 Ca -0.08 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.77 1aw2 h ASP 21 Cb 1.65 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 41.09 1aw2 h ASP 21 CO 0.16 0.47 0.14 0.25 -1.72 0.00 0.00 179.24 178.55 1aw2 h LEU 22 N 0.25 0.23 -0.96 1.55 5.85 -1.06 -1.16 115.31 120.02 1aw2 h LEU 22 Ca 0.08 -0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 1aw2 h LEU 22 Cb 0.23 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1aw2 h LEU 22 CO -0.00 0.17 -0.38 -0.07 -0.34 0.00 0.00 178.44 177.82 1aw2 h LEU 23 N 0.28 0.28 -0.14 2.25 3.38 -1.41 -1.31 115.31 118.65 1aw2 h LEU 23 Ca 0.08 -0.11 -0.21 0.00 0.09 0.00 0.00 57.88 57.73 1aw2 h LEU 23 Cb -0.02 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.66 1aw2 h LEU 23 CO -0.03 0.64 -0.74 0.78 0.09 0.00 0.00 178.44 179.19 1aw2 h ASN 24 N 0.23 0.90 0.08 -0.43 -0.26 -1.06 -2.27 115.58 112.77 1aw2 h ASN 24 Ca 0.02 -0.63 -0.16 0.00 -0.56 0.00 0.00 56.30 54.97 1aw2 h ASN 24 Cb 0.78 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 37.77 1aw2 h ASN 24 CO 0.06 1.39 -0.58 1.23 -1.06 0.00 0.00 177.43 178.46 1aw2 h GLY 25 N 0.47 0.56 0.92 2.83 0.00 -1.18 -2.90 103.07 103.77 1aw2 h GLY 25 Ca -0.05 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.60 1aw2 h GLY 25 CO 0.15 0.61 0.07 -2.00 0.00 0.00 0.00 176.54 175.37 1aw2 h LEU 26 N 0.39 0.17 -1.98 3.11 5.85 -1.25 -1.10 115.31 120.50 1aw2 h LEU 26 Ca -0.00 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1aw2 h LEU 26 Cb 1.13 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 1aw2 h LEU 26 CO 0.11 0.23 -0.09 -1.13 -0.34 0.00 0.00 178.44 177.22 1aw2 h ASN 27 N 0.10 0.00 0.24 1.25 -1.24 -1.44 -2.12 115.58 112.36 1aw2 h ASN 27 Ca 0.05 0.00 -0.32 0.00 0.71 0.00 0.00 56.30 56.74 1aw2 h ASN 27 Cb 0.10 0.00 0.03 0.00 0.73 0.00 0.00 38.32 39.18 1aw2 h ASN 27 CO -0.01 0.09 -1.37 0.00 -1.29 0.00 0.00 177.43 174.85 1aw2 h ALA 28 N 1.91 -0.08 0.00 1.57 0.00 -1.19 -3.25 119.26 118.22 1aw2 h ALA 28 Ca -0.00 -0.83 -0.05 0.00 0.00 0.00 0.00 54.91 54.03 1aw2 h ALA 28 Cb 0.32 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1aw2 h ALA 28 CO 0.01 0.71 -0.25 0.93 0.00 0.00 0.00 179.25 180.66 1aw2 h GLU 29 N 0.19 0.00 -0.64 0.00 4.39 -0.60 -3.14 114.58 114.78 1aw2 h GLU 29 Ca -0.22 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.48 1aw2 h GLU 29 Cb 2.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.71 1aw2 h GLU 29 CO 0.26 0.25 0.00 1.28 -1.16 0.00 0.00 179.01 179.64 1aw2 n LEU 30 N -3.62 4.39 -0.37 1.33 4.77 -0.87 -4.71 117.00 117.91 1aw2 n LEU 30 Ca -0.01 -2.22 -0.02 0.00 -0.03 0.00 0.00 56.01 53.74 1aw2 n LEU 30 Cb 0.38 -0.56 0.03 0.00 -2.33 0.00 0.00 43.42 40.94 1aw2 n LEU 30 CO 0.34 0.73 0.55 1.21 -1.33 0.00 0.00 177.39 178.89 1aw2 n GLU 31 N 0.98 -0.25 0.00 3.23 2.13 -1.19 -1.45 120.64 124.10 1aw2 n GLU 31 Ca 0.23 1.47 0.11 0.00 0.66 0.00 0.00 57.16 59.64 1aw2 n GLU 31 Cb 0.83 -2.19 0.02 0.00 0.27 0.00 0.00 31.44 30.38 1aw2 n GLU 31 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1aw2 n GLY 32 N -1.43 -0.35 3.69 8.31 0.00 -1.26 -4.95 105.19 109.20 1aw2 n GLY 32 Ca 0.09 -0.59 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 1aw2 n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aw2 s VAL 33 N -2.63 2.89 0.00 1.61 1.01 -0.53 -4.90 120.40 117.85 1aw2 s VAL 33 Ca 0.16 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1aw2 s VAL 33 Cb 0.18 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1aw2 s VAL 33 CO 0.64 -0.00 0.00 0.35 0.00 0.00 0.00 175.10 176.09 1aw2 n THR 34 N 4.84 0.00 -1.22 3.92 -2.24 -1.26 -4.88 114.28 113.45 1aw2 n THR 34 Ca 0.17 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.75 1aw2 n THR 34 Cb 0.40 1.67 0.20 0.00 -2.10 0.00 0.00 70.33 70.50 1aw2 n THR 34 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1aw2 n GLY 35 N 0.00 4.41 3.33 3.38 0.00 -1.26 -4.88 105.19 110.16 1aw2 n GLY 35 Ca 0.00 -1.09 -0.14 0.00 0.00 0.00 0.00 46.02 44.80 1aw2 n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aw2 s VAL 36 N -3.25 0.01 -0.21 1.61 1.01 -1.26 -4.43 120.40 113.89 1aw2 s VAL 36 Ca 0.56 -0.11 -0.17 0.00 0.00 0.00 0.00 61.98 62.26 1aw2 s VAL 36 Cb 0.47 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 36.17 1aw2 s VAL 36 CO 0.11 -0.06 0.46 -1.81 0.00 0.00 0.00 175.10 173.79 1aw2 s ASP 37 N -0.23 6.49 -0.26 3.32 1.01 -0.10 -4.99 116.67 121.90 1aw2 s ASP 37 Ca -0.04 0.58 -0.06 0.00 0.71 0.00 0.00 52.55 53.74 1aw2 s ASP 37 Cb -0.03 -2.26 -0.00 0.00 1.01 0.00 0.00 42.92 41.63 1aw2 s ASP 37 CO 0.02 -0.14 0.04 -0.69 0.21 0.00 0.00 175.17 174.61 1aw2 s VAL 38 N 1.53 3.84 0.23 -1.27 1.01 -1.26 -1.35 120.40 123.14 1aw2 s VAL 38 Ca 0.21 -0.55 0.09 0.00 0.00 0.00 0.00 61.98 61.74 1aw2 s VAL 38 Cb -0.15 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 1aw2 s VAL 38 CO 0.09 0.23 -0.02 0.00 0.00 0.00 0.00 175.10 175.40 1aw2 s ALA 39 N 1.51 3.13 -0.01 5.51 0.00 -0.40 -0.34 121.76 131.16 1aw2 s ALA 39 Ca 0.04 -1.57 0.01 0.00 0.00 0.00 0.00 51.96 50.45 1aw2 s ALA 39 Cb -0.16 -0.81 -0.00 0.00 0.00 0.00 0.00 23.12 22.15 1aw2 s ALA 39 CO 0.01 0.34 -0.05 0.54 0.00 0.00 0.00 175.76 176.61 1aw2 s VAL 40 N -2.09 0.38 -0.40 0.00 0.11 0.37 -1.83 120.40 116.93 1aw2 s VAL 40 Ca 0.29 -0.19 0.02 0.00 -2.93 0.00 0.00 61.98 59.18 1aw2 s VAL 40 Cb -0.07 -0.33 0.12 0.00 -1.53 0.00 0.00 36.38 34.56 1aw2 s VAL 40 CO 0.19 0.11 0.16 0.00 -3.33 0.00 0.00 175.10 172.23 1aw2 s ALA 41 N -0.02 2.51 0.66 1.54 0.00 -0.66 -0.66 121.76 125.14 1aw2 s ALA 41 Ca 0.01 -2.54 -0.01 0.00 0.00 0.00 0.00 51.96 49.42 1aw2 s ALA 41 Cb -0.03 -1.92 0.09 0.00 0.00 0.00 0.00 23.12 21.26 1aw2 s ALA 41 CO -0.00 -1.86 0.92 -1.25 0.00 0.00 0.00 175.76 173.57 1aw2 s PRO 42 N 0.63 2.01 0.55 0.00 0.04 -1.26 -2.62 135.00 134.34 1aw2 s PRO 42 Ca 0.14 -0.94 -0.21 0.00 0.04 0.00 0.00 61.00 60.03 1aw2 s PRO 42 Cb -0.22 -2.37 -0.05 0.00 0.04 0.00 0.00 34.50 31.90 1aw2 s PRO 42 CO -0.08 -1.18 1.25 -2.14 0.04 0.00 0.00 177.00 174.89 1aw2 s PRO 43 N -5.02 3.22 0.33 0.56 0.02 -1.26 -4.33 135.00 128.52 1aw2 s PRO 43 Ca 0.63 1.95 0.12 0.00 0.02 0.00 0.00 61.00 63.71 1aw2 s PRO 43 Cb -0.07 -2.15 1.04 0.00 0.02 0.00 0.00 34.50 33.34 1aw2 s PRO 43 CO 0.42 -1.04 1.61 0.00 -0.33 0.00 0.00 177.00 177.66 1aw2 h ALA 44 N 1.35 1.75 -0.47 -1.55 0.00 -1.96 0.39 119.26 118.77 1aw2 h ALA 44 Ca -0.50 0.25 0.14 0.00 0.00 0.00 0.00 54.91 54.80 1aw2 h ALA 44 Cb 1.29 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 19.39 1aw2 h ALA 44 CO 0.57 -0.69 0.39 -0.07 0.00 0.00 0.00 179.25 179.46 1aw2 h LEU 45 N 0.13 0.00 -2.97 0.00 4.07 -2.03 -2.36 115.31 112.15 1aw2 h LEU 45 Ca 0.71 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.67 1aw2 h LEU 45 Cb 1.68 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.42 1aw2 h LEU 45 CO -0.74 0.00 0.00 0.49 -1.08 0.00 0.00 178.44 177.11 1aw2 n PHE 46 N -4.09 0.46 -0.19 1.13 3.72 0.14 -4.60 117.46 114.03 1aw2 n PHE 46 Ca 0.08 -0.59 -0.04 0.00 -0.05 0.00 0.00 57.45 56.85 1aw2 n PHE 46 Cb 0.60 -0.09 0.13 0.00 -0.94 0.00 0.00 39.48 39.18 1aw2 n PHE 46 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1aw2 h VAL 47 N 1.58 1.24 0.27 -4.37 2.07 -1.30 -0.42 116.25 115.33 1aw2 h VAL 47 Ca 0.00 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 1aw2 h VAL 47 Cb 0.83 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1aw2 h VAL 47 CO 0.04 0.33 -0.13 -0.78 0.02 0.00 0.00 177.57 177.05 1aw2 h ASP 48 N 0.94 -0.31 -0.80 0.57 1.82 -1.81 -1.48 116.42 115.36 1aw2 h ASP 48 Ca 0.21 -0.09 0.05 0.00 -0.39 0.00 0.00 57.03 56.80 1aw2 h ASP 48 Cb 0.29 0.08 -0.05 0.00 0.68 0.00 0.00 39.33 40.33 1aw2 h ASP 48 CO -0.01 -0.10 0.50 0.25 -1.61 0.00 0.00 179.24 178.27 1aw2 h LEU 49 N -0.51 0.80 -0.15 2.28 6.46 -1.85 -0.04 115.31 122.29 1aw2 h LEU 49 Ca -0.04 0.01 0.04 0.00 -0.12 0.00 0.00 57.88 57.77 1aw2 h LEU 49 Cb 0.38 -0.16 -0.05 0.00 -0.73 0.00 0.00 40.66 40.10 1aw2 h LEU 49 CO 0.06 0.53 -0.14 0.00 -0.62 0.00 0.00 178.44 178.27 1aw2 h ALA 50 N 1.36 -0.03 -0.28 1.25 0.00 -0.91 -1.45 119.26 119.19 1aw2 h ALA 50 Ca 0.33 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.34 1aw2 h ALA 50 Cb 0.09 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1aw2 