#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 2.10 0.61 -1.55 5.65 -1.26 -4.96 115.29 115.88 1aw2 s HIS 3 Ca 0.00 0.28 -0.19 0.00 0.25 0.00 0.00 55.06 55.40 1aw2 s HIS 3 Cb 0.00 -3.88 -0.02 0.00 -1.18 0.00 0.00 32.58 27.50 1aw2 s HIS 3 CO 0.00 -3.65 1.33 -0.35 -0.65 0.00 0.00 174.74 171.42 1aw2 n PRO 4 N 6.91 1.35 -4.00 2.88 -0.04 -1.26 -4.90 135.00 135.96 1aw2 n PRO 4 Ca 0.17 0.51 -0.24 0.00 -0.04 0.00 0.00 63.50 63.91 1aw2 n PRO 4 Cb 0.43 -2.56 -0.17 0.00 -0.04 0.00 0.00 33.50 31.16 1aw2 n PRO 4 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1aw2 s VAL 5 N -1.34 0.71 -0.21 0.52 1.01 -0.92 -2.14 120.40 118.04 1aw2 s VAL 5 Ca 0.79 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.62 1aw2 s VAL 5 Cb -0.39 -0.76 0.01 0.00 0.00 0.00 0.00 36.38 35.24 1aw2 s VAL 5 CO 0.44 0.30 -0.13 -0.69 0.00 0.00 0.00 175.10 175.02 1aw2 s VAL 6 N 1.50 2.58 -0.06 2.92 1.01 0.75 -3.00 120.40 126.11 1aw2 s VAL 6 Ca -0.01 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1aw2 s VAL 6 Cb -0.13 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 1aw2 s VAL 6 CO -0.04 0.42 -0.13 -0.32 0.00 0.00 0.00 175.10 175.02 1aw2 s MET 7 N 1.34 2.58 -0.29 2.72 1.75 -0.17 -1.31 119.30 125.91 1aw2 s MET 7 Ca 0.04 -0.68 -0.10 0.00 -1.25 0.00 0.00 55.69 53.70 1aw2 s MET 7 Cb -0.14 -2.41 -0.02 0.00 2.84 0.00 0.00 34.83 35.09 1aw2 s MET 7 CO -0.08 0.61 0.16 0.20 -0.65 0.00 0.00 175.02 175.25 1aw2 s GLY 8 N -0.68 1.88 -0.51 2.11 0.00 0.37 0.39 107.32 110.87 1aw2 s GLY 8 Ca 0.10 -1.25 -0.17 0.00 0.00 0.00 0.00 44.72 43.41 1aw2 s GLY 8 CO 0.01 0.66 0.50 0.21 0.00 0.00 0.00 173.10 174.47 1aw2 s ASN 9 N 1.67 6.18 0.36 1.64 2.47 0.52 -0.97 114.94 126.81 1aw2 s ASN 9 Ca 0.06 -1.40 0.27 0.00 0.42 0.00 0.00 52.86 52.21 1aw2 s ASN 9 Cb -0.16 -2.22 0.89 0.00 -1.45 0.00 0.00 41.25 38.30 1aw2 s ASN 9 CO 0.08 -0.80 1.78 -0.50 -3.72 0.00 0.00 177.10 173.93 1aw2 h TRP 10 N 8.88 0.00 0.00 0.43 4.06 -1.74 -3.40 115.95 124.17 1aw2 h TRP 10 Ca -0.29 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.66 1aw2 h TRP 10 Cb 1.10 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.26 1aw2 h TRP 10 CO 0.70 0.00 0.00 1.63 -3.56 0.00 0.00 178.44 177.21 1aw2 n LYS 11 N -2.67 0.00 -2.80 0.49 5.02 -1.26 -3.34 118.16 113.60 1aw2 n LYS 11 Ca 0.03 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.94 1aw2 n LYS 11 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.38 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 6.53 -3.74 -0.35 7.94 -1.26 -4.18 117.00 121.93 1aw2 n LEU 12 Ca 0.00 -5.41 -0.13 0.00 -1.11 0.00 0.00 56.01 49.36 1aw2 n LEU 12 Cb 0.00 -1.06 -0.14 0.00 0.53 0.00 0.00 43.42 42.75 1aw2 n LEU 12 CO 0.00 2.03 -0.16 0.20 -1.11 0.00 0.00 177.39 178.35 1aw2 s ASN 13 N -1.85 -0.20 0.00 1.96 0.01 -1.21 -5.13 114.94 108.51 1aw2 s ASN 13 Ca 0.39 0.43 0.00 0.00 -0.71 0.00 0.00 52.86 52.97 1aw2 s ASN 13 Cb 0.17 0.32 0.00 0.00 0.41 0.00 0.00 41.25 42.16 1aw2 s ASN 13 CO -0.08 -0.16 0.00 0.61 -1.51 0.00 0.00 177.10 175.97 1aw2 n GLY 14 N 4.17 2.82 3.81 0.66 0.00 -1.26 -4.63 105.19 110.76 1aw2 n GLY 14 Ca -0.25 -0.68 -0.07 0.00 0.00 0.00 0.00 46.02 45.02 1aw2 n GLY 14 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1aw2 s SER 15 N 0.00 -0.27 0.22 1.61 1.04 -1.26 -5.01 113.70 110.03 1aw2 s SER 15 Ca 0.00 -0.53 -0.02 0.00 0.48 0.00 0.00 55.95 55.87 1aw2 s SER 15 Cb 0.00 0.69 0.22 0.00 0.10 0.00 0.00 66.02 67.02 1aw2 s SER 15 CO 0.00 -1.26 1.61 0.11 0.98 0.00 0.00 173.24 174.68 1aw2 h LYS 16 N 2.00 0.64 0.11 4.02 1.57 -2.02 -2.12 116.57 120.76 1aw2 h LYS 16 Ca -0.21 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.27 1aw2 h LYS 16 Cb 1.25 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1aw2 h LYS 16 CO 0.24 0.88 -0.05 1.05 -0.57 0.00 0.00 179.45 181.00 1aw2 h GLU 17 N 0.54 -0.14 -0.29 3.15 4.11 -2.00 -3.28 114.58 116.67 1aw2 h GLU 17 Ca 0.06 0.01 0.07 0.00 0.07 0.00 0.00 59.36 59.57 1aw2 h GLU 17 Cb 0.83 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 30.04 1aw2 h GLU 17 CO 0.07 0.36 -0.17 1.98 0.07 0.00 0.00 179.01 181.32 1aw2 h MET 18 N -0.79 -0.13 -0.76 1.06 4.05 -1.96 -0.39 114.93 116.01 1aw2 h MET 18 Ca -0.01 0.01 0.14 0.00 -0.28 0.00 0.00 59.70 59.55 1aw2 h MET 18 Cb 0.56 0.03 -0.09 0.00 -0.80 0.00 0.00 31.60 31.30 1aw2 h MET 18 CO 0.02 -0.09 0.31 0.28 0.23 0.00 0.00 176.91 177.67 1aw2 h VAL 19 N -0.13 0.67 -0.05 -5.77 2.07 -1.51 0.19 116.25 111.73 1aw2 h VAL 19 Ca 0.15 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 1aw2 h VAL 19 Cb 0.37 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1aw2 h VAL 19 CO -0.37 0.08 -0.06 0.58 0.02 0.00 0.00 177.57 177.82 1aw2 h VAL 20 N 0.46 1.40 0.19 2.57 2.07 -1.47 -2.10 116.25 119.37 1aw2 h VAL 20 Ca 0.41 -1.29 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 1aw2 h VAL 20 Cb 0.62 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.53 1aw2 h VAL 20 CO -0.39 0.35 -0.29 0.44 0.02 0.00 0.00 177.57 177.70 1aw2 h ASP 21 N -0.36 -0.84 -0.65 0.57 3.32 -0.55 -1.82 116.42 116.09 1aw2 h ASP 21 Ca 0.01 0.08 0.13 0.00 0.02 0.00 0.00 57.03 57.27 1aw2 h ASP 21 Cb 0.60 0.29 -0.12 0.00 0.22 0.00 0.00 39.33 40.32 1aw2 h ASP 21 CO 0.01 -0.35 -0.11 0.25 -1.72 0.00 0.00 179.24 177.32 1aw2 h LEU 22 N -0.51 -0.52 -1.41 1.55 5.85 -0.70 0.23 115.31 119.80 1aw2 h LEU 22 Ca -0.02 0.19 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1aw2 h LEU 22 Cb 0.47 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1aw2 h LEU 22 CO -0.09 -0.19 -0.29 -0.07 -0.34 0.00 0.00 178.44 177.45 1aw2 h LEU 23 N 0.03 0.00 0.04 2.25 3.38 -1.33 0.37 115.31 120.04 1aw2 h LEU 23 Ca 0.32 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.21 1aw2 h LEU 23 Cb 0.51 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.27 1aw2 h LEU 23 CO -0.64 0.29 -0.35 0.78 0.09 0.00 0.00 178.44 178.61 1aw2 h ASN 24 N 0.00 0.24 0.11 -0.43 2.35 0.10 -2.26 115.58 115.69 1aw2 h ASN 24 Ca -0.00 -0.89 0.02 0.00 -0.55 0.00 0.00 56.30 54.88 1aw2 h ASN 24 Cb 0.56 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.82 1aw2 h ASN 24 CO 0.04 1.11 -0.30 1.23 -1.65 0.00 0.00 177.43 177.85 1aw2 h GLY 25 N -0.59 -0.57 -0.23 2.83 0.00 -0.47 -0.59 103.07 103.45 1aw2 h GLY 25 Ca -0.05 0.36 0.20 0.00 0.00 0.00 0.00 47.33 47.83 1aw2 h GLY 25 CO 0.07 -0.24 0.24 -2.00 0.00 0.00 0.00 176.54 174.61 1aw2 h LEU 26 N -0.52 0.08 -0.79 3.11 7.12 -0.35 0.12 115.31 124.07 1aw2 h LEU 26 Ca 0.03 0.16 -0.09 0.00 0.13 0.00 0.00 57.88 58.12 1aw2 h LEU 26 Cb 0.55 0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 40.87 1aw2 h LEU 26 CO -0.19 -0.07 -0.04 -1.13 -0.13 0.00 0.00 178.44 176.89 1aw2 h ASN 27 N 0.28 0.85 0.77 1.25 -1.24 -0.66 -1.79 115.58 115.05 1aw2 h ASN 27 Ca 0.49 -0.23 -0.04 0.00 0.71 0.00 0.00 56.30 57.23 1aw2 h ASN 27 Cb 0.91 -0.23 0.01 0.00 0.73 0.00 0.00 38.32 39.74 1aw2 h ASN 27 CO -0.56 0.93 -0.39 0.00 -1.29 0.00 0.00 177.43 176.12 1aw2 h ALA 28 N 1.15 -1.28 -0.84 1.57 0.00 0.69 -2.05 119.26 118.51 1aw2 h ALA 28 Ca 0.14 -0.23 0.18 0.00 0.00 0.00 0.00 54.91 55.00 1aw2 h ALA 28 Cb 0.53 0.43 -0.11 0.00 0.00 0.00 0.00 17.79 18.64 1aw2 h ALA 28 CO 0.03 -1.20 0.36 0.93 0.00 0.00 0.00 179.25 179.37 1aw2 h GLU 29 N -1.06 0.43 -0.45 0.00 4.39 -1.23 0.35 114.58 117.02 1aw2 h GLU 29 Ca -0.11 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1aw2 h GLU 29 Cb 0.82 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 1aw2 h GLU 29 CO 0.17 0.29 0.00 1.28 -1.16 0.00 0.00 179.01 179.58 1aw2 n LEU 30 N -5.01 1.96 -4.60 1.33 4.77 -0.68 -4.87 117.00 109.91 1aw2 n LEU 30 Ca 0.18 -0.99 -0.47 0.00 -0.03 0.00 0.00 56.01 54.71 1aw2 n LEU 30 Cb 0.53 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.27 1aw2 n LEU 30 CO 0.16 0.40 1.68 1.21 -1.33 0.00 0.00 177.39 179.51 1aw2 n GLU 31 N 0.34 1.87 -3.65 3.23 2.13 0.12 -1.67 120.64 123.02 1aw2 n GLU 31 Ca 0.10 0.61 -0.22 0.00 0.66 0.00 0.00 57.16 58.31 1aw2 n GLU 31 Cb 0.36 -2.78 0.05 0.00 0.27 0.00 0.00 31.44 29.35 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 5.34 -0.38 2.69 8.31 0.00 -1.26 -4.91 105.19 114.97 1aw2 n GLY 32 Ca 0.29 0.15 -0.35 0.00 0.00 0.00 0.00 46.02 46.12 1aw2 n GLY 32 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1aw2 n VAL 33 N -4.41 3.15 -1.12 1.61 0.31 -0.67 -5.05 118.33 112.15 1aw2 n VAL 33 Ca -0.20 -4.41 -0.37 0.00 -0.01 0.00 0.00 64.34 59.35 1aw2 n VAL 33 Cb 0.63 -1.24 0.03 0.00 -0.91 0.00 0.00 33.84 32.35 1aw2 n VAL 33 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1aw2 n THR 34 N -0.56 0.03 0.00 2.52 -1.04 -1.26 -4.36 114.28 109.61 1aw2 n THR 34 Ca 0.49 