#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r89 n ASN 6 N 0.00 -6.65 -3.94 1.61 5.03 -1.26 -4.77 115.26 105.28 2r89 n ASN 6 Ca 0.00 1.05 -0.43 0.00 0.87 0.00 0.00 54.58 56.08 2r89 n ASN 6 Cb 0.00 -3.64 0.00 0.00 -1.02 0.00 0.00 39.78 35.12 2r89 n ASN 6 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2r89 n GLU 7 N 1.19 3.30 0.00 3.52 4.71 -1.26 -4.55 120.64 127.54 2r89 n GLU 7 Ca 0.00 -3.22 0.13 0.00 -0.01 0.00 0.00 57.16 54.05 2r89 n GLU 7 Cb 0.00 -3.11 0.31 0.00 -1.01 0.00 0.00 31.44 27.63 2r89 n GLU 7 CO 0.00 0.00 0.00 1.97 0.09 0.00 0.00 177.13 179.19 2r89 n PHE 8 N 5.17 0.00 -3.64 -0.32 1.16 -1.26 -4.78 117.46 113.78 2r89 n PHE 8 Ca 0.44 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.95 2r89 n PHE 8 Cb 0.39 -0.04 -0.07 0.00 -1.61 0.00 0.00 39.48 38.15 2r89 n PHE 8 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 2r89 s SER 9 N -2.23 -0.71 0.25 5.98 0.15 -1.26 -4.88 113.70 111.00 2r89 s SER 9 Ca 0.29 1.21 -0.05 0.00 0.70 0.00 0.00 55.95 58.10 2r89 s SER 9 Cb 0.20 1.27 0.32 0.00 -1.71 0.00 0.00 66.02 66.10 2r89 s SER 9 CO 0.43 -0.20 1.90 0.28 1.20 0.00 0.00 173.24 176.85 2r89 h SER 10 N 5.87 1.07 -0.02 5.45 0.02 -1.88 0.17 113.55 124.23 2r89 h SER 10 Ca -0.29 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 60.68 2r89 h SER 10 Cb 1.20 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.46 2r89 h SER 10 CO 0.14 0.73 -0.18 -1.28 -1.14 0.00 0.00 176.83 175.10 2r89 h SER 11 N 1.24 -0.52 -0.06 3.07 0.87 -1.91 -1.94 113.55 114.30 2r89 h SER 11 Ca 0.39 0.08 0.03 0.00 -1.23 0.00 0.00 61.79 61.06 2r89 h SER 11 Cb -0.00 0.22 -0.06 0.00 -0.44 0.00 0.00 62.40 62.12 2r89 h SER 11 CO -0.12 -0.24 -0.50 1.23 -0.53 0.00 0.00 176.83 176.67 2r89 h GLY 12 N -0.28 -0.99 -0.72 5.77 0.00 -1.21 -0.27 103.07 105.38 2r89 h GLY 12 Ca 0.06 0.62 0.13 0.00 0.00 0.00 0.00 47.33 48.14 2r89 h GLY 12 CO -0.18 -0.23 -0.37 -2.00 0.00 0.00 0.00 176.54 173.76 2r89 h LEU 13 N -0.61 -1.32 -1.76 3.11 5.85 -0.60 0.21 115.31 120.20 2r89 h LEU 13 Ca 0.04 0.27 0.29 0.00 0.84 0.00 0.00 57.88 59.32 2r89 h LEU 13 Cb 0.69 0.68 -0.04 0.00 0.37 0.00 0.00 40.66 42.35 2r89 h LEU 13 CO -0.38 -0.30 0.88 1.23 -0.34 0.00 0.00 178.44 179.53 2r89 h GLY 14 N -0.08 0.00 -1.19 3.75 0.00 -0.24 0.16 103.07 105.46 2r89 h GLY 14 Ca 0.29 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.57 2r89 h GLY 14 CO -0.84 0.00 -0.32 -0.96 0.00 0.00 0.00 176.54 174.42 2r89 n ARG 15 N -3.79 1.67 -2.89 4.80 1.85 0.54 -3.22 116.66 115.62 2r89 n ARG 15 Ca 0.22 -3.19 -0.19 0.00 -1.00 0.00 0.00 57.85 53.69 2r89 n ARG 15 Cb 1.21 -1.67 0.00 0.00 -1.05 0.00 0.00 32.46 30.96 2r89 n ARG 15 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2r89 n ALA 16 N -1.14 -0.91 -3.89 2.89 0.00 0.55 -1.67 120.51 116.34 2r89 n ALA 16 Ca 0.23 0.13 -0.33 0.00 0.00 0.00 0.00 53.44 53.46 2r89 n ALA 16 Cb 0.79 -2.44 0.01 0.00 0.00 0.00 0.00 19.45 17.80 2r89 n ALA 16 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2r89 n TYR 17 N -3.83 -1.79 -4.04 0.00 4.02 -0.05 -4.86 117.16 106.61 2r89 n TYR 17 Ca -0.10 0.52 -0.31 0.00 -0.01 0.00 0.00 57.90 58.00 2r89 n TYR 17 Cb 0.59 -2.82 -0.16 0.00 -0.02 0.00 0.00 39.34 36.93 2r89 n TYR 17 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2r89 s SER 18 N -3.22 3.37 0.00 7.72 1.04 -0.67 -4.70 113.70 117.24 2r89 s SER 18 Ca 0.22 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.80 2r89 s SER 18 Cb -0.12 -1.33 0.00 0.00 0.10 0.00 0.00 66.02 64.68 2r89 s SER 18 CO 0.92 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.65 2r89 n GLY 19 N 4.65 2.65 1.53 7.32 0.00 -1.25 -4.41 105.19 115.68 2r89 n GLY 19 Ca -0.16 -0.35 -0.24 0.00 0.00 0.00 0.00 46.02 45.27 2r89 n GLY 19 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2r89 n GLU 20 N 0.00 0.00 -0.16 1.61 -0.58 -1.26 -0.68 120.64 119.57 2r89 n GLU 20 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2r89 n GLU 20 Cb 0.00 -0.56 0.00 0.00 -0.57 0.00 0.00 31.44 30.31 2r89 n GLU 20 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2r89 n GLY 21 N 0.78 0.58 0.33 0.62 0.00 -1.26 -4.75 105.19 101.48 2r89 n GLY 21 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2r89 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r89 n ALA 22 N -1.49 1.65 -3.65 4.61 0.00 0.15 -4.35 120.51 117.43 2r89 n ALA 22 Ca 0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 53.44 52.91 2r89 n ALA 22 Cb 0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 19.45 19.16 2r89 n ALA 22 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2r89 s ILE 23 N 0.00 -0.40 -0.35 0.00 2.07 -1.25 -4.06 121.20 117.21 2r89 s ILE 23 Ca 0.00 0.27 0.01 0.00 -1.41 0.00 0.00 60.65 59.52 2r89 s ILE 23 Cb 0.00 -0.44 0.11 0.00 0.13 0.00 0.00 42.46 42.26 2r89 s ILE 23 CO 0.00 0.10 0.12 0.00 -1.91 0.00 0.00 174.94 173.25 2r89 s ALA 24 N 2.40 2.15 0.00 1.50 0.00 -1.26 -4.64 121.76 121.91 2r89 s ALA 24 Ca 0.02 -2.18 0.00 0.00 0.00 0.00 0.00 51.96 49.80 2r89 s ALA 24 Cb -0.12 -1.80 0.00 0.00 0.00 0.00 0.00 23.12 21.19 2r89 s ALA 24 CO -0.08 -1.76 0.30 -0.25 0.00 0.00 0.00 175.76 173.96 2r89 n ASP 25 N 4.35 0.60 -3.58 0.00 8.00 -1.26 -5.00 116.55 119.66 2r89 n ASP 25 Ca 0.02 -1.00 -0.15 0.00 0.71 0.00 0.00 54.79 54.37 2r89 n ASP 25 Cb 0.40 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.44 2r89 n ASP 25 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2r89 s ASP 26 N -0.00 -0.67 0.55 -2.24 -4.77 -1.26 -4.99 116.67 103.29 2r89 s ASP 26 Ca 0.00 1.03 0.03 0.00 -3.30 0.00 0.00 52.55 50.31 2r89 s ASP 26 Cb 0.00 0.96 0.15 0.00 -1.09 0.00 0.00 42.92 42.94 2r89 s ASP 26 CO 0.00 -0.40 1.01 0.00 0.70 0.00 0.00 175.17 176.47 2r89 h ALA 27 N 3.94 1.77 -0.85 2.11 0.00 -1.90 -2.88 119.26 121.44 2r89 h ALA 27 Ca -0.27 0.00 0.09 0.00 0.00 0.00 0.00 54.91 54.73 2r89 h ALA 27 Cb 1.15 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.82 2r89 h ALA 27 CO 0.22 -0.77 -0.54 0.78 0.00 0.00 0.00 179.25 178.94 2r89 h GLY 28 N 0.00 -0.70 2.00 0.00 0.00 -1.93 -3.00 103.07 99.45 2r89 h GLY 28 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 47.33 48.05 2r89 h GLY 28 CO 0.00 -0.04 0.00 3.43 0.00 0.00 0.00 176.54 179.93 2r89 h ASN 29 N -0.09 0.00 -0.42 0.19 4.21 -1.77 -2.86 115.58 114.84 2r89 h ASN 29 Ca 0.17 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.66 2r89 h ASN 29 Cb 0.49 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.66 2r89 h ASN 29 CO -0.86 0.00 0.20 -0.37 -1.29 0.00 0.00 177.43 175.11 2r89 h VAL 30 N 0.00 1.17 -0.92 2.81 -1.51 -1.73 0.21 116.25 116.28 2r89 h VAL 30 Ca 0.00 -0.50 0.23 0.00 -1.23 0.00 0.00 66.70 65.20 2r89 h VAL 30 Cb 0.22 0.60 -0.06 0.00 -2.13 0.00 0.00 31.29 29.92 2r89 h VAL 30 CO 0.00 0.20 0.62 0.77 -1.23 0.00 0.00 177.57 177.93 2r89 h SER 31 N 0.66 0.30 0.15 4.19 4.64 -1.69 -0.37 113.55 121.42 2r89 h SER 31 Ca 0.16 0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 61.43 2r89 h SER 31 Cb 0.10 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 2r89 h SER 31 CO -0.02 0.11 -1.95 -1.14 -0.87 0.00 0.00 176.83 172.96 2r89 n ARG 32 N -4.46 0.66 -3.37 4.77 0.63 -0.20 -4.81 116.66 109.87 2r89 n ARG 32 Ca 0.20 -0.10 -0.18 0.00 -0.92 0.00 0.00 57.85 56.86 2r89 n ARG 32 Cb 0.80 -1.57 -0.08 0.00 0.45 0.00 0.00 32.46 32.05 2r89 n ARG 32 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2r89 s ASN 33 N -4.90 1.35 0.16 6.15 3.84 0.58 -4.81 114.94 117.31 2r89 s ASN 33 Ca -0.07 -1.47 -0.23 0.00 0.21 0.00 0.00 52.86 51.30 2r89 s ASN 33 Cb 0.11 0.50 0.04 0.00 -0.55 0.00 0.00 41.25 41.36 2r89 s ASN 33 CO 0.87 -0.28 1.36 -2.65 -2.79 0.00 0.00 177.10 173.61 2r89 n PRO 34 N 4.41 -0.32 -0.26 0.43 -0.02 -0.97 0.42 135.00 138.70 2r89 n PRO 34 Ca 0.09 1.34 0.32 0.00 -2.02 0.00 0.00 63.50 63.22 2r89 n PRO 34 Cb 0.45 -1.97 0.56 0.00 -0.02 0.00 0.00 33.50 32.52 2r89 n PRO 34 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r89 h ALA 35 N 0.74 3.01 0.00 3.55 0.00 -1.83 0.16 119.26 124.88 2r89 h ALA 35 Ca 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2r89 h ALA 35 Cb 0.42 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2r89 h ALA 35 CO -0.84 -1.70 0.00 -0.07 0.00 0.00 0.00 179.25 176.64 2r89 h LEU 36 N 0.00 0.00 -1.21 0.00 4.07 -0.37 -2.81 115.31 114.99 2r89 h LEU 36 Ca 0.53 0.00 0.21 0.00 0.08 0.00 0.00 57.88 58.70 2r89 h LEU 36 Cb 2.77 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 44.42 2r89 h LEU 36 CO -0.01 0.00 0.62 0.40 -1.08 0.00 0.00 178.44 178.38 2r89 h ILE 37 N 0.00 0.65 0.00 1.22 2.04 -0.86 0.44 117.51 121.00 2r89 h ILE 37 Ca 0.00 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.66 2r89 h ILE 37 Cb 0.24 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.33 2r89 h ILE 37 CO 0.00 0.11 0.00 0.35 0.00 0.00 0.00 178.15 178.61 2r89 n THR 38 N -4.67 0.00 0.20 -0.27 -2.24 -1.06 -2.47 114.28 103.76 2r89 n THR 38 Ca 0.23 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.09 2r89 n THR 38 Cb 0.68 -0.21 0.14 0.00 -2.10 0.00 0.00 70.33 68.83 2r89 n THR 38 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 2r89 n MET 39 N -0.47 1.96 -4.77 -0.78 1.56 0.15 -4.94 117.12 109.84 2r89 n MET 39 Ca 0.00 -1.83 -0.33 0.00 -0.27 0.00 0.00 57.70 55.27 2r89 n MET 39 Cb 0.01 -1.33 -0.14 0.00 2.15 0.00 0.00 33.22 33.91 2r89 n MET 39 CO 0.00 0.00 0.00 -0.06 -0.73 0.00 0.00 175.97 175.18 2r89 s PHE 40 N -1.14 2.81 -0.05 1.12 0.40 -1.03 -5.04 117.98 115.05 2r89 s PHE 40 Ca 0.25 -0.48 -0.01 0.00 -0.60 0.00 0.00 56.93 56.09 2r89 s PHE 40 Cb 0.15 -1.80 -0.00 0.00 0.51 0.00 0.00 43.02 41.88 2r89 s PHE 40 CO 0.20 -0.08 -0.02 -0.44 0.70 0.00 0.00 175.22 175.58 2r89 h ASP 41 N 6.33 0.00 -3.98 1.36 3.45 -1.92 -3.43 116.42 118.22 2r89 h ASP 41 Ca -0.32 0.00 -0.45 0.00 0.43 0.00 0.00 57.03 56.69 2r89 h ASP 41 Cb 1.20 0.00 0.15 0.00 -0.56 0.00 0.00 39.33 40.12 2r89 h ASP 41 CO 0.55 0.27 0.40 -0.13 -1.57 0.00 0.00 179.24 178.76 2r89 s ARG 42 N -1.34 0.89 -0.13 3.56 0.52 -1.26 -4.57 118.95 116.62 2r89 s ARG 42 Ca -0.02 -0.39 -0.19 0.00 -0.52 0.00 0.00 55.73 54.62 2r89 s ARG 42 Cb 0.00 -1.89 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 2r89 s ARG 42 CO 0.02 -2.24 0.51 -1.25 0.02 0.00 0.00 175.30 172.37 2r89 s PRO 43 N -5.80 4.32 0.03 3.54 0.04 -1.26 -4.43 135.00 131.44 2r89 s PRO 43 Ca 0.72 0.50 0.04 0.00 0.04 0.00 0.00 61.00 62.29 2r89 s PRO 43 Cb -0.05 -3.46 -0.04 0.00 0.04 0.00 0.00 34.50 30.99 2r89 s PRO 43 CO 0.52 0.08 -0.04 0.99 0.04 0.00 0.00 177.00 178.59 2r89 s THR 44 N 0.86 3.78 -0.06 1.26 2.01 0.16 -2.09 115.64 121.56 2r89 s THR 44 Ca 0.27 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.43 2r89 s THR 44 Cb -0.15 -2.70 0.02 0.00 0.01 0.00 0.00 72.50 69.67 2r89 s THR 44 CO 0.11 0.29 -0.07 0.12 -0.69 0.00 0.00 174.62 174.38 2r89 s PHE 45 N -1.11 1.05 -0.01 4.92 5.36 0.57 -0.59 117.98 128.18 2r89 s PHE 45 Ca 0.20 -0.37 0.01 0.00 -0.96 0.00 0.00 56.93 55.81 2r89 s PHE 45 Cb -0.11 -0.87 0.00 0.00 -0.34 0.00 0.00 43.02 41.70 2r89 s PHE 45 CO 0.11 -0.26 -0.05 0.45 -1.46 0.00 0.00 175.22 174.01 2r89 s SER 46 N 0.99 0.63 0.08 6.13 0.15 0.63 -0.41 113.70 121.90 2r89 s SER 46 Ca -0.09 -0.09 -0.03 0.00 0.70 0.00 0.00 55.95 56.43 2r89 s SER 46 Cb -0.14 -0.13 -0.03 0.00 -1.71 0.00 0.00 66.02 64.01 2r89 s SER 46 CO 0.00 0.03 0.05 0.00 1.20 0.00 0.00 173.24 174.53 2r89 s ALA 47 N 0.12 0.34 0.00 5.45 0.00 -0.74 0.87 121.76 127.80 2r89 s ALA 47 Ca -0.01 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.88 2r89 s ALA 47 Cb -0.05 0.43 0.00 0.00 0.00 0.00 0.00 23.12 23.51 2r89 s ALA 47 CO -0.00 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.73 2r89 n GLY 48 N 0.02 0.27 3.76 0.00 0.00 -0.89 0.10 105.19 108.45 2r89 n GLY 48 Ca -0.13 -1.43 -0.01 0.00 0.00 0.00 0.00 46.02 44.45 2r89 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r89 s ALA 49 N -1.00 -1.87 0.10 4.61 0.00 -0.34 0.15 121.76 123.41 2r89 s ALA 49 Ca 0.00 0.18 0.07 0.00 0.00 0.00 0.00 51.96 52.21 2r89 s ALA 49 Cb 0.00 0.61 -0.03 0.00 0.00 0.00 0.00 23.12 23.69 2r89 s ALA 49 CO 0.00 -1.06 -0.18 0.14 0.00 0.00 0.00 175.76 174.66 2r89 s VAL 50 N -2.68 1.51 -0.19 0.00 -7.23 0.38 -1.13 120.40 111.06 2r89 s VAL 50 Ca 0.16 -1.52 -0.00 0.00 -1.81 0.00 0.00 61.98 58.81 2r89 s VAL 50 Cb 0.00 -1.44 0.01 0.00 0.56 0.00 0.00 36.38 35.52 2r89 s VAL 50 CO 0.01 -0.17 -0.16 -0.47 -0.31 0.00 0.00 175.10 174.01 2r89 s TYR 51 N -1.37 2.84 -0.17 2.82 5.04 0.21 0.11 117.35 126.83 2r89 s TYR 51 Ca 0.05 -1.48 -0.06 0.00 -2.44 0.00 0.00 57.07 