h ALA 50 CO -0.14 -0.58 0.09 1.49 0.00 0.00 0.00 179.25 180.11 1aw2 h GLU 51 N -0.16 0.21 -0.50 0.00 4.81 -0.31 -1.38 114.58 117.25 1aw2 h GLU 51 Ca 0.10 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.37 1aw2 h GLU 51 Cb 0.31 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.59 1aw2 h GLU 51 CO -0.25 0.14 0.22 0.00 -0.73 0.00 0.00 179.01 178.39 1aw2 h ARG 52 N 0.22 0.42 0.13 1.92 3.08 -0.75 -0.14 114.38 119.25 1aw2 h ARG 52 Ca 0.13 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 1aw2 h ARG 52 Cb 0.10 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1aw2 h ARG 52 CO -0.13 0.28 -0.06 1.15 -1.07 0.00 0.00 179.97 180.13 1aw2 h THR 53 N 0.43 0.97 -0.59 2.04 2.02 -0.76 -1.27 112.91 115.75 1aw2 h THR 53 Ca 0.23 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 1aw2 h THR 53 Cb 0.19 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 1aw2 h THR 53 CO -0.19 0.09 0.36 -0.07 0.37 0.00 0.00 175.52 176.08 1aw2 h LEU 54 N -0.35 0.70 -0.11 2.58 3.38 -1.13 -1.92 115.31 118.47 1aw2 h LEU 54 Ca -0.02 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1aw2 h LEU 54 Cb 0.28 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1aw2 h LEU 54 CO 0.03 0.53 -0.15 0.74 0.09 0.00 0.00 178.44 179.68 1aw2 h THR 55 N 0.81 1.37 -0.76 0.22 2.02 -0.84 -0.99 112.91 114.74 1aw2 h THR 55 Ca 0.21 -1.36 0.07 0.00 0.77 0.00 0.00 66.41 66.10 1aw2 h THR 55 Cb -0.04 2.01 -0.05 0.00 -1.74 0.00 0.00 68.15 68.33 1aw2 h THR 55 CO -0.04 0.39 0.50 -0.08 0.37 0.00 0.00 175.52 176.66 1aw2 h GLU 56 N -0.12 0.77 0.00 6.66 4.81 -0.71 -1.64 114.58 124.35 1aw2 h GLU 56 Ca 0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1aw2 h GLU 56 Cb 0.70 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1aw2 h GLU 56 CO 0.03 0.51 -0.12 0.00 -0.73 0.00 0.00 179.01 178.70 1aw2 h ALA 57 N 1.59 0.92 -1.51 2.92 0.00 -1.28 -3.47 119.26 118.43 1aw2 h ALA 57 Ca 0.33 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 55.00 1aw2 h ALA 57 Cb 0.27 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1aw2 h ALA 57 CO -0.11 0.00 -0.29 0.41 0.00 0.00 0.00 179.25 179.25 1aw2 n GLY 58 N 1.30 0.11 3.73 0.00 0.00 -0.58 -4.96 105.19 104.79 1aw2 n GLY 58 Ca 0.05 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 1aw2 n GLY 58 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aw2 s SER 59 N -2.53 3.83 0.00 1.61 0.15 -0.48 -4.96 113.70 111.32 1aw2 s SER 59 Ca 0.00 1.95 0.11 0.00 0.70 0.00 0.00 55.95 58.71 1aw2 s SER 59 Cb 0.00 -2.53 0.07 0.00 -1.71 0.00 0.00 66.02 61.86 1aw2 s SER 59 CO 0.00 -2.49 0.82 0.00 1.20 0.00 0.00 173.24 172.77 1aw2 n ALA 60 N -3.82 2.55 -1.77 5.45 0.00 -1.26 -4.91 120.51 116.74 1aw2 n ALA 60 Ca 0.10 -0.56 -0.41 0.00 0.00 0.00 0.00 53.44 52.57 1aw2 n ALA 60 Cb 0.53 -0.38 -0.00 0.00 0.00 0.00 0.00 19.45 19.60 1aw2 n ALA 60 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1aw2 s ILE 61 N -1.02 2.02 0.10 0.00 1.01 -1.26 -4.83 121.20 117.23 1aw2 s ILE 61 Ca 0.12 0.02 -0.22 0.00 0.00 0.00 0.00 60.65 60.57 1aw2 s ILE 61 Cb 0.09 -3.01 -0.07 0.00 0.01 0.00 0.00 42.46 39.48 1aw2 s ILE 61 CO 0.16 0.00 0.67 -0.63 0.00 0.00 0.00 174.94 175.14 1aw2 s ILE 62 N -0.89 4.60 -0.12 2.92 1.01 0.54 -4.98 121.20 124.27 1aw2 s ILE 62 Ca 0.55 1.44 -0.06 0.00 0.00 0.00 0.00 60.65 62.58 1aw2 s ILE 62 Cb -0.47 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 37.95 1aw2 s ILE 62 CO 0.61 0.52 0.10 -0.22 0.00 0.00 0.00 174.94 175.95 1aw2 s LEU 63 N -0.98 4.16 0.00 2.97 2.96 -1.26 -0.48 118.68 126.05 1aw2 s LEU 63 Ca 0.32 0.35 0.02 0.00 -0.22 0.00 0.00 54.13 54.61 1aw2 s LEU 63 Cb -0.21 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.46 1aw2 s LEU 63 CO 0.22 0.37 0.10 0.61 -1.32 0.00 0.00 176.35 176.33 1aw2 n GLY 64 N 2.26 3.53 3.28 7.98 0.00 0.17 -0.55 105.19 121.86 1aw2 n GLY 64 Ca -0.19 -1.70 -0.12 0.00 0.00 0.00 0.00 46.02 44.01 1aw2 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw2 s ALA 65 N -2.38 0.98 -2.72 4.61 0.00 -0.93 -4.02 121.76 117.30 1aw2 s ALA 65 Ca 0.13 -1.59 0.24 0.00 0.00 0.00 0.00 51.96 50.74 1aw2 s ALA 65 Cb 0.01 1.34 0.43 0.00 0.00 0.00 0.00 23.12 24.89 1aw2 s ALA 65 CO 0.09 -0.65 1.40 1.04 0.00 0.00 0.00 175.76 177.64 1aw2 n GLN 66 N -0.33 2.23 -3.59 0.00 6.02 -1.26 -2.30 117.38 118.16 1aw2 n GLN 66 Ca 0.02 -1.81 0.02 0.00 -0.01 0.00 0.00 57.00 55.21 1aw2 n GLN 66 Cb 0.65 -1.47 -0.01 0.00 1.02 0.00 0.00 30.24 30.43 1aw2 n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1aw2 s ASN 67 N -1.82 -0.01 0.13 1.08 2.47 -1.18 -4.61 114.94 111.00 1aw2 s ASN 67 Ca 0.33 -0.01 -0.13 0.00 0.42 0.00 0.00 52.86 53.47 1aw2 s ASN 67 Cb 0.21 0.01 0.02 0.00 -1.45 0.00 0.00 41.25 40.04 1aw2 s ASN 67 CO 0.31 -0.02 0.34 0.28 -3.72 0.00 0.00 177.10 174.28 1aw2 s THR 68 N -2.04 0.08 0.26 -5.21 -1.32 -1.26 -4.88 115.64 101.28 1aw2 s THR 68 Ca 0.14 -0.88 0.02 0.00 -1.21 0.00 0.00 61.69 59.75 1aw2 s THR 68 Cb 0.05 -1.36 0.02 0.00 -1.51 0.00 0.00 72.50 69.69 1aw2 s THR 68 CO -0.05 -0.38 0.13 0.47 -2.21 0.00 0.00 174.62 172.57 1aw2 n ASP 69 N -0.19 2.17 -1.03 8.08 8.00 -0.22 -4.90 116.55 128.46 1aw2 n ASP 69 Ca -0.14 -2.00 0.09 0.00 0.71 0.00 0.00 54.79 53.46 1aw2 n ASP 69 Cb 0.63 0.05 0.25 0.00 -0.02 0.00 0.00 41.12 42.04 1aw2 n ASP 69 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1aw2 n LEU 70 N 0.00 3.00 -4.08 0.64 4.77 -1.26 -4.73 117.00 115.33 1aw2 n LEU 70 Ca -0.05 -1.48 -0.16 0.00 -0.03 0.00 0.00 56.01 54.30 1aw2 n LEU 70 Cb 0.31 -0.36 -0.12 0.00 -2.33 0.00 0.00 43.42 40.92 1aw2 n LEU 70 CO 0.18 0.74 -0.42 0.20 -1.33 0.00 0.00 177.39 176.75 1aw2 s ASN 71 N -1.05 1.13 -0.06 -1.43 0.01 -1.26 -5.06 114.94 107.22 1aw2 s ASN 71 Ca 0.38 -0.47 0.01 0.00 -0.71 0.00 0.00 52.86 52.06 1aw2 s ASN 71 Cb 0.20 -0.02 -0.25 0.00 0.41 0.00 0.00 41.25 41.58 1aw2 s ASN 71 CO 0.26 -0.09 0.60 0.78 -1.51 0.00 0.00 177.10 177.14 1aw2 h ASN 72 N 4.78 0.26 -5.02 -1.22 -0.26 -1.92 -3.38 115.58 108.81 1aw2 h ASN 72 Ca -0.36 -0.51 -0.04 0.00 -0.56 0.00 0.00 56.30 54.83 1aw2 h ASN 72 Cb 1.19 -0.08 -0.14 0.00 -1.06 0.00 0.00 38.32 38.23 1aw2 h ASN 72 CO 0.43 1.45 0.12 -0.94 -1.06 0.00 0.00 177.43 177.43 1aw2 s SER 73 N -6.69 -0.49 0.00 5.81 1.04 -1.26 -4.64 113.70 107.47 1aw2 s SER 73 Ca -0.13 0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.36 1aw2 s SER 73 Cb 0.07 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.74 1aw2 s SER 73 CO 0.81 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 174.78 1aw2 n GLY 74 N -0.04 0.88 2.70 7.32 0.00 -1.26 -4.93 105.19 109.86 1aw2 n GLY 74 Ca -0.17 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 1aw2 n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw2 n ALA 75 N -1.00 5.84 -3.52 4.61 0.00 -1.26 -4.72 120.51 120.46 1aw2 n ALA 75 Ca 0.00 -3.96 -0.27 0.00 0.00 0.00 0.00 53.44 49.21 1aw2 n ALA 75 Cb 0.00 -3.33 -0.10 0.00 0.00 0.00 0.00 19.45 16.01 1aw2 n ALA 75 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1aw2 n PHE 76 N 4.96 0.25 -1.60 0.00 3.72 -1.26 -5.09 117.46 118.44 1aw2 n PHE 76 Ca 0.53 -3.59 -0.52 0.00 -0.05 0.00 0.00 57.45 53.82 1aw2 n PHE 76 Cb 0.35 -0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.83 1aw2 n PHE 76 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1aw2 n THR 77 N 2.51 0.01 -0.91 4.37 -1.04 -1.26 -2.03 114.28 115.93 1aw2 n THR 77 Ca 0.27 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.28 1aw2 n THR 77 Cb 0.45 -0.89 0.00 0.00 -1.82 0.00 0.00 70.33 68.06 1aw2 n THR 77 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1aw2 n GLY 78 N 2.66 0.65 3.89 3.41 0.00 -1.26 -5.03 105.19 109.51 1aw2 n GLY 78 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1aw2 n GLY 78 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aw2 s ASP 79 N -2.54 5.47 -0.20 1.61 1.11 -0.86 -5.08 116.67 116.18 1aw2 s ASP 79 Ca 0.00 1.06 -0.06 0.00 0.18 0.00 0.00 52.55 53.73 1aw2 s ASP 79 Cb 0.00 -1.89 -0.03 0.00 1.07 0.00 0.00 42.92 42.07 1aw2 s ASP 79 CO 0.00 -1.30 0.03 -0.04 1.18 0.00 0.00 175.17 175.04 1aw2 s MET 80 N -5.30 3.74 -0.19 8.23 -1.94 -1.26 -5.00 119.30 117.58 1aw2 s MET 80 Ca 0.57 -0.46 -0.05 0.00 -1.71 0.00 0.00 55.69 54.04 1aw2 s MET 80 Cb -0.11 -3.14 -0.03 0.00 2.01 0.00 0.00 34.83 33.56 1aw2 s MET 80 CO 0.51 0.09 0.01 0.45 -0.01 0.00 0.00 175.02 176.06 1aw2 s SER 81 N 0.82 4.96 0.21 3.03 0.15 -1.26 -1.06 113.70 120.55 1aw2 s SER 81 Ca 0.02 -0.15 -0.10 0.00 0.70 0.00 0.00 55.95 56.42 1aw2 s SER 81 Cb -0.14 -1.84 0.23 0.00 -1.71 0.00 0.00 66.02 62.56 1aw2 s SER 81 CO 0.02 0.10 1.79 -0.65 1.20 0.00 0.00 173.24 175.70 1aw2 h PRO 82 N 7.25 0.60 -0.65 5.44 0.11 -1.85 0.13 132.00 143.04 1aw2 h PRO 82 Ca -0.35 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.67 1aw2 h PRO 82 Cb 1.18 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 1aw2 h PRO 82 CO 0.62 0.39 0.18 0.00 -0.21 0.00 0.00 178.00 178.99 1aw2 h ALA 83 N 1.35 0.85 -0.49 -0.75 0.00 -1.89 0.02 119.26 118.35 1aw2 h ALA 83 Ca 0.29 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1aw2 h ALA 83 Cb 0.