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1aw2 n THR 34 Cb 0.44 -0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.93 1aw2 n THR 34 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1aw2 n GLY 35 N 3.00 1.66 3.45 3.41 0.00 -1.26 -4.86 105.19 110.59 1aw2 n GLY 35 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1aw2 n GLY 35 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1aw2 s VAL 36 N -1.84 1.57 -0.26 1.61 -7.23 -1.26 -4.34 120.40 108.66 1aw2 s VAL 36 Ca 0.00 -2.08 -0.05 0.00 -1.81 0.00 0.00 61.98 58.04 1aw2 s VAL 36 Cb 0.00 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.36 1aw2 s VAL 36 CO 0.00 -0.20 0.01 -1.81 -0.31 0.00 0.00 175.10 172.79 1aw2 s ASP 37 N -3.48 4.69 -0.20 4.85 1.01 -0.91 -5.01 116.67 117.63 1aw2 s ASP 37 Ca 0.32 -0.60 -0.07 0.00 0.71 0.00 0.00 52.55 52.90 1aw2 s ASP 37 Cb 0.05 -1.79 -0.04 0.00 1.01 0.00 0.00 42.92 42.15 1aw2 s ASP 37 CO 0.13 -0.11 0.07 -0.69 0.21 0.00 0.00 175.17 174.78 1aw2 s VAL 38 N 1.46 4.71 0.05 -1.27 1.01 -1.26 -0.18 120.40 124.93 1aw2 s VAL 38 Ca 0.03 -0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.01 1aw2 s VAL 38 Cb -0.16 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 1aw2 s VAL 38 CO -0.01 0.43 -0.15 0.00 0.00 0.00 0.00 175.10 175.37 1aw2 s ALA 39 N 0.62 1.29 0.03 5.51 0.00 -0.42 0.43 121.76 129.22 1aw2 s ALA 39 Ca 0.03 -0.90 0.08 0.00 0.00 0.00 0.00 51.96 51.17 1aw2 s ALA 39 Cb -0.13 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 1aw2 s ALA 39 CO 0.01 0.24 -0.23 0.14 0.00 0.00 0.00 175.76 175.92 1aw2 s VAL 40 N -0.91 2.36 -0.48 0.00 -7.23 0.37 -0.48 120.40 114.02 1aw2 s VAL 40 Ca 0.02 -1.28 0.03 0.00 -1.81 0.00 0.00 61.98 58.95 1aw2 s VAL 40 Cb -0.08 -1.93 0.14 0.00 0.56 0.00 0.00 36.38 35.06 1aw2 s VAL 40 CO 0.02 0.39 0.26 0.00 -0.31 0.00 0.00 175.10 175.46 1aw2 s ALA 41 N -0.82 2.68 0.53 1.32 0.00 -0.15 0.15 121.76 125.47 1aw2 s ALA 41 Ca 0.12 -2.93 -0.03 0.00 0.00 0.00 0.00 51.96 49.13 1aw2 s ALA 41 Cb -0.10 -2.00 0.01 0.00 0.00 0.00 0.00 23.12 21.02 1aw2 s ALA 41 CO 0.03 -2.05 0.79 -1.25 0.00 0.00 0.00 175.76 173.28 1aw2 s PRO 42 N -0.00 2.92 0.50 0.00 0.04 -1.26 -2.38 135.00 134.82 1aw2 s PRO 42 Ca 0.18 -0.29 -0.22 0.00 0.04 0.00 0.00 61.00 60.71 1aw2 s PRO 42 Cb -0.23 -2.41 -0.07 0.00 0.04 0.00 0.00 34.50 31.82 1aw2 s PRO 42 CO -0.01 -0.53 1.11 -2.30 0.04 0.00 0.00 177.00 175.30 1aw2 n PRO 43 N -2.36 1.38 -0.34 0.56 -0.02 -1.26 -4.37 135.00 128.60 1aw2 n PRO 43 Ca 0.04 0.51 0.17 0.00 -2.02 0.00 0.00 63.50 62.19 1aw2 n PRO 43 Cb 0.58 -2.25 0.37 0.00 -0.02 0.00 0.00 33.50 32.18 1aw2 n PRO 43 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1aw2 h ALA 44 N 1.28 1.71 -0.46 3.55 0.00 -1.96 0.19 119.26 123.57 1aw2 h ALA 44 Ca -0.48 0.14 0.13 0.00 0.00 0.00 0.00 54.91 54.70 1aw2 h ALA 44 Cb 1.33 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1aw2 h ALA 44 CO 0.55 -0.29 0.40 -0.07 0.00 0.00 0.00 179.25 179.84 1aw2 h LEU 45 N 0.53 0.00 -2.93 0.00 3.38 -2.02 -2.71 115.31 111.56 1aw2 h LEU 45 Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.60 1aw2 h LEU 45 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1aw2 h LEU 45 CO -0.49 0.00 0.00 0.49 0.09 0.00 0.00 178.44 178.53 1aw2 n PHE 46 N -4.01 1.07 -0.10 1.13 3.72 0.66 -4.49 117.46 115.43 1aw2 n PHE 46 Ca 0.08 -0.55 -0.07 0.00 -0.05 0.00 0.00 57.45 56.85 1aw2 n PHE 46 Cb 0.60 -0.10 0.09 0.00 -0.94 0.00 0.00 39.48 39.13 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 3.75 1.27 0.47 -4.37 2.07 -1.49 -0.87 116.25 117.09 1aw2 h VAL 47 Ca 0.00 -1.28 -0.02 0.00 0.82 0.00 0.00 66.70 66.22 1aw2 h VAL 47 Cb 1.12 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1aw2 h VAL 47 CO 0.09 0.43 -0.24 -0.78 0.02 0.00 0.00 177.57 177.10 1aw2 h ASP 48 N 0.71 -0.56 -0.31 0.57 1.82 -1.80 -1.47 116.42 115.38 1aw2 h ASP 48 Ca 0.11 0.02 0.05 0.00 -0.39 0.00 0.00 57.03 56.82 1aw2 h ASP 48 Cb 0.69 0.15 -0.05 0.00 0.68 0.00 0.00 39.33 40.80 1aw2 h ASP 48 CO 0.05 -0.39 0.01 0.25 -1.61 0.00 0.00 179.24 177.55 1aw2 h LEU 49 N -0.65 -0.10 -0.06 2.28 6.46 -1.83 -2.05 115.31 119.37 1aw2 h LEU 49 Ca -0.06 0.07 0.04 0.00 -0.12 0.00 0.00 57.88 57.80 1aw2 h LEU 49 Cb 0.50 0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 40.50 1aw2 h LEU 49 CO 0.10 -0.02 -0.25 0.00 -0.62 0.00 0.00 178.44 177.65 1aw2 h ALA 50 N 1.26 -0.29 -0.38 1.25 0.00 -1.10 0.42 119.26 120.42 1aw2 h ALA 50 Ca 0.15 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.14 1aw2 h ALA 50 Cb 0.20 0.46 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 1aw2 h ALA 50 CO -0.24 -0.73 0.03 1.49 0.00 0.00 0.00 179.25 179.79 1aw2 h GLU 51 N -0.36 0.14 -0.65 0.00 4.81 -0.87 -1.11 114.58 116.54 1aw2 h GLU 51 Ca 0.08 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1aw2 h GLU 51 Cb 0.47 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1aw2 h GLU 51 CO -0.26 0.09 0.34 0.00 -0.73 0.00 0.00 179.01 178.45 1aw2 h ARG 52 N 0.14 0.92 -0.06 1.92 3.08 -0.95 -0.79 114.38 118.63 1aw2 h ARG 52 Ca 0.19 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1aw2 h ARG 52 Cb 0.25 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1aw2 h ARG 52 CO -0.29 0.71 0.02 1.15 -1.07 0.00 0.00 179.97 180.49 1aw2 h THR 53 N 0.89 1.19 -0.38 2.04 2.02 -0.44 -1.29 112.91 116.94 1aw2 h THR 53 Ca 0.23 -0.57 -0.03 0.00 0.77 0.00 0.00 66.41 66.81 1aw2 h THR 53 Cb 0.07 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 1aw2 h THR 53 CO -0.03 0.16 0.12 -0.07 0.37 0.00 0.00 175.52 176.06 1aw2 h LEU 54 N -0.12 0.56 -0.70 2.58 3.38 -1.16 -1.46 115.31 118.40 1aw2 h LEU 54 Ca 0.02 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1aw2 h LEU 54 Cb 0.24 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1aw2 h LEU 54 CO 0.00 0.62 0.43 0.74 0.09 0.00 0.00 178.44 180.32 1aw2 h THR 55 N 0.47 1.20 0.86 0.22 2.02 -1.13 0.12 112.91 116.67 1aw2 h THR 55 Ca 0.12 -0.43 -0.04 0.00 0.77 0.00 0.00 66.41 66.84 1aw2 h THR 55 Cb 0.26 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1aw2 h THR 55 CO -0.00 0.20 -0.49 -0.33 0.37 0.00 0.00 175.52 175.27 1aw2 h GLU 56 N 0.96 -1.21 0.00 6.66 4.39 -1.09 -1.16 114.58 123.13 1aw2 h GLU 56 Ca 0.25 0.08 0.00 0.00 0.34 0.00 0.00 59.36 60.04 1aw2 h GLU 56 Cb -0.04 0.28 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1aw2 h GLU 56 CO -0.05 -0.81 0.24 0.00 -1.16 0.00 0.00 179.01 177.23 1aw2 n ALA 57 N -2.72 0.59 -1.44 3.43 0.00 -0.56 -4.73 120.51 115.07 1aw2 n ALA 57 Ca -0.16 0.03 -0.15 0.00 0.00 0.00 0.00 53.44 53.16 1aw2 n ALA 57 Cb 0.51 -0.63 -0.07 0.00 0.00 0.00 0.00 19.45 19.27 1aw2 n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aw2 n GLY 58 N -1.29 1.46 3.44 0.00 0.00 0.33 -4.94 105.19 104.19 1aw2 n GLY 58 Ca -0.00 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1aw2 n GLY 58 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1aw2 n SER 59 N -1.26 -1.68 -0.29 1.61 2.88 -0.71 -4.99 113.62 109.17 1aw2 n SER 59 Ca -0.15 0.20 0.05 0.00 -1.33 0.00 0.00 58.87 57.63 1aw2 n SER 59 Cb 0.63 -1.21 0.02 0.00 -0.75 0.00 0.00 64.21 62.91 1aw2 n SER 59 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aw2 n ALA 60 N -4.04 2.62 -1.74 -1.46 0.00 -1.26 -4.92 120.51 109.70 1aw2 n ALA 60 Ca 0.06 -0.50 -0.42 0.00 0.00 0.00 0.00 53.44 52.58 1aw2 n ALA 60 Cb 0.55 -0.31 -0.01 0.00 0.00 0.00 0.00 19.45 19.68 1aw2 n ALA 60 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1aw2 n ILE 61 N 0.14 1.49 -3.11 0.00 5.41 -1.26 -4.78 119.36 117.25 1aw2 n ILE 61 Ca 0.05 -0.37 -0.36 0.00 1.00 0.00 0.00 62.75 63.06 1aw2 n ILE 61 Cb 0.21 -1.87 -0.06 0.00 -0.71 0.00 0.00 39.64 37.21 1aw2 n ILE 61 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1aw2 s ILE 62 N -0.55 4.57 -0.18 1.39 1.01 0.17 -4.95 121.20 122.66 1aw2 s ILE 62 Ca 0.59 1.28 -0.09 0.00 0.00 0.00 0.00 60.65 62.43 1aw2 s ILE 62 Cb -0.51 -3.86 -0.05 0.00 0.01 0.00 0.00 42.46 38.04 1aw2 s ILE 62 CO 0.56 0.22 0.13 -0.22 0.00 0.00 0.00 174.94 175.63 1aw2 s LEU 63 N -1.93 4.24 0.00 2.97 2.96 -1.26 -0.48 118.68 125.18 1aw2 s LEU 63 Ca 0.42 0.28 0.01 0.00 -0.22 0.00 0.00 54.13 54.62 1aw2 s LEU 63 Cb -0.17 -2.08 -0.00 0.00 0.50 0.00 0.00 46.19 44.44 1aw2 s LEU 63 CO 0.21 0.23 0.02 0.61 -1.32 0.00 0.00 176.35 176.10 1aw2 n GLY 64 N 3.18 3.98 3.22 7.98 0.00 0.39 -1.27 105.19 122.68 1aw2 n GLY 64 Ca -0.17 -1.94 -0.11 0.00 0.00 0.00 0.00 46.02 43.81 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 -2.17 -0.51 -2.01 4.61 0.00 -0.56 -4.10 121.76 117.02 1aw2 s ALA 65 Ca 0.03 -0.20 0.04 0.00 0.00 0.00 0.00 51.96 51.84 1aw2 s ALA 65 Cb 0.00 0.36 0.20 0.00 0.00 0.00 0.00 23.12 