#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r88 s ALA 34 N 0.00 -2.29 0.31 0.00 0.00 -1.26 -5.10 121.76 113.42 1r88 s ALA 34 Ca 0.00 2.23 -0.29 0.00 0.00 0.00 0.00 51.96 53.89 1r88 s ALA 34 Cb 0.00 -1.77 -0.12 0.00 0.00 0.00 0.00 23.12 21.22 1r88 s ALA 34 CO 0.00 -0.64 1.41 -2.30 0.00 0.00 0.00 175.76 174.23 1r88 n PRO 35 N 4.52 2.28 -4.12 0.00 -0.02 -1.26 -5.03 135.00 131.36 1r88 n PRO 35 Ca -0.15 0.80 -0.08 0.00 -2.02 0.00 0.00 63.50 62.05 1r88 n PRO 35 Cb 0.55 -2.46 -0.10 0.00 -0.02 0.00 0.00 33.50 31.46 1r88 n PRO 35 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1r88 s TYR 36 N -0.58 0.68 0.02 6.00 -0.85 -1.26 -4.97 117.35 116.38 1r88 s TYR 36 Ca 0.60 -1.04 -0.30 0.00 -0.52 0.00 0.00 57.07 55.81 1r88 s TYR 36 Cb -0.57 -0.44 -0.04 0.00 0.38 0.00 0.00 41.96 41.29 1r88 s TYR 36 CO 0.56 -0.32 1.03 -1.21 -1.52 0.00 0.00 175.55 174.09 1r88 s GLU 37 N -3.91 4.54 -1.21 -3.49 2.02 -0.49 -4.89 118.70 111.26 1r88 s GLU 37 Ca 0.10 1.50 -0.11 0.00 0.02 0.00 0.00 54.97 56.49 1r88 s GLU 37 Cb 0.07 -3.43 0.19 0.00 0.10 0.00 0.00 34.13 31.07 1r88 s GLU 37 CO -0.07 -0.09 1.52 0.09 0.02 0.00 0.00 175.26 176.73 1r88 n ASN 38 N 3.86 5.32 -4.76 -0.19 3.02 -1.26 -1.42 115.26 119.83 1r88 n ASN 38 Ca 0.07 -3.05 -0.36 0.00 -0.03 0.00 0.00 54.58 51.20 1r88 n ASN 38 Cb 0.50 -1.50 0.01 0.00 -0.61 0.00 0.00 39.78 38.18 1r88 n ASN 38 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1r88 s LEU 39 N 0.41 3.82 -0.51 3.41 1.43 -0.56 -4.85 118.68 121.83 1r88 s LEU 39 Ca 0.40 2.37 0.02 0.00 -1.03 0.00 0.00 54.13 55.89 1r88 s LEU 39 Cb 0.00 -4.44 0.13 0.00 0.03 0.00 0.00 46.19 41.92 1r88 s LEU 39 CO 0.00 -1.30 0.26 -0.04 0.23 0.00 0.00 176.35 175.50 1r88 s MET 40 N -3.06 2.01 -0.25 1.70 -1.94 -1.26 -1.23 119.30 115.27 1r88 s MET 40 Ca 0.71 -2.47 -0.22 0.00 -1.71 0.00 0.00 55.69 52.00 1r88 s MET 40 Cb -0.30 -3.39 -0.01 0.00 2.01 0.00 0.00 34.83 33.14 1r88 s MET 40 CO 0.34 -1.09 0.71 0.08 -0.01 0.00 0.00 175.02 175.05 1r88 s VAL 41 N -0.02 4.92 0.31 -6.03 1.01 -0.57 -4.78 120.40 115.24 1r88 s VAL 41 Ca 0.16 1.29 -0.30 0.00 0.00 0.00 0.00 61.98 63.13 1r88 s VAL 41 Cb -0.24 -4.01 -0.12 0.00 0.00 0.00 0.00 36.38 32.02 1r88 s VAL 41 CO -0.02 -0.02 1.56 -2.65 0.00 0.00 0.00 175.10 173.97 1r88 n PRO 42 N 5.84 2.67 -3.95 2.72 -0.02 -1.26 -0.77 135.00 140.23 1r88 n PRO 42 Ca 0.02 0.95 -0.30 0.00 -2.02 0.00 0.00 63.50 62.14 1r88 n PRO 42 Cb 0.48 -2.71 -0.14 0.00 -0.02 0.00 0.00 33.50 31.11 1r88 n PRO 42 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1r88 s SER 43 N 0.33 4.35 0.34 2.55 0.15 -0.49 -4.87 113.70 116.06 1r88 s SER 43 Ca 0.61 -2.92 0.11 0.00 0.70 0.00 0.00 55.95 54.45 1r88 s SER 43 Cb -0.50 -1.63 0.89 0.00 -1.71 0.00 0.00 66.02 63.08 1r88 s SER 43 CO 0.52 -0.25 1.76 -0.65 1.20 0.00 0.00 173.24 175.83 1r88 h PRO 44 N 6.61 0.58 -0.22 5.44 0.11 -1.94 0.65 132.00 143.23 1r88 h PRO 44 Ca -0.08 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.91 1r88 h PRO 44 Cb 0.90 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.87 1r88 h PRO 44 CO 0.67 0.38 -0.25 0.77 -0.21 0.00 0.00 178.00 179.36 1r88 h SER 45 N 0.60 0.42 0.36 -2.05 0.02 -1.94 -2.72 113.55 108.24 1r88 h SER 45 Ca 0.60 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.42 1r88 h SER 45 Cb 1.17 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1r88 h SER 45 CO -0.39 0.67 -0.74 0.23 -1.14 0.00 0.00 176.83 175.47 1r88 n MET 46 N -4.13 0.06 -2.03 3.45 2.81 -0.85 -4.80 117.12 111.63 1r88 n MET 46 Ca -0.00 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.79 1r88 n MET 46 Cb 0.40 -1.52 -0.01 0.00 -0.71 0.00 0.00 33.22 31.37 1r88 n MET 46 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1r88 n GLY 47 N 1.47 0.17 3.68 3.03 0.00 0.17 -4.48 105.19 109.23 1r88 n GLY 47 Ca 0.04 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 1r88 n GLY 47 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1r88 s ARG 48 N -4.20 1.59 0.13 1.61 1.70 -1.14 -5.04 118.95 113.60 1r88 s ARG 48 Ca 0.00 -0.79 -0.27 0.00 -0.47 0.00 0.00 55.73 54.21 1r88 s ARG 48 Cb 0.00 0.60 -0.07 0.00 -0.57 0.00 0.00 34.95 34.91 1r88 s ARG 48 CO 0.00 -0.71 0.83 -0.51 -1.08 0.00 0.00 175.30 173.82 1r88 s ASP 49 N -2.85 7.39 -0.23 -2.89 -0.00 -1.26 -1.40 116.67 115.42 1r88 s ASP 49 Ca 0.07 1.65 -0.09 0.00 -0.00 0.00 0.00 52.55 54.19 1r88 s ASP 49 Cb -0.04 -2.52 -0.04 0.00 -0.00 0.00 0.00 42.92 40.32 1r88 s ASP 49 CO -0.01 0.10 0.11 -0.63 -0.00 0.00 0.00 175.17 174.74 1r88 s ILE 50 N -0.62 4.86 0.12 0.77 -1.09 0.05 -4.88 121.20 120.41 1r88 s ILE 50 Ca 0.39 0.01 -0.31 0.00 -2.23 0.00 0.00 60.65 58.51 1r88 s ILE 50 Cb -0.23 -3.26 -0.09 0.00 -1.58 0.00 0.00 42.46 37.31 1r88 s ILE 50 CO 0.27 0.36 1.55 -2.84 -1.23 0.00 0.00 174.94 173.04 1r88 s PRO 51 N 1.15 4.23 -0.16 2.79 0.02 -1.26 -1.52 135.00 140.26 1r88 s PRO 51 Ca 0.06 2.28 -0.02 0.00 0.02 0.00 0.00 61.00 63.33 1r88 s PRO 51 Cb -0.14 -3.31 0.05 0.00 0.02 0.00 0.00 34.50 31.11 1r88 s PRO 51 CO 0.04 -0.61 0.02 0.08 -0.33 0.00 0.00 177.00 176.20 1r88 s VAL 52 N 1.61 0.56 0.02 3.83 1.01 -0.37 -0.70 120.40 126.35 1r88 s VAL 52 Ca 0.70 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 61.98 1r88 s VAL 52 Cb -0.41 -0.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.98 1r88 s VAL 52 CO 0.31 -0.05 1.31 0.00 0.00 0.00 0.00 175.10 176.68 1r88 s ALA 53 N 1.86 3.52 -0.11 5.51 0.00 -0.78 -1.50 121.76 130.26 1r88 s ALA 53 Ca 0.01 0.86 -0.02 0.00 0.00 0.00 0.00 51.96 52.80 1r88 s ALA 53 Cb -0.16 -3.54 0.04 0.00 0.00 0.00 0.00 23.12 19.47 1r88 s ALA 53 CO -0.07 -0.74 0.03 0.12 0.00 0.00 0.00 175.76 175.10 1r88 s PHE 54 N 1.88 0.60 -0.30 0.00 5.36 -0.50 -1.04 117.98 123.99 1r88 s PHE 54 Ca 0.61 -0.29 -0.06 0.00 -0.96 0.00 0.00 56.93 56.23 1r88 s PHE 54 Cb -0.30 -0.80 0.02 0.00 -0.34 0.00 0.00 43.02 41.60 1r88 s PHE 54 CO 0.27 -0.40 0.06 -1.17 -1.46 0.00 0.00 175.22 172.52 1r88 s LEU 55 N 2.00 3.84 0.09 6.12 2.96 -0.57 -1.40 118.68 131.72 1r88 s LEU 55 Ca 0.03 -0.82 -0.31 0.00 -0.22 0.00 0.00 54.13 52.81 1r88 s LEU 55 Cb -0.14 -1.84 -0.07 0.00 0.50 0.00 0.00 46.19 44.63 1r88 s LEU 55 CO -0.06 -0.21 1.39 0.00 -1.32 0.00 0.00 176.35 176.15 1r88 s ALA 56 N 1.45 3.58 0.00 5.97 0.00 -1.26 -1.39 121.76 130.11 1r88 s ALA 56 Ca 0.01 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.05 1r88 s ALA 56 Cb -0.18 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1r88 s ALA 56 CO 0.01 -0.66 0.32 0.41 0.00 0.00 0.00 175.76 175.85 1r88 n GLY 57 N 3.52 -1.59 0.00 0.00 0.00 -1.25 -4.87 105.19 100.99 1r88 n GLY 57 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1r88 n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r88 n GLY 58 N 0.00 2.76 0.28 -0.02 0.00 -1.26 -2.63 105.19 104.32 1r88 n GLY 58 Ca 0.00 -1.54 0.16 0.00 0.00 0.00 0.00 46.02 44.64 1r88 n GLY 58 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1r88 h PRO 59 N 0.00 0.00 -5.97 1.61 0.13 -1.86 -3.35 132.00 122.56 1r88 h PRO 59 Ca 0.00 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.45 1r88 h PRO 59 Cb 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 30.98 1r88 h PRO 59 CO 0.00 0.07 -0.62 -1.01 -0.23 0.00 0.00 178.00 176.21 1r88 s HIS 60 N -3.99 3.18 0.17 1.56 3.76 -1.26 -1.11 115.29 117.60 1r88 s HIS 60 Ca -0.02 0.20 0.08 0.00 -0.15 0.00 0.00 55.06 55.18 1r88 s HIS 60 Cb 0.12 -1.79 -0.04 0.00 1.11 0.00 0.00 32.58 31.97 1r88 s HIS 60 CO 0.54 0.48 -0.18 0.00 -0.85 0.00 0.00 174.74 174.73 1r88 s ALA 61 N -0.90 2.01 -0.21 -1.40 0.00 -1.26 -1.08 121.76 118.92 1r88 s ALA 61 Ca 0.14 -1.51 -0.06 0.00 0.00 0.00 0.00 51.96 50.52 1r88 s ALA 61 Cb -0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.81 1r88 s ALA 61 CO 0.03 0.21 0.02 0.54 0.00 0.00 0.00 175.76 176.56 1r88 s VAL 62 N -2.18 4.13 -0.20 0.00 0.11 -0.50 -1.07 120.40 120.69 1r88 s VAL 62 Ca 0.17 -0.25 -0.20 0.00 -2.93 0.00 0.00 61.98 58.77 1r88 s VAL 62 Cb -0.05 -2.88 -0.03 0.00 -1.53 0.00 0.00 36.38 31.89 1r88 s VAL 62 CO 0.07 0.41 0.60 -0.31 -3.33 0.00 0.00 175.10 172.54 1r88 s TYR 63 N 1.06 3.38 -0.23 1.54 1.51 0.54 -1.53 117.35 123.62 1r88 s TYR 63 Ca 0.03 0.89 -0.08 0.00 -1.01 0.00 0.00 57.07 56.90 1r88 s TYR 63 Cb -0.14 -2.77 -0.04 0.00 -0.11 0.00 0.00 41.96 38.90 1r88 s TYR 63 CO 0.02 -0.15 0.09 -0.51 -1.11 0.00 0.00 175.55 173.88 1r88 s LEU 64 N 1.83 3.66 -0.16 -1.29 1.43 0.51 -0.75 118.68 123.92 1r88 s LEU 64 Ca 0.28 -0.08 -0.01 0.00 -1.03 0.00 0.00 54.13 53.29 1r88 s LEU 64 Cb -0.16 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 1r88 s LEU 64 CO 0.10 0.04 -0.10 -0.76 0.23 0.00 0.00 176.35 175.85 1r88 s LEU 65 N 1.20 2.77 0.92 1.79 1.43 0.40 -4.14 118.68 123.06 1r88 s LEU 65 Ca 0.05 -0.35 -0.12 0.00 -1.03 0.00 0.00 54.13 52.68 1r88 s LEU 65 Cb -0.14 -1.65 0.14 0.00 0.03 0.00 0.00 46.19 44.57 1r88 s LEU 65 CO 0.04 0.11 1.10 -0.62 0.23 0.00 0.00 176.35 177.20 1r88 s ASP 66 N 0.71 3.32 1.14 2.29 -1.08 -1.26 -2.50 116.67 119.29 1r88 s ASP 66 Ca -0.05 1.34 -0.18 0.00 -0.52 0.00 0.00 52.55 53.14 1r88 s ASP 66 Cb -0.15 -2.01 0.25 0.00 -1.46 0.00 0.00 42.92 39.55 1r88 s ASP 66 CO 0.02 -2.71 1.10 0.00 0.52 0.00 0.00 175.17 174.10 1r88 n ALA 67 N -3.92 -2.50 -0.19 3.66 0.00 -1.22 -2.22 120.51 114.13 1r88 n ALA 67 Ca 0.06 -1.55 -0.05 0.00 0.00 0.00 0.00 53.44 51.90 1r88 n ALA 67 Cb 0.56 -0.10 0.05 0.00 0.00 0.00 0.00 19.45 19.97 1r88 n ALA 67 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1r88 h PHE 68 N -2.28 0.62 -0.60 0.00 -1.00 -1.76 -2.90 116.94 109.03 1r88 h PHE 68 Ca -0.39 0.02 -0.71 0.00 2.81 0.00 0.00 57.97 59.70 1r88 h PHE 68 Cb 1.14 -0.20 -0.05 0.00 3.61 0.00 0.00 35.95 40.45 1r88 h PHE 68 CO 0.00 0.35 3.07 0.27 -1.61 0.00 0.00 178.31 180.39 1r88 n ASN 69 N -4.77 7.90 -4.77 2.17 6.94 -1.26 -1.14 115.26 120.33 1r88 n ASN 69 Ca 0.05 -2.87 -0.39 0.00 -0.02 0.00 0.00 54.58 51.34 1r88 n ASN 69 Cb 0.08 -1.47 -0.02 0.00 -2.36 0.00 0.00 39.78 36.01 1r88 n ASN 69 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1r88 s ALA 70 N 0.67 3.26 0.14 -2.53 0.00 -1.09 -4.95 121.76 117.26 1r88 s ALA 70 Ca 0.60 1.01 -0.31 0.00 0.00 0.00 0.00 51.96 53.25 1r88 s ALA 70 Cb 0.17 -3.39 -0.11 0.00 0.00 0.00 0.00 23.12 19.80 1r88 s ALA 70 CO -0.07 -0.49 1.82 0.20 0.00 0.00 0.00 175.76 177.22 1r88 s GLY 71 N -0.97 1.30 0.24 0.00 0.00 -1.26 -4.49 107.32 102.14 1r88 s GLY 71 Ca 0.53 1.49 -0.03 0.00 0.00 0.00 0.00 44.72 46.71 1r88 s GLY 71 CO 0.42 3.11 1.69 -2.55 0.00 0.00 0.00 173.10 175.77 1r88 h PRO 72 N 8.24 0.78 0.00 2.90 0.11 -1.93 -1.79 132.00 140.32 1r88 h PRO 72 Ca -0.46 -0.26 -0.22 0.00 0.11 0.00 0.00 66.00 65.17 1r88 h PRO 72 Cb 1.21 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 1r88 h PRO 72 CO 0.95 0.86 -1.84 -0.25 -0.21 0.00 0.00 178.00 177.52 1r88 n ASP 73 N -4.16 2.55 -3.97 -2.05 8.00 -1.26 -3.01 116.55 112.65 1r88 n ASP 73 Ca 0.01 -0.05 -0.23 0.00 0.71 0.00 0.00 54.79 55.24 1r88 n ASP 73 Cb 0.37 0.16 -0.16 0.00 -0.02 0.00 0.00 41.12 41.46 1r88 n ASP 73 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1r88 s VAL 74 N -2.29 0.89 0.35 2.53 1.01 -1.26 -4.78 120.40 116.84 1r88 s VAL 74 Ca -0.15 -0.33 -0.29 0.00 0.00 0.00 0.00 61.98 61.21 1r88 s VAL 74 Cb 0.05 -0.84 -0.11 0.00 0.00 0.00 0.00 36.38 35.47 1r88 s VAL 74 CO 0.40 0.30 1.51 -0.24 0.00 0.00 0.00 175.10 177.07 1r88 n SER 75 N 3.90 3.73 0.31 3.32 2.88 -1.26 -4.19 113.62 122.30 1r88 n SER 75 Ca -0.24 1.20 0.19 0.00 -1.33 0.00 0.00 58.87 58.69 1r88 n SER 75 Cb 0.51 -1.60 1.01 0.00 -0.75 0.00 0.00 64.21 63.38 1r88 n SER 75 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1r88 h ASN 76 N 3.53 0.00 -0.43 -3.46 2.35 -1.94 -1.67 115.58 113.96 1r88 h ASN 76 Ca -0.49 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 55.31 1r88 h ASN 76 Cb 1.24 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.59 1r88 h ASN 76 CO 0.69 0.02 0.29 -0.50 -1.65 0.00 0.00 177.43 176.28 1r88 h TRP 77 N 0.00 0.36 -0.00 1.19 4.06 -1.94 0.68 115.95 120.30 1r88 h TRP 77 Ca -0.00 0.01 -0.04 0.00 2.06 0.00 0.00 58.89 60.92 1r88 h TRP 77 Cb 0.15 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 28.19 1r88 h TRP 77 CO 0.00 0.20 -0.14 0.28 -3.56 0.00 0.00 178.44 175.21 1r88 h VAL 78 N 0.36 1.57 0.00 1.49 2.07 -1.64 -1.65 116.25 118.45 1r88 h VAL 78 Ca 0.19 -1.88 -0.02 0.00 0.82 0.00 0.00 66.70 65.81 1r88 h VAL 78 Cb 0.29 2.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1r88 h VAL 78 CO -0.04 0.50 -0.25 0.71 0.02 0.00 0.00 177.57 178.51 1r88 h THR 79 N -0.61 0.28 0.00 2.57 1.35 -1.51 -3.27 112.91 111.73 1r88 h THR 79 Ca -0.02 -1.25 -0.08 0.00 -0.55 0.00 0.00 66.41 64.51 1r88 h THR 79 Cb 0.90 0.57 -0.01 0.00 -1.73 0.00 0.00 68.15 67.88 1r88 h THR 79 CO 0.03 0.10 -0.89 0.00 -0.25 0.00 0.00 175.52 174.50 1r88 h ALA 80 N -0.84 0.66 -0.00 6.62 0.00 -1.25 -3.37 119.26 121.08 1r88 h ALA 80 Ca -0.03 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1r88 h ALA 80 Cb 0.37 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1r88 h ALA 80 CO -0.02 0.47 -0.57 0.41 0.00 0.00 0.00 179.25 179.55 1r88 n GLY 81 N 1.26 -0.87 3.56 0.00 0.00 0.03 -4.77 105.19 104.39 1r88 n GLY 81 Ca -0.02 -0.47 -0.26 0.00 0.00 0.00 0.00 46.02 45.27 1r88 n GLY 81 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1r88 n ASN 82 N -1.11 -4.52 -0.15 1.61 4.05 -0.95 -4.63 115.26 109.56 1r88 n ASN 82 Ca 0.07 -0.55 -0.12 0.00 0.45 0.00 0.00 54.58 54.44 1r88 n ASN 82 Cb 0.35 -3.66 -0.01 0.00 1.23 0.00 0.00 39.78 37.69 1r88 n ASN 82 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1r88 h ALA 83 N 0.97 0.64 -0.16 5.20 0.00 -1.48 -2.42 119.26 122.03 1r88 h ALA 83 Ca -0.51 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 53.87 1r88 h ALA 83 Cb 1.34 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1r88 h ALA 83 CO 0.60 0.64 -0.48 0.52 0.00 0.00 0.00 179.25 180.53 1r88 h MET 84 N 0.81 0.42 -0.18 0.00 2.86 -1.85 -1.52 114.93 115.47 1r88 h MET 84 Ca 0.10 -0.23 -0.05 0.00 -2.06 0.00 0.00 59.70 57.45 1r88 h MET 84 Cb 0.82 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.49 1r88 h MET 84 CO 0.07 0.81 -0.09 -0.97 1.06 0.00 0.00 176.91 177.79 1r88 h ASN 85 N 0.33 0.39 -0.60 1.22 -1.24 -1.93 -2.58 115.58 111.17 1r88 h ASN 85 Ca 0.02 -0.42 -0.07 0.00 0.71 0.00 0.00 56.30 56.54 1r88 h ASN 85 Cb 0.97 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.89 1r88 h ASN 85 CO 0.08 0.72 0.08 0.74 -1.29 0.00 0.00 177.43 177.77 1r88 h THR 86 N 0.06 1.26 -0.01 -3.57 2.02 -1.33 -3.32 112.91 108.03 1r88 h THR 86 Ca 0.04 -1.02 0.00 0.00 0.77 0.00 0.00 66.41 66.20 1r88 h THR 86 Cb 0.58 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1r88 h THR 86 CO 0.03 0.37 -0.68 0.18 0.37 0.00 0.00 175.52 175.79 1r88 n LEU 87 N -4.28 1.26 -4.76 2.58 4.77 -0.58 -4.96 117.00 111.02 1r88 n LEU 87 Ca 0.03 -0.61 -0.36 0.00 -0.03 0.00 0.00 56.01 55.04 1r88 n LEU 87 Cb 0.29 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.39 1r88 n LEU 87 CO 0.42 0.27 0.84 0.00 -1.33 0.00 0.00 177.39 177.59 1r88 s ALA 88 N -2.51 2.72 -1.15 -1.18 0.00 -0.97 -3.62 121.76 115.05 1r88 s ALA 88 Ca 0.11 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1r88 s ALA 88 Cb 0.15 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1r88 s ALA 88 CO 0.64 -0.97 0.00 0.41 0.00 0.00 0.00 175.76 175.85 1r88 n GLY 89 N 0.44 0.80 0.47 0.00 0.00 -1.26 -4.90 105.19 100.74 1r88 n GLY 89 Ca 0.11 -0.46 0.05 0.00 0.00 0.00 0.00 46.02 45.72 1r88 n GLY 89 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r88 n LYS 90 N -2.48 1.76 -0.65 1.61 5.02 -1.24 -4.99 118.16 117.19 1r88 n LYS 90 Ca -0.12 -1.57 0.00 0.00 -2.02 0.00 0.00 58.31 54.60 1r88 n LYS 90 Cb 0.46 -1.21 0.00 0.00 -0.02 0.00 0.00 35.03 34.26 1r88 n LYS 90 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r88 n GLY 91 N 0.43 0.67 3.28 0.72 0.00 -1.26 -4.98 105.19 104.05 1r88 n GLY 91 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 1r88 n GLY 91 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1r88 s ILE 92 N -2.00 1.61 0.55 -0.61 -4.36 -1.08 -4.27 121.20 111.03 1r88 s ILE 92 Ca 0.00 -1.63 -0.15 0.00 -0.26 0.00 0.00 60.65 58.61 1r88 s ILE 92 Cb 0.00 -1.56 -0.06 0.00 1.25 0.00 0.00 42.46 42.08 1r88 s ILE 92 CO 0.00 -0.20 1.00 -0.44 0.24 0.00 0.00 174.94 175.55 1r88 s SER 93 N -2.15 6.47 -0.11 4.36 0.01 -0.24 -3.86 113.70 118.17 1r88 s SER 93 Ca 0.08 1.53 0.03 0.00 1.31 0.00 0.00 55.95 58.90 1r88 s SER 93 Cb -0.08 -2.50 -0.00 0.00 0.21 0.00 0.00 66.02 63.65 1r88 s SER 93 CO 0.04 -0.70 -0.21 -0.69 0.41 0.00 0.00 173.24 172.10 1r88 s VAL 94 N -2.80 2.31 -0.11 3.43 1.01 -0.48 -1.41 120.40 122.34 1r88 s VAL 94 Ca 0.58 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 1r88 s VAL 94 Cb -0.10 -1.91 0.03 0.00 0.00 0.00 0.00 36.38 34.40 1r88 s VAL 94 CO 0.39 0.55 -0.03 -0.69 0.00 0.00 0.00 175.10 175.31 1r88 s VAL 95 N 0.37 0.73 -0.37 2.92 1.01 -0.58 -1.51 120.40 122.96 1r88 s VAL 95 Ca -0.16 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1r88 s VAL 95 Cb -0.17 -0.85 0.13 0.00 0.00 0.00 0.00 36.38 35.49 1r88 s VAL 95 CO 0.08 0.27 0.20 0.00 0.00 0.00 0.00 175.10 175.64 1r88 s ALA 96 N 1.82 1.35 0.17 5.51 0.00 -0.20 -0.36 121.76 130.05 1r88 s ALA 96 Ca 0.04 -2.00 -0.30 0.00 0.00 0.00 0.00 51.96 49.71 1r88 s ALA 96 Cb -0.13 -1.68 -0.08 0.00 0.00 0.00 0.00 23.12 21.24 1r88 s ALA 96 CO -0.07 -2.00 1.20 -1.25 0.00 0.00 0.00 175.76 173.63 1r88 s PRO 97 N 1.01 4.49 0.35 0.00 0.04 -1.26 -1.87 135.00 137.75 1r88 s PRO 97 Ca 0.16 1.86 0.05 0.00 0.04 0.00 0.00 61.00 63.10 1r88 s PRO 97 Cb -0.22 -3.25 -0.01 0.00 0.04 0.00 0.00 34.50 31.05 1r88 s PRO 97 CO -0.06 -0.10 0.50 0.00 0.04 0.00 0.00 177.00 177.38 1r88 s ALA 98 N 0.08 4.05 0.00 8.56 0.00 0.12 -4.71 121.76 129.86 1r88 s ALA 98 Ca 0.53 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 51.19 1r88 s ALA 98 Cb -0.32 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 20.98 1r88 s ALA 98 CO 0.36 -0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.46 1r88 n GLY 99 N -1.71 0.83 2.17 0.00 0.00 -0.67 -4.47 105.19 101.34 1r88 n GLY 99 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 1r88 n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r88 n GLY 100 N -2.16 4.66 3.77 -0.02 0.00 -1.26 -4.96 105.19 105.22 1r88 n GLY 100 Ca 0.00 -1.31 -0.40 0.00 0.00 0.00 0.00 46.02 44.31 1r88 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r88 