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1aw2 h ALA 83 CO -0.20 0.55 -0.04 0.52 0.00 0.00 0.00 179.25 180.07 1aw2 h MET 84 N 0.95 0.85 -0.73 0.00 2.86 -1.58 -2.69 114.93 114.59 1aw2 h MET 84 Ca 0.21 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1aw2 h MET 84 Cb 0.33 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 1aw2 h MET 84 CO -0.00 0.88 0.43 -0.07 1.06 0.00 0.00 176.91 179.21 1aw2 h LEU 85 N 0.78 0.88 -2.25 1.22 3.38 -0.04 -2.19 115.31 117.09 1aw2 h LEU 85 Ca 0.14 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.09 1aw2 h LEU 85 Cb 0.53 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1aw2 h LEU 85 CO 0.03 0.69 0.15 0.11 0.09 0.00 0.00 178.44 179.51 1aw2 h LYS 86 N 0.99 0.00 0.00 1.13 1.57 -0.68 -1.66 116.57 117.93 1aw2 h LYS 86 Ca 0.26 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.97 1aw2 h LYS 86 Cb -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1aw2 h LYS 86 CO -0.05 0.00 -0.33 0.93 -0.57 0.00 0.00 179.45 179.43 1aw2 h GLU 87 N 0.00 0.00 -0.02 3.15 5.08 -1.25 -2.54 114.58 119.00 1aw2 h GLU 87 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1aw2 h GLU 87 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1aw2 h GLU 87 CO -0.00 0.33 -0.05 1.19 -1.00 0.00 0.00 179.01 179.48 1aw2 n PHE 88 N -3.90 0.00 -0.80 4.33 3.72 -0.64 -4.94 117.46 115.23 1aw2 n PHE 88 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1aw2 n PHE 88 Cb 0.40 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 1aw2 n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1aw2 n GLY 89 N 1.26 0.56 3.68 1.37 0.00 -0.96 -4.81 105.19 106.30 1aw2 n GLY 89 Ca 0.16 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1aw2 n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw2 s ALA 90 N -2.00 3.55 -0.07 4.61 0.00 -1.10 -4.58 121.76 122.17 1aw2 s ALA 90 Ca 0.00 0.68 -0.01 0.00 0.00 0.00 0.00 51.96 52.63 1aw2 s ALA 90 Cb 0.00 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 1aw2 s ALA 90 CO 0.00 -0.90 -0.07 0.25 0.00 0.00 0.00 175.76 175.03 1aw2 n THR 91 N 4.80 0.42 -2.84 0.00 -2.24 0.28 -4.38 114.28 110.32 1aw2 n THR 91 Ca 0.12 -0.14 -0.43 0.00 -2.27 0.00 0.00 64.05 61.33 1aw2 n THR 91 Cb 0.45 -1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 67.64 1aw2 n THR 91 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1aw2 s HIS 92 N -2.14 2.93 -0.25 4.78 3.76 -1.22 -0.42 115.29 122.73 1aw2 s HIS 92 Ca -0.10 0.35 -0.03 0.00 -0.15 0.00 0.00 55.06 55.13 1aw2 s HIS 92 Cb 0.03 -3.93 0.02 0.00 1.11 0.00 0.00 32.58 29.80 1aw2 s HIS 92 CO 0.16 -1.09 -0.04 0.42 -0.85 0.00 0.00 174.74 173.34 1aw2 s ILE 93 N 3.70 3.11 0.02 0.60 -1.09 0.74 -2.20 121.20 126.08 1aw2 s ILE 93 Ca 0.36 -0.88 -0.30 0.00 -2.23 0.00 0.00 60.65 57.59 1aw2 s ILE 93 Cb -0.10 -2.55 -0.06 0.00 -1.58 0.00 0.00 42.46 38.17 1aw2 s ILE 93 CO 0.26 0.22 1.41 -0.63 -1.23 0.00 0.00 174.94 174.97 1aw2 s ILE 94 N 1.38 3.63 0.03 2.92 1.01 -0.97 -1.45 121.20 127.74 1aw2 s ILE 94 Ca 0.02 1.05 0.02 0.00 0.00 0.00 0.00 60.65 61.73 1aw2 s ILE 94 Cb -0.16 -3.67 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 1aw2 s ILE 94 CO -0.03 0.01 -0.07 0.27 0.00 0.00 0.00 174.94 175.12 1aw2 s ILE 95 N 2.25 0.48 0.00 2.92 -4.36 -1.01 -3.08 121.20 118.40 1aw2 s ILE 95 Ca 0.64 -0.80 0.00 0.00 -0.26 0.00 0.00 60.65 60.23 1aw2 s ILE 95 Cb -0.32 -0.51 0.00 0.00 1.25 0.00 0.00 42.46 42.87 1aw2 s ILE 95 CO 0.27 -0.23 0.00 0.61 0.24 0.00 0.00 174.94 175.83 1aw2 n GLY 96 N 1.94 0.76 3.54 6.27 0.00 -1.26 -1.78 105.19 114.65 1aw2 n GLY 96 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 1aw2 n GLY 96 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1aw2 n HIS 97 N -2.43 0.42 -0.06 1.61 -0.00 -1.26 -4.58 115.22 108.92 1aw2 n HIS 97 Ca 0.00 0.59 0.06 0.00 0.46 0.00 0.00 57.72 58.83 1aw2 n HIS 97 Cb 0.00 -2.12 0.41 0.00 -0.12 0.00 0.00 29.99 28.16 1aw2 n HIS 97 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1aw2 h SER 98 N 1.19 0.52 0.51 0.26 4.64 -1.94 -0.73 113.55 118.00 1aw2 h SER 98 Ca -0.42 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 60.85 1aw2 h SER 98 Cb 1.37 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 1aw2 h SER 98 CO 0.55 0.36 -0.20 -0.33 -0.87 0.00 0.00 176.83 176.33 1aw2 h GLU 99 N 0.60 0.00 0.20 4.77 5.08 -1.99 -1.00 114.58 122.23 1aw2 h GLU 99 Ca 0.21 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.23 1aw2 h GLU 99 Cb 0.10 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.36 1aw2 h GLU 99 CO -0.05 0.20 -1.64 0.00 -1.00 0.00 0.00 179.01 176.51 1aw2 h ARG 100 N 0.00 0.41 -0.21 2.33 3.08 -1.50 -1.01 114.38 117.48 1aw2 h ARG 100 Ca -0.00 -0.71 -0.02 0.00 0.07 0.00 0.00 59.98 59.33 1aw2 h ARG 100 Cb 0.50 0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1aw2 h ARG 100 CO 0.03 1.32 0.06 0.00 -1.07 0.00 0.00 179.97 180.31 1aw2 h ARG 101 N 0.11 0.30 0.00 0.04 3.08 -1.00 -0.63 114.38 116.28 1aw2 h ARG 101 Ca -0.30 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.59 1aw2 h ARG 101 Cb 2.11 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 32.08 1aw2 h ARG 101 CO 0.20 0.28 -0.96 -1.91 -1.07 0.00 0.00 179.97 176.51 1aw2 n GLU 102 N -4.42 0.51 0.14 0.04 2.13 -0.40 -3.14 120.64 115.49 1aw2 n GLU 102 Ca 0.00 0.52 -0.01 0.00 0.66 0.00 0.00 57.16 58.33 1aw2 n GLU 102 Cb 0.14 -1.70 0.17 0.00 0.27 0.00 0.00 31.44 30.32 1aw2 n GLU 102 CO 0.00 0.00 0.00 1.88 -0.41 0.00 0.00 177.13 178.60 1aw2 h TYR 103 N -1.00 0.00 -0.15 4.31 0.05 -1.28 -3.31 116.97 115.59 1aw2 h TYR 103 Ca -0.19 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.59 1aw2 h TYR 103 Cb 0.93 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.67 1aw2 h TYR 103 CO -0.08 0.62 0.00 0.72 -1.05 0.00 0.00 178.16 178.37 1aw2 n HIS 104 N -3.79 0.20 -4.07 4.88 8.25 -0.28 -5.01 115.22 115.40 1aw2 n HIS 104 Ca -0.01 -0.33 -0.28 0.00 -0.26 0.00 0.00 57.72 56.84 1aw2 n HIS 104 Cb 0.62 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.67 1aw2 n HIS 104 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1aw2 n ALA 105 N 0.24 -1.93 -2.68 -1.41 0.00 -0.99 -4.90 120.51 108.84 1aw2 n ALA 105 Ca 0.06 -0.28 -0.43 0.00 0.00 0.00 0.00 53.44 52.80 1aw2 n ALA 105 Cb 0.30 -1.52 -0.02 0.00 0.00 0.00 0.00 19.45 18.21 1aw2 n ALA 105 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1aw2 s GLU 106 N -6.79 4.38 0.88 0.00 2.02 -1.15 -4.99 118.70 113.06 1aw2 s GLU 106 Ca 0.08 1.39 -0.12 0.00 0.02 0.00 0.00 54.97 56.33 1aw2 s GLU 106 Cb -0.04 -3.57 0.16 0.00 0.10 0.00 0.00 34.13 30.78 1aw2 s GLU 106 CO 0.92 -0.39 1.23 -1.54 0.02 0.00 0.00 175.26 175.50 1aw2 s SER 107 N 1.12 3.64 0.26 -0.19 1.04 -1.26 -4.58 113.70 113.73 1aw2 s SER 107 Ca 0.47 0.26 0.07 0.00 0.48 0.00 0.00 55.95 57.23 1aw2 s SER 107 Cb -0.18 -0.46 0.33 0.00 0.10 0.00 0.00 66.02 65.81 1aw2 s SER 107 CO 0.15 -2.39 1.60 0.44 0.98 0.00 0.00 173.24 174.02 1aw2 h ASP 108 N -1.30 0.17 -0.37 7.02 3.32 -1.96 -1.60 116.42 121.69 1aw2 h ASP 108 Ca -0.43 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 56.49 1aw2 h ASP 108 Cb 1.26 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 1aw2 h ASP 108 CO 0.44 0.71 0.09 -0.33 -1.72 0.00 0.00 179.24 178.43 1aw2 h GLU 109 N 0.11 0.60 0.61 3.56 3.07 -1.94 0.30 114.58 120.89 1aw2 h GLU 109 Ca -0.00 -0.14 -0.03 0.00 -0.50 0.00 0.00 59.36 58.68 1aw2 h GLU 109 Cb 1.05 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 