53.14 2r89 s TYR 51 Cb -0.09 -1.97 -0.04 0.00 0.35 0.00 0.00 41.96 40.21 2r89 s TYR 51 CO 0.04 -0.74 0.04 0.42 -1.34 0.00 0.00 175.55 173.96 2r89 s ILE 52 N 1.33 4.57 -0.49 3.14 1.01 -0.02 -1.88 121.20 128.87 2r89 s ILE 52 Ca 0.05 -0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.62 2r89 s ILE 52 Cb -0.14 -3.04 0.13 0.00 0.01 0.00 0.00 42.46 39.43 2r89 s ILE 52 CO -0.10 0.48 0.26 -0.62 0.00 0.00 0.00 174.94 174.96 2r89 s ASP 53 N 0.25 4.07 1.23 3.58 3.68 -0.45 -1.77 116.67 127.26 2r89 s ASP 53 Ca 0.02 -2.89 -0.20 0.00 2.13 0.00 0.00 52.55 51.61 2r89 s ASP 53 Cb -0.13 -1.41 0.29 0.00 -1.45 0.00 0.00 42.92 40.22 2r89 s ASP 53 CO 0.01 -0.24 1.05 -2.65 0.13 0.00 0.00 175.17 173.47 2r89 n PRO 54 N 3.24 -2.99 -2.74 4.34 -0.02 -1.26 -2.04 135.00 133.52 2r89 n PRO 54 Ca 0.07 -1.68 -0.08 0.00 -2.02 0.00 0.00 63.50 59.78 2r89 n PRO 54 Cb 0.33 -1.56 0.07 0.00 -0.02 0.00 0.00 33.50 32.32 2r89 n PRO 54 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2r89 n ASP 55 N -4.75 -2.64 -4.62 2.55 4.64 -0.61 -4.86 116.55 106.26 2r89 n ASP 55 Ca 0.15 -3.49 -0.41 0.00 -1.38 0.00 0.00 54.79 49.65 2r89 n ASP 55 Cb 0.56 1.88 -0.06 0.00 -1.04 0.00 0.00 41.12 42.47 2r89 n ASP 55 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 2r89 s VAL 56 N 0.49 4.91 -0.21 5.18 1.01 -1.26 -3.00 120.40 127.53 2r89 s VAL 56 Ca 0.27 1.08 0.01 0.00 0.00 0.00 0.00 61.98 63.34 2r89 s VAL 56 Cb 0.26 -4.02 0.05 0.00 0.00 0.00 0.00 36.38 32.67 2r89 s VAL 56 CO -0.16 -0.10 -0.10 0.20 0.00 0.00 0.00 175.10 174.95 2r89 s ASN 57 N 1.55 3.54 0.13 3.32 0.02 -1.18 -0.20 114.94 122.12 2r89 s ASN 57 Ca 0.28 -0.97 -0.13 0.00 -1.02 0.00 0.00 52.86 51.02 2r89 s ASN 57 Cb -0.15 -1.25 -0.07 0.00 0.02 0.00 0.00 41.25 39.80 2r89 s ASN 57 CO 0.10 -0.16 0.51 -0.63 0.02 0.00 0.00 177.10 176.95 2r89 s ILE 58 N 1.37 4.91 -0.01 0.60 -1.09 -1.01 -3.49 121.20 122.48 2r89 s ILE 58 Ca -0.02 0.74 -0.07 0.00 -2.23 0.00 0.00 60.65 59.07 2r89 s ILE 58 Cb -0.17 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.00 2r89 s ILE 58 CO -0.08 0.25 0.14 -0.94 -1.23 0.00 0.00 174.94 173.08 2r89 s SER 59 N -1.73 -0.00 0.00 3.58 1.04 -0.93 -1.43 113.70 114.23 2r89 s SER 59 Ca 0.37 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.68 2r89 s SER 59 Cb -0.15 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.20 2r89 s SER 59 CO 0.19 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.71 2r89 n GLY 60 N 1.76 -0.90 3.01 7.32 0.00 -1.25 -1.76 105.19 113.37 2r89 n GLY 60 Ca -0.21 -1.53 -0.16 0.00 0.00 0.00 0.00 46.02 44.13 2r89 n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r89 s THR 61 N -2.17 0.55 0.59 2.61 2.01 -1.26 -1.79 115.64 116.18 2r89 s THR 61 Ca 0.00 -0.56 -0.08 0.00 0.31 0.00 0.00 61.69 61.36 2r89 s THR 61 Cb 0.00 -0.51 -0.01 0.00 0.01 0.00 0.00 72.50 71.98 2r89 s THR 61 CO 0.00 -0.03 0.93 -0.55 -0.69 0.00 0.00 174.62 174.28 2r89 s SER 62 N -0.65 5.87 -0.08 3.53 0.15 -1.05 -4.40 113.70 117.06 2r89 s SER 62 Ca -0.01 0.97 0.04 0.00 0.70 0.00 0.00 55.95 57.65 2r89 s SER 62 Cb -0.05 -2.03 0.25 0.00 -1.71 0.00 0.00 66.02 62.48 2r89 s SER 62 CO 0.00 -0.94 0.91 -2.65 1.20 0.00 0.00 173.24 171.75 2r89 n PRO 63 N -2.60 2.16 -0.20 5.44 -0.02 -1.26 -2.71 135.00 135.81 2r89 n PRO 63 Ca 0.04 -0.97 0.05 0.00 -2.02 0.00 0.00 63.50 60.60 2r89 n PRO 63 Cb 0.56 -1.72 0.07 0.00 -0.02 0.00 0.00 33.50 32.39 2r89 n PRO 63 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2r89 n SER 64 N 0.18 1.39 0.00 2.55 3.41 -1.26 -5.00 113.62 114.88 2r89 n SER 64 Ca 0.09 -2.49 0.00 0.00 -0.26 0.00 0.00 58.87 56.22 2r89 n SER 64 Cb 0.56 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 2r89 n SER 64 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2r89 n GLY 65 N -0.78 0.88 3.74 5.00 0.00 -1.10 -4.92 105.19 108.01 2r89 n GLY 65 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2r89 n GLY 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2r89 s ARG 66 N 0.00 4.14 0.81 1.61 0.52 -1.26 -4.66 118.95 120.11 2r89 s ARG 66 Ca 0.00 2.54 -0.12 0.00 -0.52 0.00 0.00 55.73 57.63 2r89 s ARG 66 Cb 0.00 -3.06 0.09 0.00 0.52 0.00 0.00 34.95 32.50 2r89 s ARG 66 CO 0.00 -0.65 1.15 0.45 0.02 0.00 0.00 175.30 176.27 2r89 s SER 67 N 0.77 3.76 -0.18 0.23 0.15 -1.26 -2.54 113.70 114.63 2r89 s SER 67 Ca 0.67 2.16 0.13 0.00 0.70 0.00 0.00 55.95 59.61 2r89 s SER 67 Cb -0.47 -2.56 0.42 0.00 -1.71 0.00 0.00 66.02 61.69 2r89 s SER 67 CO 0.41 -2.54 1.21 0.18 1.20 0.00 0.00 173.24 173.70 2r89 n LEU 68 N -3.52 2.46 -4.78 3.45 4.77 -0.74 -4.07 117.00 114.58 2r89 n LEU 68 Ca 0.12 -3.63 -0.37 0.00 -0.03 0.00 0.00 56.01 52.09 2r89 n LEU 68 Cb 0.52 -0.45 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 2r89 n LEU 68 CO 0.49 1.28 0.68 -0.75 -1.33 0.00 0.00 177.39 177.76 2r89 s LYS 69 N -2.77 4.53 -0.46 3.23 2.20 -1.26 -3.91 119.74 121.30 2r89 s LYS 69 Ca 0.37 1.41 0.06 0.00 -0.36 0.00 0.00 55.97 57.46 2r89 s LYS 69 Cb 0.37 -2.81 0.21 0.00 -1.51 0.00 0.00 37.83 34.09 2r89 s LYS 69 CO -0.08 0.21 0.64 0.00 -0.36 0.00 0.00 175.35 175.76 2r89 n ALA 70 N 0.55 0.14 -2.08 3.13 0.00 -0.52 -4.98 120.51 116.76 2r89 n ALA 70 Ca 0.02 -2.05 -0.42 0.00 0.00 0.00 0.00 53.44 50.99 2r89 n ALA 70 Cb 0.49 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.76 2r89 n ALA 70 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2r89 s ASP 71 N -0.40 6.74 -1.13 0.00 -0.00 -1.26 -2.42 116.67 118.19 2r89 s ASP 71 Ca 0.32 2.40 -0.05 0.00 -0.00 0.00 0.00 52.55 55.21 2r89 s ASP 71 Cb 0.10 -2.58 -0.03 0.00 -0.00 0.00 0.00 42.92 40.41 2r89 s ASP 71 CO -0.15 -0.74 0.90 -3.20 -0.00 0.00 0.00 175.17 171.98 2r89 n ASN 72 N 4.35 -4.53 0.00 0.27 4.05 -0.89 -4.94 115.26 113.57 2r89 n ASN 72 Ca 0.13 -0.74 0.13 0.00 0.45 0.00 0.00 54.58 54.55 2r89 n ASN 72 Cb 0.41 -4.81 0.62 0.00 1.23 0.00 0.00 39.78 37.22 2r89 n ASN 72 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2r89 n ILE 73 N -3.73 0.19 -3.86 -1.44 3.06 0.72 -4.72 119.36 109.59 2r89 n ILE 73 Ca -0.16 0.05 -0.36 0.00 -2.50 0.00 0.00 62.75 59.78 2r89 n ILE 73 Cb 0.64 -0.61 -0.13 0.00 0.54 0.00 0.00 39.64 40.08 2r89 n ILE 73 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2r89 s ALA 74 N -2.73 3.05 0.46 1.51 0.00 -1.26 0.11 121.76 122.91 2r89 s ALA 74 Ca 0.20 -1.11 -0.19 0.00 0.00 0.00 0.00 51.96 50.87 2r89 s ALA 74 Cb 0.17 -1.92 -0.10 0.00 0.00 0.00 0.00 23.12 21.27 2r89 s ALA 74 CO 0.42 -0.40 0.96 -1.25 0.00 0.00 0.00 175.76 175.49 2r89 s PRO 75 N 1.45 4.10 0.84 0.00 0.04 -1.26 -4.55 135.00 135.62 2r89 s PRO 75 Ca 0.05 1.03 -0.11 0.00 0.04 0.00 0.00 61.00 62.01 2r89 s PRO 75 Cb -0.15 -2.17 0.09 0.00 0.04 0.00 0.00 34.50 32.32 2r89 s PRO 75 CO 0.01 -0.13 1.09 0.95 0.04 0.00 0.00 177.00 178.96 2r89 s THR 76 N -2.37 2.97 -0.07 1.26 -4.23 -1.26 -4.62 115.64 107.32 2r89 s THR 76 Ca 0.60 0.32 -0.22 0.00 -1.18 0.00 0.00 61.69 61.21 2r89 s THR 76 Cb -0.09 -2.86 0.05 0.00 1.34 0.00 0.00 72.50 70.94 2r89 s THR 76 CO 0.21 -0.41 0.52 0.00 -0.54 0.00 0.00 174.62 174.40 2r89 s ALA 77 N -2.97 -1.32 -0.11 3.99 0.00 -0.73 -4.99 121.76 115.62 2r89 s ALA 77 Ca 0.62 1.02 -0.04 0.00 0.00 0.00 0.00 51.96 53.56 2r89 s ALA 77 Cb -0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 2r89 s ALA 77 CO 0.56 -0.30 0.05 -1.58 0.00 0.00 0.00 175.76 174.49 2r89 s TRP 78 N -0.88 3.29 -0.21 0.00 0.52 -1.26 -0.84 118.94 119.56 2r89 s TRP 78 Ca -0.09 0.25 -0.02 0.00 0.02 0.00 0.00 56.10 56.26 2r89 s TRP 78 Cb -0.03 -1.88 0.06 0.00 -1.15 0.00 0.00 33.47 30.47 2r89 s TRP 78 CO 0.06 0.48 0.03 0.08 0.02 0.00 0.00 176.95 177.61 2r89 s VAL 79 N -0.68 0.70 0.32 4.03 1.01 0.29 -4.94 120.40 121.13 2r89 s VAL 79 Ca 0.12 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 2r89 s VAL 79 Cb -0.12 -1.20 -0.06 0.00 0.00 0.00 0.00 36.38 35.01 2r89 s VAL 79 CO 0.02 -0.24 0.62 -2.16 0.00 0.00 0.00 175.10 173.34 2r89 s PRO 80 N 1.77 3.68 0.01 2.72 0.04 -1.26 0.14 135.00 142.11 2r89 s PRO 80 Ca -0.01 0.15 0.01 0.00 0.04 0.00 0.00 61.00 61.20 2r89 s PRO 80 Cb -0.17 -2.57 -0.01 0.00 0.04 0.00 0.00 34.50 31.79 2r89 s PRO 80 CO -0.09 0.14 -0.04 0.54 0.04 0.00 0.00 177.00 177.59 2r89 s ASN 81 N -3.13 0.41 -0.14 6.66 6.03 0.41 -4.34 114.94 120.83 2r89 s ASN 81 Ca 0.46 -0.23 0.00 0.00 -1.03 0.00 0.00 52.86 52.06 2r89 s ASN 81 Cb -0.11 0.00 0.02 0.00 -3.03 0.00 0.00 41.25 38.14 2r89 s ASN 81 CO 0.30 -0.08 -0.13 -0.32 -2.03 0.00 0.00 177.10 174.85 2r89 s MET 82 N -0.63 2.11 -0.14 3.55 1.75 0.35 -2.10 119.30 124.21 2r89 s MET 82 Ca -0.04 -0.49 -0.00 0.00 -1.25 0.00 0.00 55.69 53.91 2r89 s MET 82 Cb -0.04 -1.97 0.03 0.00 2.84 0.00 0.00 34.83 35.68 2r89 s MET 82 CO -0.00 -0.23 -0.09 -1.01 -0.65 0.00 0.00 175.02 173.03 2r89 s HIS 83 N 1.51 1.77 -0.07 4.11 3.76 0.25 -0.74 115.29 125.89 2r89 s HIS 83 Ca 0.04 -0.99 0.01 0.00 -0.15 0.00 0.00 55.06 53.98 2r89 s HIS 83 Cb -0.13 -1.37 0.02 0.00 1.11 0.00 0.00 32.58 32.21 2r89 s HIS 83 CO -0.10 -0.59 -0.09 0.12 -0.85 0.00 0.00 174.74 173.24 2r89 s PHE 84 N 1.62 1.21 -0.00 1.40 5.36 0.16 -0.27 117.98 127.46 2r89 s PHE 84 Ca 0.04 -0.45 0.03 0.00 -0.96 0.00 0.00 56.93 55.58 2r89 s PHE 84 Cb -0.13 -0.96 -0.01 0.00 -0.34 0.00 0.00 43.02 41.58 2r89 s PHE 84 CO -0.09 -0.29 -0.09 0.08 -1.46 0.00 0.00 175.22 173.37 2r89 s VAL 85 N 0.97 0.73 -0.22 3.12 1.01 0.24 0.30 120.40 126.56 2r89 s VAL 85 Ca -0.09 -0.45 -0.18 0.00 0.00 0.00 0.00 61.98 61.26 2r89 s VAL 85 Cb -0.15 -0.62 0.06 0.00 0.00 0.00 0.00 36.38 35.67 2r89 s VAL 85 CO 0.00 0.17 0.57 0.00 0.00 0.00 0.00 175.10 175.84 2r89 s ALA 86 N -0.29 -1.44 -0.01 5.51 0.00 -0.50 0.37 121.76 125.40 2r89 s ALA 86 Ca 0.03 1.72 -0.28 0.00 0.00 0.00 0.00 51.96 53.43 2r89 s ALA 86 Cb -0.04 -1.00 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 2r89 s ALA 86 CO -0.00 -0.28 0.88 -1.25 0.00 0.00 0.00 175.76 175.10 2r89 s PRO 87 N 0.61 4.52 -0.02 0.00 0.04 -1.26 -1.82 135.00 137.07 2r89 s PRO 87 Ca -0.02 1.23 -0.22 0.00 0.04 0.00 0.00 61.00 62.02 2r89 s PRO 87 Cb -0.05 -3.44 -0.24 0.00 0.04 0.00 0.00 34.50 30.81 2r89 s PRO 87 CO -0.04 0.02 1.05 0.82 0.04 0.00 0.00 177.00 178.89 2r89 h ILE 88 N 4.70 1.49 0.00 0.56 2.04 -1.57 -3.48 117.51 121.24 2r89 h ILE 88 Ca -0.41 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 63.36 2r89 h ILE 88 Cb 1.21 2.74 0.00 0.00 -0.74 0.00 0.00 36.82 40.03 2r89 h ILE 88 CO 0.75 0.59 0.00 -0.46 0.00 0.00 0.00 178.15 179.03 2r89 n ASN 89 N -4.31 0.00 0.00 1.72 6.94 -0.99 -5.02 115.26 113.59 2r89 n ASN 89 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.46 2r89 n ASN 89 Cb 0.63 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.05 2r89 n ASN 89 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2r89 n ASP 90 N 0.00 0.00 0.00 0.53 10.43 -1.26 -4.85 116.55 121.40 2r89 n ASP 90 Ca 0.00 -0.22 0.00 0.00 2.57 0.00 0.00 54.79 57.14 2r89 n ASP 90 Cb 0.