23.69 1aw2 s ALA 65 CO 0.02 -0.43 1.14 1.04 0.00 0.00 0.00 175.76 177.54 1aw2 n GLN 66 N 0.45 1.14 0.00 0.00 6.02 -1.26 -0.85 117.38 122.88 1aw2 n GLN 66 Ca -0.18 -0.22 0.00 0.00 -0.01 0.00 0.00 57.00 56.59 1aw2 n GLN 66 Cb 0.60 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 30.77 1aw2 n GLN 66 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1aw2 n ASN 67 N -0.36 0.00 -3.84 1.08 5.15 -0.98 -4.64 115.26 111.66 1aw2 n ASN 67 Ca 0.04 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 53.92 1aw2 n ASN 67 Cb 0.06 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.26 1aw2 n ASN 67 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1aw2 s THR 68 N -2.00 0.06 0.25 -0.44 -1.32 -1.26 -4.85 115.64 106.08 1aw2 s THR 68 Ca 0.00 -1.08 0.01 0.00 -1.21 0.00 0.00 61.69 59.42 1aw2 s THR 68 Cb 0.00 -1.66 0.01 0.00 -1.51 0.00 0.00 72.50 69.35 1aw2 s THR 68 CO 0.00 -0.25 0.12 0.47 -2.21 0.00 0.00 174.62 172.75 1aw2 n ASP 69 N -0.25 2.14 -1.46 8.08 8.00 0.38 -4.88 116.55 128.56 1aw2 n ASP 69 Ca -0.09 -1.96 0.09 0.00 0.71 0.00 0.00 54.79 53.53 1aw2 n ASP 69 Cb 0.63 0.05 0.32 0.00 -0.02 0.00 0.00 41.12 42.10 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 4.31 -3.93 0.64 4.77 -1.26 -4.79 117.00 116.75 1aw2 n LEU 70 Ca -0.04 -2.17 -0.09 0.00 -0.03 0.00 0.00 56.01 53.67 1aw2 n LEU 70 Cb 0.30 -0.55 -0.09 0.00 -2.33 0.00 0.00 43.42 40.75 1aw2 n LEU 70 CO 0.17 0.75 -0.21 0.20 -1.33 0.00 0.00 177.39 176.97 1aw2 s ASN 71 N -0.86 0.17 0.02 -1.43 -0.87 -1.26 -5.05 114.94 105.66 1aw2 s ASN 71 Ca 0.46 -0.52 0.14 0.00 -1.57 0.00 0.00 52.86 51.37 1aw2 s ASN 71 Cb 0.29 0.23 -0.18 0.00 -0.02 0.00 0.00 41.25 41.57 1aw2 s ASN 71 CO 0.23 -0.51 0.80 0.78 -2.57 0.00 0.00 177.10 175.83 1aw2 h ASN 72 N 3.67 0.00 -4.73 -1.22 2.35 -1.92 -3.39 115.58 110.34 1aw2 h ASN 72 Ca -0.32 0.00 0.08 0.00 -0.55 0.00 0.00 56.30 55.51 1aw2 h ASN 72 Cb 1.19 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 39.41 1aw2 h ASN 72 CO 0.50 0.84 0.44 -0.94 -1.65 0.00 0.00 177.43 176.61 1aw2 s SER 73 N -6.05 -0.40 0.00 5.81 1.04 -1.26 -4.69 113.70 108.15 1aw2 s SER 73 Ca -0.03 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.39 1aw2 s SER 73 Cb 0.08 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.63 1aw2 s SER 73 CO 0.82 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.95 1aw2 n GLY 74 N -0.28 0.79 3.34 7.32 0.00 -1.26 -4.91 105.19 110.19 1aw2 n GLY 74 Ca -0.10 -2.02 -0.43 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 4.17 -3.40 4.61 0.00 -1.26 -4.71 120.51 118.91 1aw2 n ALA 75 Ca 0.00 -4.07 -0.27 0.00 0.00 0.00 0.00 53.44 49.10 1aw2 n ALA 75 Cb 0.00 -3.30 -0.10 0.00 0.00 0.00 0.00 19.45 16.05 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 6.42 -0.74 -1.67 0.00 3.72 -1.26 -5.09 117.46 118.83 1aw2 n PHE 76 Ca 0.43 -3.36 -0.43 0.00 -0.05 0.00 0.00 57.45 54.04 1aw2 n PHE 76 Cb 0.43 0.20 -0.03 0.00 -0.94 0.00 0.00 39.48 39.13 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 2.72 0.58 -0.29 4.37 -1.04 -1.26 -2.24 114.28 117.11 1aw2 n THR 77 Ca 0.29 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 62.20 1aw2 n THR 77 Cb 0.48 -2.15 0.00 0.00 -1.82 0.00 0.00 70.33 66.84 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 4.38 0.78 3.87 3.41 0.00 -1.26 -5.06 105.19 111.32 1aw2 n GLY 78 Ca 0.20 0.00 -0.31 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 -2.94 6.26 -0.27 1.61 1.11 -0.95 -5.06 116.67 116.42 1aw2 s ASP 79 Ca 0.00 1.37 -0.11 0.00 0.18 0.00 0.00 52.55 53.99 1aw2 s ASP 79 Cb 0.00 -2.44 -0.05 0.00 1.07 0.00 0.00 42.92 41.50 1aw2 s ASP 79 CO 0.00 -0.81 0.18 -0.04 1.18 0.00 0.00 175.17 175.67 1aw2 s MET 80 N -5.05 3.94 -0.19 8.23 -1.94 -1.26 -5.00 119.30 118.03 1aw2 s MET 80 Ca 0.54 -0.33 -0.06 0.00 -1.71 0.00 0.00 55.69 54.14 1aw2 s MET 80 Cb -0.11 -3.62 -0.03 0.00 2.01 0.00 0.00 34.83 33.08 1aw2 s MET 80 CO 0.51 -0.16 0.02 0.45 -0.01 0.00 0.00 175.02 175.84 1aw2 s SER 81 N 1.69 5.12 0.23 3.03 0.15 -1.26 -0.47 113.70 122.19 1aw2 s SER 81 Ca 0.07 -0.10 -0.07 0.00 0.70 0.00 0.00 55.95 56.55 1aw2 s SER 81 Cb -0.16 -1.88 0.29 0.00 -1.71 0.00 0.00 66.02 62.57 1aw2 s SER 81 CO 0.10 0.10 1.85 -0.65 1.20 0.00 0.00 173.24 175.84 1aw2 h PRO 82 N 7.20 0.89 -0.42 5.44 0.11 -1.87 -0.87 132.00 142.49 1aw2 h PRO 82 Ca -0.35 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.67 1aw2 h PRO 82 Cb 1.18 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 1aw2 h PRO 82 CO 0.63 0.59 0.12 0.00 -0.21 0.00 0.00 178.00 179.14 1aw2 h ALA 83 N 1.38 1.43 -0.18 -0.75 0.00 -1.90 -0.82 119.26 118.41 1aw2 h ALA 83 Ca 0.35 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 1aw2 h ALA 83 Cb 0.14 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1aw2 h ALA 83 CO -0.16 0.42 -0.64 0.52 0.00 0.00 0.00 179.25 179.39 1aw2 h MET 84 N 0.60 0.75 -0.97 0.00 2.86 -1.62 -3.12 114.93 113.44 1aw2 h MET 84 Ca 0.14 -0.57 0.02 0.00 -2.06 0.00 0.00 59.70 57.24 1aw2 h MET 84 Cb 0.20 0.10 -0.05 0.00 0.06 0.00 0.00 31.60 31.91 1aw2 h MET 84 CO -0.01 1.18 0.64 -0.07 1.06 0.00 0.00 176.91 179.72 1aw2 h LEU 85 N 0.48 1.09 -2.44 1.22 3.38 -0.88 -1.99 115.31 116.16 1aw2 h LEU 85 Ca -0.03 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1aw2 h LEU 85 Cb 1.26 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 1aw2 h LEU 85 CO 0.13 0.77 0.03 0.11 0.09 0.00 0.00 178.44 179.57 1aw2 h LYS 86 N 1.27 0.00 0.00 1.13 1.57 -1.10 -1.94 116.57 117.51 1aw2 h LYS 86 Ca 0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 1aw2 h LYS 86 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1aw2 h LYS 86 CO -0.10 0.00 0.00 1.49 -0.57 0.00 0.00 179.45 180.27 1aw2 h GLU 87 N 0.00 0.00 -0.32 3.15 4.81 -1.33 -2.83 114.58 118.05 1aw2 h GLU 87 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1aw2 h GLU 87 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1aw2 h GLU 87 CO -0.00 0.00 0.00 1.19 -0.73 0.00 0.00 179.01 179.47 1aw2 n PHE 88 N -2.45 0.43 -0.13 0.92 3.72 -0.74 -4.98 117.46 114.23 1aw2 n PHE 88 Ca 0.02 -0.41 0.00 0.00 -0.05 0.00 0.00 57.45 57.01 1aw2 n PHE 88 Cb 0.28 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 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 0.65 2.06 3.59 1.37 0.00 -1.07 -4.77 105.19 107.02 1aw2 n GLY 89 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1aw2 n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aw2 n ALA 90 N -0.34 -0.03 -0.29 4.61 0.00 -1.15 -4.67 120.51 118.63 1aw2 n ALA 90 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1aw2 n ALA 90 Cb 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.38 1aw2 n ALA 90 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1aw2 n THR 91 N -1.74 0.00 -3.81 0.00 -2.24 -0.39 -4.46 114.28 101.63 1aw2 n THR 91 Ca 0.13 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.55 1aw2 n THR 91 Cb 0.47 0.14 -0.13 0.00 -2.10 0.00 0.00 70.33 68.72 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 0.00 3.28 -0.27 4.78 3.76 -1.23 0.38 115.29 125.99 1aw2 s HIS 92 Ca 0.00 -1.66 -0.04 0.00 -0.15 0.00 0.00 55.06 53.21 1aw2 s HIS 92 Cb 0.00 -2.27 0.02 0.00 1.11 0.00 0.00 32.58 31.44 1aw2 s HIS 92 CO 0.00 -0.78 -0.00 0.42 -0.85 0.00 0.00 174.74 173.53 1aw2 s ILE 93 N 1.33 3.28 0.02 0.60 -1.09 -0.58 -1.49 121.20 123.27 1aw2 s ILE 93 Ca -0.03 -0.97 -0.30 0.00 -2.23 0.00 0.00 60.65 57.12 1aw2 s ILE 93 Cb -0.20 -2.71 -0.07 0.00 -1.58 0.00 0.00 42.46 37.90 1aw2 s ILE 93 CO 0.01 0.10 1.58 -0.63 -1.23 0.00 0.00 174.94 174.77 1aw2 s ILE 94 N 1.37 3.36 0.03 2.92 1.01 -0.03 -2.36 121.20 127.50 1aw2 s ILE 94 Ca 0.00 0.71 0.04 0.00 0.00 0.00 0.00 60.65 61.40 1aw2 s ILE 94 Cb -0.17 -3.46 -0.02 0.00 0.01 0.00 0.00 42.46 38.82 1aw2 s ILE 94 CO -0.01 -0.02 -0.11 0.27 0.00 0.00 0.00 174.94 175.07 1aw2 s ILE 95 N 2.89 0.83 0.00 2.92 -4.36 -0.95 -2.32 121.20 120.21 1aw2 s ILE 95 Ca 0.71 -0.85 0.00 0.00 -0.26 0.00 0.00 60.65 60.25 1aw2 s ILE 95 Cb -0.36 -0.77 0.00 0.00 1.25 0.00 0.00 42.46 42.58 1aw2 s ILE 95 CO 0.30 -0.06 0.00 0.61 0.24 0.00 0.00 174.94 176.03 1aw2 n GLY 96 N 2.02 0.70 3.48 6.27 0.00 -1.26 -1.10 105.19 115.30 1aw2 n GLY 96 Ca -0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.42 0.07 0.03 1.61 -0.00 -1.26 -4.58 115.22 108.67 1aw2 n HIS 97 Ca 0.00 0.74 0.22 0.00 0.46 0.00 0.00 57.72 59.14 1aw2 n HIS 97 Cb 0.02 -2.07 0.73 0.00 -0.12 0.00 0.00 29.99 28.55 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 1.25 0.00 0.38 0.26 4.64 -1.93 -1.32 113.55 116.83 1aw2 h SER 98 Ca -0.36 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.71 1aw2 h SER 98 Cb 1.39 