28.89 1aw2 h GLU 109 CO 0.08 0.63 -0.29 0.35 -1.40 0.00 0.00 179.01 178.38 1aw2 h PHE 110 N 0.45 -0.76 -0.45 4.33 3.57 -1.91 -1.69 116.94 120.47 1aw2 h PHE 110 Ca 0.12 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.69 1aw2 h PHE 110 Cb 0.31 0.25 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 1aw2 h PHE 110 CO 0.02 -0.43 -0.05 0.28 -2.23 0.00 0.00 178.31 175.90 1aw2 h VAL 111 N -0.99 0.61 -0.62 1.41 2.07 -1.25 -0.36 116.25 117.11 1aw2 h VAL 111 Ca -0.08 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.48 1aw2 h VAL 111 Cb 0.68 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 1aw2 h VAL 111 CO 0.14 0.01 0.41 0.00 0.02 0.00 0.00 177.57 178.15 1aw2 h ALA 112 N 1.42 1.83 -0.51 1.67 0.00 -0.32 -1.03 119.26 122.33 1aw2 h ALA 112 Ca 0.22 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 1aw2 h ALA 112 Cb 0.34 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1aw2 h ALA 112 CO -0.41 0.06 -0.10 0.87 0.00 0.00 0.00 179.25 179.66 1aw2 h LYS 113 N 0.58 0.97 -0.35 0.00 1.57 -0.13 -2.55 116.57 116.65 1aw2 h LYS 113 Ca 0.27 -0.36 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 1aw2 h LYS 113 Cb 0.33 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 1aw2 h LYS 113 CO -0.08 1.03 0.09 0.87 -0.57 0.00 0.00 179.45 180.79 1aw2 h LYS 114 N 0.83 0.51 -0.16 3.15 1.57 -0.15 -2.38 116.57 119.95 1aw2 h LYS 114 Ca 0.13 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1aw2 h LYS 114 Cb 0.66 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 1aw2 h LYS 114 CO 0.05 0.47 0.06 0.35 -0.57 0.00 0.00 179.45 179.81 1aw2 h PHE 115 N 0.51 0.23 -0.47 -1.35 3.04 -1.02 -0.76 116.94 117.11 1aw2 h PHE 115 Ca 0.12 -0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.02 1aw2 h PHE 115 Cb 0.19 -0.07 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 1aw2 h PHE 115 CO 0.01 0.30 0.18 0.00 -2.02 0.00 0.00 178.31 176.78 1aw2 h ALA 116 N 0.91 1.42 -0.16 2.41 0.00 -1.28 -1.45 119.26 121.11 1aw2 h ALA 116 Ca 0.05 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.65 1aw2 h ALA 116 Cb 0.17 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1aw2 h ALA 116 CO -0.00 0.44 -0.61 0.35 0.00 0.00 0.00 179.25 179.42 1aw2 h PHE 117 N 0.68 0.71 -0.14 0.00 3.57 -1.15 0.14 116.94 120.75 1aw2 h PHE 117 Ca 0.16 -0.27 -0.02 0.00 3.53 0.00 0.00 57.97 61.37 1aw2 h PHE 117 Cb 0.16 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 1aw2 h PHE 117 CO 0.01 1.02 -0.00 -0.07 -2.23 0.00 0.00 178.31 177.04 1aw2 h LEU 118 N 0.41 0.24 -0.89 0.59 3.38 -0.77 -0.71 115.31 117.57 1aw2 h LEU 118 Ca -0.01 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.66 1aw2 h LEU 118 Cb 1.17 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.81 1aw2 h LEU 118 CO 0.11 0.49 0.59 0.11 0.09 0.00 0.00 178.44 179.84 1aw2 h LYS 119 N -0.02 1.16 -0.50 1.13 1.79 -1.12 -0.30 116.57 118.70 1aw2 h LYS 119 Ca 0.04 -0.07 0.04 0.00 -2.18 0.00 0.00 60.65 58.48 1aw2 h LYS 119 Cb 0.37 -0.26 -0.03 0.00 -1.58 0.00 0.00 32.23 30.73 1aw2 h LYS 119 CO 0.01 0.77 0.33 0.93 -1.08 0.00 0.00 179.45 180.41 1aw2 h GLU 120 N 1.19 0.53 -0.26 3.15 5.08 -0.27 -2.11 114.58 121.89 1aw2 h GLU 120 Ca 0.33 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1aw2 h GLU 120 Cb -0.12 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.01 1aw2 h GLU 120 CO -0.08 0.35 0.00 0.09 -1.00 0.00 0.00 179.01 178.37 1aw2 n ASN 121 N -4.47 2.39 0.00 1.42 4.13 -0.20 -4.94 115.26 113.58 1aw2 n ASN 121 Ca 0.06 -1.84 0.00 0.00 1.68 0.00 0.00 54.58 54.48 1aw2 n ASN 121 Cb 0.16 -0.17 0.00 0.00 -1.54 0.00 0.00 39.78 38.23 1aw2 n ASN 121 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1aw2 n GLY 122 N 1.28 0.60 3.99 7.41 0.00 -0.72 -5.01 105.19 112.74 1aw2 n GLY 122 Ca 0.17 -0.28 -0.18 0.00 0.00 0.00 0.00 46.02 45.73 1aw2 n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aw2 s LEU 123 N 0.00 3.78 -0.38 0.99 1.43 -0.73 -5.02 118.68 118.75 1aw2 s LEU 123 Ca 0.00 -0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 52.65 1aw2 s LEU 123 Cb 0.00 -2.67 0.03 0.00 0.03 0.00 0.00 46.19 43.57 1aw2 s LEU 123 CO 0.00 -0.61 0.22 -0.89 0.23 0.00 0.00 176.35 175.30 1aw2 s THR 124 N -2.28 4.70 0.14 5.49 2.01 0.45 -4.27 115.64 121.87 1aw2 s THR 124 Ca 0.50 -0.82 -0.28 0.00 0.31 0.00 0.00 61.69 61.40 1aw2 s THR 124 Cb -0.09 -3.62 -0.07 0.00 0.01 0.00 0.00 72.50 68.73 1aw2 s THR 124 CO 0.32 -0.25 0.89 -2.16 -0.69 0.00 0.00 174.62 172.73 1aw2 s PRO 125 N 1.58 4.68 -0.70 4.92 0.04 -1.26 -0.18 135.00 144.07 1aw2 s PRO 125 Ca 0.03 1.34 -0.09 0.00 0.04 0.00 0.00 61.00 62.32 1aw2 s PRO 125 Cb -0.19 -3.33 0.18 0.00 0.04 0.00 0.00 34.50 31.20 1aw2 s PRO 125 CO 0.07 0.35 0.58 0.08 0.04 0.00 0.00 177.00 178.13 1aw2 s VAL 126 N -0.47 4.68 -0.50 -0.36 1.01 -0.53 -1.57 120.40 122.66 1aw2 s VAL 126 Ca 0.42 -2.56 -0.28 0.00 0.00 0.00 0.00 61.98 59.56 1aw2 s VAL 126 Cb -0.23 -3.97 0.01 0.00 0.00 0.00 0.00 36.38 32.19 1aw2 s VAL 126 CO 0.28 -0.93 1.45 -0.22 0.00 0.00 0.00 175.10 175.68 1aw2 s LEU 127 N 0.26 3.46 0.13 3.92 0.20 0.93 -2.42 118.68 125.16 1aw2 s LEU 127 Ca 0.16 0.51 -0.26 0.00 0.69 0.00 0.00 54.13 55.23 1aw2 s LEU 127 Cb -0.17 -3.22 -0.07 0.00 -0.43 0.00 0.00 46.19 42.31 1aw2 s LEU 127 CO -0.05 -1.65 0.80 0.00 -0.29 0.00 0.00 176.35 175.16 1aw2 s ILE 129 N -0.68 0.18 0.00 0.00 -4.36 -0.74 -4.70 121.20 110.90 1aw2 s ILE 129 Ca 0.38 -1.73 0.00 0.00 -0.26 0.00 0.00 60.65 59.05 1aw2 s ILE 129 Cb -0.22 -1.62 0.00 0.00 1.25 0.00 0.00 42.46 41.87 1aw2 s ILE 129 CO 0.26 -0.81 0.00 0.61 0.24 0.00 0.00 174.94 175.24 1aw2 n GLY 130 N 0.03 3.06 3.71 6.27 0.00 -1.26 0.31 105.19 117.31 1aw2 n GLY 130 Ca -0.12 -0.64 -0.26 0.00 0.00 0.00 0.00 46.02 45.01 1aw2 n GLY 130 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1aw2 s GLU 131 N -2.00 2.57 0.90 1.61 1.03 -1.24 -4.88 118.70 116.69 1aw2 s GLU 131 Ca 0.00 -1.06 -0.14 0.00 0.03 0.00 0.00 54.97 53.81 1aw2 s GLU 131 Cb 0.00 -2.44 0.16 0.00 -0.80 0.00 0.00 34.13 31.05 1aw2 s GLU 131 CO 0.00 0.45 1.25 -1.54 -1.33 0.00 0.00 175.26 174.10 1aw2 s SER 132 N -3.09 3.63 0.10 0.83 1.04 -1.26 -2.42 113.70 112.53 1aw2 s SER 132 Ca 0.29 0.37 -0.33 0.00 0.48 0.00 0.00 55.95 56.77 1aw2 s SER 132 Cb -0.09 -0.58 -0.14 0.00 0.10 0.00 0.00 66.02 65.31 1aw2 s SER 132 CO 0.20 -2.41 1.59 -0.78 0.98 0.00 0.00 173.24 172.82 1aw2 h ASP 133 N -1.38 -1.19 0.07 7.02 3.58 -1.83 -0.32 116.42 122.37 1aw2 h ASP 133 Ca -0.44 0.11 -0.00 0.00 0.42 0.00 0.00 57.03 57.11 1aw2 h ASP 133 Cb 1.26 0.41 -0.00 0.00 1.72 0.00 0.00 39.33 42.73 1aw2 h ASP 133 CO 0.46 -0.56 -0.01 0.00 -2.88 0.00 0.00 179.24 176.26 1aw2 h ALA 134 N -0.45 1.26 0.12 -0.78 0.00 -1.96 0.19 119.26 117.64 1aw2 h ALA 134 Ca -0.02 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.55 1aw2 h ALA 134 Cb 0.74 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1aw2 h ALA 134 CO -0.12 0.01 -1.65 1.96 0.00 0.00 0.00 179.25 179.45 1aw2 h GLN 135 N 0.00 0.26 -0.24 0.00 4.20 -1.81 -2.36 115.11 115.16 1aw2 h GLN 135 Ca -0.00 -0.44 -0.07 0.00 0.06 0.00 0.00 58.65 58.19 1aw2 h GLN 135 Cb 0.05 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1aw2 h GLN 135 CO 0.00 1.12 -0.13 -0.97 -0.67 0.00 0.00 178.83 178.17 1aw2 h ASN 136 N 0.07 0.54 0.08 1.46 -0.73 -0.21 1.18 115.58 117.98 1aw2 h ASN 136 Ca -0.29 -0.42 -0.00 0.00 1.87 0.00 0.00 56.30 57.46 1aw2 h ASN 136 Cb 2.04 -0.15 -0.00 0.00 0.27 0.00 0.00 38.32 40.47 1aw2 h ASN 136 CO 0.15 0.84 -0.06 -0.33 -0.37 0.00 0.00 177.43 177.66 1aw2 h GLU 137 N 0.24 -0.14 0.00 6.67 5.08 -0.78 0.60 114.58 126.25 1aw2 h GLU 137 Ca 0.05 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1aw2 h GLU 137 Cb 0.65 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.93 1aw2 h GLU 137 CO 0.04 -0.09 0.00 0.00 -1.00 0.00 0.00 179.01 177.96 1aw2 n ALA 138 N -2.19 1.83 -3.75 3.43 0.00 -0.89 -4.83 120.51 114.12 1aw2 n ALA 138 Ca -0.08 -0.06 -0.25 0.00 0.00 0.00 0.00 53.44 53.06 1aw2 n ALA 138 Cb 0.09 -1.15 0.04 0.00 0.00 0.00 0.00 19.45 18.44 1aw2 n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aw2 n GLY 139 N -0.43 -0.42 1.39 0.00 0.00 0.21 -4.92 105.19 101.03 1aw2 n GLY 139 Ca 0.07 0.17 -0.05 0.00 0.00 0.00 0.00 46.02 