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 42.96 2r89 n ASP 90 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2r89 n GLN 91 N 0.00 0.87 -4.25 -1.24 6.02 -1.26 -4.92 117.38 112.61 2r89 n GLN 91 Ca 0.00 -0.06 -0.17 0.00 -0.01 0.00 0.00 57.00 56.77 2r89 n GLN 91 Cb 0.05 -0.35 -0.14 0.00 1.02 0.00 0.00 30.24 30.83 2r89 n GLN 91 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2r89 s PHE 92 N -0.14 0.67 0.07 1.08 0.40 -1.26 -1.70 117.98 117.10 2r89 s PHE 92 Ca 0.00 -0.17 -0.14 0.00 -0.60 0.00 0.00 56.93 56.01 2r89 s PHE 92 Cb 0.00 -0.43 0.02 0.00 0.51 0.00 0.00 43.02 43.13 2r89 s PHE 92 CO 0.00 -0.02 0.34 0.20 0.70 0.00 0.00 175.22 176.44 2r89 s GLY 93 N -0.37 -0.16 0.33 4.36 0.00 -1.06 -1.43 107.32 109.00 2r89 s GLY 93 Ca 0.01 -0.04 0.03 0.00 0.00 0.00 0.00 44.72 44.72 2r89 s GLY 93 CO -0.00 -0.28 0.14 0.66 0.00 0.00 0.00 173.10 173.62 2r89 s TRP 94 N -3.08 1.70 -0.17 1.90 1.48 -0.75 -0.77 118.94 119.24 2r89 s TRP 94 Ca -0.01 -1.28 -0.35 0.00 -1.06 0.00 0.00 56.10 53.40 2r89 s TRP 94 Cb 0.01 -1.00 0.14 0.00 -1.16 0.00 0.00 33.47 31.46 2r89 s TRP 94 CO -0.07 -0.38 1.24 0.20 -4.06 0.00 0.00 176.95 173.88 2r89 s GLY 95 N -3.45 -0.31 0.04 3.67 0.00 0.18 -1.41 107.32 106.05 2r89 s GLY 95 Ca 0.33 1.47 -0.12 0.00 0.00 0.00 0.00 44.72 46.39 2r89 s GLY 95 CO 0.16 0.47 0.27 0.00 0.00 0.00 0.00 173.10 174.00 2r89 s ALA 96 N -2.38 -0.59 -0.12 3.20 0.00 0.15 0.27 121.76 122.29 2r89 s ALA 96 Ca 0.10 -0.05 -0.24 0.00 0.00 0.00 0.00 51.96 51.77 2r89 s ALA 96 Cb 0.00 0.29 0.06 0.00 0.00 0.00 0.00 23.12 23.47 2r89 s ALA 96 CO -0.04 -0.38 0.59 -1.54 0.00 0.00 0.00 175.76 174.39 2r89 s SER 97 N -2.00 -0.58 -0.23 0.00 1.04 -0.85 0.38 113.70 111.46 2r89 s SER 97 Ca -0.06 0.82 -0.04 0.00 0.48 0.00 0.00 55.95 57.16 2r89 s SER 97 Cb -0.01 0.79 -0.00 0.00 0.10 0.00 0.00 66.02 66.90 2r89 s SER 97 CO -0.03 -0.42 -0.04 -0.63 0.98 0.00 0.00 173.24 173.10 2r89 s ILE 98 N -0.61 3.29 0.13 -1.02 1.01 0.08 -2.39 121.20 121.69 2r89 s ILE 98 Ca -0.07 -0.61 -0.06 0.00 0.00 0.00 0.00 60.65 59.91 2r89 s ILE 98 Cb -0.03 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.89 2r89 s ILE 98 CO 0.05 0.37 0.18 0.42 0.00 0.00 0.00 174.94 175.96 2r89 s THR 99 N 1.45 0.11 -0.61 2.92 -4.23 -0.20 -0.49 115.64 114.58 2r89 s THR 99 Ca 0.05 -1.50 -0.04 0.00 -1.18 0.00 0.00 61.69 59.01 2r89 s THR 99 Cb -0.15 -1.75 0.16 0.00 1.34 0.00 0.00 72.50 72.10 2r89 s THR 99 CO -0.03 -0.48 0.44 -0.55 -0.54 0.00 0.00 174.62 173.45 2r89 s SER 100 N -2.96 5.40 0.32 3.99 0.15 -1.26 0.21 113.70 119.55 2r89 s SER 100 Ca 0.15 -2.69 0.05 0.00 0.70 0.00 0.00 55.95 54.16 2r89 s SER 100 Cb 0.05 -1.89 0.54 0.00 -1.71 0.00 0.00 66.02 63.01 2r89 s SER 100 CO -0.03 -0.43 1.80 0.78 1.20 0.00 0.00 173.24 176.56 2r89 h ASN 101 N 7.29 0.40 -4.90 5.45 4.21 -1.94 -3.41 115.58 122.69 2r89 h ASN 101 Ca -0.03 -0.11 -0.16 0.00 1.21 0.00 0.00 56.30 57.21 2r89 h ASN 101 Cb 0.98 -0.11 -0.21 0.00 -1.12 0.00 0.00 38.32 37.86 2r89 h ASN 101 CO 0.72 0.60 -0.61 -0.31 -1.29 0.00 0.00 177.43 176.54 2r89 s TYR 102 N -4.62 0.15 -0.29 1.19 1.51 -1.26 -4.61 117.35 109.42 2r89 s TYR 102 Ca -0.06 -0.33 -0.15 0.00 -1.01 0.00 0.00 57.07 55.52 2r89 s TYR 102 Cb 0.14 -0.12 0.14 0.00 -0.11 0.00 0.00 41.96 42.01 2r89 s TYR 102 CO 0.77 -0.22 0.90 0.20 -1.11 0.00 0.00 175.55 176.09 2r89 s GLY 103 N -1.33 -0.21 -0.02 0.71 0.00 -1.26 -3.27 107.32 101.94 2r89 s GLY 103 Ca -0.14 2.93 0.01 0.00 0.00 0.00 0.00 44.72 47.52 2r89 s GLY 103 CO 0.00 2.74 -0.04 -2.27 0.00 0.00 0.00 173.10 173.53 2r89 s LEU 104 N 1.75 1.70 -0.30 0.66 2.96 -0.92 -5.04 118.68 119.50 2r89 s LEU 104 Ca -0.08 -0.08 -0.12 0.00 -0.22 0.00 0.00 54.13 53.64 2r89 s LEU 104 Cb -0.05 -0.27 0.14 0.00 0.50 0.00 0.00 46.19 46.51 2r89 s LEU 104 CO -0.17 0.00 0.77 0.00 -1.32 0.00 0.00 176.35 175.64 2r89 s ALA 105 N 0.32 -2.26 0.05 5.97 0.00 -1.24 -0.51 121.76 124.08 2r89 s ALA 105 Ca -0.03 2.25 0.03 0.00 0.00 0.00 0.00 51.96 54.21 2r89 s ALA 105 Cb -0.07 -1.85 -0.02 0.00 0.00 0.00 0.00 23.12 21.18 2r89 s ALA 105 CO -0.00 -0.89 -0.10 0.95 0.00 0.00 0.00 175.76 175.72 2r89 s THR 106 N 2.65 0.70 -0.14 0.00 -4.23 -0.94 -3.99 115.64 109.69 2r89 s THR 106 Ca -0.05 -1.08 -0.06 0.00 -1.18 0.00 0.00 61.69 59.31 2r89 s THR 106 Cb -0.10 -0.73 0.06 0.00 1.34 0.00 0.00 72.50 73.08 2r89 s THR 106 CO -0.18 -0.30 0.31 -0.70 -0.54 0.00 0.00 174.62 173.21 2r89 s GLU 107 N -1.51 0.25 0.44 3.99 2.12 0.31 -1.36 118.70 122.93 2r89 s GLU 107 Ca -0.07 0.71 0.07 0.00 0.36 0.00 0.00 54.97 56.05 2r89 s GLU 107 Cb -0.09 -0.02 -0.01 0.00 0.26 0.00 0.00 34.13 34.26 2r89 s GLU 107 CO 0.01 -0.20 0.39 -0.06 -0.54 0.00 0.00 175.26 174.85 2r89 s PHE 108 N 1.73 2.55 0.74 5.30 2.99 -0.12 -4.54 117.98 126.63 2r89 s PHE 108 Ca -0.06 -0.54 -0.11 0.00 0.00 0.00 0.00 56.93 56.21 2r89 s PHE 108 Cb -0.10 -2.14 0.04 0.00 0.00 0.00 0.00 43.02 40.81 2r89 s PHE 108 CO -0.10 -0.18 1.12 -0.80 -0.00 0.00 0.00 175.22 175.26 2r89 s ASN 109 N -4.16 5.12 0.23 1.36 0.02 -1.26 -4.74 114.94 111.51 2r89 s ASN 109 Ca 0.47 1.00 -0.08 0.00 -1.02 0.00 0.00 52.86 53.22 2r89 s ASN 109 Cb -0.03 -1.69 0.21 0.00 0.02 0.00 0.00 41.25 39.76 2r89 s ASN 109 CO 0.27 -1.53 1.90 0.44 0.02 0.00 0.00 177.10 178.20 2r89 h ASP 110 N -0.79 0.97 -2.08 -1.22 3.32 -1.94 -3.24 116.42 111.45 2r89 h ASP 110 Ca -0.45 -0.02 -0.79 0.00 0.02 0.00 0.00 57.03 55.78 2r89 h ASP 110 Cb 1.28 -0.24 -0.25 0.00 0.22 0.00 0.00 39.33 40.34 2r89 h ASP 110 CO 0.64 0.70 1.20 0.35 -1.72 0.00 0.00 179.24 180.41 2r89 n THR 111 N -4.50 5.75 -3.45 0.35 -2.24 -1.24 -4.11 114.28 104.84 2r89 n THR 111 Ca 0.09 -5.59 -0.37 0.00 -2.27 0.00 0.00 64.05 55.91 2r89 n THR 111 Cb 0.02 -1.58 -0.07 0.00 -2.10 0.00 0.00 70.33 66.60 2r89 n THR 111 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2r89 s TYR 112 N -3.90 3.44 0.29 4.78 5.04 -1.23 -4.95 117.35 120.82 2r89 s TYR 112 Ca 0.42 0.64 0.02 0.00 -2.44 0.00 0.00 57.07 55.72 2r89 s TYR 112 Cb 0.22 -2.44 0.72 0.00 0.35 0.00 0.00 41.96 40.80 2r89 s TYR 112 CO -0.15 0.14 1.63 0.00 -1.34 0.00 0.00 175.55 175.83 2r89 h ALA 113 N 6.94 1.26 -1.43 3.97 0.00 -1.88 -0.58 119.26 127.53 2r89 h ALA 113 Ca -0.39 0.24 -0.73 0.00 0.00 0.00 0.00 54.91 54.03 2r89 h ALA 113 Cb 1.17 0.36 -0.32 0.00 0.00 0.00 0.00 17.79 19.00 2r89 h ALA 113 CO 0.74 -0.49 0.51 0.41 0.00 0.00 0.00 179.25 180.42 2r89 n GLY 114 N -1.39 5.88 1.09 0.00 0.00 -1.26 0.83 105.19 110.34 2r89 n GLY 114 Ca 0.22 -2.62 0.03 0.00 0.00 0.00 0.00 46.02 43.65 2r89 n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r89 n GLY 115 N -0.26 2.09 0.08 -0.02 0.00 -0.23 -2.90 105.19 103.96 2r89 n GLY 115 Ca 0.45 -0.40 0.12 0.00 0.00 0.00 0.00 46.02 46.19 2r89 n GLY 115 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2r89 h SER 116 N 1.74 0.00 -1.24 1.61 0.02 -1.78 1.18 113.55 115.07 2r89 h SER 116 Ca 0.00 -0.16 -0.39 0.00 -0.84 0.00 0.00 61.79 60.40 2r89 h SER 116 Cb 1.12 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 63.26 2r89 h SER 116 CO 0.21 0.08 -1.20 1.33 -1.14 0.00 0.00 176.83 176.11 2r89 n VAL 117 N -2.28 0.69 0.00 2.27 0.24 -1.14 -4.79 118.33 113.32 2r89 n VAL 117 Ca 0.03 -3.43 0.00 0.00 -2.04 0.00 0.00 64.34 58.90 2r89 n VAL 117 Cb 0.47 0.44 0.00 0.00 -1.47 0.00 0.00 33.84 33.28 2r89 n VAL 117 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2r89 n GLY 118 N 0.02 -1.21 0.00 7.63 0.00 -1.25 -4.49 105.19 105.89 2r89 n GLY 118 Ca 0.13 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.62 2r89 n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r89 n GLY 119 N 0.00 1.75 3.06 -0.02 0.00 -0.14 -4.14 105.19 105.70 2r89 n GLY 119 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2r89 n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r89 s THR 120 N 0.06 0.74 -0.33 2.61 2.01 -0.34 -0.95 115.64 119.44 2r89 s THR 120 Ca 0.00 -0.72 -0.00 0.00 0.31 0.00 0.00 61.69 61.28 2r89 s THR 120 Cb 0.00 -0.68 0.13 0.00 0.01 0.00 0.00 72.50 71.96 2r89 s THR 120 CO 0.00 -0.02 0.24 -0.89 -0.69 0.00 0.00 174.62 173.26 2r89 s THR 121 N -0.68 -0.09 -0.10 -0.82 2.01 -0.47 -1.38 115.64 114.12 2r89 s THR 121 Ca -0.01 -1.17 -0.02 0.00 0.31 0.00 0.00 61.69 60.80 2r89 s THR 121 Cb -0.06 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.45 2r89 s THR 121 CO 0.00 -0.77 -0.02 -1.81 -0.69 0.00 0.00 174.62 171.33 2r89 s ASP 122 N 1.56 5.05 -0.31 3.53 1.11 -0.94 -2.21 116.67 124.46 2r89 s ASP 122 Ca 0.15 0.05 0.02 0.00 0.18 0.00 0.00 52.55 52.95 2r89 s ASP 122 Cb -0.18 -1.50 0.16 0.00 1.07 0.00 0.00 42.92 42.46 2r89 s ASP 122 CO -0.13 0.32 0.41 -0.22 1.18 0.00 0.00 175.17 176.73 2r89 s LEU 123 N -0.54 -0.71 -0.12 1.23 0.20 0.33 -0.19 118.68 118.87 2r89 s LEU 123 Ca 0.09 -0.58 -0.08 0.00 0.69 0.00 0.00 54.13 54.25 2r89 s LEU 123 Cb -0.12 1.06 -0.04 0.00 -0.43 0.00 0.00 46.19 46.66 2r89 s LEU 123 CO 0.02 -0.33 0.17 -1.61 -0.29 0.00 0.00 176.35 174.30 2r89 s GLU 124 N 2.36 3.59 0.04 1.98 2.02 0.24 -2.17 118.70 126.76 2r89 s GLU 124 Ca 0.11 -0.09 0.05 0.00 0.02 0.00 0.00 54.97 55.06 2r89 s GLU 124 Cb -0.12 -3.23 -0.02 0.00 0.10 0.00 0.00 34.13 30.86 2r89 s GLU 124 CO -0.26 0.70 -0.14 0.99 0.02 0.00 0.00 175.26 176.57 2r89 s THR 125 N -0.84 1.15 -0.03 3.63 2.01 -1.20 0.99 115.64 121.35 2r89 s THR 125 Ca 0.15 -0.99 0.02 0.00 0.31 0.00 0.00 61.69 61.17 2r89 s THR 125 Cb -0.12 -1.03 0.01 0.00 0.01 0.00 0.00 72.50 71.36 2r89 s THR 125 CO 0.04 0.03 -0.06 -0.32 -0.69 0.00 0.00 174.62 173.62 2r89 s MET 126 N -1.10 0.79 -0.19 4.92 0.00 0.39 -4.65 119.30 119.46 2r89 s MET 126 Ca 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 55.69 55.50 2r89 s MET 126 Cb -0.08 -0.76 -0.00 0.00 0.00 0.00 0.00 34.83 33.99 2r89 s MET 126 CO 0.01 0.04 -0.11 1.21 0.00 0.00 0.00 175.02 176.17 2r89 s ASN 127 N 0.41 3.86 -0.31 1.11 3.84 0.57 -0.46 114.94 123.95 2r89 s ASN 127 Ca -0.06 -0.46 -0.07 0.00 0.21 0.00 0.00 52.86 52.48 2r89 s ASN 127 Cb -0.10 -1.63 0.02 0.00 -0.55 0.00 0.00 41.25 38.99 2r89 s ASN 127 CO 0.00 0.02 0.10 -0.76 -2.79 0.00 0.00 177.10 173.68 2r89 s LEU 128 N 1.19 4.06 -0.08 3.21 1.43 0.09 -1.03 118.68 127.55 2r89 s LEU 128 Ca 0.02 -0.85 0.03 0.00 -1.03 0.00 0.00 54.13 52.30 2r89 s LEU 128 Cb -0.14 -1.89 0.01 0.00 0.03 0.00 0.00 46.19 44.19 2r89 s LEU 128 CO -0.04 -0.25 -0.16 0.21 0.23 0.00 0.00 176.35 176.35 2r89 s ASN 129 N 1.48 2.21 -0.08 2.29 2.47 -1.01 -0.30 114.94 122.00 2r89 s ASN 129 Ca 0.01 -0.38 0.05 0.00 0.42 0.00 0.00 52.86 52.96 2r89 s ASN 129 Cb -0.18 -1.01 -0.00 0.00 -1.45 0.00 0.00 41.25 38.60 2r89 s ASN 129 CO 0.03 0.06 -0.23 -0.22 -3.72 0.00 0.00 177.10 173.02 2r89 s LEU 130 N 0.63 2.03 0.15 3.21 0.20 -0.85 -2.02 118.68 122.03 2r89 s LEU 130 Ca -0.15 -0.51 -0.20 0.00 0.69 0.00 0.00 54.13 53.97 2r89 s LEU 130 Cb -0.16 -1.32 0.05 0.00 -0.43 0.00 0.00 46.19 44.33 2r89 s LEU 130 CO 0.04 0.18 0.51 -0.94 -0.29 0.00 0.00 176.35 175.85 2r89 s SER 131 N 0.19 -0.42 0.11 3.68 1.04 0.14 -1.51 113.70 116.94 2r89 s SER 131 Ca -0.13 -0.15 0.07 0.00 0.48 0.00 0.00 55.95 56.22 2r89 s SER 131 Cb -0.16 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 2r89 s SER 131 CO 0.06 -0.92 -0.17 -0.83 0.98 0.00 0.00 173.24 172.36 2r89 s GLY 132 N -2.78 1.13 0.10 7.32 0.00 -0.80 0.51 107.32 112.80 2r89 s GLY 132 Ca 0.02 -1.23 0.07 0.00 0.00 0.00 0.00 44.72 43.58 2r89 s GLY 132 CO -0.12 -1.26 -0.18 0.00 0.00 0.00 0.00 173.10 171.54 2r89 s ALA 133 N -1.54 1.57 0.01 3.20 0.00 0.05 -1.18 121.76 123.87 2r89 s ALA 133 Ca 0.06 -1.18 0.08 0.00 0.00 0.00 0.00 51.96 50.93 2r89 s ALA 133 Cb -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.84 2r89 s ALA 133 CO 0.04 0.27 -0.26 -0.47 0.00 0.00 0.00 175.76 175.34 2r89 s TYR 134 N -1.33 2.27 -0.09 0.00 6.04 0.31 -2.57 117.35 121.98 2r89 s TYR 134 Ca 0.04 -0.42 0.03 0.00 0.04 0.00 0.00 57.07 56.77 2r89 s TYR 134 Cb -0.09 -1.42 -0.01 0.00 -1.04 0.00 0.00 41.96 39.40 2r89 s TYR 134 CO 0.04 0.03 -0.21 0.50 -1.54 0.00 0.00 175.55 174.36 2r89 s ARG 135 N -0.86 2.99 -0.06 4.97 3.52 -0.69 0.38 118.95 129.20 2r89 s ARG 135 Ca 0.10 -0.83 0.08 0.00 -0.13 0.00 0.00 55.73 54.96 2r89 s ARG 135 Cb -0.10 -2.35 0.12 0.00 -1.56 0.00 0.00 34.95 31.06 2r89 s ARG 135 CO 0.00 0.26 1.01 -0.11 -0.81 0.00 0.00 175.30 175.65 2r89 n LEU 136 N 3.32 1.57 0.00 -0.88 7.94 -0.59 -4.79 117.00 123.57 2r89 n LEU 136 Ca -0.18 -2.06 0.00 0.00 -1.11 0.00 0.00 56.01 52.66 2r89 n LEU 136 Cb 0.53 -0.18 0.00 0.00 0.53 0.00 0.00 43.42 44.29 2r89 n LEU 136 CO 0.28 0.49 0.00 -3.20 -1.11 0.00 0.00 177.39 173.85 2r89 n ASN 137 N -0.76 0.00 0.26 1.96 4.05 -1.19 -4.83 115.26 114.75 2r89 n ASN 137 Ca 0.07 0.00 0.10 0.00 0.45 0.00 0.00 54.58 55.20 2r89 n ASN 137 Cb 0.52 0.00 0.40 0.00 1.23 0.00 0.00 39.78 41.94 2r89 n ASN 137 CO 0.00 0.00 0.00 0.78 -3.05 0.00 0.00 177.26 174.99 2r89 h ASN 138 N 0.00 0.00 0.00 1.20 2.35 -1.97 -2.87 115.58 114.28 2r89 h ASN 138 Ca 0.00 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.50 2r89 h ASN 138 Cb 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 2r89 h ASN 138 CO 0.00 0.00 -1.74 0.00 -1.65 0.00 0.00 177.43 174.04 2r89 n ALA 139 N -1.78 1.72 -2.61 -0.83 0.00 -1.26 -4.80 120.51 110.95 2r89 n ALA 139 Ca 0.02 -0.71 -0.39 0.00 0.00 0.00 0.00 53.44 52.36 2r89 n ALA 139 Cb 0.79 0.22 -0.05 0.00 0.00 0.00 0.00 19.45 20.41 2r89 n ALA 139 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2r89 s TRP 140 N -2.41 3.61 -0.05 0.00 0.52 -1.09 -2.04 118.94 117.48 2r89 s TRP 140 Ca -0.25 1.12 -0.04 0.00 0.02 0.00 0.00 56.10 56.95 2r89 s TRP 140 Cb 0.08 -2.64 0.02 0.00 -1.15 0.00 0.00 33.47 29.78 2r89 s TRP 140 CO 0.33 0.24 0.13 -1.12 0.02 0.00 0.00 176.95 176.54 2r89 s SER 141 N 0.28 -0.13 -0.07 2.95 0.01 -0.67 -1.54 113.70 114.53 2r89 s SER 141 Ca 0.31 0.27 0.03 0.00 1.31 0.00 0.00 55.95 57.87 2r89 s SER 141 Cb -0.17 0.25 0.01 0.00 0.21 0.00 0.00 66.02 66.32 2r89 s SER 141 CO 0.15 -0.06 -0.16 -0.36 0.41 0.00 0.00 173.24 173.22 2r89 s PHE 142 N 0.25 1.80 0.16 2.43 0.40 0.16 -2.03 117.98 121.15 2r89 s PHE 142 Ca -0.01 -0.68 0.10 0.00 -0.60 0.00 0.00 56.93 55.74 2r89 s PHE 142 Cb -0.03 -1.26 -0.04 0.00 0.51 0.00 0.00 43.02 42.20 2r89 s PHE 142 CO -0.01 -0.30 -0.17 0.20 0.70 0.00 0.00 175.22 175.63 2r89 s GLY 143 N 0.49 1.70 -0.16 4.36 0.00 -0.94 0.11 107.32 112.89 2r89 s GLY 143 Ca -0.14 -1.47 -0.13 0.00 0.00 0.00 0.00 44.72 42.98 2r89 s GLY 143 CO 0.05 -1.47 0.40 -2.27 0.00 0.00 0.00 173.10 169.82 2r89 s LEU 144 N -2.47 0.30 0.22 0.66 0.20 -0.33 0.44 118.68 117.70 2r89 s LEU 144 Ca 0.20 0.83 -0.03 0.00 0.69 0.00 0.00 54.13 55.83 2r89 s LEU 144 Cb -0.09 1.37 -0.03 0.00 -0.43 0.00 0.00 46.19 47.00 2r89 s LEU 144 CO 0.11 -0.16 0.21 -0.83 -0.29 0.00 0.00 176.35 175.40 2r89 s GLY 145 N 0.57 1.34 -0.01 7.98 0.00 -0.44 -1.90 107.32 114.86 2r89 s GLY 145 Ca -0.03 -1.57 0.05 0.00 0.00 0.00 0.00 44.72 43.17 2r89 s GLY 145 CO -0.03 -1.25 -0.17 -1.36 0.00 0.00 0.00 173.10 170.28 2r89 s PHE 146 N -4.06 1.55 0.01 1.90 0.40 -0.57 -2.75 117.98 114.46 2r89 s PHE 146 Ca 0.36 -0.30 0.07 0.00 -0.60 0.00 0.00 56.93 56.47 2r89 s PHE 146 Cb 0.05 -0.99 -0.02 0.00 0.51 0.00 0.00 43.02 42.57 2r89 s PHE 146 CO 0.13 -0.02 -0.22 -0.80 0.70 0.00 0.00 175.22 175.01 2r89 s ASN 147 N -0.44 2.59 -0.22 1.36 -0.87 0.27 -2.01 114.94 115.62 2r89 s ASN 147 Ca 0.07 -0.45 0.02 0.00 -1.57 0.00 0.00 52.86 50.92 2r89 s ASN 147 Cb -0.07 -0.26 0.04 0.00 -0.02 0.00 0.00 41.25 40.95 2r89 s ASN 147 CO -0.01 0.23 -0.13 0.00 -2.57 0.00 0.00 177.10 174.63 2r89 s ALA 148 N -0.63 2.29 -0.15 0.60 0.00 0.59 -1.46 121.76 122.99 2r89 s ALA 148 Ca 0.08 -1.41 -0.05 0.00 0.00 0.00 0.00 51.96 50.59 2r89 s ALA 148 Cb -0.09 -1.36 -0.03 0.00 0.00 0.00 0.00 23.12 21.64 2r89 s ALA 148 CO 0.00 -0.83 0.02 0.08 0.00 0.00 0.00 175.76 175.03 2r89 s VAL 149 N 1.26 4.39 -0.30 0.00 1.01 0.26 -0.73 120.40 126.29 2r89 s VAL 149 Ca -0.02 -0.19 -0.10 0.00 0.00 0.00 0.00 61.98 61.67 2r89 s VAL 149 Cb -0.17 -2.93 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 2r89 s VAL 149 CO -0.08 0.51 0.15 -0.47 0.00 0.00 0.00 175.10 175.21 2r89 s TYR 150 N 0.05 3.17 -0.21 5.22 5.04 0.39 0.17 117.35 131.19 2r89 s TYR 150 Ca 0.03 -0.47 -0.03 0.00 -2.44 0.00 0.00 57.07 54.16 2r89 s TYR 150 Cb -0.13 -2.35 -0.00 0.00 0.35 0.00 0.00 41.96 39.83 2r89 s TYR 150 CO 0.02 -0.41 -0.07 0.00 -1.34 0.00 0.00 175.55 173.74 2r89 s ALA 151 N 1.63 2.72 -0.27 3.97 0.00 -0.31 -0.46 121.76 129.04 2r89 s ALA 151 Ca 0.05 -1.18 -0.05 0.00 0.00 0.00 0.00 51.96 50.78 2r89 s ALA 151 Cb -0.17 -1.61 0.01 0.00 0.00 0.00 0.00 23.12 21.36 2r89 s ALA 151 CO 0.07 -0.41 0.03 1.03 0.00 0.00 0.00 175.76 176.47 2r89 s ARG 152 N 1.44 3.08 0.02 0.00 0.52 0.28 -2.13 118.95 122.16 2r89 s ARG 152 Ca 0.06 -0.85 0.08 0.00 -0.52 0.00 0.00 55.73 54.50 2r89 s ARG 152 Cb -0.14 -3.23 -0.02 0.00 0.52 0.00 0.00 34.95 32.08 2r89 s ARG 152 CO -0.05 -0.39 -0.23 0.00 0.02 0.00 0.00 175.30 174.65 2r89 s ALA 153 N 1.46 1.92 -0.04 2.13 0.00 -0.90 0.80 121.76 127.14 2r89 s ALA 153 Ca 0.02 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 50.93 2r89 s ALA 153 Cb -0.17 -0.43 0.02 0.00 0.00 0.00 0.00 23.12 22.54 2r89 s ALA 153 CO 0.00 0.46 -0.06 0.21 0.00 0.00 0.00 175.76 176.37 2r89 s LYS 154 N -0.91 0.89 -0.05 0.00 2.20 0.73 -2.44 119.74 120.17 2r89 s LYS 154 Ca 0.09 -0.17 -0.00 0.00 -0.36 0.00 0.00 55.97 55.53 2r89 s LYS 154 Cb -0.09 -0.86 0.03 0.00 -1.51 0.00 0.00 37.83 35.40 2r89 s LYS 154 CO 0.01 -0.03 -0.01 0.42 -0.36 0.00 0.00 175.35 175.38 2r89 s ILE 155 N 0.70 0.31 -0.03 5.43 1.01 -1.02 -2.21 121.20 125.40 2r89 s ILE 155 Ca -0.10 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.62 2r89 s ILE 155 Cb -0.13 -0.42 0.03 0.00 0.01 0.00 0.00 42.46 41.95 2r89 s ILE 155 CO 0.01 0.20 0.01 -1.61 0.00 0.00 0.00 174.94 173.55 2r89 s GLU 156 N 1.35 0.20 0.01 2.79 2.02 -0.48 -2.93 118.70 121.67 2r89 s GLU 156 Ca -0.05 0.11 0.03 0.00 0.02 0.00 0.00 54.97 55.08 2r89 s GLU 156 Cb -0.13 -0.41 -0.01 0.00 0.10 0.00 0.00 34.13 33.67 2r89 s GLU 156 CO -0.02 -0.14 -0.09 1.03 0.02 0.00 0.00 175.26 176.05 2r89 s ARG 157 N 1.02 0.67 0.45 1.61 1.81 -0.95 -0.96 118.95 122.60 2r89 s ARG 157 Ca -0.10 -0.48 0.05 0.00 -1.72 0.00 0.00 55.73 53.48 2r89 s ARG 157 Cb -0.13 -0.61 -0.05 0.00 -0.45 0.00 0.00 34.95 33.70 2r89 s ARG 157 CO -0.02 0.16 0.03 -0.06 -0.68 0.00 0.00 175.30 174.73 2r89 s PHE 158 N -0.58 2.29 -1.50 -0.53 0.40 0.41 -0.12 117.98 118.34 2r89 s PHE 158 Ca -0.00 -0.76 0.22 0.00 -0.60 0.00 0.00 56.93 55.78 2r89 s PHE 158 Cb -0.06 -1.75 1.11 0.00 0.51 0.00 0.00 43.02 42.84 2r89 s PHE 158 CO 0.00 0.33 1.69 0.00 0.70 0.00 0.00 175.22 177.94 2r89 n ALA 159 N -1.11 2.14 -0.16 5.36 0.00 -0.76 -2.66 120.51 123.31 2r89 n ALA 159 Ca -0.09 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2r89 n ALA 159 Cb 0.67 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.77 2r89 n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r89 n GLY 160 N 0.51 2.41 1.60 0.00 0.00 -1.26 -0.98 105.19 107.47 2r89 n GLY 160 Ca 0.11 0.33 -0.07 0.00 0.00 0.00 0.00 46.02 46.39 2r89 n GLY 160 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2r89 n ASP 161 N 3.36 2.91 0.26 1.61 5.68 0.24 -4.00 116.55 126.61 2r89 n ASP 161 Ca 0.00 -3.35 -0.16 0.00 -0.50 0.00 0.00 54.79 50.78 2r89 n ASP 161 Cb 0.00 -0.42 -0.08 0.00 -1.14 0.00 0.00 41.12 39.48 2r89 n ASP 161 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 2r89 h LEU 162 N 1.71 -0.52 -2.00 -2.12 3.38 -1.31 -2.19 115.31 112.26 2r89 h LEU 162 Ca 0.10 -0.01 0.30 0.00 0.09 0.00 0.00 57.88 58.36 2r89 h LEU 162 Cb 1.36 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 42.21 2r89 h LEU 162 CO 0.34 -0.33 0.74 1.23 0.09 0.00 0.00 178.44 180.51 2r89 h GLY 163 N -0.66 0.00 2.00 0.83 0.00 -1.80 1.65 103.07 105.09 2r89 h GLY 163 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2r89 h GLY 163 CO 0.10 0.00 0.00 1.46 0.00 0.00 0.00 176.54 178.10 2r89 h GLN 164 N 0.00 0.00 0.03 4.80 4.20 -1.51 -0.64 115.11 121.99 2r89 h GLN 164 Ca 0.48 0.00 -0.39 0.00 0.06 0.00 0.00 58.65 58.81 2r89 h GLN 164 Cb 1.96 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 29.68 2r89 h GLN 164 CO -0.01 0.00 -2.32 1.28 -0.67 0.00 0.00 178.83 177.12 2r89 n LEU 165 N -2.61 2.68 -0.34 1.46 4.77 0.52 -3.15 117.00 120.33 2r89 n LEU 165 Ca 0.03 0.05 0.06 0.00 -0.03 0.00 0.00 56.01 56.12 2r89 n LEU 165 Cb 0.36 -0.94 0.25 0.00 -2.33 0.00 0.00 43.42 40.75 2r89 n LEU 165 CO 0.27 0.83 1.24 0.58 -1.33 0.00 0.00 177.39 178.98 2r89 h VAL 166 N -0.20 0.97 0.00 4.08 2.07 -0.28 -0.97 116.25 121.91 2r89 h VAL 166 Ca -0.55 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 66.63 2r89 h VAL 166 Cb 1.85 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 2r89 h VAL 166 CO -0.11 0.18 0.00 0.00 0.02 0.00 0.00 177.57 177.66 2r89 n ALA 167 N -2.37 -0.05 0.30 1.67 0.00 -0.25 -1.60 120.51 118.20 2r89 n ALA 167 Ca 0.17 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.63 2r89 n ALA 167 Cb 0.31 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.83 2r89 n ALA 167 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2r89 h GLY 168 N 0.00 0.00 0.10 0.00 0.00 -1.53 1.86 103.07 103.50 2r89 h GLY 168 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2r89 h GLY 168 CO 0.00 0.00 -0.03 -1.61 0.00 0.00 0.00 176.54 174.90 2r89 h GLN 169 N 0.00 -0.07 -0.13 4.80 5.75 -1.05 -3.26 115.11 121.14 2r89 h GLN 169 Ca 0.03 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.57 2r89 h GLN 169 Cb 1.98 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 30.54 2r89 h GLN 169 CO -0.00 0.38 0.11 0.82 -2.65 0.00 0.00 178.83 177.49 2r89 h ILE 170 N -0.97 0.73 -0.93 2.39 2.04 0.38 -1.89 117.51 119.25 2r89 h ILE 170 Ca -0.01 0.00 -0.54 0.00 1.00 0.00 0.00 64.86 65.31 2r89 h ILE 170 Cb 0.48 0.92 -0.14 0.00 -0.74 0.00 0.00 36.82 37.34 2r89 h ILE 170 CO 0.01 0.00 1.01 0.23 0.00 0.00 0.00 178.15 179.40 2r89 n MET 171 N -4.19 3.02 0.00 2.37 2.81 0.33 -3.13 117.12 118.34 2r89 n MET 171 Ca 0.00 -2.50 0.00 0.00 -1.81 0.00 0.00 57.70 53.39 2r89 n MET 171 Cb 0.23 -2.29 0.00 0.00 -0.71 0.00 0.00 33.22 30.45 2r89 n MET 171 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 2r89 n GLN 172 N 1.39 0.00 -2.13 0.03 7.27 -0.72 -4.89 117.38 118.34 2r89 n GLN 172 Ca 0.53 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 57.31 2r89 n GLN 172 Cb 0.49 0.00 0.02 0.00 2.41 0.00 0.00 30.24 33.17 2r89 n GLN 172 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 2r89 s SER 173 N -0.63 5.88 0.60 1.69 1.04 -1.18 -4.92 113.70 116.18 2r89 s SER 173 Ca 0.00 1.10 0.29 0.00 0.48 0.00 0.00 55.95 57.82 2r89 s SER 173 Cb 0.00 -2.12 1.59 0.00 0.10 0.00 0.00 66.02 65.59 2r89 s SER 173 CO 0.00 -0.99 1.99 1.55 0.98 0.00 0.00 173.24 176.78 2r89 h PRO 174 N -0.28 0.00 -0.27 4.02 0.13 -1.96 0.54 132.00 134.18 2r89 h PRO 174 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2r89 h PRO 174 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2r89 h PRO 174 CO 0.62 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.39 2r89 n ALA 175 N -2.29 2.05 -0.52 -0.56 0.00 -1.26 -4.02 120.51 113.91 2r89 n ALA 175 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2r89 n ALA 175 Cb 0.48 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.93 2r89 n ALA 175 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r89 n GLY 176 N 0.15 -0.96 0.33 0.00 0.00 0.19 -4.04 105.19 100.87 2r89 n GLY 176 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 2r89 n GLY 176 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2r89 h GLN 177 N 0.00 0.02 -5.10 1.61 7.50 -1.81 -3.42 115.11 113.90 2r89 h GLN 177 Ca 0.00 -0.00 -0.65 0.00 0.50 0.00 0.00 58.65 58.50 2r89 h GLN 177 Cb 0.00 -0.00 0.05 0.00 0.05 0.00 0.00 27.48 27.58 2r89 h GLN 177 CO 0.00 0.01 -0.06 2.41 -1.50 0.00 0.00 178.83 179.69 2r89 n THR 178 N -5.53 0.38 1.16 -0.54 -1.04 -1.26 -4.83 114.28 102.62 2r89 n THR 178 Ca 0.18 -0.10 0.12 0.00 -2.04 0.00 0.00 64.05 62.21 2r89 n THR 178 Cb 0.58 0.00 0.25 0.00 -1.82 0.00 0.00 70.33 69.34 2r89 n THR 178 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2r89 n GLN 179 N 1.18 0.88 0.18 -2.82 10.64 -1.26 -2.17 117.38 124.00 2r89 n GLN 179 Ca 0.17 -0.59 0.12 0.00 -1.83 0.00 0.00 57.00 54.87 2r89 n GLN 179 Cb 0.10 -1.49 0.25 0.00 -0.86 0.00 0.00 30.24 28.24 2r89 n GLN 179 CO 0.00 0.00 0.00 0.37 -1.83 0.00 0.00 177.06 175.60 2r89 h GLN 180 N 1.45 0.00 0.00 2.61 -0.00 -1.93 -3.09 115.11 114.15 2r89 h GLN 180 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 58.65 58.50 2r89 h GLN 180 Cb 0.57 0.00 -0.03 0.00 0.00 0.00 0.00 27.48 28.03 2r89 h GLN 180 CO 0.00 0.00 -2.02 0.41 0.00 0.00 0.00 178.83 177.22 2r89 n GLY 181 N 1.17 -1.05 0.32 2.39 0.00 -1.09 -4.33 105.19 102.60 2r89 n GLY 181 Ca 0.04 -0.39 0.17 0.00 0.00 0.00 0.00 46.02 45.84 2r89 n GLY 181 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2r89 h GLN 182 N 0.00 0.33 0.42 1.61 3.07 -1.35 0.74 115.11 119.93 2r89 h GLN 182 Ca -0.22 -0.02 -0.01 0.00 0.09 0.00 0.00 58.65 58.49 2r89 h GLN 182 Cb 1.52 -0.07 -0.03 0.00 0.08 0.00 0.00 27.48 28.98 2r89 h GLN 182 CO 0.02 0.22 -0.50 0.00 0.09 0.00 0.00 178.83 178.65 2r89 h ALA 183 N 1.78 -1.12 -0.99 0.06 0.00 -1.76 0.42 119.26 117.66 2r89 h ALA 183 Ca 0.62 -0.17 0.13 0.00 0.00 0.00 0.00 54.91 55.49 2r89 h ALA 183 Cb 1.28 0.76 -0.08 0.00 0.00 0.00 0.00 17.79 19.74 2r89 h ALA 183 CO -0.59 -1.17 0.62 -0.07 0.00 0.00 0.00 179.25 178.04 2r89 h LEU 184 N -0.95 0.87 -0.02 0.00 -0.00 -0.64 -2.44 115.31 112.13 2r89 h LEU 184 Ca -0.05 0.05 0.01 0.00 -0.00 0.00 0.00 57.88 57.89 2r89 h LEU 184 Cb 0.84 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 41.36 2r89 h LEU 184 CO -0.11 0.44 -0.20 0.00 -0.00 0.00 0.00 178.44 178.58 2r89 h ALA 185 N 1.56 -0.64 -3.00 1.53 0.00 0.20 -3.36 119.26 115.56 2r89 h ALA 185 Ca 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.38 2r89 h ALA 185 Cb 0.57 0.70 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2r89 h ALA 185 CO -0.27 -0.70 0.00 0.00 0.00 0.00 0.00 179.25 178.28 2r89 n ALA 186 N -2.70 0.00 0.00 0.00 0.00 -0.04 -4.07 120.51 113.71 2r89 n ALA 186 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2r89 n ALA 186 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.59 2r89 n ALA 186 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2r89 n THR 187 N 0.00 0.00 -0.12 0.00 -1.04 -1.19 -3.85 114.28 108.07 2r89 n THR 187 Ca 0.00 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.80 2r89 n THR 187 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 2r89 n THR 187 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2r89 n ALA 188 N 0.73 1.47 0.26 2.41 