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.49 1aw2 h SER 98 CO 0.56 0.00 -1.04 -0.33 -0.87 0.00 0.00 176.83 175.15 1aw2 h GLU 99 N 0.00 0.40 -0.03 4.77 5.08 -1.99 -2.44 114.58 120.37 1aw2 h GLU 99 Ca 0.25 -0.49 -0.23 0.00 -1.00 0.00 0.00 59.36 57.89 1aw2 h GLU 99 Cb 1.24 0.15 0.02 0.00 0.50 0.00 0.00 28.75 30.66 1aw2 h GLU 99 CO -0.00 1.16 -0.88 0.00 -1.00 0.00 0.00 179.01 178.29 1aw2 h ARG 100 N 0.20 0.64 -0.46 2.33 2.47 -1.59 -1.06 114.38 116.91 1aw2 h ARG 100 Ca -0.10 -0.65 0.02 0.00 -1.26 0.00 0.00 59.98 57.98 1aw2 h ARG 100 Cb 1.70 0.18 -0.03 0.00 -1.65 0.00 0.00 29.97 30.17 1aw2 h ARG 100 CO 0.18 1.25 0.28 0.00 0.56 0.00 0.00 179.97 182.24 1aw2 h ARG 101 N 0.28 0.55 0.33 0.04 3.08 -1.43 0.37 114.38 117.60 1aw2 h ARG 101 Ca -0.10 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 1aw2 h ARG 101 Cb 1.54 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.47 1aw2 h ARG 101 CO 0.17 0.36 -0.16 1.49 -1.07 0.00 0.00 179.97 180.77 1aw2 h GLU 102 N 0.57 -0.43 -0.02 0.04 4.81 -1.51 -2.47 114.58 115.57 1aw2 h GLU 102 Ca 0.18 0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.28 1aw2 h GLU 102 Cb -0.01 0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.48 1aw2 h GLU 102 CO -0.07 -0.16 -0.61 1.88 -0.73 0.00 0.00 179.01 179.31 1aw2 h TYR 103 N -1.03 0.66 -0.42 0.92 0.05 -1.24 -3.29 116.97 112.61 1aw2 h TYR 103 Ca -0.05 -0.34 0.00 0.00 0.05 0.00 0.00 58.73 58.39 1aw2 h TYR 103 Cb 0.46 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.12 1aw2 h TYR 103 CO 0.03 1.15 0.00 0.72 -1.05 0.00 0.00 178.16 179.01 1aw2 n HIS 104 N -4.19 0.54 -3.97 4.88 8.25 0.12 -4.96 115.22 115.89 1aw2 n HIS 104 Ca -0.10 -0.27 -0.29 0.00 -0.26 0.00 0.00 57.72 56.80 1aw2 n HIS 104 Cb 0.67 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.78 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 1.23 -1.58 -2.25 -1.41 0.00 -0.86 -4.91 120.51 110.74 1aw2 n ALA 105 Ca 0.19 -0.03 -0.41 0.00 0.00 0.00 0.00 53.44 53.19 1aw2 n ALA 105 Cb 0.53 -3.07 -0.04 0.00 0.00 0.00 0.00 19.45 16.88 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 -6.59 4.54 0.40 0.00 2.02 -1.16 -4.98 118.70 112.93 1aw2 s GLU 106 Ca 0.41 1.70 0.08 0.00 0.02 0.00 0.00 54.97 57.18 1aw2 s GLU 106 Cb -0.22 -3.32 0.01 0.00 0.10 0.00 0.00 34.13 30.70 1aw2 s GLU 106 CO 0.87 -0.05 0.55 -1.54 0.02 0.00 0.00 175.26 175.11 1aw2 s SER 107 N 0.40 5.73 0.19 -0.19 1.04 -1.26 -4.54 113.70 115.06 1aw2 s SER 107 Ca 0.53 -0.36 -0.12 0.00 0.48 0.00 0.00 55.95 56.48 1aw2 s SER 107 Cb -0.29 -0.80 0.15 0.00 0.10 0.00 0.00 66.02 65.19 1aw2 s SER 107 CO 0.32 -0.69 1.80 0.44 0.98 0.00 0.00 173.24 176.09 1aw2 h ASP 108 N 0.69 0.44 -0.01 7.02 3.32 -1.96 0.18 116.42 126.09 1aw2 h ASP 108 Ca -0.41 0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.51 1aw2 h ASP 108 Cb 1.27 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1aw2 h ASP 108 CO 0.47 0.30 -0.51 1.05 -1.72 0.00 0.00 179.24 178.83 1aw2 h GLU 109 N 0.57 0.58 0.44 3.56 9.09 -1.95 -0.42 114.58 126.46 1aw2 h GLU 109 Ca 0.24 -0.35 -0.02 0.00 0.05 0.00 0.00 59.36 59.28 1aw2 h GLU 109 Cb 0.12 0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.26 1aw2 h GLU 109 CO -0.15 0.95 -0.21 0.35 0.05 0.00 0.00 179.01 180.00 1aw2 h PHE 110 N 0.46 -0.55 -0.56 2.06 3.57 -1.70 -1.69 116.94 118.53 1aw2 h PHE 110 Ca 0.02 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.58 1aw2 h PHE 110 Cb 1.04 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.93 1aw2 h PHE 110 CO 0.04 -0.26 0.37 0.28 -2.23 0.00 0.00 178.31 176.51 1aw2 h VAL 111 N -0.76 0.95 -0.30 1.41 2.07 -0.67 -1.31 116.25 117.64 1aw2 h VAL 111 Ca -0.06 -0.15 -0.12 0.00 0.82 0.00 0.00 66.70 67.19 1aw2 h VAL 111 Cb 0.53 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1aw2 h VAL 111 CO 0.10 0.08 -0.30 0.00 0.02 0.00 0.00 177.57 177.47 1aw2 h ALA 112 N 1.71 0.91 -0.54 1.67 0.00 -0.73 -1.29 119.26 120.99 1aw2 h ALA 112 Ca 0.25 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1aw2 h ALA 112 Cb 0.40 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1aw2 h ALA 112 CO -0.07 0.62 -0.05 0.87 0.00 0.00 0.00 179.25 180.62 1aw2 h LYS 113 N 0.54 0.99 -0.32 0.00 1.57 -0.33 -1.60 116.57 117.41 1aw2 h LYS 113 Ca 0.07 -0.34 0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1aw2 h LYS 113 Cb 0.79 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1aw2 h LYS 113 CO 0.06 1.01 0.21 0.87 -0.57 0.00 0.00 179.45 181.03 1aw2 h LYS 114 N 0.86 0.41 -0.39 3.15 1.57 -1.13 -0.51 116.57 120.53 1aw2 h LYS 114 Ca 0.15 -0.02 0.08 0.00 -1.87 0.00 0.00 60.65 58.99 1aw2 h LYS 114 Cb 0.60 -0.09 -0.08 0.00 0.08 0.00 0.00 32.23 32.73 1aw2 h LYS 114 CO 0.04 0.27 -0.17 0.35 -0.57 0.00 0.00 179.45 179.37 1aw2 h PHE 115 N 0.42 -0.41 -0.64 -1.35 3.04 -0.85 0.12 116.94 117.27 1aw2 h PHE 115 Ca 0.12 0.04 -0.05 0.00 3.98 0.00 0.00 57.97 62.07 1aw2 h PHE 115 Cb -0.04 0.24 -0.03 0.00 2.56 0.00 0.00 35.95 38.69 1aw2 h PHE 115 CO -0.06 -0.25 0.22 0.00 -2.02 0.00 0.00 178.31 176.20 1aw2 h ALA 116 N 1.21 0.84 -0.45 2.41 0.00 -1.10 -2.61 119.26 119.56 1aw2 h ALA 116 Ca 0.19 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1aw2 h ALA 116 Cb 0.39 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1aw2 h ALA 116 CO -0.46 0.49 -0.05 0.35 0.00 0.00 0.00 179.25 179.58 1aw2 h PHE 117 N 0.92 0.92 -0.31 0.00 3.57 -0.15 -1.59 116.94 120.29 1aw2 h PHE 117 Ca 0.21 -0.18 0.02 0.00 3.53 0.00 0.00 57.97 61.55 1aw2 h PHE 117 Cb 0.27 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 1aw2 h PHE 117 CO 0.02 0.90 0.15 -0.07 -2.23 0.00 0.00 178.31 177.08 1aw2 h LEU 118 N 0.67 0.21 -1.31 0.59 3.38 -0.97 -1.10 115.31 116.78 1aw2 h LEU 118 Ca 0.12 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1aw2 h LEU 118 Cb 0.57 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1aw2 h LEU 118 CO 0.03 0.16 0.12 0.11 0.09 0.00 0.00 178.44 178.96 1aw2 h LYS 119 N 0.31 0.59 0.00 1.13 1.57 -1.39 0.33 116.57 119.11 1aw2 h LYS 119 Ca 0.13 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1aw2 h LYS 119 Cb 0.06 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 1aw2 h LYS 119 CO -0.10 0.52 -0.11 1.49 -0.57 0.00 0.00 179.45 180.68 1aw2 h GLU 120 N 0.58 0.00 -0.68 3.15 4.81 -0.48 -2.52 114.58 119.45 1aw2 h GLU 120 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1aw2 h GLU 120 Cb 0.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1aw2 h GLU 120 CO -0.01 0.11 0.00 0.09 -0.73 0.00 0.00 179.01 178.47 1aw2 n ASN 121 N -3.34 3.88 -0.14 1.04 3.02 -0.07 -4.92 115.26 114.73 1aw2 n ASN 121 Ca -0.01 -2.00 -0.02 0.00 -0.03 0.00 0.00 54.58 52.53 1aw2 n ASN 121 Cb 0.31 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 39.02 1aw2 n ASN 121 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1aw2 n GLY 122 N 1.63 0.54 3.97 7.41 0.00 -0.95 -5.00 105.19 112.79 1aw2 n GLY 122 Ca 0.24 -0.65 -0.19 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.43 3.66 -0.33 0.99 2.01 -0.19 -5.01 118.68 119.38 1aw2 s LEU 123 Ca 0.00 -0.45 -0.08 0.00 0.01 0.00 0.00 54.13 53.61 1aw2 s LEU 123 Cb 0.00 -2.51 0.03 0.00 0.01 0.00 0.00 46.19 43.71 1aw2 s LEU 123 CO 0.00 -0.64 0.12 -0.89 1.01 0.00 0.00 176.35 175.95 1aw2 s THR 124 N -2.34 4.02 0.44 5.49 2.01 0.16 -4.05 115.64 121.36 1aw2 s THR 124 Ca 0.50 -0.93 -0.22 0.00 0.31 0.00 0.00 61.69 61.35 1aw2 s THR 124 Cb -0.08 -3.20 -0.09 0.00 0.01 0.00 0.00 72.50 69.13 1aw2 s THR 124 CO 0.31 -0.11 1.01 -2.16 -0.69 0.00 0.00 174.62 172.97 1aw2 s PRO 125 N 1.47 4.07 -0.63 4.92 0.04 -1.26 -1.52 135.00 142.09 1aw2 s PRO 125 Ca 0.00 1.31 0.05 0.00 0.04 0.00 0.00 61.00 62.40 1aw2 s PRO 125 Cb -0.19 -2.27 0.17 0.00 0.04 0.00 0.00 34.50 32.26 1aw2 s PRO 125 CO 0.04 -0.19 0.45 0.08 0.04 0.00 0.00 177.00 177.42 1aw2 s VAL 126 N -1.95 2.19 -0.11 -0.36 1.01 -1.00 -1.69 120.40 118.50 1aw2 s VAL 126 Ca 0.62 -3.84 -0.29 0.00 0.00 0.00 0.00 61.98 58.47 1aw2 s VAL 126 Cb -0.15 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 1aw2 s VAL 126 CO 0.20 -1.07 1.53 -0.22 0.00 0.00 0.00 175.10 175.53 1aw2 s LEU 127 N -1.05 4.23 -0.17 3.92 2.96 -0.69 -2.25 118.68 125.64 1aw2 s LEU 127 Ca 0.27 2.00 -0.10 0.00 -0.22 0.00 0.00 54.13 56.08 1aw2 s LEU 127 Cb -0.02 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.09 1aw2 s LEU 127 CO -0.18 -0.91 0.18 0.00 -1.32 0.00 0.00 176.35 174.11 1aw2 s ILE 129 N 0.01 1.23 0.00 0.00 -4.36 -0.73 -4.58 121.20 112.77 1aw2 s ILE 129 Ca 0.12 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.48 1aw2 s ILE 129 Cb -0.12 -2.62 0.00 0.00 1.25 0.00 0.00 42.46 40.98 1aw2 s ILE 129 CO 0.01 -0.14 0.00 0.61 0.24 