46.20 1aw2 n GLY 139 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1aw2 n GLU 140 N -4.54 2.34 -0.30 1.61 0.28 0.38 -4.79 120.64 115.62 1aw2 n GLU 140 Ca -0.12 -3.08 0.06 0.00 -0.16 0.00 0.00 57.16 53.87 1aw2 n GLU 140 Cb 0.60 -1.93 0.16 0.00 1.43 0.00 0.00 31.44 31.69 1aw2 n GLU 140 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 177.13 178.12 1aw2 h THR 141 N 1.35 0.15 0.00 3.84 2.02 -1.88 -1.84 112.91 116.55 1aw2 h THR 141 Ca 0.26 -0.01 -0.16 0.00 0.77 0.00 0.00 66.41 67.27 1aw2 h THR 141 Cb 1.91 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 1aw2 h THR 141 CO 0.52 0.00 -0.75 0.24 0.37 0.00 0.00 175.52 175.91 1aw2 h MET 142 N 0.02 0.00 -0.51 6.66 2.86 -1.97 -2.02 114.93 119.97 1aw2 h MET 142 Ca 0.45 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 58.04 1aw2 h MET 142 Cb 0.77 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.41 1aw2 h MET 142 CO -0.85 0.75 0.13 0.00 1.06 0.00 0.00 176.91 178.00 1aw2 h ALA 143 N 1.25 0.68 0.37 6.32 0.00 -1.73 0.21 119.26 126.36 1aw2 h ALA 143 Ca -0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1aw2 h ALA 143 Cb 1.35 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1aw2 h ALA 143 CO 0.10 0.37 -0.18 0.28 0.00 0.00 0.00 179.25 179.82 1aw2 h VAL 144 N 0.71 0.60 -0.30 0.00 2.07 -1.44 -0.21 116.25 117.68 1aw2 h VAL 144 Ca 0.16 -0.48 0.03 0.00 0.82 0.00 0.00 66.70 67.23 1aw2 h VAL 144 Cb 0.32 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1aw2 h VAL 144 CO 0.00 0.09 0.11 0.00 0.02 0.00 0.00 177.57 177.78 1aw2 h ALA 146 N 1.19 1.30 0.28 0.00 0.00 -0.61 -0.27 119.26 121.15 1aw2 h ALA 146 Ca 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1aw2 h ALA 146 Cb 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1aw2 h ALA 146 CO -0.13 0.47 -0.13 -0.09 0.00 0.00 0.00 179.25 179.36 1aw2 h ARG 147 N 0.49 -0.36 -0.20 0.00 2.43 -0.12 0.86 114.38 117.48 1aw2 h ARG 147 Ca 0.10 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1aw2 h ARG 147 Cb 0.41 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1aw2 h ARG 147 CO 0.02 -0.21 -0.07 1.96 -1.51 0.00 0.00 179.97 180.16 1aw2 h GLN 148 N -0.42 0.31 0.08 0.20 4.20 -0.69 -2.48 115.11 116.31 1aw2 h GLN 148 Ca -0.04 -0.06 -0.25 0.00 0.06 0.00 0.00 58.65 58.36 1aw2 h GLN 148 Cb 0.32 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1aw2 h GLN 148 CO 0.06 0.39 -1.13 -0.07 -0.67 0.00 0.00 178.83 177.42 1aw2 h LEU 149 N 0.29 0.41 -1.54 1.46 3.38 -0.90 -3.27 115.31 115.15 1aw2 h LEU 149 Ca 0.06 -0.40 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 1aw2 h LEU 149 Cb 0.31 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1aw2 h LEU 149 CO 0.01 1.27 -0.13 0.44 0.09 0.00 0.00 178.44 180.12 1aw2 h ASP 150 N 0.11 0.12 -1.01 -0.43 3.32 -0.43 0.03 116.42 118.12 1aw2 h ASP 150 Ca -0.11 -0.02 0.24 0.00 0.02 0.00 0.00 57.03 57.16 1aw2 h ASP 150 Cb 1.82 -0.03 -0.11 0.00 0.22 0.00 0.00 39.33 41.23 1aw2 h ASP 150 CO 0.18 0.27 0.61 0.00 -1.72 0.00 0.00 179.24 178.59 1aw2 h ALA 151 N 1.75 1.84 0.08 3.45 0.00 -1.50 0.78 119.26 125.65 1aw2 h ALA 151 Ca 0.03 0.10 -0.37 0.00 0.00 0.00 0.00 54.91 54.67 1aw2 h ALA 151 Cb 0.32 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1aw2 h ALA 151 CO 0.02 -0.28 -2.11 1.33 0.00 0.00 0.00 179.25 178.21 1aw2 n VAL 152 N -4.81 1.67 -0.20 0.00 0.24 -0.71 -4.09 118.33 110.43 1aw2 n VAL 152 Ca 0.26 -0.58 -0.06 0.00 -2.04 0.00 0.00 64.34 61.92 1aw2 n VAL 152 Cb 0.72 -1.67 0.04 0.00 -1.47 0.00 0.00 33.84 31.47 1aw2 n VAL 152 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1aw2 h ILE 153 N -0.06 1.13 0.00 1.34 2.04 -0.35 0.47 117.51 122.08 1aw2 h ILE 153 Ca -0.48 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.12 1aw2 h ILE 153 Cb 1.93 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 1aw2 h ILE 153 CO -0.00 0.14 0.00 0.59 0.00 0.00 0.00 178.15 178.88 1aw2 n ASN 154 N -4.69 0.23 -0.00 1.72 3.02 0.27 -0.58 115.26 115.22 1aw2 n ASN 154 Ca 0.04 0.54 0.02 0.00 -0.03 0.00 0.00 54.58 55.16 1aw2 n ASN 154 Cb 0.03 -0.60 -0.03 0.00 -0.61 0.00 0.00 39.78 38.58 1aw2 n ASN 154 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1aw2 n THR 155 N -1.74 0.00 0.00 3.41 -2.24 -1.07 -4.80 114.28 107.84 1aw2 n THR 155 Ca 0.04 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1aw2 n THR 155 Cb 0.25 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 1aw2 n THR 155 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aw2 n GLN 156 N -1.50 3.66 0.00 -0.78 6.02 0.13 -5.10 117.38 119.81 1aw2 n GLN 156 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1aw2 n GLN 156 Cb 0.09 -0.47 0.00 0.00 1.02 0.00 0.00 30.24 30.88 1aw2 n GLN 156 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1aw2 n GLY 157 N 0.90 0.27 0.39 1.08 0.00 0.25 -4.42 105.19 103.68 1aw2 n GLY 157 Ca 0.00 -1.48 0.21 0.00 0.00 0.00 0.00 46.02 44.75 1aw2 n GLY 157 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1aw2 h VAL 158 N 0.00 0.68 0.00 1.61 -1.51 -1.91 0.52 116.25 115.65 1aw2 h VAL 158 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1aw2 h VAL 158 Cb 0.00 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 29.86 1aw2 h VAL 158 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 177.57 177.39 1aw2 h GLU 159 N 0.00 0.00 0.00 5.19 9.09 -1.95 -1.58 114.58 125.33 1aw2 h GLU 159 Ca 0.27 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.66 1aw2 h GLU 159 Cb 1.11 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.21 1aw2 h GLU 159 CO -0.00 0.00 -0.11 0.00 0.05 0.00 0.00 179.01 178.95 1aw2 h ALA 160 N 2.02 1.34 0.00 1.06 0.00 -1.09 -0.10 119.26 122.48 1aw2 h ALA 160 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1aw2 h ALA 160 Cb 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1aw2 h ALA 160 CO 0.00 0.14 0.00 1.28 0.00 0.00 0.00 179.25 180.67 1aw2 n LEU 161 N -3.71 0.55 -4.67 0.00 4.77 -0.59 -4.62 117.00 108.73 1aw2 n LEU 161 Ca -0.02 0.57 -0.42 0.00 -0.03 0.00 0.00 56.01 56.11 1aw2 n LEU 161 Cb 0.22 -0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 40.87 1aw2 n LEU 161 CO 0.30 -0.20 1.36 -0.70 -1.33 0.00 0.00 177.39 176.82 1aw2 s GLU 162 N -3.10 4.19 0.00 3.23 2.56 -0.05 -1.00 118.70 124.53 1aw2 s GLU 162 Ca 0.10 2.26 0.00 0.00 0.00 0.00 0.00 54.97 57.33 1aw2 s GLU 162 Cb 0.13 -3.83 0.00 0.00 2.00 0.00 0.00 34.13 32.43 1aw2 s GLU 162 CO 0.53 -0.79 0.00 0.41 -0.56 0.00 0.00 175.26 174.85 1aw2 n GLY 163 N 4.08 0.80 4.01 -1.50 0.00 -1.26 -5.04 105.19 106.27 1aw2 n GLY 163 Ca 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 1aw2 n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw2 s ALA 164 N -2.76 4.43 -0.00 4.61 0.00 -0.17 -4.66 121.76 123.21 1aw2 s ALA 164 Ca 0.00 -1.66 0.05 0.00 0.00 0.00 0.00 51.96 50.35 1aw2 s ALA 164 Cb 0.00 -1.69 -0.01 0.00 0.00 0.00 0.00 23.12 21.41 1aw2 s ALA 164 CO 0.00 -0.44 -0.16 0.42 0.00 0.00 0.00 175.76 175.59 1aw2 s ILE 165 N -2.46 1.24 -0.06 0.00 1.01 -0.61 -4.25 121.20 116.07 1aw2 s ILE 165 Ca 0.56 -0.73 0.05 0.00 0.00 0.00 0.00 60.65 60.53 1aw2 s ILE 165 Cb -0.10 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.32 1aw2 s ILE 165 CO 0.35 0.30 -0.22 -0.63 0.00 0.00 0.00 174.94 174.74 1aw2 s ILE 166 N -0.44 2.30 -0.18 2.92 1.01 -0.66 -0.05 121.20 126.09 1aw2 s ILE 166 Ca 0.06 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.73 1aw2 s ILE 166 Cb -0.06 -1.86 0.04 0.00 0.01 0.00 0.00 42.46 40.58 1aw2 s ILE 166 CO -0.00 0.57 -0.12 0.00 0.00 0.00 0.00 174.94 175.39 1aw2 s ALA 167 N -0.19 1.94 -0.18 9.38 0.00 -0.34 0.71 121.76 133.08 1aw2 s ALA 167 Ca -0.02 -1.09 -0.29 0.00 0.00 0.00 0.00 51.96 50.56 1aw2 s ALA 167 Cb -0.14 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1aw2 s ALA 167 CO 0.03 -0.66 1.02 -0.47 0.00 0.00 0.00 175.76 175.68 1aw2 s TYR 168 N 1.43 3.40 -0.38 0.00 5.04 -0.43 -1.79 117.35 124.63 1aw2 s TYR 168 Ca 0.01 1.50 -0.09 0.00 -2.44 0.00 0.00 57.07 56.05 1aw2 s TYR 168 Cb -0.15 -3.23 0.04 0.00 0.35 0.00 0.00 41.96 38.98 1aw2 s TYR 168 CO -0.09 -0.38 0.19 -1.21 -1.34 0.00 0.00 175.55 172.72 1aw2 s GLU 169 N 2.73 2.70 -0.95 4.97 2.02 0.15 0.66 118.70 130.98 1aw2 s GLU 169 Ca 0.45 -1.21 -0.23 0.00 0.02 0.00 0.00 54.97 53.99 1aw2 s GLU 