s ALA 101 N -3.18 3.44 -1.38 4.61 0.00 -1.26 -3.57 121.76 120.42 1r88 s ALA 101 Ca 0.55 1.35 -0.01 0.00 0.00 0.00 0.00 51.96 53.84 1r88 s ALA 101 Cb 0.45 -3.52 0.01 0.00 0.00 0.00 0.00 23.12 20.06 1r88 s ALA 101 CO 0.07 -0.82 0.56 0.66 0.00 0.00 0.00 175.76 176.23 1r88 n TYR 102 N 0.49 -1.78 0.00 0.00 4.02 -0.29 -4.87 117.16 114.73 1r88 n TYR 102 Ca 0.01 0.79 0.00 0.00 -0.01 0.00 0.00 57.90 58.70 1r88 n TYR 102 Cb 0.42 -3.98 0.00 0.00 -0.02 0.00 0.00 39.34 35.75 1r88 n TYR 102 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1r88 n SER 103 N -3.00 1.16 -1.12 7.72 3.41 -1.23 -5.01 113.62 115.55 1r88 n SER 103 Ca -0.28 -0.17 -0.11 0.00 -0.26 0.00 0.00 58.87 58.04 1r88 n SER 103 Cb 0.67 0.57 -0.05 0.00 -0.26 0.00 0.00 64.21 65.15 1r88 n SER 103 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1r88 n MET 104 N -0.69 -1.46 -4.29 4.33 2.81 -1.26 -2.86 117.12 113.70 1r88 n MET 104 Ca 0.00 0.74 -0.34 0.00 -1.81 0.00 0.00 57.70 56.29 1r88 n MET 104 Cb 0.00 -4.93 -0.06 0.00 -0.71 0.00 0.00 33.22 27.52 1r88 n MET 104 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1r88 n TYR 105 N -1.83 -1.41 -4.52 2.03 4.02 -1.26 -4.47 117.16 109.72 1r88 n TYR 105 Ca -0.11 0.70 -0.25 0.00 -0.01 0.00 0.00 57.90 58.22 1r88 n TYR 105 Cb 0.45 -2.78 -0.09 0.00 -0.02 0.00 0.00 39.34 36.89 1r88 n TYR 105 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 1r88 s THR 106 N -3.80 0.96 -0.08 -0.72 -1.32 -1.14 -3.67 115.64 105.87 1r88 s THR 106 Ca 0.36 -2.00 -0.24 0.00 -1.21 0.00 0.00 61.69 58.61 1r88 s THR 106 Cb -0.21 -2.53 -0.03 0.00 -1.51 0.00 0.00 72.50 68.22 1r88 s THR 106 CO 0.97 0.00 0.72 0.20 -2.21 0.00 0.00 174.62 174.30 1r88 s ASN 107 N -3.59 6.97 -0.10 8.08 0.01 -1.26 -1.90 114.94 123.16 1r88 s ASN 107 Ca 0.27 1.18 -0.13 0.00 -0.71 0.00 0.00 52.86 53.47 1r88 s ASN 107 Cb 0.05 -2.42 -0.05 0.00 0.41 0.00 0.00 41.25 39.25 1r88 s ASN 107 CO 0.14 -0.16 0.32 0.26 -1.51 0.00 0.00 177.10 176.15 1r88 s TRP 108 N 1.02 3.58 0.38 2.20 0.52 -0.27 -4.82 118.94 121.55 1r88 s TRP 108 Ca 0.37 0.74 0.12 0.00 0.02 0.00 0.00 56.10 57.35 1r88 s TRP 108 Cb -0.18 -2.27 0.75 0.00 -1.15 0.00 0.00 33.47 30.62 1r88 s TRP 108 CO 0.17 0.45 1.86 0.93 0.02 0.00 0.00 176.95 180.38 1r88 h GLU 109 N 5.73 0.07 0.00 4.98 5.08 -0.58 -3.27 114.58 126.60 1r88 h GLU 109 Ca -0.47 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1r88 h GLU 109 Cb 1.19 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1r88 h GLU 109 CO 0.68 0.37 -0.10 1.04 -1.00 0.00 0.00 179.01 180.00 1r88 n GLN 110 N -4.16 1.26 -3.63 2.33 1.13 -0.45 -4.92 117.38 108.94 1r88 n GLN 110 Ca -0.02 -1.96 -0.29 0.00 -1.94 0.00 0.00 57.00 52.79 1r88 n GLN 110 Cb 0.36 -1.16 -0.15 0.00 0.11 0.00 0.00 30.24 29.40 1r88 n GLN 110 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1r88 s ASP 111 N -2.02 3.55 0.58 1.08 -1.08 -1.23 -5.00 116.67 112.54 1r88 s ASP 111 Ca 0.18 -1.30 0.36 0.00 -0.52 0.00 0.00 52.55 51.27 1r88 s ASP 111 Cb 0.16 -0.54 1.66 0.00 -1.46 0.00 0.00 42.92 42.75 1r88 s ASP 111 CO 0.02 -0.41 2.10 1.23 0.52 0.00 0.00 175.17 178.62 1r88 h GLY 112 N 8.29 0.00 1.72 2.66 0.00 -1.92 -2.29 103.07 111.54 1r88 h GLY 112 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1r88 h GLY 112 CO 0.43 0.00 -0.02 -1.14 0.00 0.00 0.00 176.54 175.81 1r88 n SER 113 N -3.15 0.03 -3.93 0.19 3.41 -1.26 -4.16 113.62 104.75 1r88 n SER 113 Ca -0.01 0.13 -0.30 0.00 -0.26 0.00 0.00 58.87 58.44 1r88 n SER 113 Cb 0.24 -0.36 -0.13 0.00 -0.26 0.00 0.00 64.21 63.69 1r88 n SER 113 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1r88 s LYS 114 N -2.78 2.07 -0.49 4.33 1.02 -0.86 -4.92 119.74 118.12 1r88 s LYS 114 Ca 0.21 -2.78 0.08 0.00 0.02 0.00 0.00 55.97 53.51 1r88 s LYS 114 Cb 0.20 -3.30 0.33 0.00 -0.52 0.00 0.00 37.83 34.54 1r88 s LYS 114 CO 0.50 -1.16 0.83 1.04 -0.92 0.00 0.00 175.35 175.64 1r88 n GLN 115 N 2.84 2.15 0.13 1.68 1.13 -1.26 -1.12 117.38 122.94 1r88 n GLN 115 Ca 0.09 -4.17 0.02 0.00 -1.94 0.00 0.00 57.00 51.00 1r88 n GLN 115 Cb 0.33 -1.97 0.02 0.00 0.11 0.00 0.00 30.24 28.72 1r88 n GLN 115 CO 0.00 0.00 0.00 -1.49 -1.44 0.00 0.00 177.06 174.13 1r88 h TRP 116 N 3.10 0.00 -0.33 1.08 4.06 -1.65 -2.17 115.95 120.05 1r88 h TRP 116 Ca 0.12 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 61.01 1r88 h TRP 116 Cb 0.72 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.87 1r88 h TRP 116 CO 0.65 0.52 -0.02 0.22 -3.56 0.00 0.00 178.44 176.26 1r88 h ASP 117 N 0.00 0.59 -0.46 -3.49 3.58 -1.68 -0.42 116.42 114.54 1r88 h ASP 117 Ca -0.01 -0.32 -0.03 0.00 0.42 0.00 0.00 57.03 57.08 1r88 h ASP 117 Cb 1.40 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 42.28 1r88 h ASP 117 CO 0.07 0.77 0.16 0.74 -2.88 0.00 0.00 179.24 178.09 1r88 h THR 118 N 0.39 1.22 -0.04 2.25 2.02 -1.91 -1.26 112.91 115.58 1r88 h THR 118 Ca 0.09 -0.71 -0.00 0.00 0.77 0.00 0.00 66.41 66.56 1r88 h THR 118 Cb 0.48 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.71 1r88 h THR 118 CO 0.02 0.26 0.01 0.15 0.37 0.00 0.00 175.52 176.33 1r88 h PHE 119 N 0.60 0.07 -0.00 3.16 3.57 -1.35 -1.92 116.94 121.06 1r88 h PHE 119 Ca 0.15 -0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.47 1r88 h PHE 119 Cb 0.24 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1r88 h PHE 119 CO 0.01 0.28 -0.81 -0.07 -2.23 0.00 0.00 178.31 175.50 1r88 h LEU 120 N -0.17 0.09 0.00 0.59 3.38 -1.08 0.16 115.31 118.28 1r88 h LEU 120 Ca 0.01 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1r88 h LEU 120 Cb 0.25 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1r88 h LEU 120 CO 0.00 0.86 -0.77 -1.54 0.09 0.00 0.00 178.44 177.08 1r88 n SER 121 N -3.63 0.67 0.05 -0.43 3.41 -0.48 -4.45 113.62 108.76 1r88 n SER 121 Ca -0.02 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.14 1r88 n SER 121 Cb 0.77 0.59 0.00 0.00 -0.26 0.00 0.00 64.21 65.31 1r88 n SER 121 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r88 n ALA 122 N -1.58 2.92 -0.18 7.33 0.00 -0.77 -4.85 120.51 123.38 1r88 n ALA 122 Ca 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.41 1r88 n ALA 122 Cb 0.36 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.83 1r88 n ALA 122 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1r88 h GLU 123 N 0.00 0.71 0.13 0.00 5.08 -1.22 -0.40 114.58 118.87 1r88 h GLU 123 Ca 0.00 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1r88 h GLU 123 Cb 0.00 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.10 1r88 h GLU 123 CO 0.00 0.52 -0.06 1.25 -1.00 0.00 0.00 179.01 179.71 1r88 h LEU 124 N 0.70 -0.14 -1.59 1.33 5.85 -0.95 -1.08 115.31 119.42 1r88 h LEU 124 Ca 0.19 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1r88 h LEU 124 Cb -0.01 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1r88 h LEU 124 CO -0.03 0.34 0.10 1.55 -0.34 0.00 0.00 178.44 180.05 1r88 h PRO 125 N -0.67 0.37 -0.39 5.25 0.13 -1.76 -0.91 132.00 134.01 1r88 h PRO 125 Ca -0.02 -0.04 -0.15 0.00 -0.87 0.00 0.00 66.00 64.92 1r88 h PRO 125 Cb 0.51 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.56 1r88 h PRO 125 CO 0.03 0.31 -0.35 -0.44 -0.23 0.00 0.00 178.00 177.32 1r88 h ASP 126 N 0.37 0.96 -0.44 1.44 3.32 -1.07 -1.51 116.42 119.49 1r88 h ASP 126 Ca 0.09 -0.42 -0.06 0.00 0.02 0.00 0.00 57.03 56.66 1r88 h ASP 126 Cb 0.09 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 1r88 h ASP 126 CO -0.01 1.21 0.03 -0.25 -1.72 0.00 0.00 179.24 178.50 1r88 h TRP 127 N 0.75 0.82 0.00 4.55 7.01 -0.79 -1.32 115.95 126.97 1r88 h TRP 127 Ca 0.07 -0.13 -0.11 0.00 2.11 0.00 0.00 58.89 60.83 1r88 h TRP 127 Cb 0.93 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.76 1r88 h TRP 127 CO 0.06 0.79 -0.53 -0.07 -2.79 0.00 0.00 178.44 175.90 1r88 h LEU 128 N 0.61 0.00 -0.26 0.65 3.38 -1.15 0.12 115.31 118.66 1r88 h LEU 128 Ca 0.13 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.92 1r88 h LEU 128 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1r88 h LEU 128 CO 0.02 0.53 -0.55 0.00 0.09 0.00 0.00 178.44 178.52 1r88 h ALA 129 N 1.47 0.41 0.00 1.53 0.00 -1.16 -1.15 119.26 120.38 1r88 h ALA 129 Ca -0.01 -0.51 -0.19 0.00 0.00 0.00 0.00 54.91 54.20 1r88 h ALA 129 Cb 0.95 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1r88 h ALA 129 CO 0.07 0.63 -0.91 0.00 0.00 0.00 0.00 179.25 179.04 1r88 h ALA 130 N 0.65 0.50 0.00 0.00 0.00 -0.96 -3.29 119.26 116.17 1r88 h ALA 130 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1r88 h ALA 130 Cb 1.16 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1r88 h ALA 130 CO 0.12 1.11 -0.95 0.09 0.00 0.00 0.00 179.25 179.62 1r88 n ASN 131 N -3.48 3.92 -0.02 0.00 3.02 0.39 -4.76 115.26 114.33 1r88 n ASN 131 Ca -0.01 -0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 1r88 n ASN 131 Cb 0.86 1.08 0.00 0.00 -0.61 0.00 0.00 39.78 41.11 1r88 n ASN 131 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1r88 n ARG 132 N -1.49 1.10 -1.23 3.52 5.12 -0.52 -5.02 116.66 118.13 1r88 n ARG 132 Ca -0.00 -0.93 -0.08 0.00 -1.93 0.00 0.00 57.85 54.90 1r88 n ARG 132 Cb 0.05 -0.70 -0.03 0.00 -1.16 0.00 0.00 32.46 30.61 1r88 n ARG 132 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1r88 