0.00 0.00 174.94 175.66 1aw2 n GLY 130 N -0.60 3.94 3.92 6.27 0.00 -1.26 0.43 105.19 117.89 1aw2 n GLY 130 Ca -0.03 -0.56 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.16 3.34 1.15 1.61 1.03 -1.24 -4.87 118.70 117.56 1aw2 s GLU 131 Ca 0.00 -0.63 -0.19 0.00 0.03 0.00 0.00 54.97 54.17 1aw2 s GLU 131 Cb 0.00 -2.91 0.28 0.00 -0.80 0.00 0.00 34.13 30.69 1aw2 s GLU 131 CO 0.00 0.52 1.21 0.45 -1.33 0.00 0.00 175.26 176.11 1aw2 s SER 132 N -3.15 1.45 0.11 0.83 0.15 -1.26 -2.40 113.70 109.44 1aw2 s SER 132 Ca 0.34 0.36 -0.15 0.00 0.70 0.00 0.00 55.95 57.20 1aw2 s SER 132 Cb -0.11 -0.42 -0.05 0.00 -1.71 0.00 0.00 66.02 63.74 1aw2 s SER 132 CO 0.28 -3.77 1.50 -0.78 1.20 0.00 0.00 173.24 171.67 1aw2 h ASP 133 N -2.35 0.72 1.02 5.45 3.58 -1.84 -2.33 116.42 120.67 1aw2 h ASP 133 Ca -0.43 -0.38 -0.17 0.00 0.42 0.00 0.00 57.03 56.46 1aw2 h ASP 133 Cb 1.25 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 42.08 1aw2 h ASP 133 CO 0.30 0.94 -0.83 0.00 -2.88 0.00 0.00 179.24 176.77 1aw2 h ALA 134 N 0.80 0.53 0.00 -0.78 0.00 -1.96 -1.17 119.26 116.68 1aw2 h ALA 134 Ca 0.08 -0.75 -0.05 0.00 0.00 0.00 0.00 54.91 54.20 1aw2 h ALA 134 Cb 0.65 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1aw2 h ALA 134 CO 0.04 1.04 -0.22 1.96 0.00 0.00 0.00 179.25 182.07 1aw2 h GLN 135 N 0.00 0.00 0.21 0.00 4.20 -1.91 -2.44 115.11 115.16 1aw2 h GLN 135 Ca -0.01 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.42 1aw2 h GLN 135 Cb 1.56 0.00 0.03 0.00 0.30 0.00 0.00 27.48 29.37 1aw2 h GLN 135 CO 0.11 0.22 -1.23 -0.97 -0.67 0.00 0.00 178.83 176.29 1aw2 h ASN 136 N 0.00 0.68 -0.71 1.46 -1.24 -1.22 0.52 115.58 115.07 1aw2 h ASN 136 Ca -0.00 -0.93 -0.02 0.00 0.71 0.00 0.00 56.30 56.05 1aw2 h ASN 136 Cb 0.84 -0.22 -0.03 0.00 0.73 0.00 0.00 38.32 39.64 1aw2 h ASN 136 CO 0.03 1.59 0.36 -0.33 -1.29 0.00 0.00 177.43 177.79 1aw2 h GLU 137 N -0.07 1.02 0.00 6.67 4.39 -1.26 -1.73 114.58 123.60 1aw2 h GLU 137 Ca -0.22 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1aw2 h GLU 137 Cb 1.95 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 30.41 1aw2 h GLU 137 CO 0.22 0.79 0.00 0.00 -1.16 0.00 0.00 179.01 178.86 1aw2 n ALA 138 N -2.37 2.15 -3.32 3.43 0.00 -0.92 -4.87 120.51 114.61 1aw2 n ALA 138 Ca 0.06 -0.11 -0.20 0.00 0.00 0.00 0.00 53.44 53.19 1aw2 n ALA 138 Cb 0.12 -1.31 0.06 0.00 0.00 0.00 0.00 19.45 18.32 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 0.21 -0.30 0.82 0.00 0.00 -0.65 -4.92 105.19 100.35 1aw2 n GLY 139 Ca 0.13 0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.30 1aw2 n GLY 139 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1aw2 n GLU 140 N -4.12 2.94 -0.33 1.61 1.02 0.18 -4.80 120.64 117.14 1aw2 n GLU 140 Ca -0.01 -2.31 0.07 0.00 -0.02 0.00 0.00 57.16 54.89 1aw2 n GLU 140 Cb 0.56 -1.45 0.16 0.00 -0.02 0.00 0.00 31.44 30.69 1aw2 n GLU 140 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1aw2 h THR 141 N 2.33 0.06 0.00 2.62 2.02 -1.89 0.09 112.91 118.13 1aw2 h THR 141 Ca 0.00 -0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1aw2 h THR 141 Cb 0.94 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 1aw2 h THR 141 CO 0.06 0.00 -0.34 0.24 0.37 0.00 0.00 175.52 175.85 1aw2 h MET 142 N 0.01 0.00 0.30 6.66 2.86 -1.95 -2.11 114.93 120.70 1aw2 h MET 142 Ca 0.48 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 58.10 1aw2 h MET 142 Cb 0.79 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.45 1aw2 h MET 142 CO -0.95 0.28 -0.14 0.00 1.06 0.00 0.00 176.91 177.16 1aw2 h ALA 143 N 1.71 -0.40 -0.03 6.32 0.00 -1.38 0.12 119.26 125.60 1aw2 h ALA 143 Ca -0.01 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.76 1aw2 h ALA 143 Cb 1.23 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1aw2 h ALA 143 CO 0.04 -0.62 -0.09 0.28 0.00 0.00 0.00 179.25 178.86 1aw2 h VAL 144 N -0.62 0.77 -0.18 0.00 2.07 -1.24 -0.30 116.25 116.74 1aw2 h VAL 144 Ca -0.04 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 1aw2 h VAL 144 Cb 0.45 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1aw2 h VAL 144 CO 0.07 0.00 -0.13 0.00 0.02 0.00 0.00 177.57 177.53 1aw2 h ALA 146 N 1.60 0.57 0.83 0.00 0.00 -0.34 -2.68 119.26 119.24 1aw2 h ALA 146 Ca 0.05 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1aw2 h ALA 146 Cb 0.40 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1aw2 h ALA 146 CO 0.02 0.58 -0.40 -0.09 0.00 0.00 0.00 179.25 179.37 1aw2 h ARG 147 N 0.70 -1.07 -0.29 0.00 2.43 -0.29 -0.46 114.38 115.40 1aw2 h ARG 147 Ca 0.08 0.07 0.08 0.00 -0.81 0.00 0.00 59.98 59.41 1aw2 h ARG 147 Cb 0.83 0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 1aw2 h ARG 147 CO 0.07 -0.71 0.23 1.96 -1.51 0.00 0.00 179.97 180.02 1aw2 h GLN 148 N -1.15 0.00 0.12 0.20 4.20 -1.26 -2.00 115.11 115.23 1aw2 h GLN 148 Ca -0.11 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.29 1aw2 h GLN 148 Cb 0.86 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.64 1aw2 h GLN 148 CO 0.19 0.00 -1.53 1.25 -0.67 0.00 0.00 178.83 178.06 1aw2 h LEU 149 N 0.00 0.41 -1.62 1.46 5.85 -1.29 -3.33 115.31 116.80 1aw2 h LEU 149 Ca 0.14 -0.56 -0.02 0.00 0.84 0.00 0.00 57.88 58.27 1aw2 h LEU 149 Cb 0.60 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 1aw2 h LEU 149 CO -0.00 1.47 -0.09 0.44 -0.34 0.00 0.00 178.44 179.92 1aw2 h ASP 150 N 0.07 0.00 0.10 1.25 3.32 -0.32 -2.55 116.42 118.29 1aw2 h ASP 150 Ca -0.24 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.80 1aw2 h ASP 150 Cb 2.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.57 1aw2 h ASP 150 CO 0.17 0.09 -0.01 0.00 -1.72 0.00 0.00 179.24 177.77 1aw2 h ALA 151 N 1.91 1.14 0.00 3.45 0.00 -1.61 0.72 119.26 124.87 1aw2 h ALA 151 Ca -0.00 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.60 1aw2 h ALA 151 Cb 0.49 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1aw2 h ALA 151 CO 0.01 0.01 -1.97 0.28 0.00 0.00 0.00 179.25 177.58 1aw2 n VAL 152 N -3.29 1.52 -0.03 0.00 0.31 -1.00 -4.42 118.33 111.43 1aw2 n VAL 152 Ca -0.03 -0.19 -0.09 0.00 -0.01 0.00 0.00 64.34 64.02 1aw2 n VAL 152 Cb 0.10 -2.05 -0.03 0.00 -0.91 0.00 0.00 33.84 30.95 1aw2 n VAL 152 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1aw2 h ILE 153 N -1.00 0.90 0.00 2.52 2.04 -1.31 0.53 117.51 121.19 1aw2 h ILE 153 Ca -0.45 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1aw2 h ILE 153 Cb 1.39 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 1aw2 h ILE 153 CO -0.27 0.01 0.00 0.59 0.00 0.00 0.00 178.15 178.48 1aw2 n ASN 154 N -5.11 0.24 0.08 1.72 5.03 0.25 -0.33 115.26 117.15 1aw2 n ASN 154 Ca -0.03 -1.32 0.00 0.00 0.87 0.00 0.00 54.58 54.10 1aw2 n ASN 154 Cb 0.09 -0.12 0.00 0.00 -1.02 0.00 0.00 39.78 38.73 1aw2 n ASN 154 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 1aw2 n THR 155 N -0.25 0.25 0.09 3.41 -1.04 -0.77 -4.86 114.28 111.10 1aw2 n THR 155 Ca 0.00 0.08 0.03 0.00 -2.04 0.00 0.00 64.05 62.12 1aw2 n THR 155 Cb 0.06 -0.81 -0.02 0.00 -1.82 0.00 0.00 70.33 67.74 1aw2 n THR 155 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 1aw2 h GLN 156 N 0.00 0.00 0.00 -2.82 4.20 -0.06 -3.51 115.11 112.93 1aw2 h GLN 156 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1aw2 h GLN 156 Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1aw2 h GLN 156 CO 0.00 0.30 0.00 0.41 -0.67 0.00 0.00 178.83 178.87 1aw2 n GLY 157 N 1.29 0.32 0.27 3.46 0.00 0.56 -4.46 105.19 106.63 1aw2 n GLY 157 Ca -0.04 -1.49 0.03 0.00 0.00 0.00 0.00 46.02 44.52 1aw2 n GLY 157 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1aw2 n VAL 158 N 0.84 -0.33 -0.30 1.61 0.31 -1.25 0.61 118.33 119.82 1aw2 n VAL 158 Ca 0.00 1.68 0.08 0.00 -0.01 0.00 0.00 64.34 66.09 1aw2 n VAL 158 Cb 0.00 -2.29 0.20 0.00 -0.91 0.00 0.00 33.84 30.84 1aw2 n VAL 158 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1aw2 h GLU 159 N 0.00 0.06 -1.89 5.55 4.39 -1.95 -1.46 114.58 119.28 1aw2 h GLU 159 Ca 0.32 -0.00 0.55 0.00 0.34 0.00 0.00 59.36 60.57 1aw2 h GLU 159 Cb 0.50 -0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 29.06 1aw2 h GLU 159 CO -0.74 0.04 1.36 0.00 -1.16 0.00 0.00 179.01 178.51 1aw2 n ALA 160 N -3.09 1.82 1.53 3.43 0.00 0.20 0.20 120.51 124.61 1aw2 n ALA 160 Ca 0.17 0.64 0.10 0.00 0.00 0.00 0.00 53.44 54.35 1aw2 n ALA 160 Cb 0.57 -1.10 0.57 0.00 0.00 0.00 0.00 19.45 19.50 1aw2 n ALA 160 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1aw2 n LEU 161 N -3.88 0.00 -4.57 0.00 4.77 -0.55 -4.77 117.00 108.01 1aw2 n LEU 161 Ca 0.43 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 55.96 1aw2 n LEU 161 Cb 1.93 