0.00 -1.26 -3.71 120.51 120.41 2r89 n ALA 188 Ca 0.00 -0.97 0.13 0.00 0.00 0.00 0.00 53.44 52.60 2r89 n ALA 188 Cb 0.00 0.08 0.66 0.00 0.00 0.00 0.00 19.45 20.19 2r89 n ALA 188 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2r89 h ASN 189 N -0.44 0.00 -0.41 0.00 -1.24 -1.65 -2.37 115.58 109.47 2r89 h ASN 189 Ca -0.56 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.36 2r89 h ASN 189 Cb 1.66 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.69 2r89 h ASN 189 CO -0.23 0.13 -0.04 1.23 -1.29 0.00 0.00 177.43 177.24 2r89 h GLY 190 N 1.36 0.89 -6.01 1.57 0.00 -1.82 -3.44 103.07 95.61 2r89 h GLY 190 Ca -0.00 -0.62 -0.66 0.00 0.00 0.00 0.00 47.33 46.04 2r89 h GLY 190 CO 0.02 0.58 1.04 1.39 0.00 0.00 0.00 176.54 179.57 2r89 n ILE 191 N -4.19 0.48 -2.01 2.60 5.41 -0.89 -4.87 119.36 115.88 2r89 n ILE 191 Ca 0.02 -0.09 -0.42 0.00 1.00 0.00 0.00 62.75 63.26 2r89 n ILE 191 Cb 0.33 -1.64 -0.03 0.00 -0.71 0.00 0.00 39.64 37.59 2r89 n ILE 191 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 2r89 s ASP 192 N 4.02 6.67 -0.37 4.38 1.01 -1.26 -4.84 116.67 126.27 2r89 s ASP 192 Ca 0.95 2.42 -0.02 0.00 0.71 0.00 0.00 52.55 56.61 2r89 s ASP 192 Cb -0.84 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 40.50 2r89 s ASP 192 CO 0.57 -0.82 1.46 -1.54 0.21 0.00 0.00 175.17 175.05 2r89 n SER 193 N 5.07 2.04 0.00 0.27 3.41 -1.26 -0.43 113.62 122.73 2r89 n SER 193 Ca 0.14 -2.13 0.00 0.00 -0.26 0.00 0.00 58.87 56.63 2r89 n SER 193 Cb 0.41 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 2r89 n SER 193 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2r89 n ASN 194 N 4.63 0.00 -4.62 4.04 0.23 -1.26 -3.65 115.26 114.63 2r89 n ASN 194 Ca 0.18 0.00 -0.43 0.00 -0.53 0.00 0.00 54.58 53.81 2r89 n ASN 194 Cb 0.06 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.73 2r89 n ASN 194 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2r89 s THR 195 N 0.00 3.19 0.17 5.53 2.01 0.43 -4.77 115.64 122.19 2r89 s THR 195 Ca 0.00 0.20 -0.34 0.00 0.31 0.00 0.00 61.69 61.87 2r89 s THR 195 Cb 0.00 -3.22 -0.15 0.00 0.01 0.00 0.00 72.50 69.15 2r89 s THR 195 CO 0.00 -0.11 1.43 1.17 -0.69 0.00 0.00 174.62 176.41 2r89 n LYS 196 N 8.32 1.77 -0.38 4.92 4.81 -1.26 -1.83 118.16 134.51 2r89 n LYS 196 Ca 0.25 0.64 0.04 0.00 -0.87 0.00 0.00 58.31 58.37 2r89 n LYS 196 Cb 0.45 -2.31 0.06 0.00 0.02 0.00 0.00 35.03 33.25 2r89 n LYS 196 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 2r89 n THR 197 N 2.58 0.82 0.00 3.15 5.66 0.82 -4.85 114.28 122.46 2r89 n THR 197 Ca 0.16 -1.05 0.00 0.00 -3.05 0.00 0.00 64.05 60.11 2r89 n THR 197 Cb 0.27 0.21 0.00 0.00 -1.55 0.00 0.00 70.33 69.25 2r89 n THR 197 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2r89 n ALA 198 N -0.58 0.00 -3.55 1.79 0.00 -1.02 -4.84 120.51 112.31 2r89 n ALA 198 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.27 2r89 n ALA 198 Cb 0.70 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.00 2r89 n ALA 198 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2r89 s HIS 199 N 0.00 0.05 -0.16 0.00 5.04 -1.26 -2.24 115.29 116.72 2r89 s HIS 199 Ca 0.00 -0.27 -0.05 0.00 -1.54 0.00 0.00 55.06 53.20 2r89 s HIS 199 Cb 0.00 -0.63 0.06 0.00 0.04 0.00 0.00 32.58 32.05 2r89 s HIS 199 CO 0.00 -0.62 0.09 -0.51 -2.34 0.00 0.00 174.74 171.36 2r89 s LEU 200 N 2.20 0.32 0.02 8.88 1.43 -1.15 -5.05 118.68 125.33 2r89 s LEU 200 Ca 0.05 -0.56 0.05 0.00 -1.03 0.00 0.00 54.13 52.63 2r89 s LEU 200 Cb -0.16 -0.23 -0.02 0.00 0.03 0.00 0.00 46.19 45.82 2r89 s LEU 200 CO -0.17 -0.34 -0.14 0.21 0.23 0.00 0.00 176.35 176.14 2r89 s ASN 201 N 2.14 1.62 -0.15 2.29 3.84 -1.26 -2.43 114.94 120.99 2r89 s ASN 201 Ca 0.02 -0.39 -0.35 0.00 0.21 0.00 0.00 52.86 52.36 2r89 s ASN 201 Cb -0.16 -0.13 0.15 0.00 -0.55 0.00 0.00 41.25 40.56 2r89 s ASN 201 CO -0.09 0.07 1.38 -0.83 -2.79 0.00 0.00 177.10 174.85 2r89 s GLY 202 N -0.88 -0.38 0.07 1.21 0.00 -1.02 -5.05 107.32 101.27 2r89 s GLY 202 Ca 0.03 1.28 0.06 0.00 0.00 0.00 0.00 44.72 46.09 2r89 s GLY 202 CO 0.01 0.35 -0.15 -1.31 0.00 0.00 0.00 173.10 171.99 2r89 s ASN 203 N -2.62 1.82 -0.16 1.64 -0.87 -1.26 -2.11 114.94 111.38 2r89 s ASN 203 Ca 0.13 -0.62 -0.31 0.00 -1.57 0.00 0.00 52.86 50.49 2r89 s ASN 203 Cb 0.04 -0.07 0.14 0.00 -0.02 0.00 0.00 41.25 41.34 2r89 s ASN 203 CO -0.05 -0.05 1.09 -1.58 -2.57 0.00 0.00 177.10 173.94 2r89 s GLN 204 N -1.74 0.47 -0.12 -0.60 2.00 -0.91 -4.98 119.66 113.78 2r89 s GLN 204 Ca -0.00 -0.01 -0.07 0.00 -2.00 0.00 0.00 55.36 53.28 2r89 s GLN 204 Cb -0.10 0.22 -0.04 0.00 0.80 0.00 0.00 33.01 33.89 2r89 s GLN 204 CO 0.03 -0.17 0.12 -1.58 -0.50 0.00 0.00 175.29 173.18 2r89 s TRP 205 N -1.71 3.52 0.27 1.67 0.52 -1.26 -1.17 118.94 120.79 2r89 s TRP 205 Ca 0.04 0.46 0.10 0.00 0.02 0.00 0.00 56.10 56.72 2r89 s TRP 205 Cb -0.01 -1.94 -0.05 0.00 -1.15 0.00 0.00 33.47 30.32 2r89 s TRP 205 CO -0.03 0.65 -0.07 0.20 0.02 0.00 0.00 176.95 177.71 2r89 s GLY 206 N -0.85 1.76 0.10 0.98 0.00 0.46 -4.78 107.32 104.99 2r89 s GLY 206 Ca 0.14 -1.75 0.03 0.00 0.00 0.00 0.00 44.72 43.14 2r89 s GLY 206 CO 0.03 -1.82 -0.08 -1.36 0.00 0.00 0.00 173.10 169.87 2r89 s PHE 207 N -2.40 0.96 0.00 1.90 0.08 -1.26 0.92 117.98 118.18 2r89 s PHE 207 Ca 0.31 -0.77 0.00 0.00 0.12 0.00 0.00 56.93 56.59 2r89 s PHE 207 Cb -0.06 -0.53 0.00 0.00 -0.57 0.00 0.00 43.02 41.86 2r89 s PHE 207 CO 0.18 -0.07 0.00 0.41 -0.10 0.00 0.00 175.22 175.64 2r89 n GLY 208 N 0.28 1.29 0.00 4.36 0.00 -0.54 -4.47 105.19 106.12 2r89 n GLY 208 Ca -0.14 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.07 2r89 n GLY 208 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2r89 n TRP 209 N -0.36 -0.84 0.00 1.61 4.27 -1.26 0.93 117.44 121.79 2r89 n TRP 209 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 2r89 n TRP 209 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 2r89 n TRP 209 CO 0.00 0.00 0.00 0.27 -2.29 0.00 0.00 177.69 175.67 2r89 n ASN 210 N -0.94 0.00 -4.35 -0.67 6.94 -1.11 -2.65 115.26 112.48 2r89 n ASN 210 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 54.58 54.38 2r89 n ASN 210 Cb 0.00 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.32 2r89 n ASN 210 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2r89 s ALA 211 N -0.67 1.98 0.16 -2.53 0.00 0.81 -1.33 121.76 120.19 2r89 s ALA 211 Ca 0.00 -1.71 0.06 0.00 0.00 0.00 0.00 51.96 50.30 2r89 s ALA 211 Cb 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.17 2r89 s ALA 211 CO 0.00 -0.04 -0.12 0.20 0.00 0.00 0.00 175.76 175.80 2r89 s GLY 212 N -3.32 1.17 -0.39 0.00 0.00 0.17 -0.44 107.32 104.51 2r89 s GLY 212 Ca 0.24 -1.52 0.11 0.00 0.00 0.00 0.00 44.72 43.55 2r89 s GLY 212 CO 0.07 -1.62 1.02 1.39 0.00 0.00 0.00 173.10 173.96 2r89 n ILE 213 N -0.18 0.18 -1.87 0.90 5.41 -0.26 -2.22 119.36 121.32 2r89 n ILE 213 Ca -0.10 -2.77 -0.41 0.00 1.00 0.00 0.00 62.75 60.47 2r89 n ILE 213 Cb 0.60 0.68 -0.01 0.00 -0.71 0.00 0.00 39.64 40.20 2r89 n ILE 213 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 2r89 s LEU 214 N -2.71 4.35 -0.02 1.39 2.96 -0.86 -3.91 118.68 119.89 2r89 s LEU 214 Ca 0.28 2.91 0.03 0.00 -0.22 0.00 0.00 54.13 57.13 2r89 s LEU 214 Cb 0.37 -3.65 -0.00 0.00 0.50 0.00 0.00 46.19 43.41 2r89 s LEU 214 CO -0.05 -0.82 -0.09 -0.47 -1.32 0.00 0.00 176.35 173.61 2r89 s TYR 215 N -0.56 0.87 -0.11 5.38 6.04 -0.13 -1.67 117.35 127.17 2r89 s TYR 215 Ca 0.57 -0.19 -0.03 0.00 0.04 0.00 0.00 57.07 57.46 2r89 s TYR 215 Cb -0.45 -0.59 0.04 0.00 -1.04 0.00 0.00 41.96 39.92 2r89 s TYR 215 CO 0.53 -0.06 0.05 -1.83 -1.54 0.00 0.00 175.55 172.71 2r89 s GLU 216 N 0.01 0.20 0.00 4.97 -1.05 -0.86 -0.73 118.70 121.24 2r89 s GLU 216 Ca -0.00 0.06 0.07 0.00 -0.15 0.00 0.00 54.97 54.96 2r89 s GLU 216 Cb -0.06 -1.26 0.32 0.00 -0.44 0.00 0.00 34.13 32.68 2r89 s GLU 216 CO 0.00 -0.48 1.23 1.47 0.95 0.00 0.00 175.26 178.43 2r89 n LEU 217 N 5.23 0.00 0.00 1.83 -0.00 -0.56 -4.51 117.00 118.99 2r89 n LEU 217 Ca -0.06 0.49 0.00 0.00 -0.00 0.00 0.00 56.01 56.44 2r89 n LEU 217 Cb 0.49 -0.49 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2r89 n LEU 217 CO 0.09 -0.37 0.00 -0.90 -0.00 0.00 0.00 177.39 176.22 2r89 n ASP 218 N -1.49 0.00 0.26 1.45 5.68 -1.18 -4.93 116.55 116.34 2r89 n ASP 218 Ca 0.02 0.00 0.17 0.00 -0.50 0.00 0.00 54.79 54.48 2r89 n ASP 218 Cb 0.08 0.00 0.91 0.00 -1.14 0.00 0.00 41.12 40.97 2r89 n ASP 218 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2r89 h LYS 219 N 0.00 0.00 -0.03 0.11 1.79 -1.96 -2.84 116.57 113.65 2r89 h LYS 219 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2r89 h LYS 219 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2r89 h LYS 219 CO 0.00 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.46 2r89 n ASN 220 N -2.69 1.57 -3.67 0.86 3.02 -1.26 -4.99 115.26 108.09 2r89 n ASN 220 Ca -0.02 -1.44 -0.12 0.00 -0.03 0.00 0.00 54.58 52.97 2r89 n ASN 220 Cb 0.09 -0.02 -0.12 0.00 -0.61 0.00 0.00 39.78 39.12 2r89 n ASN 220 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2r89 s ASN 221 N -0.50 0.05 0.07 6.41 0.01 -1.07 -0.28 114.94 119.62 2r89 s ASN 221 Ca 0.03 0.71 -0.09 0.00 -0.71 0.00 0.00 52.86 52.81 2r89 s ASN 221 Cb 0.02 0.83 -0.00 0.00 0.41 0.00 0.00 41.25 42.51 2r89 s ASN 221 CO 0.03 -0.22 0.18 0.00 -1.51 0.00 0.00 177.10 175.58 2r89 s ARG 222 N 2.23 0.78 0.01 -0.60 1.70 -0.72 -1.49 118.95 120.86 2r89 s ARG 222 Ca -0.02 -0.85 0.01 0.00 -0.47 0.00 0.00 55.73 54.41 2r89 s ARG 222 Cb -0.11 0.32 -0.01 0.00 -0.57 0.00 0.00 34.95 34.57 2r89 s ARG 222 CO -0.10 -0.24 -0.05 0.71 -1.08 0.00 0.00 175.30 174.55 2r89 s TYR 223 N -3.38 0.43 0.08 5.89 1.51 0.09 -1.46 117.35 120.51 2r89 s TYR 223 Ca 0.01 -0.22 0.01 0.00 -1.01 0.00 0.00 57.07 55.86 2r89 s TYR 223 Cb 0.03 -0.27 -0.04 0.00 -0.11 0.00 0.00 41.96 41.57 2r89 s TYR 223 CO -0.08 -0.04 -0.05 0.00 -1.11 0.00 0.00 175.55 174.26 2r89 s ALA 224 N -0.56 0.83 -0.16 3.71 0.00 -0.10 -0.96 121.76 124.53 2r89 s ALA 224 Ca -0.03 -1.31 -0.01 0.00 0.00 0.00 0.00 51.96 50.61 2r89 s ALA 224 Cb -0.05 0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.31 2r89 s ALA 224 CO -0.00 -0.28 -0.04 -1.17 0.00 0.00 0.00 175.76 174.27 2r89 s LEU 225 N -3.01 1.50 0.24 0.00 2.96 -1.25 -2.38 118.68 116.75 2r89 s LEU 225 Ca 0.10 -0.63 0.09 0.00 -0.22 0.00 0.00 54.13 53.47 2r89 s LEU 225 Cb 0.06 -0.86 -0.04 0.00 0.50 0.00 0.00 46.19 45.85 2r89 s LEU 225 CO -0.06 -0.19 0.01 0.42 -1.32 0.00 0.00 176.35 175.21 2r89 s THR 226 N 1.67 3.59 -0.13 3.68 -4.23 -0.41 -1.11 115.64 118.71 2r89 s THR 226 Ca 0.01 -1.75 -0.06 0.00 -1.18 0.00 0.00 61.69 58.70 2r89 s THR 226 Cb -0.15 -2.89 0.05 0.00 1.34 0.00 0.00 72.50 70.85 2r89 s THR 226 CO -0.08 -0.31 0.30 -0.47 -0.54 0.00 0.00 174.62 173.52 2r89 s TYR 227 N -2.15 -0.42 -0.11 3.99 5.04 0.41 -2.37 117.35 121.75 2r89 s TYR 227 Ca 0.30 0.94 0.02 0.00 -2.44 0.00 0.00 57.07 55.90 2r89 s TYR 227 Cb -0.07 0.11 -0.01 0.00 0.35 0.00 0.00 41.96 42.35 2r89 s TYR 227 CO 0.20 -0.27 -0.20 0.50 -1.34 0.00 0.00 175.55 174.44 2r89 s ARG 228 N 1.32 3.16 0.00 4.97 3.52 -0.68 -0.13 118.95 131.11 2r89 s ARG 228 Ca -0.09 -0.81 0.00 0.00 -0.13 0.00 0.00 55.73 54.70 2r89 s ARG 228 Cb -0.10 -2.42 0.00 0.00 -1.56 0.00 0.00 34.95 30.87 2r89 s ARG 228 CO -0.10 0.20 0.00 -1.13 -0.81 0.00 0.00 175.30 173.46 2r89 n SER 229 N 3.50 0.00 -4.55 -2.12 3.41 -1.09 -0.98 113.62 111.79 2r89 n SER 229 Ca -0.19 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.10 2r89 n SER 229 Cb 0.53 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.37 2r89 n SER 229 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2r89 s GLU 230 N 0.00 2.54 -0.19 4.33 2.12 -1.26 -3.62 118.70 122.62 2r89 s GLU 230 Ca 0.00 -0.70 -0.00 0.00 0.36 0.00 0.00 54.97 54.63 2r89 s GLU 230 Cb 0.00 -2.47 0.05 0.00 0.26 0.00 0.00 34.13 31.97 2r89 s GLU 230 CO 0.00 0.62 -0.05 0.08 -0.54 0.00 0.00 175.26 175.36 2r89 s VAL 231 N -0.89 1.23 -0.32 3.70 1.01 -0.70 -4.68 120.40 119.76 2r89 s VAL 231 Ca 0.15 -0.80 -0.17 0.00 0.00 0.00 0.00 61.98 61.15 2r89 s VAL 231 Cb -0.11 -1.44 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 2r89 s VAL 231 CO 0.04 0.06 0.48 -0.54 0.00 0.00 0.00 175.10 175.15 2r89 s LYS 232 N 1.56 3.79 -0.34 2.72 1.02 -1.26 -1.25 119.74 125.98 2r89 s LYS 232 Ca -0.01 -0.03 -0.09 0.00 0.02 0.00 0.00 55.97 55.86 2r89 s LYS 232 Cb -0.16 -3.75 0.02 0.00 -0.52 0.00 0.00 37.83 33.42 2r89 s LYS 232 CO -0.07 -0.51 0.15 0.42 -0.92 0.00 0.00 175.35 174.42 2r89 s ILE 233 N 2.30 