n GLY 133 N -0.22 1.00 3.84 -0.13 0.00 -0.70 -4.94 105.19 104.04 1r88 n GLY 133 Ca 0.00 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 45.09 1r88 n GLY 133 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r88 s LEU 134 N -1.83 3.49 0.71 0.99 1.43 -0.98 -4.78 118.68 117.71 1r88 s LEU 134 Ca 0.00 1.57 -0.15 0.00 -1.03 0.00 0.00 54.13 54.52 1r88 s LEU 134 Cb 0.00 -4.50 0.03 0.00 0.03 0.00 0.00 46.19 41.75 1r88 s LEU 134 CO 0.00 -0.76 1.18 0.00 0.23 0.00 0.00 176.35 176.99 1r88 s ALA 135 N -2.75 2.22 0.28 4.21 0.00 -0.26 -4.20 121.76 121.25 1r88 s ALA 135 Ca 0.58 0.78 0.05 0.00 0.00 0.00 0.00 51.96 53.38 1r88 s ALA 135 Cb -0.11 -3.42 0.41 0.00 0.00 0.00 0.00 23.12 20.00 1r88 s ALA 135 CO 0.38 -1.70 1.68 -1.00 0.00 0.00 0.00 175.76 175.12 1r88 h PRO 136 N -0.21 0.27 0.00 0.00 0.13 -1.89 -3.45 132.00 126.86 1r88 h PRO 136 Ca -0.47 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1r88 h PRO 136 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1r88 h PRO 136 CO 0.51 0.66 0.00 0.41 -0.23 0.00 0.00 178.00 179.34 1r88 n GLY 137 N -0.13 4.35 2.22 1.56 0.00 -1.26 -4.74 105.19 107.19 1r88 n GLY 137 Ca -0.02 -1.57 -0.09 0.00 0.00 0.00 0.00 46.02 44.34 1r88 n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r88 n GLY 138 N 0.00 0.56 3.96 -0.02 0.00 -1.15 -4.92 105.19 103.62 1r88 n GLY 138 Ca 0.00 -0.57 -0.24 0.00 0.00 0.00 0.00 46.02 45.21 1r88 n GLY 138 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1r88 s HIS 139 N -2.39 2.49 0.07 1.61 3.76 -0.64 -4.60 115.29 115.60 1r88 s HIS 139 Ca 0.00 0.09 0.06 0.00 -0.15 0.00 0.00 55.06 55.06 1r88 s HIS 139 Cb 0.00 -3.03 -0.04 0.00 1.11 0.00 0.00 32.58 30.62 1r88 s HIS 139 CO 0.00 -1.36 -0.11 0.00 -0.85 0.00 0.00 174.74 172.42 1r88 s ALA 140 N -3.08 2.89 -0.07 -1.40 0.00 -0.23 -0.84 121.76 119.04 1r88 s ALA 140 Ca 0.61 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 51.42 1r88 s ALA 140 Cb -0.09 -0.91 0.00 0.00 0.00 0.00 0.00 23.12 22.12 1r88 s ALA 140 CO 0.43 0.62 -0.20 0.00 0.00 0.00 0.00 175.76 176.61 1r88 s ALA 141 N -1.11 1.83 -0.02 0.00 0.00 -0.32 -0.34 121.76 121.80 1r88 s ALA 141 Ca 0.19 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.35 1r88 s ALA 141 Cb -0.11 -0.67 0.01 0.00 0.00 0.00 0.00 23.12 22.36 1r88 s ALA 141 CO 0.11 0.27 0.03 0.08 0.00 0.00 0.00 175.76 176.25 1r88 s VAL 142 N 0.26 -0.02 0.27 0.00 1.01 0.08 -0.47 120.40 121.53 1r88 s VAL 142 Ca -0.12 0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.73 1r88 s VAL 142 Cb -0.15 -0.07 0.02 0.00 0.00 0.00 0.00 36.38 36.18 1r88 s VAL 142 CO 0.05 0.03 0.73 -0.83 0.00 0.00 0.00 175.10 175.09 1r88 s GLY 143 N 0.42 -0.09 0.03 4.51 0.00 -0.72 -0.45 107.32 111.02 1r88 s GLY 143 Ca -0.03 -0.29 0.07 0.00 0.00 0.00 0.00 44.72 44.47 1r88 s GLY 143 CO -0.01 -0.09 -0.19 0.00 0.00 0.00 0.00 173.10 172.81 1r88 s ALA 144 N -3.87 2.53 0.00 3.20 0.00 -1.04 -1.53 121.76 121.05 1r88 s ALA 144 Ca 0.11 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.89 1r88 s ALA 144 Cb -0.06 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.35 1r88 s ALA 144 CO 0.07 0.56 0.00 0.00 0.00 0.00 0.00 175.76 176.39 1r88 n ALA 145 N 1.69 0.00 0.11 0.00 0.00 -0.51 -0.73 120.51 121.08 1r88 n ALA 145 Ca -0.16 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.33 1r88 n ALA 145 Cb 0.52 0.00 0.49 0.00 0.00 0.00 0.00 19.45 20.46 1r88 n ALA 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 1r88 h GLN 146 N 0.00 0.29 -0.05 0.00 3.07 -1.84 -2.04 115.11 114.54 1r88 h GLN 146 Ca 0.00 -0.03 -0.08 0.00 0.09 0.00 0.00 58.65 58.63 1r88 h GLN 146 Cb 0.00 -0.06 -0.01 0.00 0.08 0.00 0.00 27.48 27.49 1r88 h GLN 146 CO 0.00 0.25 -0.34 0.78 0.09 0.00 0.00 178.83 179.61 1r88 h GLY 147 N 0.42 0.09 0.87 0.06 0.00 -0.45 -0.62 103.07 103.44 1r88 h GLY 147 Ca 0.07 -0.08 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 1r88 h GLY 147 CO -0.01 0.07 -0.10 -1.33 0.00 0.00 0.00 176.54 175.17 1r88 h GLY 148 N 1.07 0.58 0.62 4.60 0.00 -1.28 -1.37 103.07 107.30 1r88 h GLY 148 Ca 0.01 -0.50 0.04 0.00 0.00 0.00 0.00 47.33 46.88 1r88 h GLY 148 CO 0.05 0.46 0.05 -1.82 0.00 0.00 0.00 176.54 175.28 1r88 h TYR 149 N 0.27 0.09 -0.47 5.60 3.20 -1.37 -2.97 116.97 121.32 1r88 h TYR 149 Ca 0.06 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.97 1r88 h TYR 149 Cb 0.59 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.84 1r88 h TYR 149 CO 0.06 0.01 0.29 0.78 -1.64 0.00 0.00 178.16 177.66 1r88 h GLY 150 N 0.16 0.67 0.98 1.82 0.00 -0.94 -0.75 103.07 105.01 1r88 h GLY 150 Ca 0.14 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 1r88 h GLY 150 CO -0.20 0.20 0.26 0.00 0.00 0.00 0.00 176.54 176.81 1r88 h ALA 151 N 1.20 0.68 -0.40 3.60 0.00 -1.25 -0.37 119.26 122.73 1r88 h ALA 151 Ca 0.19 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1r88 h ALA 151 Cb -0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1r88 h ALA 151 CO -0.07 0.23 -0.34 1.98 0.00 0.00 0.00 179.25 181.05 1r88 h MET 152 N 0.71 0.92 -0.43 0.00 -1.53 -1.30 -2.41 114.93 110.89 1r88 h MET 152 Ca 0.18 -0.46 -0.13 0.00 -3.44 0.00 0.00 59.70 55.85 1r88 h MET 152 Cb 0.10 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.14 1r88 h MET 152 CO -0.02 1.12 -0.25 0.00 0.14 0.00 0.00 176.91 177.89 1r88 h ALA 153 N 0.83 0.74 -0.44 0.39 0.00 -1.00 -1.65 119.26 118.13 1r88 h ALA 153 Ca 0.07 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1r88 h ALA 153 Cb 0.93 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1r88 h ALA 153 CO 0.09 0.66 0.26 -0.07 0.00 0.00 0.00 179.25 180.19 1r88 h LEU 154 N 0.77 0.53 -0.62 0.00 3.38 -0.96 -2.22 115.31 116.19 1r88 h LEU 154 Ca 0.10 -0.06 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 1r88 h LEU 154 Cb 0.81 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1r88 h LEU 154 CO 0.07 0.43 -0.58 0.00 0.09 0.00 0.00 178.44 178.45 1r88 h ALA 155 N 1.12 0.81 -0.32 1.53 0.00 -1.38 -0.01 119.26 121.00 1r88 h ALA 155 Ca 0.16 -0.53 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1r88 h ALA 155 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1r88 h ALA 155 CO -0.03 0.71 0.04 0.00 0.00 0.00 0.00 179.25 179.97 1r88 h ALA 156 N 1.12 0.43 -0.00 0.00 0.00 -1.10 -2.98 119.26 116.72 1r88 h ALA 156 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1r88 h ALA 156 Cb 1.09 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1r88 h ALA 156 CO 0.10 0.14 -0.74 1.19 0.00 0.00 0.00 179.25 179.93 1r88 n PHE 157 N -4.59 0.00 -3.17 0.00 3.01 -0.85 -4.52 117.46 107.34 1r88 n PHE 157 Ca -0.02 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.25 1r88 n PHE 157 Cb 0.23 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.67 1r88 n PHE 157 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 1r88 n HIS 158 N -0.98 0.56 0.27 1.38 8.25 -0.02 -4.95 115.22 119.73 1r88 n HIS 158 Ca 0.05 -3.83 0.12 0.00 -0.26 0.00 0.00 57.72 53.81 1r88 n HIS 158 Cb 0.34 -0.42 0.74 0.00 1.12 0.00 0.00 29.99 31.77 1r88 n HIS 158 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1r88 h PRO 159 N 3.06 0.00 -0.61 -0.41 0.13 -1.71 -1.70 132.00 130.76 1r88 h PRO 159 Ca 0.10 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.29 1r88 h PRO 159 Cb 0.92 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.01 1r88 h PRO 159 CO 0.53 0.10 0.41 0.38 -0.23 0.00 0.00 178.00 179.19 1r88 h ASP 160 N 0.00 0.55 0.27 1.44 2.03 -1.92 -3.21 116.42 115.58 1r88 h ASP 160 Ca -0.00 -0.00 -0.33 0.00 -0.73 0.00 0.00 57.03 55.96 1r88 h ASP 160 Cb 0.26 -0.12 -0.04 0.00 -0.83 0.00 0.00 39.33 38.60 1r88 h ASP 160 CO 0.01 0.36 -1.94 0.54 -1.03 0.00 0.00 179.24 177.19 1r88 n ARG 161 N -4.47 0.69 -3.87 4.15 5.12 -0.68 -3.49 116.66 114.10 1r88 n ARG 161 Ca 0.08 0.25 -0.28 0.00 -1.93 0.00 0.00 57.85 55.97 1r88 n ARG 161 Cb 0.21 -1.72 -0.16 0.00 -1.16 0.00 0.00 32.46 29.63 1r88 n ARG 161 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1r88 s PHE 162 N -2.57 1.61 -2.64 -1.55 0.08 -0.95 -1.62 117.98 110.35 1r88 s PHE 162 Ca -0.14 -1.03 0.24 0.00 0.12 0.00 0.00 56.93 56.11 1r88 s PHE 162 Cb 0.07 -1.27 0.47 0.00 -0.57 0.00 0.00 43.02 41.72 1r88 s PHE 162 CO 0.79 -0.60 1.42 0.41 -0.10 0.00 0.00 175.22 177.13 1r88 n GLY 163 N 4.90 1.04 2.94 4.36 0.00 -0.02 -4.46 105.19 113.95 1r88 n GLY 163 Ca -0.11 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 1r88 n GLY 163 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1r88 s PHE 164 N -1.78 -0.13 -0.07 1.61 5.36 -1.15 -1.99 117.98 119.83 1r88 s PHE 164 Ca 0.34 0.36 0.01 0.00 -0.96 0.00 0.00 56.93 56.67 1r88 s PHE 164 Cb 0.21 -0.03 0.02 0.00 -0.34 0.00 0.00 43.02 42.88 1r88 s PHE 164 CO 0.31 -0.11 -0.06 0.00 -1.46 0.00 0.00 175.22 173.90 1r88 s ALA 165 N 0.61 0.93 -0.09 11.12 0.00 -0.25 -1.17 121.76 132.91 1r88 s ALA 165 Ca -0.05 -0.24 0.04 0.00 0.00 0.00 0.00 51.96 51.71 1r88 s ALA 165 Cb -0.06 -0.60 0.00 0.00 0.00 0.00 0.00 23.12 22.45 1r88 s ALA 165 CO -0.03 -0.14 -0.22 0.20 0.00 0.00 0.00 175.76 175.57 1r88 s GLY 166 N 1.20 1.21 -0.07 0.00 0.00 0.38 -1.06 107.32 108.99 1r88 s GLY 166 Ca -0.06 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 43.82 1r88 s GLY 