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 42.98 1aw2 n LEU 161 CO 0.42 0.00 1.81 -1.84 -1.33 0.00 0.00 177.39 176.45 1aw2 n GLU 162 N -0.89 1.82 -3.08 3.23 0.28 0.54 -2.26 120.64 120.28 1aw2 n GLU 162 Ca 0.14 0.52 -0.13 0.00 -0.16 0.00 0.00 57.16 57.53 1aw2 n GLU 162 Cb 0.07 -3.02 0.05 0.00 1.43 0.00 0.00 31.44 29.97 1aw2 n GLU 162 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1aw2 n GLY 163 N 5.82 -0.02 3.31 -1.84 0.00 -1.26 -5.03 105.19 106.17 1aw2 n GLY 163 Ca 0.32 -0.10 -0.16 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.21 1.71 0.06 4.61 0.00 -0.96 -4.68 121.76 119.29 1aw2 s ALA 164 Ca 0.23 -1.69 0.09 0.00 0.00 0.00 0.00 51.96 50.58 1aw2 s ALA 164 Cb -0.10 0.37 -0.03 0.00 0.00 0.00 0.00 23.12 23.36 1aw2 s ALA 164 CO 0.46 -0.21 -0.22 0.42 0.00 0.00 0.00 175.76 176.20 1aw2 s ILE 165 N -3.40 2.48 -0.00 0.00 1.01 -0.68 -4.17 121.20 116.43 1aw2 s ILE 165 Ca 0.25 -1.36 0.08 0.00 0.00 0.00 0.00 60.65 59.62 1aw2 s ILE 165 Cb 0.05 -2.03 -0.02 0.00 0.01 0.00 0.00 42.46 40.47 1aw2 s ILE 165 CO 0.07 0.30 -0.25 -0.63 0.00 0.00 0.00 174.94 174.42 1aw2 s ILE 166 N -0.91 2.02 -0.10 2.92 1.01 -0.91 -1.69 121.20 123.53 1aw2 s ILE 166 Ca 0.14 -1.16 -0.00 0.00 0.00 0.00 0.00 60.65 59.63 1aw2 s ILE 166 Cb -0.10 -1.69 0.02 0.00 0.01 0.00 0.00 42.46 40.70 1aw2 s ILE 166 CO 0.04 0.51 -0.07 0.00 0.00 0.00 0.00 174.94 175.43 1aw2 s ALA 167 N -0.65 1.21 -0.32 9.38 0.00 -0.18 -0.36 121.76 130.83 1aw2 s ALA 167 Ca 0.10 -0.45 -0.20 0.00 0.00 0.00 0.00 51.96 51.41 1aw2 s ALA 167 Cb -0.10 -0.84 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 1aw2 s ALA 167 CO -0.00 -0.36 0.61 -0.47 0.00 0.00 0.00 175.76 175.54 1aw2 s TYR 168 N 1.62 3.20 -0.40 0.00 5.04 -0.67 -1.77 117.35 124.38 1aw2 s TYR 168 Ca 0.03 0.48 -0.14 0.00 -2.44 0.00 0.00 57.07 55.00 1aw2 s TYR 168 Cb -0.13 -3.00 0.02 0.00 0.35 0.00 0.00 41.96 39.21 1aw2 s TYR 168 CO -0.06 -0.51 0.28 -1.21 -1.34 0.00 0.00 175.55 172.71 1aw2 s GLU 169 N 2.59 2.93 -1.33 4.97 2.02 0.17 -0.05 118.70 130.00 1aw2 s GLU 169 Ca 0.24 -1.04 -0.17 0.00 0.02 0.00 0.00 54.97 54.01 1aw2 s GLU 169 Cb -0.15 -3.92 0.06 0.00 0.10 0.00 0.00 34.13 30.22 1aw2 s GLU 169 CO 0.13 -0.74 1.84 -0.35 0.02 0.00 0.00 175.26 176.15 1aw2 n PRO 170 N 5.12 3.09 0.03 0.39 -0.04 -1.26 -3.71 135.00 138.62 1aw2 n PRO 170 Ca -0.11 -3.12 0.07 0.00 -0.04 0.00 0.00 63.50 60.29 1aw2 n PRO 170 Cb 0.47 -3.46 0.49 0.00 -0.04 0.00 0.00 33.50 30.95 1aw2 n PRO 170 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1aw2 h ILE 171 N 5.27 1.03 -0.93 0.52 2.04 -1.87 -2.62 117.51 120.94 1aw2 h ILE 171 Ca 0.47 -0.14 0.12 0.00 1.00 0.00 0.00 64.86 66.31 1aw2 h ILE 171 Cb 0.82 0.59 -0.08 0.00 -0.74 0.00 0.00 36.82 37.41 1aw2 h ILE 171 CO 1.54 0.07 0.56 4.11 0.00 0.00 0.00 178.15 184.44 1aw2 h TRP 172 N 0.41 1.01 -1.69 1.37 5.08 -1.65 -3.41 115.95 117.07 1aw2 h TRP 172 Ca 0.15 0.03 0.00 0.00 1.08 0.00 0.00 58.89 60.15 1aw2 h TRP 172 Cb 0.11 -0.31 0.00 0.00 -3.00 0.00 0.00 29.16 25.95 1aw2 h TRP 172 CO -0.00 0.39 0.00 0.00 -1.28 0.00 0.00 178.44 177.55 1aw2 n ALA 173 N -2.36 0.00 0.00 0.11 0.00 -0.99 -4.69 120.51 112.57 1aw2 n ALA 173 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1aw2 n ALA 173 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1aw2 n ALA 173 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1aw2 n ILE 174 N -1.97 0.00 0.00 0.00 5.41 -1.24 -4.74 119.36 116.83 1aw2 n ILE 174 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1aw2 n ILE 174 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1aw2 n ILE 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1aw2 n GLY 175 N 0.00 0.63 1.12 7.39 0.00 -1.26 -4.74 105.19 108.33 1aw2 n GLY 175 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.27 0.91 0.00 2.61 -2.24 -1.26 -4.73 114.28 108.30 1aw2 n THR 176 Ca 0.00 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1aw2 n THR 176 Cb 0.00 -0.98 0.00 0.00 -2.10 0.00 0.00 70.33 67.25 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 0.82 1.20 3.81 3.38 0.00 -1.26 -4.92 105.19 108.23 1aw2 n GLY 177 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 4.29 0.02 1.61 -0.14 -1.26 -5.06 119.74 119.20 1aw2 s LYS 178 Ca 0.00 0.98 0.01 0.00 -1.36 0.00 0.00 55.97 55.60 1aw2 s LYS 178 Cb 0.00 -2.69 -0.01 0.00 -1.68 0.00 0.00 37.83 33.44 1aw2 s LYS 178 CO 0.00 0.27 -0.05 0.00 -0.76 0.00 0.00 175.35 174.81 1aw2 s ALA 179 N -1.71 0.36 0.00 5.17 0.00 -1.26 -3.58 121.76 120.74 1aw2 s ALA 179 Ca 0.49 -0.46 -0.01 0.00 0.00 0.00 0.00 51.96 51.98 1aw2 s ALA 179 Cb -0.15 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 1aw2 s ALA 179 CO 0.20 -0.01 0.15 0.00 0.00 0.00 0.00 175.76 176.10 1aw2 s ALA 180 N -0.82 3.82 0.42 0.00 0.00 -1.26 -5.01 121.76 118.90 1aw2 s ALA 180 Ca -0.06 -0.82 0.07 0.00 0.00 0.00 0.00 51.96 51.15 1aw2 s ALA 180 Cb -0.06 -1.75 -0.05 0.00 0.00 0.00 0.00 23.12 21.26 1aw2 s ALA 180 CO -0.00 0.74 0.18 0.95 0.00 0.00 0.00 175.76 177.63 1aw2 s THR 181 N -1.30 2.26 0.46 0.00 -4.23 -1.26 -4.98 115.64 106.59 1aw2 s THR 181 Ca 0.27 -1.70 0.35 0.00 -1.18 0.00 0.00 61.69 59.42 1aw2 s THR 181 Cb -0.12 -2.96 0.37 0.00 1.34 0.00 0.00 72.50 71.13 1aw2 s THR 181 CO 0.18 0.00 2.18 0.00 -0.54 0.00 0.00 174.62 176.44 1aw2 h ALA 182 N 1.41 1.17 -0.01 3.99 0.00 -1.98 -1.28 119.26 122.56 1aw2 h ALA 182 Ca -0.43 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 1aw2 h ALA 182 Cb 1.25 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.05 1aw2 h ALA 182 CO 0.70 0.06 -0.56 0.93 0.00 0.00 0.00 179.25 180.37 1aw2 h GLU 183 N 0.00 0.40 0.56 0.00 4.39 -1.94 -1.66 114.58 116.32 1aw2 h GLU 183 Ca -0.00 -0.42 -0.02 0.00 0.34 0.00 0.00 59.36 59.26 1aw2 h GLU 183 Cb 0.22 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 1aw2 h GLU 183 CO 0.01 1.08 -0.35 -0.44 -1.16 0.00 0.00 179.01 178.15 1aw2 h ASP 184 N -0.12 -0.89 -0.52 1.42 3.32 -1.83 -0.01 116.42 117.80 1aw2 h ASP 184 Ca -0.07 0.05 0.10 0.00 0.02 0.00 0.00 57.03 57.14 1aw2 h ASP 184 Cb 1.27 0.26 -0.10 0.00 0.22 0.00 0.00 39.33 40.98 1aw2 h ASP 184 CO 0.11 -0.55 -0.23 0.00 -1.72 0.00 0.00 179.24 176.85 1aw2 h ALA 185 N -0.50 0.13 -0.56 3.45 0.00 -1.30 0.18 119.26 120.67 1aw2 h ALA 185 Ca -0.07 0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1aw2 h ALA 185 Cb 0.71 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1aw2 h ALA 185 CO 0.06 -0.56 0.07 0.37 0.00 0.00 0.00 179.25 179.19 1aw2 h GLN 186 N -0.11 0.90 0.33 0.00 5.75 -1.19 0.97 115.11 121.76 1aw2 h GLN 186 Ca 0.24 -0.22 -0.01 0.00 -0.15 0.00 0.00 58.65 58.50 1aw2 h GLN 186 Cb 0.48 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.91 1aw2 h GLN 186 CO -0.59 0.85 -0.31 -0.09 -2.65 0.00 0.00 178.83 176.04 1aw2 h ARG 187 N 0.85 -0.61 -0.51 1.69 2.43 0.22 -1.15 114.38 117.30 1aw2 h ARG 187 Ca 0.17 0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.47 1aw2 h ARG 187 Cb 0.40 0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 30.02 1aw2 h ARG 187 CO 0.01 -0.41 0.11 0.82 -1.51 0.00 0.00 179.97 178.99 1aw2 h ILE 188 N -0.64 0.72 0.00 1.20 2.04 -0.85 -1.16 117.51 118.82 1aw2 h ILE 188 Ca -0.04 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 1aw2 h ILE 188 Cb 0.55 0.45 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1aw2 h ILE 188 CO -0.03 0.05 -0.10 0.45 0.00 0.00 0.00 178.15 178.52 1aw2 h HIS 189 N 0.25 0.00 0.02 1.37 3.86 -0.67 -1.64 115.15 118.34 1aw2 h HIS 189 Ca 0.26 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.20 1aw2 h HIS 189 Cb 0.34 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.83 1aw2 h HIS 189 CO -0.22 0.10 -1.06 0.00 0.86 0.00 0.00 177.93 177.60 1aw2 h ALA 190 N 1.90 0.16 -0.37 2.45 0.00 0.06 -2.63 119.26 120.83 1aw2 h ALA 190 Ca -0.00 -0.72 -0.03 0.00 0.00 0.00 0.00 54.91 54.16 1aw2 h ALA 190 Cb 0.29 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1aw2 h ALA 190 CO 0.01 0.72 0.10 1.96 0.00 0.00 0.00 179.25 182.04 1aw2 h GLN 191 N 0.34 0.58 0.24 0.00 4.20 -0.95 -0.57 115.11 118.95 1aw2 h GLN 191 Ca -0.13 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.44 1aw2 h GLN 191 Cb 1.71 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.41 1aw2 h GLN 191 CO 0.20 0.61 -0.11 0.82 -0.67 0.00 0.00 178.83 179.68 1aw2 h ILE 192 N 0.45 0.78 -0.58 2.54 2.04 -1.42 0.12 117.51 121.44 1aw2 h ILE 192 Ca 0.12 -0.09 0.07 0.00 1.00 0.00 0.00 64.86 65.95 1aw2 h ILE 192 Cb 0.29 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.15 1aw2 h ILE 192 CO -0.00 0.02 0.26 -0.09 0.00 0.00 0.00 178.15 178.34 1aw2 h ARG 193 N -0.37 0.46 -1.00 2.37 2.43 -1.42 -1.00 114.38 115.86 1aw2 h ARG 193 Ca -0.03 -0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.19 1aw2 h ARG 193 Cb 0.28 -0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 29.65 1aw2 h ARG 193 CO 0.05 0.31 0.64 0.00 -1.51 0.00 0.00 179.97 179.46 1aw2 h ALA 194 N 1.35 1.44 -0.08 2.80 0.00 -0.76 0.47 119.26 124.48 1aw2 h ALA 194 Ca 0.27 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1aw2 h ALA 194 Cb 0.26 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1aw2 h ALA 194 CO -0.23 0.39 -0.09 1.25 0.00 0.00 0.00 179.25 180.56 1aw2 h HIS 195 N 1.12 0.12 0.21 0.00 -0.00 0.36 -1.23 115.15 115.73 1aw2 h HIS 195 Ca 0.44 -0.01 -0.33 0.00 -0.00 0.00 0.00 60.37 60.47 1aw2 h HIS 195 Cb 0.25 -0.04 0.02 0.00 -0.00 0.00 0.00 27.41 27.64 1aw2 h HIS 195 CO -0.00 0.21 -1.54 0.82 -0.00 0.00 0.00 177.93 177.42 1aw2 h ILE 196 N 0.12 1.20 0.00 6.26 2.04 -0.39 -3.25 117.51 123.48 1aw2 h ILE 196 Ca 0.03 -2.70 0.00 0.00 1.00 0.00 0.00 64.86 63.18 1aw2 h ILE 196 Cb 0.24 2.