169 Cb -0.16 -3.67 0.06 0.00 0.10 0.00 0.00 34.13 30.46 1aw2 s GLU 169 CO 0.10 -0.76 1.37 -1.25 0.02 0.00 0.00 175.26 174.74 1aw2 s PRO 170 N 1.47 3.50 0.34 0.39 0.04 -1.26 -3.60 135.00 135.88 1aw2 s PRO 170 Ca 0.01 -1.03 0.12 0.00 0.04 0.00 0.00 61.00 60.14 1aw2 s PRO 170 Cb -0.20 -5.06 0.60 0.00 0.04 0.00 0.00 34.50 29.87 1aw2 s PRO 170 CO 0.04 -2.14 1.75 0.82 0.04 0.00 0.00 177.00 177.52 1aw2 h ILE 171 N 6.53 1.32 0.00 0.56 2.04 -1.82 -2.99 117.51 123.15 1aw2 h ILE 171 Ca 0.09 -1.56 -0.01 0.00 1.00 0.00 0.00 64.86 64.38 1aw2 h ILE 171 Cb 1.02 1.84 -0.00 0.00 -0.74 0.00 0.00 36.82 38.94 1aw2 h ILE 171 CO 1.36 0.45 -0.04 4.11 0.00 0.00 0.00 178.15 184.02 1aw2 h TRP 172 N 0.00 0.00 0.00 1.37 5.08 -1.69 0.70 115.95 121.41 1aw2 h TRP 172 Ca -0.00 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.88 1aw2 h TRP 172 Cb 0.81 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.95 1aw2 h TRP 172 CO 0.00 0.04 -0.93 0.00 -1.28 0.00 0.00 178.44 176.27 1aw2 h ALA 173 N 1.96 0.65 -2.21 0.11 0.00 -1.80 -3.39 119.26 114.58 1aw2 h ALA 173 Ca -0.00 -0.41 -0.60 0.00 0.00 0.00 0.00 54.91 53.90 1aw2 h ALA 173 Cb 0.11 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 17.89 1aw2 h ALA 173 CO 0.01 0.47 0.47 0.42 0.00 0.00 0.00 179.25 180.62 1aw2 s ILE 174 N -3.10 4.76 -0.32 0.00 1.01 0.24 -3.87 121.20 119.92 1aw2 s ILE 174 Ca 0.00 1.32 0.00 0.00 0.00 0.00 0.00 60.65 61.98 1aw2 s ILE 174 Cb 0.08 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.37 1aw2 s ILE 174 CO 0.77 -0.26 0.00 0.61 0.00 0.00 0.00 174.94 176.07 1aw2 n GLY 175 N 4.08 0.54 2.33 6.18 0.00 -1.26 -4.94 105.19 112.12 1aw2 n GLY 175 Ca 0.05 -0.19 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 1aw2 n GLY 175 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1aw2 n THR 176 N -2.61 -0.56 0.00 2.61 -2.24 -1.25 -5.03 114.28 105.20 1aw2 n THR 176 Ca -0.03 -3.40 0.00 0.00 -2.27 0.00 0.00 64.05 58.35 1aw2 n THR 176 Cb 0.25 -1.16 0.00 0.00 -2.10 0.00 0.00 70.33 67.33 1aw2 n THR 176 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1aw2 n GLY 177 N 1.54 0.00 3.91 3.38 0.00 -1.26 -4.74 105.19 108.02 1aw2 n GLY 177 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 1aw2 n GLY 177 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aw2 s LYS 178 N 0.00 2.52 -0.04 1.61 1.02 -1.26 -5.10 119.74 118.49 1aw2 s LYS 178 Ca 0.00 0.09 -0.07 0.00 0.02 0.00 0.00 55.97 56.01 1aw2 s LYS 178 Cb 0.00 -2.11 0.01 0.00 -0.52 0.00 0.00 37.83 35.21 1aw2 s LYS 178 CO 0.00 -1.12 0.17 0.00 -0.92 0.00 0.00 175.35 173.48 1aw2 s ALA 179 N -3.28 -0.41 0.21 5.17 0.00 -1.26 -4.67 121.76 117.51 1aw2 s ALA 179 Ca 0.58 0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.84 1aw2 s ALA 179 Cb -0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.86 1aw2 s ALA 179 CO 0.48 -0.14 0.28 0.00 0.00 0.00 0.00 175.76 176.38 1aw2 s ALA 180 N -0.54 3.83 0.26 0.00 0.00 -1.26 -5.00 121.76 119.05 1aw2 s ALA 180 Ca -0.06 -1.22 0.08 0.00 0.00 0.00 0.00 51.96 50.76 1aw2 s ALA 180 Cb -0.04 -1.61 -0.05 0.00 0.00 0.00 0.00 23.12 21.42 1aw2 s ALA 180 CO 0.01 0.35 -0.11 0.95 0.00 0.00 0.00 175.76 176.96 1aw2 s THR 181 N -1.92 1.86 0.44 0.00 -4.23 -1.26 -4.99 115.64 105.53 1aw2 s THR 181 Ca 0.34 -2.20 0.16 0.00 -1.18 0.00 0.00 61.69 58.81 1aw2 s THR 181 Cb -0.09 -2.33 0.35 0.00 1.34 0.00 0.00 72.50 71.78 1aw2 s THR 181 CO 0.27 -0.39 1.94 0.00 -0.54 0.00 0.00 174.62 175.90 1aw2 h ALA 182 N 2.34 2.14 -0.29 3.99 0.00 -1.95 0.18 119.26 125.67 1aw2 h ALA 182 Ca -0.40 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.32 1aw2 h ALA 182 Cb 1.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1aw2 h ALA 182 CO 0.65 -0.32 -0.55 0.93 0.00 0.00 0.00 179.25 179.96 1aw2 h GLU 183 N 0.37 0.86 -0.20 0.00 3.07 -1.94 0.33 114.58 117.07 1aw2 h GLU 183 Ca 0.34 -0.55 -0.18 0.00 -0.50 0.00 0.00 59.36 58.47 1aw2 h GLU 183 Cb 0.81 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.79 1aw2 h GLU 183 CO -0.10 1.18 -0.57 -0.44 -1.40 0.00 0.00 179.01 177.69 1aw2 h ASP 184 N 0.66 0.85 0.42 1.42 3.32 -1.81 -2.63 116.42 118.64 1aw2 h ASP 184 Ca 0.01 -0.58 -0.01 0.00 0.02 0.00 0.00 57.03 56.47 1aw2 h ASP 184 Cb 1.15 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.45 1aw2 h ASP 184 CO 0.12 1.28 -0.30 0.00 -1.72 0.00 0.00 179.24 178.62 1aw2 h ALA 185 N 0.59 -0.70 -0.79 3.45 0.00 -0.82 -1.55 119.26 119.44 1aw2 h ALA 185 Ca -0.01 -0.13 0.16 0.00 0.00 0.00 0.00 54.91 54.92 1aw2 h ALA 185 Cb 1.19 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 19.31 1aw2 h ALA 185 CO 0.12 -0.92 0.52 0.37 0.00 0.00 0.00 179.25 179.35 1aw2 h GLN 186 N -0.70 0.43 -0.32 0.00 5.75 -0.41 -0.77 115.11 119.10 1aw2 h GLN 186 Ca -0.04 -0.03 -0.15 0.00 -0.15 0.00 0.00 58.65 58.28 1aw2 h GLN 186 Cb 0.59 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.04 1aw2 h GLN 186 CO 0.02 0.28 -0.41 -0.09 -2.65 0.00 0.00 178.83 175.98 1aw2 h ARG 187 N 0.44 0.78 -0.11 1.69 2.43 -1.05 -2.72 114.38 115.83 1aw2 h ARG 187 Ca 0.39 -0.42 -0.17 0.00 -0.81 0.00 0.00 59.98 58.98 1aw2 h ARG 187 Cb 0.88 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 1aw2 h ARG 187 CO -0.13 1.05 -0.63 0.82 -1.51 0.00 0.00 179.97 179.56 1aw2 h ILE 188 N 0.64 1.36 0.00 1.20 2.04 -0.20 -3.12 117.51 119.43 1aw2 h ILE 188 Ca 0.05 -1.97 -0.07 0.00 1.00 0.00 0.00 64.86 63.86 1aw2 h ILE 188 Cb 0.97 1.96 -0.01 0.00 -0.74 0.00 0.00 36.82 39.00 1aw2 h ILE 188 CO 0.09 0.60 -0.35 0.45 0.00 0.00 0.00 178.15 178.94 1aw2 h HIS 189 N 0.30 0.00 0.00 1.37 3.86 -1.15 -1.36 115.15 118.18 1aw2 h HIS 189 Ca -0.01 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.06 1aw2 h HIS 189 Cb 1.18 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.63 1aw2 h HIS 189 CO 0.04 0.35 -0.71 0.00 0.86 0.00 0.00 177.93 178.46 1aw2 h ALA 190 N 1.65 0.57 -0.07 2.45 0.00 -1.49 -0.57 119.26 121.80 1aw2 h ALA 190 Ca -0.00 -0.63 -0.24 0.00 0.00 0.00 0.00 54.91 54.04 1aw2 h ALA 190 Cb 0.79 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.52 1aw2 h ALA 190 CO 0.05 0.85 -0.89 1.96 0.00 0.00 0.00 179.25 181.21 1aw2 h GLN 191 N 0.00 0.74 0.21 0.00 4.20 -1.39 -0.06 115.11 118.81 1aw2 h GLN 191 Ca -0.02 -0.69 -0.01 0.00 0.06 0.00 0.00 58.65 57.99 1aw2 h GLN 191 Cb 1.52 0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.48 1aw2 h GLN 191 CO 0.09 1.28 -0.10 0.82 -0.67 0.00 0.00 178.83 180.25 1aw2 h ILE 192 N 0.44 0.84 -0.52 2.54 2.04 -1.27 -1.70 117.51 119.87 1aw2 h ILE 192 Ca -0.09 -0.23 0.02 0.00 1.00 0.00 0.00 64.86 65.56 1aw2 h ILE 192 Cb 1.54 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 38.56 1aw2 h ILE 192 CO 0.18 0.05 0.35 -0.09 0.00 0.00 0.00 178.15 178.64 1aw2 h ARG 193 N -0.40 0.61 0.00 2.37 2.43 -1.05 -1.62 114.38 116.73 1aw2 h ARG 193 Ca -0.03 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.02 1aw2 h ARG 193 Cb 0.30 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1aw2 h ARG 193 CO 0.05 0.40 -0.38 0.00 -1.51 0.00 0.00 179.97 178.53 1aw2 h ALA 194 N 1.69 1.02 -0.18 2.80 0.00 -0.77 -0.33 119.26 123.49 1aw2 h ALA 194 Ca 0.20 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.61 1aw2 h ALA 194 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1aw2 h ALA 194 CO -0.05 0.48 -0.48 1.25 0.00 0.00 0.00 179.25 180.44 1aw2 h HIS 195 N 0.00 0.84 -0.18 0.00 -0.00 -0.35 -2.10 115.15 113.36 1aw2 h HIS 195 Ca -0.00 -0.33 -0.12 0.00 -0.00 0.00 0.00 60.37 59.92 1aw2 h HIS 195 Cb 0.88 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 28.13 1aw2 h HIS 195 CO 0.00 1.11 -0.40 0.82 -0.00 0.00 0.00 177.93 179.46 1aw2 h ILE 196 N 0.34 1.30 0.00 6.26 2.04 -1.29 -2.93 117.51 123.24 1aw2 h ILE 196 Ca -0.01 -1.54 -0.03 0.00 1.00 0.00 0.00 64.86 64.28 1aw2 h ILE 196 Cb 1.10 1.61 -0.00 0.00 -0.74 0.00 0.00 36.82 38.78 1aw2 h ILE 196 CO 0.10 0.47 -0.16 0.00 0.00 0.00 0.00 178.15 178.57 1aw2 h ALA 197 N 1.24 0.99 0.00 1.87 0.00 -0.96 -0.40 119.26 122.00 1aw2 h ALA 197 Ca 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1aw2 h ALA 197 Cb 0.85 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1aw2 h ALA 197 CO 0.07 0.20 -0.05 1.49 0.00 0.00 0.00 179.25 180.96 1aw2 h GLU 198 N 0.00 0.00 0.00 0.00 4.57 -1.18 -3.03 114.58 114.94 