166 CO -0.02 -0.28 -0.12 -0.45 0.00 0.00 0.00 173.10 172.23 1r88 s SER 167 N 0.34 1.83 -0.16 1.64 0.15 0.16 -1.75 113.70 115.91 1r88 s SER 167 Ca -0.16 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 56.20 1r88 s SER 167 Cb -0.17 -0.85 0.02 0.00 -1.71 0.00 0.00 66.02 63.31 1r88 s SER 167 CO 0.07 0.03 -0.20 -0.04 1.20 0.00 0.00 173.24 174.30 1r88 s MET 168 N 0.71 2.94 -1.54 5.44 -1.94 -0.58 -0.72 119.30 123.60 1r88 s MET 168 Ca -0.14 -0.82 -0.10 0.00 -1.71 0.00 0.00 55.69 52.92 1r88 s MET 168 Cb -0.16 -2.46 0.08 0.00 2.01 0.00 0.00 34.83 34.31 1r88 s MET 168 CO 0.03 -0.11 0.70 0.43 -0.01 0.00 0.00 175.02 176.06 1r88 n SER 169 N 4.36 -2.48 -4.87 3.03 7.64 -0.43 -1.42 113.62 119.45 1r88 n SER 169 Ca -0.20 -0.95 -0.32 0.00 1.01 0.00 0.00 58.87 58.40 1r88 n SER 169 Cb 0.51 -3.18 -0.05 0.00 -1.01 0.00 0.00 64.21 60.47 1r88 n SER 169 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1r88 s GLY 170 N -3.73 2.31 -1.23 0.23 0.00 -1.26 -3.07 107.32 100.57 1r88 s GLY 170 Ca 0.43 -0.26 -0.12 0.00 0.00 0.00 0.00 44.72 44.77 1r88 s GLY 170 CO 0.89 -0.09 1.56 0.69 0.00 0.00 0.00 173.10 176.14 1r88 n PHE 171 N 0.03 4.35 1.76 1.90 3.72 -1.23 -4.30 117.46 123.68 1r88 n PHE 171 Ca -0.01 -3.20 0.15 0.00 -0.05 0.00 0.00 57.45 54.35 1r88 n PHE 171 Cb 0.52 -2.09 0.76 0.00 -0.94 0.00 0.00 39.48 37.74 1r88 n PHE 171 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1r88 n LEU 172 N 4.95 0.57 -3.18 4.37 4.77 -1.26 -3.93 117.00 123.29 1r88 n LEU 172 Ca 0.37 -0.17 -0.19 0.00 -0.03 0.00 0.00 56.01 55.99 1r88 n LEU 172 Cb 0.40 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 1r88 n LEU 172 CO 0.68 0.10 -0.22 0.00 -1.33 0.00 0.00 177.39 176.61 1r88 n TYR 173 N -0.59 0.30 0.21 -1.77 -0.00 -1.26 -2.45 117.16 111.59 1r88 n TYR 173 Ca 0.21 -3.81 0.05 0.00 -0.00 0.00 0.00 57.90 54.35 1r88 n TYR 173 Cb 0.21 -0.42 0.45 0.00 -0.00 0.00 0.00 39.34 39.58 1r88 n TYR 173 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.86 175.86 1r88 h PRO 174 N 3.08 0.00 0.00 2.98 0.13 -1.94 -2.61 132.00 133.64 1r88 h PRO 174 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1r88 h PRO 174 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1r88 h PRO 174 CO 0.51 0.30 0.00 -1.13 -0.23 0.00 0.00 178.00 177.45 1r88 n SER 175 N -3.98 0.21 -4.52 1.44 3.41 -1.26 -2.43 113.62 106.49 1r88 n SER 175 Ca -0.02 0.52 -0.44 0.00 -0.26 0.00 0.00 58.87 58.67 1r88 n SER 175 Cb 0.36 -0.58 -0.01 0.00 -0.26 0.00 0.00 64.21 63.73 1r88 n SER 175 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1r88 n ASN 176 N -1.70 0.22 -0.14 4.04 5.15 -0.98 -4.68 115.26 117.17 1r88 n ASN 176 Ca 0.06 1.08 -0.06 0.00 -0.60 0.00 0.00 54.58 55.06 1r88 n ASN 176 Cb 0.34 -1.18 -0.00 0.00 -0.53 0.00 0.00 39.78 38.41 1r88 n ASN 176 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 1r88 h THR 177 N 1.44 0.27 -0.02 -0.44 2.02 -1.90 -1.09 112.91 113.19 1r88 h THR 177 Ca -0.38 0.00 -0.23 0.00 0.77 0.00 0.00 66.41 66.57 1r88 h THR 177 Cb 1.37 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1r88 h THR 177 CO 0.57 0.00 -0.92 0.71 0.37 0.00 0.00 175.52 176.25 1r88 h THR 178 N -0.20 1.37 -0.59 3.16 1.35 -1.95 -3.35 112.91 112.71 1r88 h THR 178 Ca 0.20 -2.35 -0.09 0.00 -0.55 0.00 0.00 66.41 63.62 1r88 h THR 178 Cb 0.51 2.35 -0.02 0.00 -1.73 0.00 0.00 68.15 69.26 1r88 h THR 178 CO -0.55 0.71 0.02 0.74 -0.25 0.00 0.00 175.52 176.18 1r88 h THR 179 N 0.28 1.26 -0.09 6.82 2.02 -1.64 -2.19 112.91 119.37 1r88 h THR 179 Ca -0.08 -1.10 -0.10 0.00 0.77 0.00 0.00 66.41 65.90 1r88 h THR 179 Cb 1.55 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 1r88 h THR 179 CO 0.16 0.40 -0.40 -0.55 0.37 0.00 0.00 175.52 175.51 1r88 h ASN 180 N 0.93 0.20 0.08 4.18 7.08 -0.88 0.44 115.58 127.60 1r88 h ASN 180 Ca 0.17 -0.08 -0.14 0.00 -3.08 0.00 0.00 56.30 53.17 1r88 h ASN 180 Cb 0.51 -0.05 -0.01 0.00 -2.08 0.00 0.00 38.32 36.69 1r88 h ASN 180 CO 0.02 0.58 -0.49 1.23 -2.08 0.00 0.00 177.43 176.70 1r88 h GLY 181 N 1.21 0.51 1.17 9.14 0.00 -1.66 -2.49 103.07 110.95 1r88 h GLY 181 Ca 0.02 -0.56 -0.21 0.00 0.00 0.00 0.00 47.33 46.58 1r88 h GLY 181 CO 0.06 0.50 -0.68 0.00 0.00 0.00 0.00 176.54 176.42 1r88 h ALA 182 N 1.10 0.38 -0.45 3.60 0.00 -0.78 -2.26 119.26 120.84 1r88 h ALA 182 Ca 0.02 -0.56 -0.08 0.00 0.00 0.00 0.00 54.91 54.28 1r88 h ALA 182 Cb 0.99 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1r88 h ALA 182 CO 0.09 0.68 -0.05 0.82 0.00 0.00 0.00 179.25 180.79 1r88 h ILE 183 N 0.60 1.27 -0.59 0.00 2.04 -0.98 -1.34 117.51 118.51 1r88 h ILE 183 Ca -0.02 -1.13 0.01 0.00 1.00 0.00 0.00 64.86 64.72 1r88 h ILE 183 Cb 1.30 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 38.44 1r88 h ILE 183 CO 0.14 0.39 0.38 0.00 0.00 0.00 0.00 178.15 179.07 1r88 h ALA 184 N 0.89 0.75 -0.37 1.87 0.00 -1.45 -0.44 119.26 120.51 1r88 h ALA 184 Ca 0.12 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 1r88 h ALA 184 Cb 0.57 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1r88 h ALA 184 CO 0.03 0.16 -0.34 0.00 0.00 0.00 0.00 179.25 179.10 1r88 h ALA 185 N 1.23 0.54 -0.16 0.00 0.00 -1.27 -2.53 119.26 117.06 1r88 h ALA 185 Ca 0.22 -0.43 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 1r88 h ALA 185 Cb -0.06 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1r88 h ALA 185 CO -0.06 0.61 -0.61 0.78 0.00 0.00 0.00 179.25 179.98 1r88 h GLY 186 N 0.70 0.60 1.84 0.00 0.00 -1.12 -1.75 103.07 103.34 1r88 h GLY 186 Ca 0.06 -0.75 -0.11 0.00 0.00 0.00 0.00 47.33 46.54 1r88 h GLY 186 CO 0.09 0.67 -0.44 -0.33 0.00 0.00 0.00 176.54 176.52 1r88 h MET 187 N 0.41 0.17 -0.07 4.80 2.86 -1.07 -1.44 114.93 120.59 1r88 h MET 187 Ca -0.01 -0.09 -0.16 0.00 -2.06 0.00 0.00 59.70 57.39 1r88 h MET 187 Cb 1.17 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.84 1r88 h MET 187 CO 0.11 0.59 -0.59 0.37 1.06 0.00 0.00 176.91 178.45 1r88 h GLN 188 N 0.15 0.53 -0.05 1.72 5.75 -1.38 -1.29 115.11 120.53 1r88 h GLN 188 Ca 0.01 -0.47 -0.01 0.00 -0.15 0.00 0.00 58.65 58.03 1r88 h GLN 188 Cb 0.84 0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.50 1r88 h GLN 188 CO 0.07 1.10 0.00 0.37 -2.65 0.00 0.00 178.83 177.72 1r88 h GLN 189 N 0.11 0.08 0.02 1.69 4.15 -1.20 -2.16 115.11 117.81 1r88 h GLN 189 Ca -0.05 -0.02 -0.35 0.00 0.77 0.00 0.00 58.65 58.99 1r88 h GLN 189 Cb 1.26 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.88 1r88 h GLN 189 CO 0.12 0.34 -2.13 1.19 -1.93 0.00 0.00 178.83 176.42 1r88 n PHE 190 N -4.90 0.54 0.33 3.99 3.01 -0.55 -4.52 117.46 115.36 1r88 n PHE 190 Ca -0.07 0.16 0.09 0.00 1.01 0.00 0.00 57.45 58.64 1r88 n PHE 190 Cb 0.17 -1.09 -0.13 0.00 -0.01 0.00 0.00 39.48 38.42 1r88 n PHE 190 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1r88 n GLY 191 N 1.84 -0.81 2.33 1.37 0.00 -0.58 -5.00 105.19 104.35 1r88 n GLY 191 Ca -0.30 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.09 1r88 n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r88 n GLY 192 N 1.43 0.30 3.40 -0.02 0.00 -0.68 -4.96 105.19 104.67 1r88 n GLY 192 Ca -0.01 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 1r88 n GLY 192 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r88 s VAL 193 N -2.69 2.25 -0.31 1.61 -7.23 -1.05 -4.95 120.40 108.02 1r88 s VAL 193 Ca 0.00 -1.96 -0.08 0.00 -1.81 0.00 0.00 61.98 58.13 1r88 s VAL 193 Cb 0.00 -2.05 0.01 0.00 0.56 0.00 0.00 36.38 34.90 1r88 s VAL 193 CO 0.00 -0.10 0.13 -0.62 -0.31 0.00 0.00 175.10 174.19 1r88 s ASP 194 N -2.54 5.39 0.00 4.85 -1.08 -1.26 -3.09 116.67 118.94 1r88 s ASP 194 Ca 0.18 -0.70 0.21 0.00 -0.52 0.00 0.00 52.55 51.73 1r88 s ASP 194 Cb -0.08 -1.95 1.07 0.00 -1.46 0.00 0.00 42.92 40.50 1r88 s ASP 194 CO 0.09 -0.23 1.69 0.35 0.52 0.00 0.00 175.17 177.59 1r88 n THR 195 N 4.93 0.35 0.09 1.71 -2.24 -1.26 -1.91 114.28 115.94 1r88 n THR 195 Ca -0.14 0.09 0.08 0.00 -2.27 0.00 0.00 64.05 61.81 1r88 n THR 195 Cb 0.48 -0.73 0.54 0.00 -2.10 0.00 0.00 70.33 68.52 1r88 n THR 195 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1r88 h ASN 196 N 0.00 0.24 0.87 3.42 4.21 -1.94 -1.95 115.58 120.43 1r88 h ASN 196 Ca 0.00 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1r88 h ASN 196 Cb 0.22 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.36 1r88 h ASN 196 CO 0.00 0.17 0.00 0.61 -1.29 0.00 0.00 177.43 176.92 1r88 n GLY 197 N -1.52 -1.38 0.01 2.83 0.00 -0.80 -1.63 105.19 102.70 1r88 n GLY 197 Ca 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 46.02 45.95 1r88 n GLY 197 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1r88 h MET 198 N 0.00 0.00 0.00 1.61 -1.53 -1.50 -1.00 114.93 112.51 1r88 h MET 198 Ca 0.00 0.00 -0.02 0.00 -3.44 0.00 0.00 59.70 56.24 1r88 h MET 198 Cb 0.44 0.00 -0.05 0.00 -0.55 0.00 0.00 31.60 31.43 1r88 h MET 198 CO 0.00 0.00 -0.39 0.91 0.14 0.00 0.00 176.91 177.57 1r88 n TRP 199 N -2.46 0.00 -0.02 1.39 8.01 -1.19 -1.67 117.44 121.49 1r88 n TRP 199 Ca -0.00 -1.00 0.00 0.00 -1.31 0.00 0.00 57.50 55.19 1r88 n TRP 199 Cb 0.01 -0.18 -0.00 0.00 -2.01 0.00 0.00 31.31 29.13 1r88 n TRP 199 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1r88 n GLY 200 N -0.88 -1.84 3.74 6.99 0.00 -0.65 -4.26 105.19 108.29 1r88 n GLY 200 Ca 0.14 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 1r88 n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r88 n ALA 201 N -2.27 2.64 0.28 4.61 0.00 -1.26 -4.42 120.51 120.10 1r88 n ALA 201 Ca -0.00 0.38 0.17 0.00 0.00 0.00 0.00 53.44 53.99 1r88 n ALA 201 Cb 0.01 -2.48 0.87 0.00 0.00 0.00 0.00 19.45 17.85 1r88 n ALA 201 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1r88 h PRO 202 N 5.46 0.00 0.00 0.00 0.13 -1.93 -1.95 132.00 133.71 1r88 h PRO 202 Ca -0.46 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 1r88 h PRO 202 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1r88 h PRO 202 CO 0.85 0.00 -0.20 1.96 -0.23 0.00 0.00 178.00 180.38 1r88 h GLN 203 N 0.00 0.00 0.00 0.86 7.50 -1.97 -2.68 115.11 118.81 1r88 h GLN 203 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1r88 h GLN 203 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.64 1r88 h GLN 203 CO 0.00 0.20 0.00 -0.07 -1.50 0.00 0.00 178.83 177.46 1r88 h LEU 204 N 0.00 0.00 0.00 1.46 3.38 -1.72 -3.47 115.31 114.95 1r88 h LEU 204 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1r88 h LEU 204 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1r88 h LEU 204 CO 0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.17 1r88 n GLY 205 N 0.41 0.66 0.06 0.83 0.00 -1.01 -4.96 105.19 101.18 1r88 n GLY 205 Ca 0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.17 1r88 n GLY 205 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r88 n ARG 206 N -2.04 0.14 0.06 1.61 1.74 -1.26 -3.10 116.66 113.81 1r88 n ARG 206 Ca 0.00 0.15 0.02 0.00 -0.77 0.00 0.00 57.85 57.25 1r88 n ARG 206 Cb 0.00 -1.68 0.37 0.00 -1.02 0.00 0.00 32.46 30.13 1r88 n ARG 206 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1r88 h TRP 207 N 0.00 0.40 -0.11 -1.55 4.06 -1.87 -2.51 115.95 114.37 1r88 h TRP 207 Ca 0.00 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.91 1r88 h TRP 207 Cb 0.58 -0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 28.62 1r88 h TRP 207 CO 0.00 0.41 0.03 0.87 -3.56 0.00 0.00 178.44 176.20 1r88 h LYS 208 N 0.38 0.15 -0.48 0.49 1.57 -1.89 -2.82 116.57 113.96 1r88 h LYS 208 Ca 0.08 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.92 1r88 h LYS 208 Cb 0.28 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 1r88 h LYS 208 CO 0.01 0.14 0.33 -1.49 -0.57 0.00 0.00 179.45 177.87 1r88 h TRP 209 N 0.15 0.39 -0.51 -1.35 4.06 -1.63 -2.85 115.95 114.21 1r88 h TRP 209 Ca 0.04 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.00 1r88 h TRP 209 Cb 0.06 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.09 1r88 h TRP 209 CO 0.00 0.21 0.00 0.72 -3.56 0.00 0.00 178.44 175.81 1r88 n HIS 210 N -4.47 0.82 -3.59 0.49 8.25 -1.07 -4.99 115.22 110.66 1r88 n HIS 210 Ca 0.07 -0.55 -0.39 0.00 -0.26 0.00 0.00 57.72 56.59 1r88 n HIS 210 Cb 0.27 -0.07 -0.11 0.00 1.12 0.00 0.00 29.99 31.19 1r88 n HIS 210 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1r88 s ASP 211 N -1.06 5.89 0.44 0.41 -1.08 -1.08 -4.87 116.67 115.32 1r88 s ASP 211 Ca 0.37 -0.24 0.24 0.00 -0.52 0.00 0.00 52.55 52.40 1r88 s ASP 211 Cb 0.21 -2.09 0.89 0.00 -1.46 0.00 0.00 42.92 40.47 1r88 s ASP 211 CO 0.22 -0.13 1.81 1.55 0.52 0.00 0.00 175.17 179.15 1r88 h PRO 212 N 8.40 0.00 0.12 4.34 0.13 -1.90 -1.59 132.00 141.50 1r88 h PRO 212 Ca -0.34 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.79 1r88 h PRO 212 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1r88 h PRO 212 CO 0.59 0.23 -0.06 2.35 -0.23 0.00 0.00 178.00 180.88 1r88 h TRP 213 N 0.00 -0.16 -0.69 1.56 7.01 -1.86 -1.09 115.95 120.72 1r88 h TRP 213 Ca -0.00 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.99 1r88 h TRP 213 Cb 0.76 0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.84 1r88 h TRP 213 CO 0.00 0.06 0.43 0.28 -2.79 0.00 0.00 178.44 176.42 1r88 h VAL 214 N -0.36 1.19 -0.79 2.65 2.07 -1.80 -2.83 116.25 116.38 1r88 h VAL 214 Ca -0.02 -0.39 -0.54 0.00 0.82 0.00 0.00 66.70 66.57 1r88 h VAL 214 Cb 0.29 0.20 -0.33 0.00 -1.52 0.00 0.00 31.29 29.93 1r88 h VAL 214 CO 0.03 0.19 -0.07 1.41 0.02 0.00 0.00 177.57 179.15 1r88 n HIS 215 N -4.41 2.70 0.25 1.57 8.25 -0.62 -4.69 115.22 118.27 1r88 n HIS 215 Ca 0.07 -2.43 0.12 0.00 -0.26 0.00 0.00 57.72 55.23 1r88 n HIS 215 Cb 0.06 -0.78 0.67 0.00 1.12 0.00 0.00 29.99 31.05 1r88 n HIS 215 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1r88 h ALA 216 N 1.92 1.20 -0.24 -1.41 0.00 -0.93 -2.40 119.26 117.41 1r88 h ALA 216 Ca 0.44 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 1r88 h ALA 216 Cb 1.32 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1r88 h ALA 216 CO 1.02 0.18 0.07 1.03 0.00 0.00 0.00 179.25 181.55 1r88 h SER 217 N 0.00 0.29 -0.12 0.00 0.87 -1.86 -1.79 113.55 110.95 1r88 h SER 217 Ca -0.00 -0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1r88 h SER 217 Cb 0.44 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 1r88 h SER 217 CO 0.02 0.29 0.07 -0.07 -0.53 0.00 0.00 176.83 176.61 1r88 h LEU 218 N 0.33 0.14 -0.91 2.23 3.38 -1.78 -1.71 115.31 116.98 1r88 h LEU 218 Ca 0.08 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1r88 h LEU 218 Cb 0.11 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1r88 h LEU 218 CO -0.01 0.14 0.31 -0.07 0.09 0.00 0.00 178.44 178.90 1r88 h LEU 219 N 0.13 1.01 -0.11 1.67 3.38 -1.54 -1.90 115.31 117.95 1r88 h LEU 219 Ca 0.04 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1r88 h LEU 219 Cb 0.02 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1r88 h LEU 219 CO -0.01 0.89 -0.05 0.00 0.09 0.00 0.00 178.44 179.36 1r88 h ALA 220 N 1.26 0.15 0.00 1.53 0.00 -1.22 -2.49 119.26 118.48 1r88 h ALA 220 Ca 0.25 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 1r88 h ALA 220 Cb 0.19 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1r88 h ALA 220 CO -0.02 -0.08 -0.74 1.96 0.00 0.00 0.00 179.25 180.37 1r88 h GLN 221 N -0.13 0.00 0.00 0.00 4.20 -1.31 -2.73 115.11 115.14 1r88 h GLN 221 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1r88 h GLN 221 Cb 0.50 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 1r88 h GLN 221 CO 0.02 0.74 0.00 0.09 -0.67 0.00 0.00 178.83 179.00 1r88 n ASN 222 N -3.33 0.00 -2.60 1.46 3.02 -0.72 -4.91 115.26 108.18 1r88 n ASN 222 Ca 0.01 0.28 -0.21 0.00 -0.03 0.00 0.00 54.58 54.62 1r88 n ASN 222 Cb 0.82 -0.41 0.01 0.00 -0.61 0.00 0.00 39.78 39.58 1r88 n ASN 222 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1r88 n ASN 223 N -1.41 -5.98 -4.72 6.41 5.15 -1.03 -4.95 115.26 108.73 1r88 n ASN 223 Ca 0.08 -0.12 -0.43 0.00 -0.60 0.00 0.00 54.58 53.51 1r88 n ASN 223 Cb 0.24 -4.91 -0.02 0.00 -0.53 0.00 0.00 39.78 34.56 1r88 n ASN 223 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 1r88 n THR 224 N -4.21 0.85 -2.32 -0.44 -1.04 -0.96 -4.93 114.28 101.22 1r88 n THR 224 Ca -0.20 -0.21 -0.43 0.00 -2.04 0.00 0.00 64.05 61.17 1r88 n THR 224 Cb 0.66 -1.81 -0.02 0.00 -1.82 0.00 0.00 70.33 67.34 1r88 n THR 224 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 1r88 s ARG 225 N -0.24 3.92 -0.06 -2.82 6.06 -0.84 -4.71 118.95 120.26 1r88 s ARG 225 Ca 0.67 1.43 0.02 0.00 -2.50 0.00 0.00 55.73 55.35 1r88 s ARG 225 Cb -0.55 -3.91 -0.03 0.00 0.06 0.00 0.00 34.95 30.52 1r88 s ARG 225 CO 0.47 -1.12 -0.12 0.14 -2.50 0.00 0.00 175.30 172.17 1r88 s VAL 226 N 4.51 3.28 -0.11 7.11 -7.23 -0.83 -1.09 120.40 126.04 1r88 s VAL 226 Ca 0.61 -0.64 -0.02 0.00 -1.81 0.00 0.00 61.98 60.12 1r88 s VAL 226 Cb -0.20 -2.31 0.04 0.00 0.56 0.00 0.00 36.38 34.47 1r88 s VAL 226 CO 0.24 0.59 -0.00 0.86 -0.31 0.00 0.00 175.10 176.48 1r88 s TRP 227 N -0.70 0.87 -0.10 2.82 -0.11 -0.22 -0.91 118.94 120.59 1r88 s TRP 227 Ca 0.11 -0.41 0.03 0.00 1.22 0.00 0.00 56.10 57.04 1r88 s TRP 227 Cb -0.11 -0.92 0.01 0.00 -1.50 0.00 0.00 33.47 30.95 1r88 s TRP 227 CO 0.01 -0.42 -0.18 0.08 -4.62 0.00 0.00 176.95 171.81 1r88 s VAL 228 N 1.91 1.67 -0.06 5.86 1.01 -0.30 -0.67 120.40 129.83 1r88 s VAL 228 Ca 0.04 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.27 1r88 s VAL 228 Cb -0.13 -1.48 0.01 0.00 0.00 0.00 0.00 36.38 34.77 1r88 s VAL 228 CO -0.06 0.47 -0.13 0.86 0.00 0.00 0.00 175.10 176.24 1r88 s TRP 229 N 0.65 1.48 -0.30 5.22 -0.00 0.10 -1.72 118.94 124.38 1r88 s TRP 229 Ca -0.13 -0.51 -0.12 0.00 -0.00 0.00 0.00 56.10 55.34 1r88 s TRP 229 Cb -0.16 -1.06 0.15 0.00 -0.00 0.00 0.00 33.47 32.40 1r88 s TRP 229 CO 0.04 -0.24 0.81 0.45 -0.00 0.00 0.00 176.95 178.00 1r88 s SER 230 N 0.48 -0.90 0.65 5.86 0.15 -0.87 -1.31 113.70 117.77 1r88 s SER 230 Ca -0.11 1.14 -0.16 0.00 0.70 0.00 0.00 55.95 57.52 1r88 s SER 230 Cb -0.14 1.98 -0.01 0.00 -1.71 0.00 0.00 66.02 66.14 1r88 s SER 230 CO 0.03 -0.17 1.12 -2.16 1.20 0.00 0.00 173.24 173.26 1r88 s PRO 231 N 2.71 2.83 -0.18 5.44 0.04 -1.26 -4.05 135.00 140.53 1r88 s PRO 231 Ca -0.02 1.44 0.04 0.00 0.04 0.00 0.00 61.00 62.50 1r88 s PRO 231 Cb -0.10 -1.95 0.35 0.00 0.04 0.00 0.00 34.50 32.84 1r88 s PRO 231 CO -0.18 -1.23 1.32 0.25 0.04 0.00 0.00 177.00 177.19 1r88 n THR 232 N -2.29 1.79 -4.28 1.26 -2.24 -0.44 -4.78 114.28 103.31 1r88 n THR 232 Ca 0.11 -0.83 -0.23 