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.24 1aw2 h ILE 196 CO 0.01 0.83 0.00 0.00 0.00 0.00 0.00 178.15 179.00 1aw2 h ALA 197 N 0.23 1.00 -0.02 1.87 0.00 0.94 -0.64 119.26 122.65 1aw2 h ALA 197 Ca -0.27 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.46 1aw2 h ALA 197 Cb 2.12 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 1aw2 h ALA 197 CO 0.23 0.00 -0.79 1.49 0.00 0.00 0.00 179.25 180.18 1aw2 h GLU 198 N 0.00 0.19 0.04 0.00 4.81 -1.35 -3.30 114.58 114.97 1aw2 h GLU 198 Ca 0.00 -0.18 -0.36 0.00 -0.13 0.00 0.00 59.36 58.69 1aw2 h GLU 198 Cb 0.08 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.46 1aw2 h GLU 198 CO 0.00 0.89 -2.17 1.63 -0.73 0.00 0.00 179.01 178.63 1aw2 n LYS 199 N -3.71 0.69 -3.66 1.92 4.76 -0.37 -4.97 118.16 112.82 1aw2 n LYS 199 Ca -0.03 0.19 -0.08 0.00 -2.87 0.00 0.00 58.31 55.52 1aw2 n LYS 199 Cb 0.75 -1.63 -0.08 0.00 -1.84 0.00 0.00 35.03 32.23 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 -6.45 -0.80 0.02 4.39 0.15 -0.47 -5.05 113.70 105.48 1aw2 s SER 200 Ca -0.21 1.30 0.13 0.00 0.70 0.00 0.00 55.95 57.87 1aw2 s SER 200 Cb 0.07 1.23 -0.19 0.00 -1.71 0.00 0.00 66.02 65.42 1aw2 s SER 200 CO 0.74 -0.22 0.82 -0.33 1.20 0.00 0.00 173.24 175.44 1aw2 h GLU 201 N 7.12 0.00 0.15 5.44 5.08 -1.79 -2.96 114.58 127.61 1aw2 h GLU 201 Ca -0.31 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.04 1aw2 h GLU 201 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1aw2 h GLU 201 CO 0.20 0.51 -0.07 0.00 -1.00 0.00 0.00 179.01 178.65 1aw2 h ALA 202 N 1.13 -0.20 0.49 3.43 0.00 -1.95 -0.18 119.26 121.99 1aw2 h ALA 202 Ca -0.20 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1aw2 h ALA 202 Cb 1.84 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.69 1aw2 h ALA 202 CO 0.08 -0.49 -0.42 0.28 0.00 0.00 0.00 179.25 178.70 1aw2 h VAL 203 N -0.43 0.16 -0.71 0.00 2.07 -1.95 -2.65 116.25 112.75 1aw2 h VAL 203 Ca -0.02 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.65 1aw2 h VAL 203 Cb 0.34 0.16 -0.11 0.00 -1.52 0.00 0.00 31.29 30.17 1aw2 h VAL 203 CO 0.03 0.00 0.14 0.00 0.02 0.00 0.00 177.57 177.76 1aw2 h ALA 204 N -0.59 0.87 0.00 1.67 0.00 -1.46 0.12 119.26 119.87 1aw2 h ALA 204 Ca -0.05 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1aw2 h ALA 204 Cb 0.77 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1aw2 h ALA 204 CO -0.02 -0.35 -0.11 1.57 0.00 0.00 0.00 179.25 180.34 1aw2 h LYS 205 N 0.23 0.00 0.00 0.00 2.10 -0.80 -3.17 116.57 114.93 1aw2 h LYS 205 Ca 0.39 0.00 -0.27 0.00 -2.00 0.00 0.00 60.65 58.77 1aw2 h LYS 205 Cb 0.67 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.95 1aw2 h LYS 205 CO -0.52 0.11 -1.77 0.09 -2.00 0.00 0.00 179.45 175.36 1aw2 n ASN 206 N -3.34 0.69 -4.69 7.07 5.03 0.27 -4.79 115.26 115.51 1aw2 n ASN 206 Ca -0.00 0.32 -0.42 0.00 0.87 0.00 0.00 54.58 55.35 1aw2 n ASN 206 Cb 0.31 0.22 -0.03 0.00 -1.02 0.00 0.00 39.78 39.27 1aw2 n ASN 206 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1aw2 s VAL 207 N -2.67 3.15 0.05 2.41 0.11 -0.44 -4.90 120.40 118.11 1aw2 s VAL 207 Ca -0.05 0.56 -0.31 0.00 -2.93 0.00 0.00 61.98 59.25 1aw2 s VAL 207 Cb 0.08 -3.36 -0.06 0.00 -1.53 0.00 0.00 36.38 31.51 1aw2 s VAL 207 CO 0.82 -0.01 1.23 -0.69 -3.33 0.00 0.00 175.10 173.13 1aw2 s VAL 208 N 2.73 3.95 -0.32 2.04 1.01 -1.26 -4.99 120.40 123.57 1aw2 s VAL 208 Ca 0.73 1.39 0.01 0.00 0.00 0.00 0.00 61.98 64.11 1aw2 s VAL 208 Cb -0.38 -3.89 0.10 0.00 0.00 0.00 0.00 36.38 32.20 1aw2 s VAL 208 CO 0.32 0.09 0.07 -0.63 0.00 0.00 0.00 175.10 174.95 1aw2 s ILE 209 N 1.23 1.41 0.53 2.22 1.01 -1.26 -2.14 121.20 124.20 1aw2 s ILE 209 Ca 0.59 -1.73 -0.12 0.00 0.00 0.00 0.00 60.65 59.40 1aw2 s ILE 209 Cb -0.30 -2.04 -0.06 0.00 0.01 0.00 0.00 42.46 40.08 1aw2 s ILE 209 CO 0.29 -0.62 0.93 -1.10 0.00 0.00 0.00 174.94 174.44 1aw2 s GLN 210 N 1.35 3.74 -0.22 2.79 -0.21 0.51 -1.19 119.66 126.43 1aw2 s GLN 210 Ca 0.09 0.69 -0.10 0.00 0.02 0.00 0.00 55.36 56.07 1aw2 s GLN 210 Cb -0.18 -2.20 -0.05 0.00 1.00 0.00 0.00 33.01 31.59 1aw2 s GLN 210 CO -0.18 -0.32 0.13 -0.47 -2.12 0.00 0.00 175.29 172.33 1aw2 s TYR 211 N -2.78 3.30 -0.90 0.91 5.04 -0.86 -1.66 117.35 120.40 1aw2 s TYR 211 Ca 0.55 0.16 0.17 0.00 -2.44 0.00 0.00 57.07 55.51 1aw2 s TYR 211 Cb -0.10 -2.22 0.76 0.00 0.35 0.00 0.00 41.96 40.75 1aw2 s TYR 211 CO 0.41 0.08 1.68 0.41 -1.34 0.00 0.00 175.55 176.79 1aw2 n GLY 212 N 4.09 2.82 0.00 8.97 0.00 0.93 -2.13 105.19 119.87 1aw2 n GLY 212 Ca -0.16 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 44.98 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 1.02 -0.88 3.59 -0.02 0.00 -1.26 -4.62 105.19 103.02 1aw2 n GLY 213 Ca 0.27 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.16 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 -1.00 6.42 -0.08 1.61 0.15 -1.26 -4.85 113.70 114.69 1aw2 s SER 214 Ca 0.00 0.31 0.04 0.00 0.70 0.00 0.00 55.95 57.00 1aw2 s SER 214 Cb 0.00 -2.55 -0.01 0.00 -1.71 0.00 0.00 66.02 61.75 1aw2 s SER 214 CO 0.00 -1.46 -0.23 -0.69 1.20 0.00 0.00 173.24 172.06 1aw2 s VAL 215 N 5.09 2.24 0.33 4.45 1.01 -1.26 -5.04 120.40 127.22 1aw2 s VAL 215 Ca 0.48 -0.98 0.06 0.00 0.00 0.00 0.00 61.98 61.54 1aw2 s VAL 215 Cb -0.09 -1.85 -0.06 0.00 0.00 0.00 0.00 36.38 34.38 1aw2 s VAL 215 CO 0.28 0.56 -0.01 -0.54 0.00 0.00 0.00 175.10 175.40 1aw2 s LYS 216 N 0.05 1.68 0.34 2.72 1.02 -1.26 -4.74 119.74 119.55 1aw2 s LYS 216 Ca -0.09 -1.91 0.14 0.00 0.02 0.00 0.00 55.97 54.14 1aw2 s LYS 216 Cb -0.15 -1.18 1.11 0.00 -0.52 0.00 0.00 37.83 37.08 1aw2 s LYS 216 CO 0.06 -0.05 1.63 -1.35 -0.92 0.00 0.00 175.35 174.71 1aw2 h PRO 217 N 2.10 0.19 -1.04 -1.68 0.11 -1.97 0.11 132.00 129.83 1aw2 h PRO 217 Ca -0.41 -0.01 -0.68 0.00 0.11 0.00 0.00 66.00 65.01 1aw2 h PRO 217 Cb 1.24 -0.04 -0.29 0.00 0.11 0.00 0.00 31.00 32.02 1aw2 h PRO 217 CO 0.71 0.12 0.88 -0.85 -0.21 0.00 0.00 178.00 178.65 1aw2 n GLU 218 N -5.16 2.68 0.07 1.05 0.00 -1.26 -4.01 120.64 114.00 1aw2 n GLU 218 Ca 0.32 -3.26 0.00 0.00 0.00 0.00 0.00 57.16 54.22 1aw2 n GLU 218 Cb 1.03 -2.28 0.00 0.00 0.00 0.00 0.00 31.44 30.19 1aw2 n GLU 218 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1aw2 n ASN 219 N -0.89 0.05 0.00 -1.84 5.03 0.23 -4.94 115.26 112.90 1aw2 n ASN 219 Ca 0.62 0.23 0.00 0.00 0.87 0.00 0.00 54.58 56.31 1aw2 n ASN 219 Cb 0.65 0.14 0.00 0.00 -1.02 0.00 0.00 39.78 39.55 1aw2 n ASN 219 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1aw2 n ALA 220 N -3.09 0.00 0.21 5.41 0.00 -0.35 0.13 120.51 122.82 1aw2 n ALA 220 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1aw2 n ALA 220 Cb 0.05 0.00 0.31 0.00 0.00 0.00 0.00 19.45 19.81 1aw2 n ALA 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aw2 h ALA 221 N 0.00 0.93 -0.37 0.00 0.00 -1.87 0.43 119.26 118.37 1aw2 h ALA 221 Ca 0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 1aw2 h ALA 221 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1aw2 h ALA 221 CO 0.00 0.26 -0.27 0.00 0.00 0.00 0.00 179.25 179.23 1aw2 h ALA 222 N 1.79 0.82 0.08 0.00 0.00 0.68 -2.72 119.26 119.92 1aw2 h ALA 222 Ca -0.00 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1aw2 h ALA 222 Cb 0.93 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1aw2 h ALA 222 CO 0.03 0.64 -0.04 1.88 0.00 0.00 0.00 179.25 181.76 1aw2 h TYR 223 N 0.66 -0.10 0.00 0.00 0.05 -1.09 -3.23 116.97 113.27 1aw2 h TYR 223 Ca 0.08 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.86 1aw2 h TYR 223 Cb 0.80 0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.57 1aw2 h TYR 223 CO 0.04 0.45 0.00 1.19 -1.05 0.00 