4.31 -0.44 2.17 1.01 0.20 -4.59 121.20 126.16 2r89 s ILE 233 Ca 0.18 -0.79 -0.21 0.00 0.00 0.00 0.00 60.65 59.84 2r89 s ILE 233 Cb -0.16 -3.33 0.02 0.00 0.01 0.00 0.00 42.46 39.01 2r89 s ILE 233 CO 0.12 -0.10 0.64 -1.81 0.00 0.00 0.00 174.94 173.79 2r89 s ASP 234 N 1.53 6.32 -0.06 3.58 1.01 -1.26 0.72 116.67 128.50 2r89 s ASP 234 Ca 0.02 -0.36 -0.04 0.00 0.71 0.00 0.00 52.55 52.88 2r89 s ASP 234 Cb -0.18 -2.32 -0.01 0.00 1.01 0.00 0.00 42.92 41.41 2r89 s ASP 234 CO 0.05 -0.78 -0.08 0.49 0.21 0.00 0.00 175.17 175.05 2r89 n PHE 235 N 6.26 0.41 -1.00 4.23 0.99 -1.26 -4.87 117.46 122.22 2r89 n PHE 235 Ca -0.02 0.18 0.00 0.00 -0.00 0.00 0.00 57.45 57.61 2r89 n PHE 235 Cb 0.48 -0.48 -0.00 0.00 -1.00 0.00 0.00 39.48 38.48 2r89 n PHE 235 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 2r89 n LEU 267 N -3.33 -0.15 -4.08 4.37 7.94 -1.26 -5.04 117.00 115.45 2r89 n LEU 267 Ca -0.03 0.26 -0.19 0.00 -1.11 0.00 0.00 56.01 54.94 2r89 n LEU 267 Cb 0.12 -1.65 -0.14 0.00 0.53 0.00 0.00 43.42 42.28 2r89 n LEU 267 CO 0.05 -0.09 -0.44 -0.89 -1.11 0.00 0.00 177.39 174.91 2r89 s THR 268 N -4.23 0.85 0.09 1.96 2.01 -1.26 -5.03 115.64 110.03 2r89 s THR 268 Ca 0.00 -0.72 0.09 0.00 0.31 0.00 0.00 61.69 61.37 2r89 s THR 268 Cb 0.00 -0.77 -0.04 0.00 0.01 0.00 0.00 72.50 71.71 2r89 s THR 268 CO 0.00 0.05 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.55 2r89 s LEU 269 N -0.75 2.51 -0.13 4.42 2.96 0.22 -4.94 118.68 122.97 2r89 s LEU 269 Ca 0.01 -0.57 -0.01 0.00 -0.22 0.00 0.00 54.13 53.34 2r89 s LEU 269 Cb -0.06 -1.42 0.03 0.00 0.50 0.00 0.00 46.19 45.24 2r89 s LEU 269 CO 0.00 0.21 -0.05 0.20 -1.32 0.00 0.00 176.35 175.40 2r89 s ASN 270 N -1.81 2.38 -0.09 3.68 0.02 -1.26 0.62 114.94 118.48 2r89 s ASN 270 Ca 0.15 -0.44 -0.22 0.00 -1.02 0.00 0.00 52.86 51.33 2r89 s ASN 270 Cb -0.10 -0.78 -0.04 0.00 0.02 0.00 0.00 41.25 40.35 2r89 s ASN 270 CO 0.07 -0.17 0.64 -0.76 0.02 0.00 0.00 177.10 176.90 2r89 s LEU 271 N 1.74 4.29 0.49 0.60 1.43 -0.38 -4.94 118.68 121.90 2r89 s LEU 271 Ca 0.03 1.07 -0.23 0.00 -1.03 0.00 0.00 54.13 53.97 2r89 s LEU 271 Cb -0.14 -2.98 -0.07 0.00 0.03 0.00 0.00 46.19 43.04 2r89 s LEU 271 CO -0.08 -0.10 1.26 -2.16 0.23 0.00 0.00 176.35 175.50 2r89 s PRO 272 N 0.85 3.54 0.39 1.29 0.04 -1.26 -1.73 135.00 138.12 2r89 s PRO 272 Ca 0.34 2.00 -0.27 0.00 0.04 0.00 0.00 61.00 63.11 2r89 s PRO 272 Cb -0.17 -2.39 -0.09 0.00 0.04 0.00 0.00 34.50 31.89 2r89 s PRO 272 CO 0.16 -0.80 1.31 -1.21 0.04 0.00 0.00 177.00 176.50 2r89 s GLU 273 N -2.73 4.06 -0.26 4.56 2.02 -1.24 -4.73 118.70 120.39 2r89 s GLU 273 Ca 0.66 2.19 -0.02 0.00 0.02 0.00 0.00 54.97 57.82 2r89 s GLU 273 Cb -0.34 -2.84 0.08 0.00 0.10 0.00 0.00 34.13 31.13 2r89 s GLU 273 CO 0.41 -0.42 0.07 1.41 0.02 0.00 0.00 175.26 176.75 2r89 s MET 274 N -2.13 0.69 -0.40 1.61 1.75 -0.15 -1.31 119.30 119.36 2r89 s MET 274 Ca 0.55 -0.75 -0.18 0.00 -1.25 0.00 0.00 55.69 54.05 2r89 s MET 274 Cb -0.39 -1.99 0.01 0.00 2.84 0.00 0.00 34.83 35.30 2r89 s MET 274 CO 0.51 -0.83 0.50 -1.58 -0.65 0.00 0.00 175.02 172.97 2r89 s TRP 275 N 1.75 3.15 -0.03 4.11 0.51 0.19 -1.68 118.94 126.94 2r89 s TRP 275 Ca 0.04 -0.11 0.07 0.00 -2.12 0.00 0.00 56.10 53.98 2r89 s TRP 275 Cb -0.17 -2.99 -0.02 0.00 -0.81 0.00 0.00 33.47 29.48 2r89 s TRP 275 CO -0.18 -0.67 -0.24 -2.00 -0.51 0.00 0.00 176.95 173.35 2r89 s GLU 276 N 2.36 2.28 -0.09 4.98 2.12 -1.00 -0.76 118.70 128.59 2r89 s GLU 276 Ca 0.16 -0.88 0.03 0.00 0.36 0.00 0.00 54.97 54.64 2r89 s GLU 276 Cb -0.16 -2.13 0.01 0.00 0.26 0.00 0.00 34.13 32.11 2r89 s GLU 276 CO 0.15 0.53 -0.18 0.08 -0.54 0.00 0.00 175.26 175.30 2r89 s VAL 277 N -0.52 1.58 0.13 3.70 1.01 -0.89 -1.29 120.40 124.12 2r89 s VAL 277 Ca 0.07 -0.73 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 2r89 s VAL 277 Cb -0.11 -1.40 -0.00 0.00 0.00 0.00 0.00 36.38 34.87 2r89 s VAL 277 CO 0.00 0.45 0.27 -0.94 0.00 0.00 0.00 175.10 174.88 2r89 s SER 278 N 0.56 0.03 -0.08 3.32 1.04 -1.00 -0.63 113.70 116.94 2r89 s SER 278 Ca -0.16 -0.71 -0.12 0.00 0.48 0.00 0.00 55.95 55.44 2r89 s SER 278 Cb -0.17 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.39 2r89 s SER 278 CO 0.05 -0.83 0.30 -0.83 0.98 0.00 0.00 173.24 172.92 2r89 s GLY 279 N -2.90 -0.20 -0.03 7.32 0.00 -0.00 -0.92 107.32 110.57 2r89 s GLY 279 Ca 0.10 0.69 0.03 0.00 0.00 0.00 0.00 44.72 45.54 2r89 s GLY 279 CO -0.06 0.54 -0.12 -0.47 0.00 0.00 0.00 173.10 173.00 2r89 s TYR 280 N -0.30 1.22 -0.03 1.90 5.04 -0.54 -0.62 117.35 124.02 2r89 s TYR 280 Ca -0.04 -0.33 0.01 0.00 -2.44 0.00 0.00 57.07 54.27 2r89 s TYR 280 Cb -0.03 -0.85 0.02 0.00 0.35 0.00 0.00 41.96 41.45 2r89 s TYR 280 CO 0.01 -0.13 -0.02 -0.80 -1.34 0.00 0.00 175.55 173.28 2r89 s ASN 281 N 0.16 0.60 -1.13 4.32 0.01 0.18 -1.76 114.94 117.31 2r89 s ASN 281 Ca -0.04 -0.07 -0.08 0.00 -0.71 0.00 0.00 52.86 51.97 2r89 s ASN 281 Cb -0.10 -0.30 0.26 0.00 0.41 0.00 0.00 41.25 41.53 2r89 s ASN 281 CO 0.01 -0.08 1.37 -1.14 -1.51 0.00 0.00 177.10 175.75 2r89 n ARG 282 N 4.05 3.86 0.21 -0.60 0.63 0.61 0.24 116.66 125.66 2r89 n ARG 282 Ca -0.26 -4.32 0.17 0.00 -0.92 0.00 0.00 57.85 52.52 2r89 n ARG 282 Cb 0.51 -2.64 0.74 0.00 0.45 0.00 0.00 32.46 31.52 2r89 n ARG 282 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2r89 h VAL 283 N 3.70 0.17 -3.89 5.15 2.07 -1.82 -3.43 116.25 118.20 2r89 h VAL 283 Ca 0.23 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.64 2r89 h VAL 283 Cb 0.76 0.61 -0.12 0.00 -1.52 0.00 0.00 31.29 31.01 2r89 h VAL 283 CO 1.22 0.00 -0.31 -0.62 0.02 0.00 0.00 177.57 177.88 2r89 s ASP 284 N -4.72 0.03 0.30 0.57 2.15 -1.20 -4.96 116.67 108.85 2r89 s ASP 284 Ca -0.04 -0.90 0.02 0.00 0.43 0.00 0.00 52.55 52.07 2r89 s ASP 284 Cb 0.11 0.45 0.57 0.00 -0.30 0.00 0.00 42.92 43.75 2r89 s ASP 284 CO 0.39 -0.91 1.88 -0.65 -0.17 0.00 0.00 175.17 175.70 2r89 h PRO 285 N 2.52 0.95 -0.27 4.34 0.11 -2.00 -2.90 132.00 134.75 2r89 h PRO 285 Ca -0.31 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2r89 h PRO 285 Cb 1.23 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2r89 h PRO 285 CO 0.47 0.63 0.00 1.04 -0.21 0.00 0.00 178.00 179.93 2r89 n GLN 286 N -4.54 2.39 -4.28 1.05 6.02 -1.26 -4.89 117.38 111.86 2r89 n GLN 286 Ca 0.16 -2.14 -0.17 0.00 -0.01 0.00 0.00 57.00 54.84 2r89 n GLN 286 Cb 0.29 -1.48 -0.10 0.00 1.02 0.00 0.00 30.24 29.97 2r89 n GLN 286 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2r89 s TRP 287 N -1.59 1.46 0.14 1.08 0.52 -1.10 -1.17 118.94 118.28 2r89 s TRP 287 Ca 0.34 -0.64 -0.16 0.00 0.02 0.00 0.00 56.10 55.66 2r89 s TRP 287 Cb 0.21 -0.72 0.03 0.00 -1.15 0.00 0.00 33.47 31.84 2r89 s TRP 287 CO 0.30 0.20 0.41 0.00 0.02 0.00 0.00 176.95 177.87 2r89 s ALA 288 N -2.91 -0.87 -0.03 0.98 0.00 -0.71 -2.82 121.76 115.40 2r89 s ALA 288 Ca 0.17 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.01 2r89 s ALA 288 Cb -0.00 0.72 0.02 0.00 0.00 0.00 0.00 23.12 23.85 2r89 s ALA 288 CO 0.03 -0.66 -0.03 0.42 0.00 0.00 0.00 175.76 175.53 2r89 s ILE 289 N -3.82 0.33 -0.01 0.00 1.01 0.14 -2.40 121.20 116.45 2r89 s ILE 289 Ca 0.05 -0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.66 2r89 s ILE 289 Cb 0.02 -0.37 0.01 0.00 0.01 0.00 0.00 42.46 42.12 2r89 s ILE 289 CO -0.10 0.16 -0.02 -1.38 0.00 0.00 0.00 174.94 173.59 2r89 s HIS 290 N 0.71 0.32 0.01 3.97 -3.43 -0.76 0.49 115.29 116.59 2r89 s HIS 290 Ca -0.08 -0.05 -0.04 0.00 -0.80 0.00 0.00 55.06 54.09 2r89 s HIS 290 Cb -0.11 -0.27 -0.01 0.00 -1.43 0.00 0.00 32.58 30.77 2r89 s HIS 290 CO -0.01 -0.05 0.07 1.52 -2.00 0.00 0.00 174.74 174.28 2r89 s TYR 291 N 0.26 0.10 0.03 0.38 -0.85 0.21 -1.27 117.35 116.20 2r89 s TYR 291 Ca -0.02 -0.24 -0.01 0.00 -0.52 0.00 0.00 57.07 56.28 2r89 s TYR 291 Cb -0.05 -0.09 -0.02 0.00 0.38 0.00 0.00 41.96 42.18 2r89 s TYR 291 CO -0.01 -0.23 -0.02 -1.12 -1.52 0.00 0.00 175.55 172.66 2r89 s SER 292 N -1.27 0.28 -0.25 -0.18 0.01 -0.34 -0.82 113.70 111.12 2r89 s SER 292 Ca -0.14 -0.59 -0.03 0.00 1.31 0.00 0.00 55.95 56.50 2r89 s SER 292 Cb -0.08 0.13 0.08 0.00 0.21 0.00 0.00 66.02 66.36 2r89 s SER 292 CO 0.01 -0.37 0.10 -0.22 0.41 0.00 0.00 173.24 173.16 2r89 s LEU 293 N -1.77 0.94 0.15 2.44 2.96 0.20 -1.98 118.68 121.61 2r89 s LEU 293 Ca -0.11 -1.10 0.04 0.00 -0.22 0.00 0.00 54.13 52.74 2r89 s LEU 293 Cb -0.06 -0.47 -0.04 0.00 0.50 0.00 0.00 46.19 46.12 2r89 s LEU 293 CO -0.03 -0.39 0.16 0.00 -1.32 0.00 0.00 176.35 174.78 2r89 s ALA 294 N 1.97 3.67 -0.17 5.97 0.00 0.13 -2.09 121.76 131.23 2r89 s ALA 294 Ca 0.05 -1.14 -0.04 0.00 0.00 0.00 0.00 51.96 50.83 2r89 s ALA 294 Cb -0.16 -1.47 0.08 0.00 0.00 0.00 0.00 23.12 21.56 2r89 s ALA 294 CO -0.22 0.55 0.18 -0.47 0.00 0.00 0.00 175.76 175.79 2r89 s TYR 295 N -1.70 -0.15 0.03 0.00 5.04 0.06 0.26 117.35 120.87 2r89 s TYR 295 Ca 0.32 0.19 -0.01 0.00 -2.44 0.00 0.00 57.07 55.13 2r89 s TYR 295 Cb -0.11 -0.41 -0.04 0.00 0.35 0.00 0.00 41.96 41.75 2r89 s TYR 295 CO 0.24 -0.51 0.16 0.95 -1.34 0.00 0.00 175.55 175.06 2r89 s THR 296 N 2.28 5.20 -0.48 4.34 -4.23 -0.80 -0.63 115.64 121.32 2r89 s THR 296 Ca 0.05 -0.35 0.03 0.00 -1.18 0.00 0.00 61.69 60.23 2r89 s THR 296 Cb -0.15 -3.47 0.15 0.00 1.34 0.00 0.00 72.50 70.37 2r89 s THR 296 CO -0.10 0.24 0.31 -0.55 -0.54 0.00 0.00 174.62 173.98 2r89 s SER 297 N -2.16 3.31 -0.57 3.99 0.15 -0.42 -2.28 113.70 115.71 2r89 s SER 297 Ca 0.29 -2.92 -0.24 0.00 0.70 0.00 0.00 55.95 53.78 2r89 s SER 297 Cb -0.13 -0.96 -0.21 0.00 -1.71 0.00 0.00 66.02 63.01 2r89 s SER 297 CO 0.22 -0.21 1.84 0.79 1.20 0.00 0.00 173.24 177.07 2r89 n TRP 298 N 3.13 1.39 -2.31 3.44 7.02 -1.26 -3.97 117.44 124.88 2r89 n TRP 298 Ca 0.16 -1.48 -0.04 0.00 -1.02 0.00 0.00 57.50 55.12 2r89 n TRP 298 Cb 0.38 -1.46 -0.01 0.00 -2.42 0.00 0.00 31.31 27.80 2r89 n TRP 298 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2r89 n SER 299 N 7.85 -0.88 0.00 -0.99 3.41 -1.26 -5.08 113.62 116.67 2r89 n SER 299 Ca 0.49 0.26 0.00 0.00 -0.26 0.00 0.00 58.87 59.36 2r89 n SER 299 Cb 0.41 -0.86 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 2r89 n SER 299 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2r89 n ASP 323 N -1.28 0.00 -3.78 4.04 10.43 -0.97 -5.18 116.55 119.81 2r89 n ASP 323 Ca 0.01 0.00 -0.10 0.00 2.57 0.00 0.00 54.79 57.27 2r89 n ASP 323 Cb 0.40 0.00 -0.05 0.00 1.84 0.00 0.00 41.12 43.31 2r89 n ASP 323 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2r89 s ALA 324 N 0.00 -0.67 0.16 2.24 0.00 -1.12 -4.45 121.76 117.92 2r89 s ALA 324 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 51.96 51.56 2r89 s ALA 324 Cb 0.00 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.89 2r89 s ALA 324 CO 0.00 -0.72 0.12 1.52 0.00 0.00 0.00 175.76 176.68 2r89 s TYR 325 N -3.88 0.88 -0.04 0.00 -0.00 -1.26 -1.90 117.35 111.15 2r89 s TYR 325 Ca 0.10 -1.21 0.01 0.00 -0.00 0.00 0.00 57.07 55.97 2r89 s TYR 325 Cb 0.01 -0.43 0.02 0.00 -0.00 0.00 0.00 41.96 41.56 2r89 s TYR 325 CO -0.04 -0.60 -0.02 0.50 -0.00 0.00 0.00 175.55 175.39 2r89 s ARG 326 N -4.07 0.58 -0.20 -3.49 3.52 0.14 -2.85 118.95 112.58 2r89 s ARG 326 Ca 0.28 -0.02 -0.01 0.00 -0.13 0.00 0.00 55.73 55.85 2r89 s ARG 326 Cb 0.07 -0.68 0.01 0.00 -1.56 0.00 0.00 34.95 32.79 2r89 s ARG 326 CO 0.05 -0.11 -0.13 0.42 -0.81 0.00 0.00 175.30 174.72 2r89 s ILE 327 N 0.98 2.64 0.00 4.11 1.09 -0.92 0.18 121.20 129.28 2r89 s ILE 327 Ca -0.10 -0.74 -0.04 0.00 -1.10 0.00 0.00 60.65 58.66 2r89 s ILE 327 Cb -0.14 -2.16 -0.00 0.00 -1.06 0.00 0.00 42.46 39.10 2r89 s ILE 327 CO -0.01 0.49 0.08 0.00 -0.10 0.00 0.00 174.94 175.40 2r89 s ALA 328 N 1.37 -0.17 -0.17 9.38 0.00 -0.84 -0.32 121.76 131.02 2r89 s ALA 328 Ca 0.05 -0.23 -0.09 0.00 0.00 0.00 0.00 51.96 51.69 2r89 s ALA 328 Cb -0.14 0.08 0.06 0.00 0.00 0.00 0.00 23.12 23.13 2r89 s ALA 328 CO -0.09 -0.17 0.41 -1.17 0.00 0.00 0.00 175.76 174.74 2r89 s LEU 329 N -1.20 -0.09 0.21 0.00 0.20 -0.97 -1.20 118.68 115.63 2r89 s LEU 329 Ca -0.13 0.89 -0.14 0.00 0.69 0.00 0.00 54.13 55.44 2r89 s LEU 329 Cb -0.07 1.34 0.01 0.00 -0.43 0.00 0.00 46.19 47.04 2r89 s LEU 329 CO 0.01 -0.19 0.46 -0.83 -0.29 0.00 0.00 176.35 175.51 2r89 s GLY 330 N 1.39 0.23 0.04 7.98 0.00 -0.40 -1.81 107.32 114.75 2r89 s GLY 330 Ca -0.10 -0.58 0.04 0.00 0.00 0.00 0.00 44.72 44.09 2r89 s GLY 330 CO -0.13 -0.50 -0.13 -0.51 0.00 0.00 0.00 173.10 171.83 2r89 s THR 331 N -3.94 1.03 0.22 0.90 -4.23 -0.03 -1.82 115.64 107.77 2r89 s THR 331 Ca 0.15 -0.98 0.08 0.00 -1.18 0.00 0.00 61.69 