0.00 -2.27 0.00 0.00 64.05 60.83 1r88 n THR 232 Cb 0.52 -0.62 -0.12 0.00 -2.10 0.00 0.00 70.33 68.00 1r88 n THR 232 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1r88 s ASN 233 N -0.19 2.38 -0.04 3.42 2.20 -1.26 -5.00 114.94 116.45 1r88 s ASN 233 Ca 0.27 -0.67 0.08 0.00 -0.94 0.00 0.00 52.86 51.60 1r88 s ASN 233 Cb 0.22 -0.13 0.28 0.00 -2.00 0.00 0.00 41.25 39.63 1r88 s ASN 233 CO 0.06 0.04 1.13 -0.81 -2.94 0.00 0.00 177.10 174.58 1r88 n PRO 234 N 1.15 2.01 -1.73 3.55 -0.04 -1.26 -4.84 135.00 133.84 1r88 n PRO 234 Ca -0.20 -1.13 -0.42 0.00 -0.04 0.00 0.00 63.50 61.71 1r88 n PRO 234 Cb 0.54 -1.45 -0.02 0.00 -0.04 0.00 0.00 33.50 32.53 1r88 n PRO 234 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1r88 n GLY 235 N 0.69 1.25 2.71 0.55 0.00 -1.26 -4.62 105.19 104.51 1r88 n GLY 235 Ca 0.10 0.47 -0.20 0.00 0.00 0.00 0.00 46.02 46.39 1r88 n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r88 s ALA 236 N 0.01 -0.12 0.32 4.61 0.00 -1.26 -1.32 121.76 124.00 1r88 s ALA 236 Ca 0.65 -0.15 -0.00 0.00 0.00 0.00 0.00 51.96 52.46 1r88 s ALA 236 Cb -0.52 -1.42 0.52 0.00 0.00 0.00 0.00 23.12 21.70 1r88 s ALA 236 CO 0.48 -1.40 1.98 0.66 0.00 0.00 0.00 175.76 177.49 1r88 h SER 237 N 8.33 0.86 -3.75 0.00 4.64 -1.95 -3.29 113.55 118.39 1r88 h SER 237 Ca -0.16 -0.02 -0.67 0.00 -0.47 0.00 0.00 61.79 60.46 1r88 h SER 237 Cb 1.11 -0.21 -0.38 0.00 -0.31 0.00 0.00 62.40 62.61 1r88 h SER 237 CO 0.32 0.62 -0.62 -0.62 -0.87 0.00 0.00 176.83 175.66 1r88 s ASP 238 N -6.35 4.92 0.31 4.97 2.15 -1.26 -5.00 116.67 116.41 1r88 s ASP 238 Ca -0.11 -2.29 0.05 0.00 0.43 0.00 0.00 52.55 50.63 1r88 s ASP 238 Cb 0.18 -1.72 0.67 0.00 -0.30 0.00 0.00 42.92 41.75 1r88 s ASP 238 CO 0.78 -0.42 1.84 -0.65 -0.17 0.00 0.00 175.17 176.56 1r88 h PRO 239 N 7.56 0.84 -0.75 4.34 0.11 -1.94 -2.40 132.00 139.77 1r88 h PRO 239 Ca -0.07 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 66.04 1r88 h PRO 239 Cb 1.01 -0.19 -0.05 0.00 0.11 0.00 0.00 31.00 31.88 1r88 h PRO 239 CO 0.62 0.56 0.49 0.00 -0.21 0.00 0.00 178.00 179.46 1r88 h ALA 240 N 1.57 1.62 -0.21 -0.75 0.00 -1.94 -0.57 119.26 118.99 1r88 h ALA 240 Ca 0.49 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.39 1r88 h ALA 240 Cb 0.61 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1r88 h ALA 240 CO -0.25 0.28 0.14 0.00 0.00 0.00 0.00 179.25 179.41 1r88 h ALA 241 N 1.58 1.94 -0.38 0.00 0.00 -1.81 -2.09 119.26 118.50 1r88 h ALA 241 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1r88 h ALA 241 Cb 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1r88 h ALA 241 CO -0.10 0.03 0.00 -1.33 0.00 0.00 0.00 179.25 177.85 1r88 n MET 242 N -4.50 3.29 -3.68 0.00 2.81 -0.57 -2.80 117.12 111.66 1r88 n MET 242 Ca 0.01 -2.72 -0.29 0.00 -1.81 0.00 0.00 57.70 52.89 1r88 n MET 242 Cb 0.13 -1.78 -0.05 0.00 -0.71 0.00 0.00 33.22 30.81 1r88 n MET 242 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1r88 n ILE 243 N 0.12 0.00 -1.64 2.02 -5.35 -0.63 -1.45 119.36 112.42 1r88 n ILE 243 Ca 0.21 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.54 1r88 n ILE 243 Cb 0.83 -0.34 -0.05 0.00 -1.74 0.00 0.00 39.64 38.34 1r88 n ILE 243 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1r88 n GLY 244 N -0.86 1.08 2.68 3.28 0.00 -0.33 -4.39 105.19 106.66 1r88 n GLY 244 Ca 0.08 -0.31 -0.07 0.00 0.00 0.00 0.00 46.02 45.72 1r88 n GLY 244 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1r88 n GLN 245 N -2.53 1.78 0.23 1.61 1.13 -0.53 -4.89 117.38 114.18 1r88 n GLN 245 Ca -0.16 -3.53 0.06 0.00 -1.94 0.00 0.00 57.00 51.43 1r88 n GLN 245 Cb 0.52 -1.57 0.54 0.00 0.11 0.00 0.00 30.24 29.85 1r88 n GLN 245 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1r88 h ALA 246 N 2.72 1.68 -0.27 -1.58 0.00 -1.84 -2.38 119.26 117.59 1r88 h ALA 246 Ca -0.05 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1r88 h ALA 246 Cb 1.24 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1r88 h ALA 246 CO 0.39 0.20 -0.08 0.00 0.00 0.00 0.00 179.25 179.75 1r88 h ALA 247 N 1.84 1.35 -0.19 0.00 0.00 -1.90 -1.79 119.26 118.57 1r88 h ALA 247 Ca -0.00 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.53 1r88 h ALA 247 Cb 0.29 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1r88 h ALA 247 CO 0.02 0.44 -0.52 0.93 0.00 0.00 0.00 179.25 180.12 1r88 h GLU 248 N 0.41 0.53 -0.62 0.00 4.39 -1.84 -2.20 114.58 115.26 1r88 h GLU 248 Ca 0.08 -0.32 -0.09 0.00 0.34 0.00 0.00 59.36 59.37 1r88 h GLU 248 Cb 0.41 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 1r88 h GLU 248 CO 0.02 0.92 0.05 0.00 -1.16 0.00 0.00 179.01 178.85 1r88 h ALA 249 N 1.01 0.91 -0.05 3.43 0.00 -1.42 0.29 119.26 123.43 1r88 h ALA 249 Ca 0.01 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.65 1r88 h ALA 249 Cb 1.05 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1r88 h ALA 249 CO 0.10 0.66 -0.04 1.98 0.00 0.00 0.00 179.25 181.95 1r88 h MET 250 N 0.98 -0.05 -0.28 0.00 1.85 -1.24 -1.70 114.93 114.50 1r88 h MET 250 Ca 0.18 0.00 -0.13 0.00 -0.61 0.00 0.00 59.70 59.15 1r88 h MET 250 Cb 0.49 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.52 1r88 h MET 250 CO 0.02 -0.03 -0.35 0.78 -0.40 0.00 0.00 176.91 176.93 1r88 h GLY 251 N -0.05 0.67 1.06 1.39 0.00 -1.30 -2.83 103.07 102.02 1r88 h GLY 251 Ca 0.04 -0.63 -0.07 0.00 0.00 0.00 0.00 47.33 46.67 1r88 h GLY 251 CO -0.08 0.57 0.17 3.43 0.00 0.00 0.00 176.54 180.63 1r88 h ASN 252 N 0.52 1.06 -0.20 0.19 4.21 -0.76 -1.52 115.58 119.07 1r88 h ASN 252 Ca 0.05 -0.23 -0.17 0.00 1.21 0.00 0.00 56.30 57.16 1r88 h ASN 252 Cb 0.85 -0.28 -0.00 0.00 -1.12 0.00 0.00 38.32 37.76 1r88 h ASN 252 CO 0.07 1.02 -0.51 0.28 -1.29 0.00 0.00 177.43 177.00 1r88 h SER 253 N 1.05 0.86 -0.17 5.81 0.02 -1.27 -0.78 113.55 119.07 1r88 h SER 253 Ca 0.22 -0.44 -0.02 0.00 -0.84 0.00 0.00 61.79 60.71 1r88 h SER 253 Cb 0.37 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 1r88 h SER 253 CO 0.00 1.21 0.04 -0.09 -1.14 0.00 0.00 176.83 176.85 1r88 h ARG 254 N 0.61 0.28 -0.20 3.45 9.65 -1.41 -2.19 114.38 124.57 1r88 h ARG 254 Ca 0.02 -0.07 -0.05 0.00 -1.10 0.00 0.00 59.98 58.78 1r88 h ARG 254 Cb 1.09 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.62 1r88 h ARG 254 CO 0.11 0.42 -0.10 0.52 2.80 0.00 0.00 179.97 183.73 1r88 h MET 255 N 0.09 0.32 -0.41 0.20 2.86 -1.22 -2.50 114.93 114.26 1r88 h MET 255 Ca 0.05 -0.07 -0.14 0.00 -2.06 0.00 0.00 59.70 57.49 1r88 h MET 255 Cb 0.27 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 1r88 h MET 255 CO 0.00 0.43 -0.29 0.35 1.06 0.00 0.00 176.91 178.46 1r88 h PHE 256 N 0.30 1.04 -0.41 -0.22 3.57 -1.01 -1.09 116.94 119.11 1r88 h PHE 256 Ca 0.06 -0.27 0.00 0.00 3.53 0.00 0.00 57.97 61.29 1r88 h PHE 256 Cb 0.36 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 1r88 h PHE 256 CO 0.01 1.07 0.26 -0.92 -2.23 0.00 0.00 178.31 176.50 1r88 h TYR 257 N 0.75 0.53 -0.52 0.41 3.20 -1.00 0.15 116.97 120.49 1r88 h TYR 257 Ca 0.08 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.85 1r88 h TYR 257 Cb 0.85 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.93 1r88 h TYR 257 CO 0.05 0.35 -0.11 -0.91 -1.64 0.00 0.00 178.16 175.91 1r88 h ASN 258 N 0.55 0.98 -0.20 -2.11 2.35 -1.36 -2.58 115.58 113.21 1r88 h ASN 258 Ca 0.15 -0.32 -0.09 0.00 -0.55 0.00 0.00 56.30 55.50 1r88 h ASN 258 Cb -0.04 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.07 1r88 h ASN 258 CO -0.03 1.09 -0.21 -0.61 -1.65 0.00 0.00 177.43 176.02 1r88 h GLN 259 N 0.87 0.50 -0.38 0.81 5.75 -0.98 -2.30 115.11 119.38 1r88 h GLN 259 Ca 0.14 -0.27 0.04 0.00 -0.15 0.00 0.00 58.65 58.41 1r88 h GLN 259 Cb 0.66 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.18 1r88 h GLN 259 CO 0.05 0.85 0.17 -0.92 -2.65 0.00 0.00 178.83 176.32 1r88 h TYR 260 N 0.17 0.30 -0.08 3.99 3.20 -0.69 -2.03 116.97 121.83 1r88 h TYR 260 Ca 0.03 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.80 1r88 h TYR 260 Cb 0.76 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1r88 h TYR 260 CO 0.08 0.15 -0.48 0.00 -1.64 0.00 0.00 178.16 176.26 1r88 h ARG 261 N 0.35 0.20 0.00 1.82 2.47 -1.48 -0.92 114.38 116.82 1r88 h ARG 261 Ca 0.17 -0.11 -0.06 0.00 -1.26 0.00 0.00 59.98 58.72 1r88 h ARG 261 Cb 0.11 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.43 1r88 h ARG 261 CO -0.14 0.65 -0.28 0.77 0.56 0.00 0.00 179.97 181.52 1r88 h SER 262 N 0.16 0.00 -0.45 7.04 0.02 -0.97 -2.78 113.55 116.58 1r88 h SER 262 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1r88 h SER 262 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1r88 h SER 262 CO 0.07 0.28 0.00 1.33 -1.14 0.00 0.00 176.83 177.37 1r88 n VAL 263 N -3.34 0.59 -0.20 2.27 0.24 -0.80 -4.93 118.33 112.17 1r88 n VAL 263 Ca 0.01 -0.65 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 1r88 n VAL 263 Cb 0.51 0.43 0.00 0.00 -1.47 0.00 0.00 33.84 33.31 1r88 n VAL 263 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1r88 n GLY 264 N 1.32 0.88 3.74 7.63 0.00 -1.05 -4.88 105.19 112.82 1r88 n GLY 264 Ca 0.17 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1r88 n GLY 264 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1r88 s GLY 