0.00 178.16 178.79 1aw2 n PHE 224 N -4.81 0.00 0.05 4.88 3.72 0.15 -1.56 117.46 119.88 1aw2 n PHE 224 Ca -0.08 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.16 1aw2 n PHE 224 Cb 0.29 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.69 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 2.17 0.33 -2.79 4.37 0.00 -1.49 -3.41 119.26 118.44 1aw2 h ALA 225 Ca 0.00 -1.16 -0.55 0.00 0.00 0.00 0.00 54.91 53.20 1aw2 h ALA 225 Cb 0.00 0.32 0.10 0.00 0.00 0.00 0.00 17.79 18.22 1aw2 h ALA 225 CO 0.00 1.20 0.75 1.04 0.00 0.00 0.00 179.25 182.24 1aw2 n GLN 226 N -3.42 2.56 0.29 0.00 1.13 -0.60 -4.90 117.38 112.44 1aw2 n GLN 226 Ca -0.17 0.90 0.17 0.00 -1.94 0.00 0.00 57.00 55.96 1aw2 n GLN 226 Cb 1.04 -2.62 0.79 0.00 0.11 0.00 0.00 30.24 29.56 1aw2 n GLN 226 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1aw2 h PRO 227 N 3.42 0.00 -0.07 -1.09 0.13 -1.89 -3.24 132.00 129.25 1aw2 h PRO 227 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1aw2 h PRO 227 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1aw2 h PRO 227 CO 0.68 0.03 0.00 -0.25 -0.23 0.00 0.00 178.00 178.23 1aw2 n ASP 228 N -3.17 2.54 -4.53 1.44 8.00 -1.26 -4.87 116.55 114.70 1aw2 n ASP 228 Ca -0.00 -1.75 -0.41 0.00 0.71 0.00 0.00 54.79 53.34 1aw2 n ASP 228 Cb 0.26 -0.04 -0.10 0.00 -0.02 0.00 0.00 41.12 41.22 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 -1.39 5.23 -0.38 0.53 1.01 -1.23 -4.69 121.20 120.29 1aw2 s ILE 229 Ca 0.22 -0.14 0.16 0.00 0.00 0.00 0.00 60.65 60.88 1aw2 s ILE 229 Cb 0.15 -3.78 0.57 0.00 0.01 0.00 0.00 42.46 39.41 1aw2 s ILE 229 CO 0.22 -0.07 1.48 0.47 0.00 0.00 0.00 174.94 177.04 1aw2 n ASP 230 N 5.23 4.19 0.00 3.58 8.00 -0.33 -4.79 116.55 132.43 1aw2 n ASP 230 Ca -0.11 -2.81 0.00 0.00 0.71 0.00 0.00 54.79 52.58 1aw2 n ASP 230 Cb 0.49 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 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 -0.01 -0.33 3.17 0.44 0.00 -1.26 -2.15 105.19 105.05 1aw2 n GLY 231 Ca 0.22 -1.41 -0.13 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.62 -0.47 4.61 0.00 -1.16 -2.03 121.76 121.09 1aw2 s ALA 232 Ca 0.00 0.40 -0.12 0.00 0.00 0.00 0.00 51.96 52.24 1aw2 s ALA 232 Cb 0.00 -0.14 0.10 0.00 0.00 0.00 0.00 23.12 23.08 1aw2 s ALA 232 CO 0.00 -0.19 0.36 -1.17 0.00 0.00 0.00 175.76 174.76 1aw2 s LEU 233 N -0.70 5.61 -0.03 0.00 2.96 -0.90 -1.00 118.68 124.61 1aw2 s LEU 233 Ca -0.08 -1.61 -0.19 0.00 -0.22 0.00 0.00 54.13 52.03 1aw2 s LEU 233 Cb -0.04 -2.09 -0.05 0.00 0.50 0.00 0.00 46.19 44.51 1aw2 s LEU 233 CO 0.02 -0.67 0.54 -0.69 -1.32 0.00 0.00 176.35 174.23 1aw2 s VAL 234 N 1.50 4.99 0.00 1.68 1.01 0.16 -4.60 120.40 125.14 1aw2 s VAL 234 Ca 0.04 1.11 0.00 0.00 0.00 0.00 0.00 61.98 63.13 1aw2 s VAL 234 Cb -0.25 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1aw2 s VAL 234 CO 0.03 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.16 1aw2 n GLY 235 N 2.52 0.52 0.30 4.51 0.00 -1.26 -0.35 105.19 111.42 1aw2 n GLY 235 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.02 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 1.32 2.00 -0.02 0.00 -1.94 -1.91 103.07 102.52 1aw2 h GLY 236 Ca 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 1aw2 h GLY 236 CO 0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 176.54 176.40 1aw2 h ALA 237 N 1.60 1.30 0.00 3.60 0.00 -1.89 -2.20 119.26 121.67 1aw2 h ALA 237 Ca 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1aw2 h ALA 237 Cb 0.77 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1aw2 h ALA 237 CO -0.44 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.82 1aw2 h ALA 238 N 2.00 1.00 -0.00 0.00 0.00 -1.58 -2.55 119.26 118.12 1aw2 h ALA 238 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aw2 h ALA 238 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1aw2 h ALA 238 CO 0.00 0.00 -0.28 1.28 0.00 0.00 0.00 179.25 180.25 1aw2 n LEU 239 N -2.39 0.73 -4.11 0.00 4.32 -0.83 -4.72 117.00 110.00 1aw2 n LEU 239 Ca 0.01 -0.10 -0.33 0.00 -0.02 0.00 0.00 56.01 55.57 1aw2 n LEU 239 Cb 0.17 -0.19 -0.16 0.00 -1.62 0.00 0.00 43.42 41.62 1aw2 n LEU 239 CO 0.17 0.14 -0.53 -0.62 -1.22 0.00 0.00 177.39 175.34 1aw2 s ASP 240 N -2.66 3.08 0.24 -1.43 2.15 -0.97 -5.02 116.67 112.06 1aw2 s ASP 240 Ca 0.21 -0.63 -0.05 0.00 0.43 0.00 0.00 52.55 52.51 1aw2 s ASP 240 Cb 0.19 -1.44 0.39 0.00 -0.30 0.00 0.00 42.92 41.76 1aw2 s ASP 240 CO 0.56 -0.00 1.77 0.00 -0.17 0.00 0.00 175.17 177.33 1aw2 h ALA 241 N 7.92 1.05 0.82 3.66 0.00 -1.84 0.24 119.26 131.10 1aw2 h ALA 241 Ca -0.44 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1aw2 h ALA 241 Cb 1.14 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.92 1aw2 h ALA 241 CO 0.62 -0.08 -0.39 0.87 0.00 0.00 0.00 179.25 180.27 1aw2 h LYS 242 N 0.58 -1.06 -0.61 0.00 1.79 -1.94 -0.87 116.57 114.46 1aw2 h LYS 242 Ca 0.38 0.07 0.08 0.00 -2.18 0.00 0.00 60.65 59.01 1aw2 h LYS 242 Cb 0.47 0.24 -0.07 0.00 -1.58 0.00 0.00 32.23 31.29 1aw2 h LYS 242 CO -0.31 -0.70 0.26 0.77 -1.08 0.00 0.00 179.45 178.38 1aw2 h SER 243 N -1.28 0.30 -0.26 0.86 0.02 -1.81 -0.44 113.55 110.95 1aw2 h SER 243 Ca -0.11 0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 60.76 1aw2 h SER 243 Cb 0.84 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 1aw2 h SER 243 CO 0.18 0.18 -0.36 0.15 -1.14 0.00 0.00 176.83 175.85 1aw2 h PHE 244 N 0.46 0.94 -0.63 3.45 3.57 -0.82 -2.04 116.94 121.88 1aw2 h PHE 244 Ca 0.30 -0.26 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 1aw2 h PHE 244 Cb 0.33 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 1aw2 h PHE 244 CO -0.14 1.03 0.11 0.00 -2.23 0.00 0.00 178.31 177.08 1aw2 h ALA 245 N 0.94 0.83 0.09 2.41 0.00 -0.69 -1.63 119.26 121.20 1aw2 h ALA 245 Ca 0.06 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1aw2 h ALA 245 Cb 0.91 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1aw2 h ALA 245 CO 0.08 0.58 -0.52 0.00 0.00 0.00 0.00 179.25 179.39 1aw2 h ALA 246 N 1.03 -0.98 -0.85 0.00 0.00 -0.89 0.30 119.26 117.87 1aw2 h ALA 246 Ca 0.19 -0.10 0.16 0.00 0.00 0.00 0.00 54.91 55.16 1aw2 h ALA 246 Cb 0.41 0.91 -0.06 0.00 0.00 0.00 0.00 17.79 19.05 1aw2 h ALA 246 CO 0.01 -1.11 0.56 0.82 0.00 0.00 0.00 179.25 179.52 1aw2 h ILE 247 N -0.71 0.78 -0.17 0.00 2.04 -1.19 0.89 117.51 119.15 1aw2 h ILE 247 Ca -0.00 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.62 1aw2 h ILE 247 Cb 0.73 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1aw2 h ILE 247 CO -0.30 0.10 -0.10 0.00 0.00 0.00 0.00 178.15 177.85 1aw2 h ALA 248 N 1.62 0.24 0.13 1.87 0.00 -0.14 -2.74 119.26 120.22 1aw2 h ALA 248 Ca 0.43 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1aw2 h ALA 248 Cb 0.87 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1aw2 h ALA 248 CO -0.17 0.07 -0.09 0.87 0.00 0.00 0.00 179.25 179.92 1aw2 h LYS 249 N 0.03 -0.21 -0.68 0.00 1.57 0.16 -2.21 116.57 115.21 1aw2 h LYS 249 Ca 0.03 0.01 0.15 0.00 -1.87 0.00 0.00 60.65 58.98 1aw2 h LYS 249 Cb 0.59 0.05 -0.11 0.00 0.08 0.00 0.00 32.23 32.84 1aw2 h LYS 249 CO 0.03 -0.14 0.06 0.00 -0.57 0.00 0.00 179.45 178.83 1aw2 h ALA 250 N 0.64 0.76 -0.15 3.86 0.00 -0.93 0.11 119.26 123.55 1aw2 h ALA 250 Ca -0.01 0.19 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1aw2 h ALA 250 Cb 0.20 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1aw2 h ALA 250 CO -0.00 -0.38 -0.28 0.00 0.00 0.00 0.00 179.25 178.59 1aw2 h ALA 251 N 1.61 1.24 0.49 0.00 0.00 -1.18 -0.95 119.26 120.47 1aw2 h ALA 251 Ca 0.37 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1aw2 h ALA 251 Cb 0.62 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1aw2 h ALA 251 CO -0.55 0.50 -0.24 0.00 0.00 0.00 0.00 179.25 178.97 1aw2 h ALA 252 N 1.46 -0.66 0.42 0.00 0.00 -0.19 -2.41 119.26 117.87 1aw2 h ALA 252 Ca 0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1aw2 h ALA 252 Cb 0.63 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1aw2 h ALA 252 CO 0.05 -0.83 -0.20 1.05 0.00 0.00 0.00 179.25 179.31 1aw2 h GLU 253 N -0.74 -0.54 -1.53 0.00 4.11 -1.41 -3.21 114.58 111.25 1aw2 h GLU 253 Ca -0.07 0.04 0.46 0.00 0.07 0.00 0.00 59.36 59.86 1aw2 h GLU 253 Cb 0.55 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 29.83 1aw2 h GLU 253 CO 0.11 -0.25 1.07 0.00 0.07 0.00 0.00 179.01 180.01 1aw2 h ALA 254 N -0.77 3.25 -0.01 1.06 0.00 -1.25 -3.52 119.26 118.02 1aw2 h ALA 254 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1aw2 h ALA 254 Cb 0.54 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1aw2 h ALA 254 CO 0.09 -1.77 0.00 1.63 0.00 0.00 0.00 179.25 179.21