1aw2 h GLU 198 Ca -0.00 0.00 -0.35 0.00 -1.18 0.00 0.00 59.36 57.83 1aw2 h GLU 198 Cb 0.75 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.28 1aw2 h GLU 198 CO 0.02 0.05 -2.33 1.63 -1.18 0.00 0.00 179.01 177.21 1aw2 n LYS 199 N -3.27 0.77 -3.64 1.92 4.76 -0.85 -4.98 118.16 112.87 1aw2 n LYS 199 Ca -0.01 0.07 -0.04 0.00 -2.87 0.00 0.00 58.31 55.45 1aw2 n LYS 199 Cb 0.24 -1.48 -0.06 0.00 -1.84 0.00 0.00 35.03 31.89 1aw2 n LYS 199 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1aw2 s SER 200 N -5.82 -1.04 0.04 4.39 0.15 -0.22 -5.01 113.70 106.19 1aw2 s SER 200 Ca -0.21 1.54 -0.17 0.00 0.70 0.00 0.00 55.95 57.82 1aw2 s SER 200 Cb 0.07 1.81 -0.26 0.00 -1.71 0.00 0.00 66.02 65.93 1aw2 s SER 200 CO 0.66 -0.23 1.10 -0.08 1.20 0.00 0.00 173.24 175.89 1aw2 h GLU 201 N 7.46 0.56 -0.11 5.44 4.81 -1.82 -2.33 114.58 128.59 1aw2 h GLU 201 Ca -0.24 -0.68 0.03 0.00 -0.13 0.00 0.00 59.36 58.34 1aw2 h GLU 201 Cb 1.17 0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.73 1aw2 h GLU 201 CO 0.13 1.28 -0.08 0.00 -0.73 0.00 0.00 179.01 179.61 1aw2 h ALA 202 N 0.30 0.01 0.56 2.92 0.00 -1.95 -0.14 119.26 120.95 1aw2 h ALA 202 Ca -0.14 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1aw2 h ALA 202 Cb 1.68 0.18 0.01 0.00 0.00 0.00 0.00 17.79 19.65 1aw2 h ALA 202 CO 0.19 -0.54 -0.27 0.28 0.00 0.00 0.00 179.25 178.91 1aw2 h VAL 203 N -0.09 0.44 -1.00 0.00 2.07 -1.93 -2.97 116.25 112.77 1aw2 h VAL 203 Ca 0.07 -0.07 0.22 0.00 0.82 0.00 0.00 66.70 67.75 1aw2 h VAL 203 Cb 0.20 0.47 -0.10 0.00 -1.52 0.00 0.00 31.29 30.34 1aw2 h VAL 203 CO -0.17 0.01 0.62 0.00 0.02 0.00 0.00 177.57 178.05 1aw2 h ALA 204 N -0.36 1.93 -0.25 1.67 0.00 -1.18 -0.51 119.26 120.56 1aw2 h ALA 204 Ca -0.08 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1aw2 h ALA 204 Cb 0.59 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1aw2 h ALA 204 CO 0.13 -0.32 -0.16 0.87 0.00 0.00 0.00 179.25 179.77 1aw2 h LYS 205 N 0.58 0.44 0.00 0.00 1.79 -0.87 -3.26 116.57 115.24 1aw2 h LYS 205 Ca 0.58 -0.13 0.00 0.00 -2.18 0.00 0.00 60.65 58.92 1aw2 h LYS 205 Cb 1.16 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.77 1aw2 h LYS 205 CO -0.34 0.59 -1.17 0.09 -1.08 0.00 0.00 179.45 177.54 1aw2 n ASN 206 N -4.19 0.58 -4.73 0.86 4.13 -0.26 -4.77 115.26 106.88 1aw2 n ASN 206 Ca 0.00 -0.28 -0.41 0.00 1.68 0.00 0.00 54.58 55.56 1aw2 n ASN 206 Cb 0.33 1.00 -0.03 0.00 -1.54 0.00 0.00 39.78 39.54 1aw2 n ASN 206 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1aw2 s VAL 207 N -3.22 3.65 -0.25 2.41 0.11 -0.86 -4.95 120.40 117.28 1aw2 s VAL 207 Ca 0.02 1.32 -0.24 0.00 -2.93 0.00 0.00 61.98 60.15 1aw2 s VAL 207 Cb 0.14 -3.84 -0.01 0.00 -1.53 0.00 0.00 36.38 31.15 1aw2 s VAL 207 CO 0.83 0.18 0.81 -0.69 -3.33 0.00 0.00 175.10 172.89 1aw2 s VAL 208 N 0.30 4.84 -0.33 2.04 1.01 -1.26 -5.01 120.40 121.99 1aw2 s VAL 208 Ca 0.55 1.47 -0.03 0.00 0.00 0.00 0.00 61.98 63.98 1aw2 s VAL 208 Cb -0.32 -4.10 0.06 0.00 0.00 0.00 0.00 36.38 32.01 1aw2 s VAL 208 CO 0.34 -0.09 0.07 -0.63 0.00 0.00 0.00 175.10 174.79 1aw2 s ILE 209 N 2.83 3.22 0.52 2.22 1.01 -1.26 -1.66 121.20 128.08 1aw2 s ILE 209 Ca 0.34 -1.48 -0.13 0.00 0.00 0.00 0.00 60.65 59.38 1aw2 s ILE 209 Cb -0.15 -2.92 -0.06 0.00 0.01 0.00 0.00 42.46 39.33 1aw2 s ILE 209 CO 0.08 -0.25 0.94 -1.10 0.00 0.00 0.00 174.94 174.61 1aw2 s GLN 210 N 1.26 3.78 -0.23 2.79 -0.21 0.22 -2.05 119.66 125.23 1aw2 s GLN 210 Ca -0.01 0.74 -0.13 0.00 0.02 0.00 0.00 55.36 55.97 1aw2 s GLN 210 Cb -0.20 -2.19 -0.04 0.00 1.00 0.00 0.00 33.01 31.57 1aw2 s GLN 210 CO -0.01 -0.30 0.27 -0.47 -2.12 0.00 0.00 175.29 172.66 1aw2 s TYR 211 N -2.73 3.33 -1.91 0.91 5.04 -0.77 -1.31 117.35 119.91 1aw2 s TYR 211 Ca 0.55 0.39 0.19 0.00 -2.44 0.00 0.00 57.07 55.76 1aw2 s TYR 211 Cb -0.10 -2.40 0.40 0.00 0.35 0.00 0.00 41.96 40.21 1aw2 s TYR 211 CO 0.39 0.01 1.33 0.41 -1.34 0.00 0.00 175.55 176.34 1aw2 n GLY 212 N 4.20 1.86 0.00 8.97 0.00 0.21 -2.04 105.19 118.39 1aw2 n GLY 212 Ca -0.12 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1aw2 n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aw2 n GLY 213 N 1.22 -1.99 3.57 -0.02 0.00 -1.25 -4.67 105.19 102.04 1aw2 n GLY 213 Ca 0.17 -1.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.34 1aw2 n GLY 213 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aw2 s SER 214 N -1.45 6.49 -0.03 1.61 0.15 -1.26 -4.88 113.70 114.32 1aw2 s SER 214 Ca 0.00 0.11 -0.00 0.00 0.70 0.00 0.00 55.95 56.76 1aw2 s SER 214 Cb 0.00 -2.51 -0.04 0.00 -1.71 0.00 0.00 66.02 61.77 1aw2 s SER 214 CO 0.00 -1.27 0.03 -0.69 1.20 0.00 0.00 173.24 172.50 1aw2 s VAL 215 N 4.36 4.42 0.06 4.45 1.01 -1.26 -5.05 120.40 128.39 1aw2 s VAL 215 Ca 0.40 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 1aw2 s VAL 215 Cb -0.09 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.32 1aw2 s VAL 215 CO 0.26 0.45 0.05 -0.54 0.00 0.00 0.00 175.10 175.33 1aw2 s LYS 216 N -1.37 0.67 0.60 2.72 1.02 -1.26 -4.69 119.74 117.43 1aw2 s LYS 216 Ca 0.18 -1.05 0.30 0.00 0.02 0.00 0.00 55.97 55.42 1aw2 s LYS 216 Cb -0.12 0.25 1.74 0.00 -0.52 0.00 0.00 37.83 39.18 1aw2 s LYS 216 CO 0.08 -0.16 2.13 -1.35 -0.92 0.00 0.00 175.35 175.14 1aw2 h PRO 217 N 3.15 0.00 0.15 -1.68 0.11 -1.96 -0.93 132.00 130.85 1aw2 h PRO 217 Ca -0.34 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.47 1aw2 h PRO 217 Cb 1.17 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.30 1aw2 h PRO 217 CO 0.60 0.00 -1.29 1.05 -0.21 0.00 0.00 178.00 178.15 1aw2 h GLU 218 N 0.00 0.50 -0.04 1.05 4.11 -1.98 -3.34 114.58 114.88 1aw2 h GLU 218 Ca 0.06 -0.74 0.00 0.00 0.07 0.00 0.00 59.36 58.75 1aw2 h GLU 218 Cb 0.39 0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1aw2 h GLU 218 CO -0.00 1.34 0.00 0.27 0.07 0.00 0.00 179.01 180.69 1aw2 n ASN 219 N -3.71 2.67 -0.02 3.06 0.23 -0.91 -4.70 115.26 111.89 1aw2 n ASN 219 Ca -0.13 -1.89 -0.11 0.00 -0.53 0.00 0.00 54.58 51.92 1aw2 n ASN 219 Cb 1.02 -0.01 -0.06 0.00 -2.08 0.00 0.00 39.78 38.65 1aw2 n ASN 219 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1aw2 h ALA 220 N 4.62 0.14 0.00 -2.53 0.00 -1.32 -2.83 119.26 117.34 1aw2 h ALA 220 Ca 0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1aw2 h ALA 220 Cb 0.88 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1aw2 h ALA 220 CO 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 179.25 178.97 1aw2 h ALA 221 N 0.87 1.51 -0.03 0.00 0.00 -1.84 -0.05 119.26 119.72 1aw2 h ALA 221 Ca 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1aw2 h ALA 221 Cb 0.18 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1aw2 h ALA 221 CO -0.00 0.01 0.01 0.00 0.00 0.00 0.00 179.25 179.27 1aw2 h ALA 222 N 1.99 0.04 -0.11 0.00 0.00 -1.83 -2.18 119.26 117.18 1aw2 h ALA 222 Ca -0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1aw2 h ALA 222 Cb 0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1aw2 h ALA 222 CO 0.00 -0.34 -0.13 1.88 0.00 0.00 0.00 179.25 180.66 1aw2 h TYR 223 N -0.17 0.34 0.00 0.00 0.05 -1.07 -3.18 116.97 112.94 1aw2 h TYR 223 Ca 0.01 -0.11 0.00 0.00 0.05 0.00 0.00 58.73 58.68 1aw2 h TYR 223 Cb 0.23 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 37.91 1aw2 h TYR 223 CO 0.00 0.72 0.00 1.19 -1.05 0.00 0.00 178.16 179.02 1aw2 n PHE 224 N -4.60 0.00 0.08 4.88 3.72 -0.17 -2.12 117.46 119.24 1aw2 n PHE 224 Ca -0.07 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.21 1aw2 n PHE 224 Cb 0.36 -0.36 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 1aw2 n PHE 224 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1aw2 h ALA 225 N 2.53 0.37 -2.77 4.37 0.00 -1.37 -3.43 119.26 118.97 1aw2 h ALA 225 Ca 0.00 -0.75 -0.53 0.00 0.00 0.00 0.00 54.91 53.63 1aw2 h ALA 225 Cb 0.15 -0.04 0.07 0.00 0.00 0.00 0.00 17.79 17.97 1aw2 h ALA 225 CO 0.00 0.89 0.82 -0.65 0.00 0.00 0.00 179.25 180.31 1aw2 s GLN 226 N -3.13 4.20 0.38 0.00 -1.52 -0.90 -4.92 119.66 113.77 1aw2 s GLN 226 Ca -0.04 2.44 0.27 0.00 -1.95 0.00 0.00 55.36 56.08 1aw2 s GLN 226 Cb 0.09 -3.07 1.31 0.00 -0.22 0.00 0.00 33.01 31.12 1aw2 s GLN 226 CO 0.85 -0.53 1.83 -1.00 -0.25 0.00 0.00 175.29 176.20 1aw2 h PRO 227 N 4.99 0.00 -0.35 2.91 0.13 -1.88 -3.01 132.00 134.79 1aw2 h PRO 227 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1aw2 h PRO 227 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1aw2 h PRO 227 CO 0.79 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.31 1aw2 n ASP 228 N -2.49 3.09 -4.34 1.44 8.00 -1.26 -4.82 116.55 116.16 1aw2 n ASP 228 Ca -0.00 -1.90 -0.42 0.00 0.71 0.00 0.00 54.79 53.18 1aw2 n ASP 228 Cb 0.15 -0.23 -0.09 0.00 -0.02 0.00 0.00 41.12 40.93 1aw2 n ASP 228 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1aw2 s ILE 229 N -1.17 4.70 -2.15 0.53 1.01 -1.14 -4.73 121.20 118.26 1aw2 s ILE 229 Ca 0.31 -1.13 0.17 0.00 0.00 0.00 0.00 60.65 60.00 1aw2 s ILE 229 Cb 0.17 -3.78 0.42 0.00 0.01 0.00 0.00 42.46 39.28 1aw2 s ILE 229 CO 0.24 -0.46 1.41 0.47 0.00 0.00 0.00 174.94 176.59 1aw2 n ASP 230 N 5.05 2.36 0.00 3.58 8.00 -0.87 -4.79 116.55 129.87 1aw2 n ASP 230 Ca -0.11 -1.91 0.00 0.00 0.71 0.00 0.00 54.79 53.48 1aw2 n ASP 230 Cb 0.44 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 1aw2 n ASP 230 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aw2 n GLY 231 N 1.24 -0.47 3.22 0.44 0.00 -1.26 -1.76 105.19 106.60 1aw2 n GLY 231 Ca 0.16 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 1aw2 n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw2 s ALA 232 N -1.00 -0.58 -0.39 4.61 0.00 -0.95 -1.84 121.76 121.62 1aw2 s ALA 232 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 51.96 51.90 1aw2 s ALA 232 Cb 0.00 0.24 0.10 0.00 0.00 0.00 0.00 23.12 23.46 1aw2 s ALA 232 CO 0.00 -0.35 0.17 -1.17 0.00 0.00 0.00 175.76 174.41 1aw2 s LEU 233 N -1.88 5.02 0.15 0.00 2.96 -0.87 -1.29 118.68 122.78 1aw2 s LEU 233 Ca -0.07 -1.90 -0.15 0.00 -0.22 0.00 0.00 54.13 51.79 1aw2 s LEU 233 Cb -0.02 -1.81 -0.07 0.00 0.50 0.00 0.00 46.19 44.79 1aw2 s LEU 233 CO -0.02 -0.49 0.57 -0.69 -1.32 0.00 0.00 176.35 174.40 1aw2 s VAL 234 N 1.16 4.82 0.00 1.68 1.01 0.21 -4.64 120.40 124.64 1aw2 s VAL 234 Ca 0.06 0.90 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1aw2 s VAL 234 Cb -0.22 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.41 1aw2 s VAL 234 CO -0.04 0.25 0.00 0.61 0.00 0.00 0.00 175.10 175.92 1aw2 n GLY 235 N 0.81 0.25 0.32 4.51 0.00 -1.26 0.63 105.19 110.45 1aw2 n GLY 235 Ca -0.05 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.07 1aw2 n GLY 235 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1aw2 h GLY 236 N 0.00 1.53 2.00 -0.02 0.00 -1.93 0.03 103.07 104.67 1aw2 h GLY 236 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1aw2 h GLY 236 CO 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 176.54 176.45 1aw2 n ALA 237 N -2.41 1.63 0.18 3.60 0.00 -1.26 -2.27 120.51 119.97 1aw2 n ALA 237 Ca 0.20 -0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.65 1aw2 n ALA 237 Cb 0.52 -1.24 0.29 0.00 0.00 0.00 0.00 19.45 19.01 1aw2 n ALA 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aw2 h ALA 238 N 2.44 0.97 0.00 0.00 0.00 -1.24 -2.80 119.26 118.64 1aw2 h ALA 238 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1aw2 h ALA 238 Cb 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1aw2 h ALA 238 CO 0.00 0.54 0.00 1.28 0.00 0.00 0.00 179.25 181.07 1aw2 n LEU 239 N -3.57 0.00 -4.08 0.00 4.32 -0.96 -4.67 117.00 108.05 1aw2 n LEU 239 Ca -0.00 0.25 -0.28 0.00 -0.02 0.00 0.00 56.01 55.96 1aw2 n LEU 239 Cb 0.54 -0.25 -0.17 0.00 -1.62 0.00 0.00 43.42 41.93 1aw2 n LEU 239 CO 0.38 -0.08 -0.50 -0.62 -1.22 0.00 0.00 177.39 175.35 1aw2 s ASP 240 N -2.50 2.36 0.29 -1.43 2.15 -1.23 -5.04 116.67 111.28 1aw2 s ASP 240 Ca 0.21 -0.41 -0.01 0.00 0.43 0.00 0.00 52.55 52.76 1aw2 s ASP 240 Cb 0.14 -1.07 0.44 0.00 -0.30 0.00 0.00 42.92 42.12 1aw2 s ASP 240 CO 0.30 0.05 1.88 0.00 -0.17 0.00 0.00 175.17 177.23 1aw2 h ALA 241 N 7.16 1.30 -0.28 3.66 0.00 -1.86 -0.96 119.26 128.28 1aw2 h ALA 241 Ca -0.29 -0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.30 1aw2 h ALA 241 Cb 1.19 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1aw2 h ALA 241 CO 0.48 0.53 -0.53 0.87 0.00 0.00 0.00 179.25 180.60 1aw2 h LYS 242 N 0.89 0.82 -0.03 0.00 1.57 -1.93 -1.72 116.57 116.16 1aw2 h LYS 242 Ca 0.21 -0.51 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 1aw2 h LYS 242 Cb 0.14 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 1aw2 h LYS 242 CO -0.02 1.14 -0.04 0.77 -0.57 0.00 0.00 179.45 180.72 1aw2 h SER 243 N 0.63 0.10 -0.51 0.86 0.02 -1.80 -2.78 113.55 110.07 1aw2 h SER 243 Ca 0.02 -0.51 -0.05 0.00 -0.84 0.00 0.00 61.79 60.41 1aw2 h SER 243 Cb 1.13 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.61 1aw2 h SER 243 CO 0.12 0.59 0.17 0.15 -1.14 0.00 0.00 176.83 176.71 1aw2 h PHE 244 N -0.39 0.87 0.00 3.45 3.57 -0.89 -2.58 116.94 120.97 1aw2 h PHE 244 Ca 0.00 -0.07 -0.10 0.00 3.53 0.00 0.00 57.97 61.33 1aw2 h PHE 244 Cb 0.57 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 1aw2 h PHE 244 CO 0.10 0.71 -0.48 0.00 -2.23 0.00 0.00 178.31 176.40 1aw2 h ALA 245 N 1.36 1.18 -0.11 2.41 0.00 -1.37 -1.14 119.26 121.59 1aw2 h ALA 245 Ca 0.19 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1aw2 h ALA 245 Cb 0.25 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1aw2 h ALA 245 CO -0.01 0.61 -0.03 0.00 0.00 0.00 0.00 179.25 179.82 1aw2 h ALA 246 N 1.52 0.16 -0.56 0.00 0.00 -1.30 -0.43 119.26 118.65 1aw2 h ALA 246 Ca -0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1aw2 h ALA 246 Cb 0.87 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1aw2 h ALA 246 CO 0.06 -0.10 0.29 0.82 0.00 0.00 0.00 179.25 180.33 1aw2 h ILE 247 N -0.10 1.19 -0.37 0.00 2.04 -1.36 -2.13 117.51 116.79 1aw2 h ILE 247 Ca 0.03 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.39 1aw2 h ILE 247 Cb 0.46 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1aw2 h ILE 247 CO 0.01 0.21 0.21 0.00 0.00 0.00 0.00 178.15 178.59 1aw2 h ALA 248 N 1.12 0.46 -0.06 1.87 0.00 -1.06 -2.85 119.26 118.74 1aw2 h ALA 248 Ca 0.19 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1aw2 h ALA 248 Cb 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1aw2 h ALA 248 CO -0.03 -0.13 -0.03 0.87 0.00 0.00 0.00 179.25 179.93 1aw2 h LYS 249 N 0.43 -0.02 -0.94 0.00 1.57 -0.92 -1.93 116.57 114.76 1aw2 h LYS 249 Ca 0.15 0.00 0.14 0.00 -1.87 0.00 0.00 60.65 59.07 1aw2 h LYS 249 Cb 0.01 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.23 1aw2 h LYS 249 CO -0.07 -0.02 0.55 0.00 -0.57 0.00 0.00 179.45 179.34 1aw2 h ALA 250 N 1.04 1.44 -0.55 3.86 0.00 -1.34 0.48 119.26 124.20 1aw2 h ALA 250 Ca 0.04 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1aw2 h ALA 250 Cb 0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1aw2 h ALA 250 CO -0.08 0.04 0.21 0.00 0.00 0.00 0.00 179.25 179.41 1aw2 h ALA 251 N 1.56 0.71 0.17 0.00 0.00 -1.24 -0.40 119.26 120.07 1aw2 h ALA 251 Ca 0.50 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.25 1aw2 h ALA 251 Cb 0.64 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1aw2 h ALA 251 CO -0.33 0.34 -0.24 0.00 0.00 0.00 0.00 179.25 179.03 1aw2 h ALA 252 N 1.06 -0.44 -0.21 0.00 0.00 -0.19 -2.38 119.26 117.09 1aw2 h ALA 252 Ca 0.18 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1aw2 h ALA 252 Cb 0.22 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1aw2 h ALA 252 CO -0.01 -0.79 -0.01 0.93 0.00 0.00 0.00 179.25 179.37 1aw2 h GLU 253 N -0.47 0.39 -1.01 0.00 5.08 -1.06 -2.71 114.58 114.81 1aw2 h GLU 253 Ca 0.01 -0.13 0.24 0.00 -1.00 0.00 0.00 59.36 58.48 1aw2 h GLU 253 Cb 0.47 -0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.57 1aw2 h GLU 253 CO -0.10 0.60 0.60 0.00 -1.00 0.00 0.00 179.01 179.11 1aw2 h ALA 254 N 0.78 1.80 -0.64 3.43 0.00 -0.97 -1.52 119.26 122.14 1aw2 h ALA 254 Ca 0.06 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1aw2 h ALA 254 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1aw2 h ALA 254 CO 0.01 -0.25 0.00 1.63 0.00 0.00 0.00 179.25 180.64 1aw2 n LYS 255 N -4.85 2.68 0.00 0.00 4.01 -0.90 -4.92 118.16 114.18 1aw2 n LYS 255 Ca 0.26 -2.54 0.07 0.00 -0.51 0.00 0.00 58.31 55.59 1aw2 n LYS 255 Cb 0.72 -1.54 0.40 0.00 -0.51 0.00 0.00 35.03 34.11 1aw2 n LYS 255 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29