265 N -2.18 2.49 0.00 -0.02 0.00 -0.36 -4.90 107.32 102.35 1r88 s GLY 265 Ca 0.00 1.07 0.09 0.00 0.00 0.00 0.00 44.72 45.88 1r88 s GLY 265 CO 0.00 2.03 0.99 -2.39 0.00 0.00 0.00 173.10 173.73 1r88 n HIS 266 N 2.67 0.00 -2.52 1.90 1.44 -1.26 -4.56 115.22 112.89 1r88 n HIS 266 Ca 0.06 -0.24 -0.15 0.00 -2.01 0.00 0.00 57.72 55.38 1r88 n HIS 266 Cb 0.43 0.02 0.02 0.00 0.12 0.00 0.00 29.99 30.59 1r88 n HIS 266 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 1r88 n ASN 267 N 0.18 3.09 -4.45 4.39 5.15 -1.26 -5.09 115.26 117.27 1r88 n ASN 267 Ca -0.01 -3.07 -0.27 0.00 -0.60 0.00 0.00 54.58 50.63 1r88 n ASN 267 Cb 0.83 -0.46 -0.11 0.00 -0.53 0.00 0.00 39.78 39.51 1r88 n ASN 267 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1r88 s GLY 268 N -3.47 1.70 -0.13 8.20 0.00 -1.26 -1.96 107.32 110.40 1r88 s GLY 268 Ca 0.38 -1.57 0.00 0.00 0.00 0.00 0.00 44.72 43.53 1r88 s GLY 268 CO -0.04 -1.59 -0.12 -1.58 0.00 0.00 0.00 173.10 169.77 1r88 s HIS 269 N -1.58 1.88 -0.02 1.90 5.04 -0.09 -4.97 115.29 117.45 1r88 s HIS 269 Ca 0.21 -1.00 0.06 0.00 -1.54 0.00 0.00 55.06 52.78 1r88 s HIS 269 Cb -0.08 -1.43 -0.01 0.00 0.04 0.00 0.00 32.58 31.09 1r88 s HIS 269 CO 0.10 -0.58 -0.19 -0.06 -2.34 0.00 0.00 174.74 171.67 1r88 s PHE 270 N 1.49 1.77 -0.13 3.88 0.08 -1.26 -1.15 117.98 122.66 1r88 s PHE 270 Ca 0.03 -0.39 -0.04 0.00 0.12 0.00 0.00 56.93 56.66 1r88 s PHE 270 Cb -0.13 -1.15 0.06 0.00 -0.57 0.00 0.00 43.02 41.23 1r88 s PHE 270 CO -0.08 -0.07 0.20 0.34 -0.10 0.00 0.00 175.22 175.51 1r88 s ASP 271 N -0.33 0.83 -0.58 1.36 2.15 -0.70 -5.00 116.67 114.41 1r88 s ASP 271 Ca 0.04 0.25 0.06 0.00 0.43 0.00 0.00 52.55 53.33 1r88 s ASP 271 Cb -0.09 0.41 0.22 0.00 -0.30 0.00 0.00 42.92 43.17 1r88 s ASP 271 CO 0.00 -0.27 0.60 0.49 -0.17 0.00 0.00 175.17 175.83 1r88 n PHE 272 N 5.33 2.25 -2.39 -5.34 3.01 -1.26 -2.04 117.46 117.02 1r88 n PHE 272 Ca -0.05 -3.98 -0.35 0.00 1.01 0.00 0.00 57.45 54.08 1r88 n PHE 272 Cb 0.50 -0.45 -0.02 0.00 -0.01 0.00 0.00 39.48 39.50 1r88 n PHE 272 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1r88 s PRO 273 N -1.73 3.62 0.11 -1.08 0.04 -1.26 -4.59 135.00 130.11 1r88 s PRO 273 Ca 0.35 1.52 -0.17 0.00 0.04 0.00 0.00 61.00 62.75 1r88 s PRO 273 Cb 0.10 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 1r88 s PRO 273 CO -0.09 -0.61 1.57 0.00 0.04 0.00 0.00 177.00 177.92 1r88 h ALA 274 N 1.51 0.44 -2.14 8.56 0.00 -1.94 -1.17 119.26 124.52 1r88 h ALA 274 Ca -0.50 -0.21 -0.47 0.00 0.00 0.00 0.00 54.91 53.73 1r88 h ALA 274 Cb 1.24 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1r88 h ALA 274 CO 0.58 0.16 -0.44 -1.54 0.00 0.00 0.00 179.25 178.01 1r88 s SER 275 N -6.00 6.11 0.00 0.00 1.04 -1.26 -4.01 113.70 109.58 1r88 s SER 275 Ca -0.13 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1r88 s SER 275 Cb 0.09 -1.68 0.00 0.00 0.10 0.00 0.00 66.02 64.52 1r88 s SER 275 CO 0.76 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.48 1r88 n GLY 276 N -1.39 4.46 3.80 7.32 0.00 -1.26 -4.84 105.19 113.27 1r88 n GLY 276 Ca -0.08 -1.18 -0.37 0.00 0.00 0.00 0.00 46.02 44.39 1r88 n GLY 276 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1r88 s ASP 277 N 0.00 7.22 -1.28 1.61 2.15 -1.26 -4.76 116.67 120.35 1r88 s ASP 277 Ca 0.00 1.63 -0.13 0.00 0.43 0.00 0.00 52.55 54.48 1r88 s ASP 277 Cb 0.00 -2.50 0.14 0.00 -0.30 0.00 0.00 42.92 40.26 1r88 s ASP 277 CO 0.00 0.00 1.73 0.59 -0.17 0.00 0.00 175.17 177.33 1r88 n ASN 278 N 0.73 4.96 -3.89 -0.34 3.02 -0.43 -4.48 115.26 114.83 1r88 n ASN 278 Ca -0.01 -2.99 0.04 0.00 -0.03 0.00 0.00 54.58 51.59 1r88 n ASN 278 Cb 0.50 -1.58 0.01 0.00 -0.61 0.00 0.00 39.78 38.10 1r88 n ASN 278 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1r88 s GLY 279 N 2.48 -0.22 0.50 7.41 0.00 -1.26 -4.39 107.32 111.83 1r88 s GLY 279 Ca 0.44 0.22 0.22 0.00 0.00 0.00 0.00 44.72 45.59 1r88 s GLY 279 CO 0.00 5.50 2.07 1.49 0.00 0.00 0.00 173.10 182.16 1r88 h TRP 280 N 2.00 0.00 -0.22 1.90 4.06 -1.93 -1.80 115.95 119.96 1r88 h TRP 280 Ca -0.22 0.00 0.05 0.00 2.06 0.00 0.00 58.89 60.78 1r88 h TRP 280 Cb 1.18 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.33 1r88 h TRP 280 CO 1.27 0.13 0.15 0.78 -3.56 0.00 0.00 178.44 177.21 1r88 h GLY 281 N 0.56 0.09 0.04 1.49 0.00 -1.91 -1.96 103.07 101.38 1r88 h GLY 281 Ca -0.00 -0.03 -0.37 0.00 0.00 0.00 0.00 47.33 46.93 1r88 h GLY 281 CO 0.02 0.03 -2.38 1.44 0.00 0.00 0.00 176.54 175.64 1r88 n SER 282 N -4.49 0.48 -0.12 0.19 7.64 -0.83 -4.52 113.62 111.97 1r88 n SER 282 Ca 0.02 -0.01 -0.11 0.00 1.01 0.00 0.00 58.87 59.78 1r88 n SER 282 Cb 0.24 0.64 0.03 0.00 -1.01 0.00 0.00 64.21 64.11 1r88 n SER 282 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 1r88 h TRP 283 N 0.00 1.04 0.72 1.43 6.55 -1.16 -2.23 115.95 122.30 1r88 h TRP 283 Ca -0.55 -0.27 -0.04 0.00 0.95 0.00 0.00 58.89 58.99 1r88 h TRP 283 Cb 2.16 -0.24 0.01 0.00 -0.86 0.00 0.00 29.16 30.24 1r88 h TRP 283 CO 0.01 1.06 -0.35 0.00 -1.05 0.00 0.00 178.44 178.11 1r88 h ALA 284 N 0.92 -0.97 -0.02 1.49 0.00 -1.61 -1.99 119.26 117.08 1r88 h ALA 284 Ca 0.09 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1r88 h ALA 284 Cb 0.84 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1r88 h ALA 284 CO 0.07 -1.04 -0.00 -1.00 0.00 0.00 0.00 179.25 177.28 1r88 h PRO 285 N -0.99 0.02 0.00 0.00 0.13 -1.79 -2.45 132.00 126.92 1r88 h PRO 285 Ca -0.10 -0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.96 1r88 h PRO 285 Cb 0.75 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 1r88 h PRO 285 CO 0.16 0.03 -0.35 0.37 -0.23 0.00 0.00 178.00 177.98 1r88 h GLN 286 N 0.02 0.00 -0.67 0.86 5.75 -1.10 -2.12 115.11 117.85 1r88 h GLN 286 Ca 0.01 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.43 1r88 h GLN 286 Cb 0.02 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.55 1r88 h GLN 286 CO 0.00 0.35 0.13 1.25 -2.65 0.00 0.00 178.83 177.92 1r88 h LEU 287 N 0.00 1.03 -0.82 -2.39 5.85 -0.87 -2.23 115.31 115.89 1r88 h LEU 287 Ca -0.00 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 1r88 h LEU 287 Cb 0.63 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1r88 h LEU 287 CO 0.05 1.01 0.41 1.23 -0.34 0.00 0.00 178.44 180.79 1r88 h GLY 288 N 1.06 1.25 1.68 3.75 0.00 -1.42 -1.99 103.07 107.40 1r88 h GLY 288 Ca 0.21 -0.60 -0.07 0.00 0.00 0.00 0.00 47.33 46.86 1r88 h GLY 288 CO 0.01 0.57 -0.18 0.00 0.00 0.00 0.00 176.54 176.94 1r88 h ALA 289 N 1.22 1.28 -0.02 3.60 0.00 -1.07 -2.95 119.26 121.31 1r88 h ALA 289 Ca 0.28 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r88 h ALA 289 Cb 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1r88 h ALA 289 CO -0.04 0.48 -0.17 0.00 0.00 0.00 0.00 179.25 179.52 1r88 n MET 290 N -4.18 1.73 -0.31 0.00 0.00 -0.87 -4.52 117.12 108.96 1r88 n MET 290 Ca -0.00 -1.34 -0.04 0.00 0.00 0.00 0.00 57.70 56.32 1r88 n MET 290 Cb 0.34 -1.47 0.08 0.00 0.00 0.00 0.00 33.22 32.17 1r88 n MET 290 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1r88 h SER 291 N 3.27 0.99 -0.14 3.17 4.64 -1.18 -1.14 113.55 123.17 1r88 h SER 291 Ca 0.00 -0.04 -0.05 0.00 -0.47 0.00 0.00 61.79 61.23 1r88 h SER 291 Cb 0.79 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 1r88 h SER 291 CO 0.00 0.73 -0.05 1.23 -0.87 0.00 0.00 176.83 177.87 1r88 h GLY 292 N 1.16 0.46 1.43 -0.77 0.00 -1.79 -1.98 103.07 101.58 1r88 h GLY 292 Ca 0.31 -0.28 -0.20 0.00 0.00 0.00 0.00 47.33 47.16 1r88 h GLY 292 CO -0.06 0.26 -0.78 -1.80 0.00 0.00 0.00 176.54 174.16 1r88 h ASP 293 N 0.41 0.66 -0.01 0.19 3.58 -1.63 -2.03 116.42 117.59 1r88 h ASP 293 Ca 0.09 -0.44 -0.00 0.00 0.42 0.00 0.00 57.03 57.09 1r88 h ASP 293 Cb 0.35 -0.20 -0.00 0.00 1.72 0.00 0.00 39.33 41.21 1r88 h ASP 293 CO 0.02 1.21 0.00 0.40 -2.88 0.00 0.00 179.24 177.99 1r88 h ILE 294 N 0.37 1.11 -0.92 2.25 2.04 -1.00 -2.59 117.51 118.76 1r88 h ILE 294 Ca -0.05 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1r88 h ILE 294 Cb 1.38 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 38.74 1r88 h ILE 294 CO 0.14 0.09 0.53 0.58 0.00 0.00 0.00 178.15 179.50 1r88 h VAL 295 N -0.13 1.26 -0.02 1.67 2.07 -1.39 -2.00 116.25 117.71 1r88 h VAL 295 Ca 0.00 -0.59 -0.05 0.00 0.82 0.00 0.00 66.70 66.87 1r88 h VAL 295 Cb 0.14 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 1r88 h VAL 295 CO -0.00 0.28 -0.24 1.23 0.02 0.00 0.00 177.57 178.86 1r88 h GLY 296 N 1.28 0.04 1.20 2.17 0.00 -1.30 -1.23 103.07 105.22 1r88 h GLY 296 Ca 0.33 -0.02 -0.33 0.00 0.00 0.00 0.00 47.33 47.31 1r88 h GLY 296 CO -0.06 0.02 -1.55 0.00 0.00 0.00 0.00 176.54 174.95 1r88 h ALA 297 N 1.73 0.08 0.00 3.60 0.00 -1.01 -3.42 119.26 120.24 1r88 h ALA 297 Ca 0.00 -1.02 -0.11 0.00 0.00 0.00 0.00 54.91 53.78 1r88 h ALA 297 Cb 0.45 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1r88 h ALA 297 CO 0.03 0.95 -1.56 0.44 0.00 0.00 0.00 179.25 179.11 1r88 n ILE 298 N -3.59 0.43 1.45 0.00 -5.35 -0.80 -5.01 119.36 106.49 1r88 n ILE 298 Ca -0.18 -0.33 0.14 0.00 -0.27 0.00 0.00 62.75 62.11 1r88 n ILE 298 Cb 1.07 -0.45 0.49 0.00 -1.74 0.00 0.00 39.64 39.01 1r88 n ILE 298 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65