59.76 2r89 s THR 331 Cb -0.00 -0.95 -0.04 0.00 1.34 0.00 0.00 72.50 72.85 2r89 s THR 331 CO 0.02 -0.03 0.04 -0.89 -0.54 0.00 0.00 174.62 173.22 2r89 s THR 332 N -0.87 3.80 -0.16 3.99 2.01 -1.01 -2.08 115.64 121.31 2r89 s THR 332 Ca 0.01 -1.58 -0.04 0.00 0.31 0.00 0.00 61.69 60.39 2r89 s THR 332 Cb -0.08 -2.98 0.07 0.00 0.01 0.00 0.00 72.50 69.52 2r89 s THR 332 CO 0.01 -0.25 0.17 -0.47 -0.69 0.00 0.00 174.62 173.40 2r89 s TYR 333 N -2.01 -0.14 -0.80 4.92 5.04 -0.09 -1.75 117.35 122.52 2r89 s TYR 333 Ca 0.30 0.20 -0.18 0.00 -2.44 0.00 0.00 57.07 54.95 2r89 s TYR 333 Cb -0.08 -0.41 0.13 0.00 0.35 0.00 0.00 41.96 41.95 2r89 s TYR 333 CO 0.20 -0.49 0.95 0.71 -1.34 0.00 0.00 175.55 175.58 2r89 s TYR 334 N 2.27 3.14 0.09 4.97 1.51 -0.31 -0.43 117.35 128.59 2r89 s TYR 334 Ca 0.05 -1.28 -0.30 0.00 -1.01 0.00 0.00 57.07 54.52 2r89 s TYR 334 Cb -0.15 -4.15 -0.15 0.00 -0.11 0.00 0.00 41.96 37.41 2r89 s TYR 334 CO -0.10 -1.38 1.64 -0.92 -1.11 0.00 0.00 175.55 173.68 2r89 h TYR 335 N 8.84 -0.75 -1.42 2.71 3.20 -1.70 -3.43 116.97 124.42 2r89 h TYR 335 Ca -0.01 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 2r89 h TYR 335 Cb 1.05 0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.59 2r89 h TYR 335 CO 1.04 -0.42 0.00 -0.40 -1.64 0.00 0.00 178.16 176.74 2r89 n ASP 336 N -5.41 0.00 -0.36 -2.11 5.68 -0.88 -4.99 116.55 108.48 2r89 n ASP 336 Ca -0.10 -0.42 -0.02 0.00 -0.50 0.00 0.00 54.79 53.75 2r89 n ASP 336 Cb 0.31 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.41 2r89 n ASP 336 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2r89 h ASP 337 N 0.00 1.10 0.00 -1.12 3.45 -2.00 -3.32 116.42 114.52 2r89 h ASP 337 Ca 0.00 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.42 2r89 h ASP 337 Cb 0.00 -0.27 -0.00 0.00 -0.56 0.00 0.00 39.33 38.50 2r89 h ASP 337 CO 0.00 0.78 -0.18 0.78 -1.57 0.00 0.00 179.24 179.05 2r89 h ASN 338 N 1.29 0.00 -3.28 6.45 2.35 -1.96 -3.44 115.58 116.99 2r89 h ASN 338 Ca 0.37 -0.21 -0.56 0.00 -0.55 0.00 0.00 56.30 55.34 2r89 h ASN 338 Cb -0.10 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.23 2r89 h ASN 338 CO -0.09 0.70 -0.16 0.26 -1.65 0.00 0.00 177.43 176.49 2r89 s TRP 339 N -1.85 3.54 -0.00 1.19 0.52 -1.25 -2.25 118.94 118.83 2r89 s TRP 339 Ca -0.08 0.88 -0.11 0.00 0.02 0.00 0.00 56.10 56.82 2r89 s TRP 339 Cb 0.00 -2.24 0.01 0.00 -1.15 0.00 0.00 33.47 30.09 2r89 s TRP 339 CO 0.20 0.41 0.21 0.99 0.02 0.00 0.00 176.95 178.79 2r89 s THR 340 N -1.56 0.07 -0.04 2.01 2.01 -1.01 -2.07 115.64 115.06 2r89 s THR 340 Ca 0.39 -0.60 -0.04 0.00 0.31 0.00 0.00 61.69 61.75 2r89 s THR 340 Cb -0.13 -0.51 0.01 0.00 0.01 0.00 0.00 72.50 71.87 2r89 s THR 340 CO 0.20 -0.33 0.11 -0.36 -0.69 0.00 0.00 174.62 173.55 2r89 s PHE 341 N -1.37 -0.10 0.07 4.92 0.40 0.43 -2.60 117.98 119.73 2r89 s PHE 341 Ca -0.14 0.25 0.02 0.00 -0.60 0.00 0.00 56.93 56.46 2r89 s PHE 341 Cb -0.07 0.03 -0.03 0.00 0.51 0.00 0.00 43.02 43.46 2r89 s PHE 341 CO 0.03 -0.07 -0.07 -0.98 0.70 0.00 0.00 175.22 174.82 2r89 s ARG 342 N -0.06 0.70 -0.14 0.44 1.70 0.30 -0.91 118.95 120.98 2r89 s ARG 342 Ca -0.01 -1.11 -0.13 0.00 -0.47 0.00 0.00 55.73 54.01 2r89 s ARG 342 Cb -0.01 -0.21 0.04 0.00 -0.57 0.00 0.00 34.95 34.19 2r89 s ARG 342 CO 0.00 0.00 0.38 -0.08 -1.08 0.00 0.00 175.30 174.53 2r89 s THR 343 N -2.78 0.00 -0.05 4.99 -1.32 -0.88 -0.05 115.64 115.54 2r89 s THR 343 Ca 0.03 -0.01 -0.10 0.00 -1.21 0.00 0.00 61.69 60.40 2r89 s THR 343 Cb -0.00 -0.54 0.02 0.00 -1.51 0.00 0.00 72.50 70.47 2r89 s THR 343 CO -0.03 -0.00 0.25 -0.83 -2.21 0.00 0.00 174.62 171.80 2r89 s GLY 344 N 0.18 -0.13 0.22 6.08 0.00 -0.17 -0.85 107.32 112.65 2r89 s GLY 344 Ca -0.00 0.43 0.10 0.00 0.00 0.00 0.00 44.72 45.25 2r89 s GLY 344 CO 0.01 0.29 -0.15 -1.50 0.00 0.00 0.00 173.10 171.75 2r89 s ILE 345 N -0.61 2.83 -0.22 0.90 2.07 -0.75 0.29 121.20 125.70 2r89 s ILE 345 Ca -0.07 -1.98 -0.31 0.00 -1.41 0.00 0.00 60.65 56.88 2r89 s ILE 345 Cb -0.04 -2.43 0.16 0.00 0.13 0.00 0.00 42.46 40.28 2r89 s ILE 345 CO 0.02 -0.22 1.20 0.00 -1.91 0.00 0.00 174.94 174.03 2r89 s ALA 346 N -1.98 -2.05 0.38 1.50 0.00 -0.78 -2.30 121.76 116.53 2r89 s ALA 346 Ca 0.26 1.71 0.05 0.00 0.00 0.00 0.00 51.96 53.98 2r89 s ALA 346 Cb -0.07 -0.87 -0.02 0.00 0.00 0.00 0.00 23.12 22.15 2r89 s ALA 346 CO 0.14 -0.36 0.19 0.34 0.00 0.00 0.00 175.76 176.07 2r89 n PHE 347 N 0.40 -0.19 0.00 0.00 7.35 0.57 0.13 117.46 125.72 2r89 n PHE 347 Ca -0.03 -2.66 0.00 0.00 -0.76 0.00 0.00 57.45 53.99 2r89 n PHE 347 Cb 0.58 0.10 0.00 0.00 0.35 0.00 0.00 39.48 40.51 2r89 n PHE 347 CO 0.00 0.00 0.00 -0.40 -0.76 0.00 0.00 176.76 175.60 2r89 n ASP 348 N -1.59 0.00 -4.43 -2.13 3.85 -1.09 -2.16 116.55 109.00 2r89 n ASP 348 Ca -0.01 0.00 -0.43 0.00 -0.71 0.00 0.00 54.79 53.64 2r89 n ASP 348 Cb 0.61 0.00 -0.00 0.00 -1.35 0.00 0.00 41.12 40.37 2r89 n ASP 348 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 2r89 n ASP 349 N 0.00 -1.12 -4.74 -1.12 2.03 -1.13 -3.84 116.55 106.62 2r89 n ASP 349 Ca 0.00 0.94 -0.40 0.00 0.52 0.00 0.00 54.79 55.85 2r89 n ASP 349 Cb 0.00 -1.06 -0.05 0.00 -0.72 0.00 0.00 41.12 39.28 2r89 n ASP 349 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2r89 s SER 350 N -0.93 7.55 0.16 1.67 0.15 -1.26 -4.06 113.70 116.97 2r89 s SER 350 Ca 0.62 1.85 -0.16 0.00 0.70 0.00 0.00 55.95 58.96 2r89 s SER 350 Cb -0.66 -2.59 0.05 0.00 -1.71 0.00 0.00 66.02 61.11 2r89 s SER 350 CO 0.59 0.07 1.79 -0.65 1.20 0.00 0.00 173.24 176.24 2r89 h PRO 351 N 4.78 0.44 -6.47 5.44 0.11 -1.91 -3.44 132.00 130.95 2r89 h PRO 351 Ca -0.44 -0.03 -0.53 0.00 0.11 0.00 0.00 66.00 65.11 2r89 h PRO 351 Cb 1.20 -0.10 0.04 0.00 0.11 0.00 0.00 31.00 32.25 2r89 h PRO 351 CO 0.69 0.29 1.15 0.28 -0.21 0.00 0.00 178.00 180.20 2r89 n VAL 352 N -4.88 0.47 -2.69 3.15 0.31 -1.26 -4.78 118.33 108.64 2r89 n VAL 352 Ca 0.01 -0.09 -0.43 0.00 -0.01 0.00 0.00 64.34 63.83 2r89 n VAL 352 Cb 0.07 -2.18 -0.03 0.00 -0.91 0.00 0.00 33.84 30.80 2r89 n VAL 352 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2r89 s PRO 353 N 3.20 4.00 0.00 5.55 0.04 -1.26 -4.89 135.00 141.64 2r89 s PRO 353 Ca 0.84 0.92 0.00 0.00 0.04 0.00 0.00 61.00 62.80 2r89 s PRO 353 Cb -0.47 -3.76 0.00 0.00 0.04 0.00 0.00 34.50 30.31 2r89 s PRO 353 CO 0.39 -0.92 0.00 0.00 0.04 0.00 0.00 177.00 176.51 2r89 n ALA 354 N 6.85 0.00 -0.36 8.56 0.00 -1.26 -0.20 120.51 134.10 2r89 n ALA 354 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.52 2r89 n ALA 354 Cb 0.47 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.03 2r89 n ALA 354 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2r89 h GLN 355 N 0.00 1.24 -0.58 0.00 -0.00 -1.98 -3.23 115.11 110.57 2r89 h GLN 355 Ca 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 58.65 58.58 2r89 h GLN 355 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 27.48 27.20 2r89 h GLN 355 CO 0.00 0.82 0.00 0.09 0.00 0.00 0.00 178.83 179.74 2r89 n ASN 356 N -4.43 1.89 -3.83 -0.69 5.03 0.72 -4.66 115.26 109.30 2r89 n ASN 356 Ca 0.11 -2.16 -0.27 0.00 0.87 0.00 0.00 54.58 53.14 2r89 n ASN 356 Cb 0.03 -0.37 0.22 0.00 -1.02 0.00 0.00 39.78 38.64 2r89 n ASN 356 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2r89 n ARG 357 N 0.18 -2.91 -3.66 3.52 1.74 -1.22 -4.87 116.66 109.44 2r89 n ARG 357 Ca 0.08 -0.85 -0.13 0.00 -0.77 0.00 0.00 57.85 56.18 2r89 n ARG 357 Cb 0.38 -1.78 -0.08 0.00 -1.02 0.00 0.00 32.46 29.97 2r89 n ARG 357 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2r89 s SER 358 N -2.31 -0.66 0.36 0.55 0.15 -1.26 -4.81 113.70 105.70 2r89 s SER 358 Ca 0.56 1.26 0.19 0.00 0.70 0.00 0.00 55.95 58.66 2r89 s SER 358 Cb -0.13 1.27 0.41 0.00 -1.71 0.00 0.00 66.02 65.86 2r89 s SER 358 CO 0.54 -0.22 1.60 0.16 1.20 0.00 0.00 173.24 176.53 2r89 h ILE 359 N 4.24 0.67 0.00 6.45 3.07 -1.97 -3.10 117.51 126.87 2r89 h ILE 359 Ca -0.29 -1.69 0.00 0.00 1.55 0.00 0.00 64.86 64.44 2r89 h ILE 359 Cb 1.17 2.14 0.00 0.00 -0.27 0.00 0.00 36.82 39.86 2r89 h ILE 359 CO 0.12 0.34 0.00 -1.28 -1.05 0.00 0.00 178.15 176.28 2r89 h SER 360 N 0.00 0.00 -2.90 2.16 0.87 -1.96 -3.36 113.55 108.36 2r89 h SER 360 Ca -0.00 0.00 -0.61 0.00 -1.23 0.00 0.00 61.79 59.94 2r89 h SER 360 Cb 1.11 0.00 -0.41 0.00 -0.44 0.00 0.00 62.40 62.66 2r89 h SER 360 CO 0.05 0.00 -0.68 -0.63 -0.53 0.00 0.00 176.83 175.03 2r89 s ILE 361 N -3.24 2.20 -0.82 2.23 1.01 -1.17 -4.59 121.20 116.82 2r89 s ILE 361 Ca 0.07 -3.84 -0.28 0.00 0.00 0.00 0.00 60.65 56.61 2r89 s ILE 361 Cb 0.09 -2.45 -0.27 0.00 0.01 0.00 0.00 42.46 39.84 2r89 s ILE 361 CO 0.59 -1.07 1.97 -2.65 0.00 0.00 0.00 174.94 173.79 2r89 n PRO 362 N 2.21 0.17 -4.08 2.79 -0.02 -1.26 -4.61 135.00 130.20 2r89 n PRO 362 Ca 0.22 -1.57 -0.22 0.00 -2.02 0.00 0.00 63.50 59.91 2r89 n PRO 362 Cb 0.38 -3.57 -0.17 0.00 -0.02 0.00 0.00 33.50 30.13 2r89 n PRO 362 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 2r89 s ASP 363 N 8.02 1.40 0.00 2.55 1.47 -1.26 -5.09 116.67 123.75 2r89 s ASP 363 Ca 0.78 -0.16 -0.28 0.00 1.18 0.00 0.00 52.55 54.06 2r89 s ASP 363 Cb 0.01 -0.55 0.10 0.00 -0.34 0.00 0.00 42.92 42.13 2r89 s ASP 363 CO 0.23 -0.09 0.82 -1.10 0.68 0.00 0.00 175.17 175.71 2r89 s GLN 364 N 1.27 0.91 -0.16 2.11 1.11 -1.26 -4.85 119.66 118.78 2r89 s GLN 364 Ca -0.05 -0.21 -0.24 0.00 0.01 0.00 0.00 55.36 54.87 2r89 s GLN 364 Cb -0.14 0.42 -0.11 0.00 -1.01 0.00 0.00 33.01 32.17 2r89 s GLN 364 CO -0.02 -0.37 0.76 -0.25 0.01 0.00 0.00 175.29 175.41 2r89 n ASP 365 N -0.00 0.39 -3.83 5.90 9.92 -1.26 -4.74 116.55 122.92 2r89 n ASP 365 Ca -0.12 0.64 -0.09 0.00 -0.53 0.00 0.00 54.79 54.69 2r89 n ASP 365 Cb 0.61 -0.49 -0.07 0.00 -0.64 0.00 0.00 41.12 40.53 2r89 n ASP 365 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2r89 s ARG 366 N 0.97 0.83 0.04 -1.24 1.70 -1.25 -3.58 118.95 116.42 2r89 s ARG 366 Ca 0.54 -0.84 0.03 0.00 -0.47 0.00 0.00 55.73 54.99 2r89 s ARG 366 Cb -0.77 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 33.92 2r89 s ARG 366 CO 0.39 -0.26 -0.00 -0.06 -1.08 0.00 0.00 175.30 174.28 2r89 s PHE 367 N -3.50 3.03 -0.02 5.89 0.40 -1.02 -2.69 117.98 120.07 2r89 s PHE 367 Ca 0.02 0.02 0.08 0.00 -0.60 0.00 0.00 56.93 56.45 2r89 s PHE 367 Cb 0.03 -1.61 -0.02 0.00 0.51 0.00 0.00 43.02 41.94 2r89 s PHE 367 CO -0.09 0.46 -0.25 -1.58 0.70 0.00 0.00 175.22 174.46 2r89 s TRP 368 N -1.19 2.36 -0.09 0.36 0.52 0.34 -2.14 118.94 119.11 2r89 s TRP 368 Ca 0.22 -0.45 -0.02 0.00 0.02 0.00 0.00 56.10 55.88 2r89 s TRP 368 Cb -0.12 -1.51 0.03 0.00 -1.15 0.00 0.00 33.47 30.72 2r89 s TRP 368 CO 0.14 -0.04 0.02 -1.17 0.02 0.00 0.00 176.95 175.91 2r89 s LEU 369 N -0.58 0.61 0.12 2.99 2.96 -0.94 -1.87 118.68 121.96 2r89 s LEU 369 Ca 0.09 -0.20 0.05 0.00 -0.22 0.00 0.00 54.13 53.85 2r89 s LEU 369 Cb -0.10 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.13 2r89 s LEU 369 CO -0.01 -0.22 -0.12 -0.55 -1.32 0.00 0.00 176.35 174.13 2r89 s SER 370 N 1.99 1.76 -0.24 3.68 0.15 0.14 0.22 113.70 121.40 2r89 s SER 370 Ca 0.04 -0.85 -0.11 0.00 0.70 0.00 0.00 55.95 55.73 2r89 s SER 370 Cb -0.13 -0.03 0.09 0.00 -1.71 0.00 0.00 66.02 64.24 2r89 s SER 370 CO -0.06 -0.22 0.55 0.00 1.20 0.00 0.00 173.24 174.71 2r89 s ALA 371 N -2.47 -1.54 0.23 5.45 0.00 -0.62 -1.00 121.76 121.81 2r89 s ALA 371 Ca 0.09 1.97 0.00 0.00 0.00 0.00 0.00 51.96 54.02 2r89 s ALA 371 Cb -0.03 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 2r89 s ALA 371 CO 0.01 -0.54 0.17 0.20 0.00 0.00 0.00 175.76 175.61 2r89 s GLY 372 N 2.04 1.58 -0.13 0.00 0.00 0.92 -2.62 107.32 109.10 2r89 s GLY 372 Ca -0.07 -1.74 -0.11 0.00 0.00 0.00 0.00 44.72 42.79 2r89 s GLY 372 CO -0.16 -1.38 0.34 -1.08 0.00 0.00 0.00 173.10 170.81 2r89 s THR 373 N -4.01 -0.00 -0.09 0.90 -1.32 -0.50 -0.54 115.64 110.08 2r89 s THR 373 Ca 0.39 0.02 0.02 0.00 -1.21 0.00 0.00 61.69 60.91 2r89 s THR 373 Cb 0.06 -0.48 -0.02 0.00 -1.51 0.00 0.00 72.50 70.55 2r89 s THR 373 CO 0.15 0.01 -0.16 -0.89 -2.21 0.00 0.00 174.62 171.52 2r89 s THR 374 N 0.36 2.83 -0.20 5.08 2.01 -1.07 0.31 115.64 124.95 2r89 s THR 374 Ca -0.01 -0.77 0.01 0.00 0.31 0.00 0.00 61.69 61.23 2r89 s THR 374 Cb -0.03 -2.14 0.04 0.00 0.01 0.00 0.00 72.50 70.38 2r89 s THR 374 CO -0.01 0.55 -0.12 -0.47 -0.69 0.00 0.00 174.62 173.88 2r89 s TYR 375 N -0.03 2.59 -0.29 4.92 6.04 0.24 -2.40 117.35 128.43 2r89 s TYR 375 Ca -0.04 -1.69 -0.19 0.00 0.04 0.00 0.00 57.07 55.19 2r89 s TYR 375 Cb -0.14 -1.73 -0.02 0.00 -1.04 0.00 0.00 41.96 39.03 2r89 s TYR 375 CO 0.04 -0.77 0.58 0.00 -1.54 0.00 0.00 175.55 173.86 2r89 s ALA 376 N 1.34 3.56 0.03 3.97 0.00 -0.96 0.17 121.76 129.87 2r89 s ALA 376 Ca -0.01 -0.63 -0.15 0.00 0.00 0.00 0.00 51.96 51.17 2r89 s ALA 376 Cb -0.16 -3.00 -0.08 0.00 0.00 0.00 0.00 23.12 19.87 2r89 s ALA 376 CO -0.09 -0.92 1.23 0.74 0.00 0.00 0.00 175.76 176.72 2r89 h PHE 377 N 8.11 -0.52 -1.39 0.00 0.04 0.18 -3.44 116.94 119.91 2r89 h PHE 377 Ca -0.28 -0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.37 2r89 h PHE 377 Cb 1.13 0.18 -0.25 0.00 2.20 0.00 0.00 35.95 39.21 2r89 h PHE 377 CO 0.75 -0.31 -0.48 0.54 -0.60 0.00 0.00 178.31 178.21 2r89 s ASN 378 N -2.85 -0.50 0.00 2.17 4.22 -1.12 -4.97 114.94 111.89 2r89 s ASN 378 Ca -0.08 -0.32 0.00 0.00 -2.14 0.00 0.00 52.86 50.32 2r89 s ASN 378 Cb 0.01 1.50 0.00 0.00 1.28 0.00 0.00 41.25 44.04 2r89 s ASN 378 CO 0.24 -0.31 0.00 0.29 -2.04 0.00 0.00 177.10 175.29 2r89 n LYS 379 N 5.19 0.00 0.00 3.55 5.02 -1.26 -3.13 118.16 127.52 2r89 n LYS 379 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2r89 n LYS 379 Cb 0.52 -0.03 0.00 0.00 -0.02 0.00 0.00 35.03 35.50 2r89 n LYS 379 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2r89 n ASP 380 N 0.00 3.65 -4.50 4.39 10.43 -1.26 -4.96 116.55 124.30 2r89 n ASP 380 Ca 0.00 0.00 -0.32 0.00 2.57 0.00 0.00 54.79 57.04 2r89 n ASP 380 Cb 0.00 0.00 -0.12 0.00 1.84 0.00 0.00 41.12 42.84 2r89 n ASP 380 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2r89 s ALA 381 N -2.00 2.72 -0.11 2.24 0.00 -1.18 -1.30 121.76 122.13 2r89 s ALA 381 Ca 0.00 -1.09 -0.25 0.00 0.00 0.00 0.00 51.96 50.62 2r89 s ALA 381 Cb 0.00 -0.90 0.06 0.00 0.00 0.00 0.00 23.12 22.28 2r89 s ALA 381 CO 0.00 0.58 0.60 -1.54 0.00 0.00 0.00 175.76 175.40 2r89 s SER 382 N -1.24 -0.58 0.09 0.00 1.04 0.78 0.19 113.70 113.98 2r89 s SER 382 Ca 0.14 0.82 0.10 0.00 0.48 0.00 0.00 55.95 57.50 2r89 s SER 382 Cb -0.11 0.78 -0.03 0.00 0.10 0.00 0.00 66.02 66.76 2r89 s SER 382 CO 0.05 -0.44 -0.27 0.54 0.98 0.00 0.00 173.24 174.10 2r89 s VAL 383 N -0.65 2.21 0.12 5.02 0.11 0.13 0.21 120.40 127.55 2r89 s VAL 383 Ca -0.07 -1.59 0.11 0.00 -2.93 0.00 0.00 61.98 57.50 2r89 s VAL 383 Cb -0.02 -1.93 -0.04 0.00 -1.53 0.00 0.00 36.38 32.86 2r89 s VAL 383 CO 0.06 0.22 -0.26 -1.81 -3.33 0.00 0.00 175.10 169.97 2r89 s ASP 384 N -1.68 3.35 -0.05 3.54 -0.00 -0.80 0.82 116.67 121.85 2r89 s ASP 384 Ca 0.13 -0.72 0.04 0.00 -0.00 0.00 0.00 52.55 51.99 2r89 s ASP 384 Cb -0.10 -0.25 0.00 0.00 -0.00 0.00 0.00 42.92 42.57 2r89 s ASP 384 CO 0.04 0.19 -0.15 -0.69 -0.00 0.00 0.00 175.17 174.55 2r89 s VAL 385 N -1.05 1.33 -0.07 -1.27 1.01 0.15 -3.30 120.40 117.20 2r89 s VAL 385 Ca 0.14 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.52 2r89 s VAL 385 Cb -0.10 -1.16 0.00 0.00 0.00 0.00 0.00 36.38 35.12 2r89 s VAL 385 CO 0.06 0.39 -0.18 -0.83 0.00 0.00 0.00 175.10 174.54 2r89 s GLY 386 N 0.24 1.04 -0.08 4.51 0.00 0.45 -1.40 107.32 112.08 2r89 s GLY 386 Ca -0.08 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 43.92 2r89 s GLY 386 CO 0.03 -0.23 -0.07 0.14 0.00 0.00 0.00 173.10 172.97 2r89 s VAL 387 N 0.30 0.85 -0.02 1.40 1.01 -1.08 -0.65 120.40 122.21 2r89 s VAL 387 Ca -0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 2r89 s VAL 387 Cb -0.15 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.37 2r89 s VAL 387 CO 0.05 0.32 0.06 -0.55 0.00 0.00 0.00 175.10 174.98 2r89 s SER 388 N 1.37 -0.06 -0.24 3.32 0.15 -0.17 -1.59 113.70 116.49 2r89 s SER 388 Ca -0.02 0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.77 2r89 s SER 388 Cb -0.14 0.11 0.05 0.00 -1.71 0.00 0.00 66.02 64.34 2r89 s SER 388 CO -0.04 -0.03 -0.10 -0.47 1.20 0.00 0.00 173.24 173.81 2r89 s TYR 389 N 0.13 2.82 -0.21 3.44 5.04 0.13 0.83 117.35 129.53 2r89 s TYR 389 Ca -0.01 -1.99 -0.12 0.00 -2.44 0.00 0.00 57.07 52.51 2r89 s TYR 389 Cb -0.01 -1.77 -0.05 0.00 0.35 0.00 0.00 41.96 40.48 2r89 s TYR 389 CO -0.00 -0.82 0.24 -1.64 -1.34 0.00 0.00 175.55 171.98 2r89 s MET 390 N 1.25 4.14 -0.24 4.97 -1.94 0.41 -2.22 119.30 125.68 2r89 s MET 390 Ca -0.06 -0.09 -0.00 0.00 -1.71 0.00 0.00 55.69 53.83 2r89 s MET 390 Cb -0.19 -3.51 0.07 0.00 2.01 0.00 0.00 34.83 33.21 2r89 s MET 390 CO -0.06 0.09 -0.00 -1.58 -0.01 0.00 0.00 175.02 173.45 2r89 s HIS 391 N 0.96 1.93 -0.34 -0.03 5.04 -0.91 0.17 115.29 122.11 2r89 s HIS 391 Ca 0.12 -1.53 -0.12 0.00 -1.54 0.00 0.00 55.06 52.00 2r89 s HIS 391 Cb -0.13 -1.48 -0.00 0.00 0.04 0.00 0.00 32.58 31.00 2r89 s HIS 391 CO 0.04 -0.74 0.21 0.20 -2.34 0.00 0.00 174.74 172.11 2r89 s GLY 392 N 1.55 1.93 0.85 1.59 0.00 -1.20 -2.42 107.32 109.61 2r89 s GLY 392 Ca -0.02 -1.47 -0.15 0.00 0.00 0.00 0.00 44.72 43.08 2r89 s GLY 392 CO -0.09 0.77 0.11 0.61 0.00 0.00 0.00 173.10 174.50 2r89 n GLN 393 N 5.05 -0.00 -2.56 2.90 -0.00 -1.23 -4.08 117.38 117.46 2r89 n GLN 393 Ca -0.13 0.03 -0.41 0.00 -0.00 0.00 0.00 57.00 56.50 2r89 n GLN 393 Cb 0.49 -1.57 -0.04 0.00 -0.00 0.00 0.00 30.24 29.11 2r89 n GLN 393 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2r89 s SER 394 N -1.51 7.34 -0.03 2.61 0.15 -1.26 -4.81 113.70 116.19 2r89 s SER 394 Ca 0.56 2.07 -0.03 0.00 0.70 0.00 0.00 55.95 59.25 2r89 s SER 394 Cb -0.27 -2.61 0.01 0.00 -1.71 0.00 0.00 66.02 61.43 2r89 s SER 394 CO 0.68 -0.15 0.08 0.68 1.20 0.00 0.00 173.24 175.74 2r89 s VAL 395 N -0.49 0.02 0.04 4.45 -7.23 0.50 -4.96 120.40 112.72 2r89 s VAL 395 Ca 0.47 -0.14 -0.26 0.00 -1.81 0.00 0.00 61.98 60.24 2r89 s VAL 395 Cb -0.29 -0.17 -0.05 0.00 0.56 0.00 0.00 36.38 36.43 2r89 s VAL 395 CO 0.35 -0.08 0.80 -1.59 -0.31 0.00 0.00 175.10 174.27 2r89 s LYS 396 N -0.22 4.52 0.04 4.82 -2.85 -1.26 -0.42 119.74 124.38 2r89 s LYS 396 Ca -0.03 1.13 0.02 0.00 -1.00 0.00 0.00 55.97 56.08 2r89 s LYS 396 Cb -0.02 -3.38 -0.04 0.00 -2.06 0.00 0.00 37.83 32.33 2r89 s LYS 396 CO 0.00 0.23 0.08 0.42 0.10 0.00 0.00 175.35 176.18 2r89 s ILE 397 N 0.12 4.60 -0.57 3.79 1.01 -0.33 -4.94 121.20 124.88 2r89 s ILE 397 Ca 0.41 -0.62 0.06 0.00 0.00 0.00 0.00 60.65 60.49 2r89 s ILE 397 Cb -0.21 -3.16 0.31 0.00 0.01 0.00 0.00 42.46 39.40 2r89 s ILE 397 CO 0.24 0.22 0.84 0.59 0.00 0.00 0.00 174.94 176.83 2r89 n ASN 398 N 0.77 3.73 -4.88 3.58 4.13 -1.26 -1.54 115.26 119.78 2r89 n ASN 398 Ca -0.10 -3.50 -0.32 0.00 1.68 0.00 0.00 54.58 52.34 2r89 n ASN 398 Cb 0.52 -0.61 -0.05 0.00 -1.54 0.00 0.00 39.78 38.10 2r89 n ASN 398 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2r89 s GLU 399 N -2.94 3.76 0.53 3.52 2.12 -1.22 -4.95 118.70 119.53 2r89 s GLU 399 Ca 0.44 0.18 0.00 0.00 0.36 0.00 0.00 54.97 55.96 2r89 s GLU 399 Cb 0.24 -2.71 0.00 0.00 0.26 0.00 0.00 34.13 31.91 2r89 s GLU 399 CO -0.09 0.36 0.00 0.41 -0.54 0.00 0.00 175.26 175.41 2r89 n GLY 400 N -0.04 1.03 0.30 -1.50 0.00 -1.26 -1.15 105.19 102.57 2r89 n GLY 400 Ca -0.01 -0.51 0.11 0.00 0.00 0.00 0.00 46.02 45.62 2r89 n GLY 400 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2r89 n PRO 401 N 3.92 1.41 -3.31 1.61 -0.04 -1.26 -4.90 135.00 132.42 2r89 n PRO 401 Ca 0.00 -0.61 -0.21 0.00 -0.04 0.00 0.00 63.50 62.65 2r89 n PRO 401 Cb 0.00 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 2r89 n PRO 401 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2r89 s TYR 402 N -1.91 3.18 -0.29 0.54 1.51 -0.30 -4.70 117.35 115.38 2r89 s TYR 402 Ca 0.33 -0.02 -0.01 0.00 -1.01 0.00 0.00 57.07 56.37 2r89 s TYR 402 Cb 0.17 -2.09 0.09 0.00 -0.11 0.00 0.00 41.96 40.02 2r89 s TYR 402 CO 0.27 -0.12 0.07 -0.65 -1.11 0.00 0.00 175.55 174.01 2r89 s GLN 403 N -4.31 0.87 0.54 -0.62 -0.21 -1.26 -3.38 119.66 111.28 2r89 s GLN 403 Ca 0.45 -1.02 0.07 0.00 0.02 0.00 0.00 55.36 54.89 2r89 s GLN 403 Cb -0.10 -2.17 0.05 0.00 1.00 0.00 0.00 33.01 31.80 2r89 s GLN 403 CO 0.34 -0.88 0.56 -0.06 -2.12 0.00 0.00 175.29 173.13 2r89 s PHE 404 N 1.57 1.68 -0.03 0.91 0.40 -0.59 -4.22 117.98 117.70 2r89 s PHE 404 Ca 0.06 -0.75 -0.01 0.00 -0.60 0.00 0.00 56.93 55.64 2r89 s PHE 404 Cb -0.18 -2.07 0.03 0.00 0.51 0.00 0.00 43.02 41.31 2r89 s PHE 404 CO -0.19 -0.71 0.06 -2.00 0.70 0.00 0.00 175.22 173.07 2r89 s GLU 405 N -4.42 -0.03 -0.04 0.44 2.12 -0.72 -1.18 118.70 114.86 2r89 s GLU 405 Ca 0.47 0.27 0.06 0.00 0.36 0.00 0.00 54.97 56.13 2r89 s GLU 405 Cb -0.04 -0.29 -0.02 0.00 0.26 0.00 0.00 34.13 34.04 2r89 s GLU 405 CO 0.29 -0.21 -0.22 0.45 -0.54 0.00 0.00 175.26 175.04 2r89 s SER 406 N 1.35 3.36 -0.28 -1.70 0.15 0.44 -2.18 113.70 114.84 2r89 s SER 406 Ca -0.06 -0.40 -0.01 0.00 0.70 0.00 0.00 55.95 56.18 2r89 s SER 406 Cb -0.13 -0.66 0.17 0.00 -1.71 0.00 0.00 66.02 63.70 2r89 s SER 406 CO -0.04 0.30 0.53 -1.83 1.20 0.00 0.00 173.24 173.40 2r89 s GLU 407 N -0.49 0.50 -0.01 5.44 4.04 -1.23 -0.37 118.70 126.58 2r89 s GLU 407 Ca 0.06 0.82 -0.02 0.00 0.04 0.00 0.00 54.97 55.86 2r89 s GLU 407 Cb -0.11 0.21 -0.00 0.00 0.02 0.00 0.00 34.13 34.25 2r89 s GLU 407 CO 0.01 -0.67 0.05 0.20 -1.84 0.00 0.00 175.26 173.01 2r89 s GLY 408 N 2.76 0.03 0.00 -3.83 0.00 -1.26 -3.08 107.32 101.94 2r89 s GLY 408 Ca 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 44.72 44.86 2r89 s GLY 408 CO -0.20 -0.09 0.00 0.58 0.00 0.00 0.00 173.10 173.39 2r89 n LYS 409 N 2.51 2.11 -3.61 2.90 2.85 -1.16 -3.27 118.16 120.49 2r89 n LYS 409 Ca -0.16 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.03 2r89 n LYS 409 Cb 0.58 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.91 2r89 n LYS 409 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2r89 s ALA 410 N -2.00 -2.01 -0.08 0.58 0.00 0.13 -1.57 121.76 116.79 2r89 s ALA 410 Ca 0.00 1.72 0.04 0.00 0.00 0.00 0.00 51.96 53.71 2r89 s ALA 410 Cb 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 22.05 2r89 s ALA 410 CO 0.00 -0.27 -0.20 -1.58 0.00 0.00 0.00 175.76 173.71 2r89 s TRP 411 N -1.01 2.16 -0.09 0.00 0.52 -0.87 -0.44 118.94 119.21 2r89 s TRP 411 Ca 0.03 -0.85 0.01 0.00 0.02 0.00 0.00 56.10 55.31 2r89 s TRP 411 Cb -0.01 -1.47 -0.02 0.00 -1.15 0.00 0.00 33.47 30.82 2r89 s TRP 411 CO -0.03 -0.36 -0.11 -0.51 0.02 0.00 0.00 176.95 175.97 2r89 s LEU 412 N 0.42 2.92 -0.03 2.99 1.43 0.24 -1.34 118.68 125.31 2r89 s LEU 412 Ca -0.16 -0.17 0.01 0.00 -1.03 0.00 0.00 54.13 52.78 2r89 s LEU 412 Cb -0.17 -1.63 0.01 0.00 0.03 0.00 0.00 46.19 44.43 2r89 s LEU 412 CO 0.07 0.29 -0.05 -0.36 0.23 0.00 0.00 176.35 176.52 2r89 s PHE 413 N -0.36 0.71 -0.04 0.29 0.40 -0.79 -0.99 117.98 117.19 2r89 s PHE 413 Ca 0.04 -0.17 -0.11 0.00 -0.60 0.00 0.00 56.93 56.09 2r89 s PHE 413 Cb -0.12 -0.57 0.02 0.00 0.51 0.00 0.00 43.02 42.85 2r89 s PHE 413 CO 0.02 -0.13 0.25 0.20 0.70 0.00 0.00 175.22 176.27 2r89 s GLY 414 N 0.53 -0.12 0.02 4.36 0.00 0.18 0.65 107.32 112.94 2r89 s GLY 414 Ca -0.07 0.36 0.03 0.00 0.00 0.00 0.00 44.72 45.03 2r89 s GLY 414 CO 0.00 0.20 -0.08 -1.08 0.00 0.00 0.00 173.10 172.14 2r89 s THR 415 N -0.85 0.62 -0.00 0.90 -1.32 -0.28 -0.41 115.64 114.30 2r89 s THR 415 Ca -0.09 -0.66 -0.07 0.00 -1.21 0.00 0.00 61.69 59.66 2r89 s THR 415 Cb -0.05 -0.58 0.00 0.00 -1.51 0.00 0.00 72.50 70.36 2r89 s THR 415 CO 0.02 -0.05 0.14 0.20 -2.21 0.00 0.00 174.62 172.72 2r89 s ASN 416 N -0.78 0.01 -0.01 8.08 0.02 -1.21 -1.20 114.94 119.86 2r89 s ASN 416 Ca -0.02 -0.17 0.06 0.00 -1.02 0.00 0.00 52.86 51.71 2r89 s ASN 416 Cb -0.06 0.21 -0.03 0.00 0.02 0.00 0.00 41.25 41.40 2r89 s ASN 416 CO 0.00 -0.34 -0.17 -0.36 0.02 0.00 0.00 177.10 176.25 2r89 s PHE 417 N -1.26 2.60 -0.18 2.20 0.40 0.12 -1.90 117.98 119.96 2r89 s PHE 417 Ca -0.13 -0.23 0.01 0.00 -0.60 0.00 0.00 56.93 55.97 2r89 s PHE 417 Cb -0.07 -1.54 0.03 0.00 0.51 0.00 0.00 43.02 41.94 2r89 s PHE 417 CO 0.01 0.19 -0.17 -0.80 0.70 0.00 0.00 175.22 175.16 2r89 s ASN 418 N -1.04 3.17 -0.05 1.36 -0.87 0.56 -1.80 114.94 116.27 2r89 s ASN 418 Ca 0.13 -0.70 0.02 0.00 -1.57 0.00 0.00 52.86 50.74 2r89 s ASN 418 Cb -0.10 -1.39 0.01 0.00 -0.02 0.00 0.00 41.25 39.74 2r89 s ASN 418 CO 0.03 -0.04 -0.11 -0.47 -2.57 0.00 0.00 177.10 173.93 2r89 s TYR 419 N 1.33 1.28 0.01 2.20 5.04 0.45 -0.16 117.35 127.50 2r89 s TYR 419 Ca 0.03 -0.41 0.08 0.00 -2.44 0.00 0.00 57.07 54.33 2r89 s TYR 419 Cb -0.14 -0.93 -0.02 0.00 0.35 0.00 0.00 41.96 41.22 2r89 s TYR 419 CO -0.11 -0.20 -0.25 0.00 -1.34 0.00 0.00 175.55 173.65 2r89 s ALA 420 N 0.48 2.07 -2.22 3.97 0.00 -0.42 -0.31 121.76 125.33 2r89 s ALA 420 Ca -0.10 -1.13 0.30 0.00 0.00 0.00 0.00 51.96 51.04 2r89 s ALA 420 Cb -0.13 -0.48 1.53 0.00 0.00 0.00 0.00 23.12 24.03 2r89 s ALA 420 CO 0.02 0.50 2.01 1.19 0.00 0.00 0.00 175.76 179.48