#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r1b n GLY 81 N 0.00 6.90 3.67 -0.02 0.00 -1.26 -4.92 105.19 109.56 2r1b n GLY 81 Ca 0.00 -1.89 -0.44 0.00 0.00 0.00 0.00 46.02 43.69 2r1b n GLY 81 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2r1b n HIS 82 N 0.00 2.48 -4.96 1.61 8.25 -1.26 -4.99 115.22 116.35 2r1b n HIS 82 Ca 0.00 -0.23 -0.29 0.00 -0.26 0.00 0.00 57.72 56.95 2r1b n HIS 82 Cb 0.00 -2.75 -0.15 0.00 1.12 0.00 0.00 29.99 28.21 2r1b n HIS 82 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2r1b s ALA 83 N 3.97 2.00 0.00 -1.41 0.00 -1.26 -5.05 121.76 120.01 2r1b s ALA 83 Ca 0.89 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 51.74 2r1b s ALA 83 Cb -0.52 -0.45 0.00 0.00 0.00 0.00 0.00 23.12 22.15 2r1b s ALA 83 CO 0.44 0.48 0.00 0.41 0.00 0.00 0.00 175.76 177.08 2r1b n GLY 84 N 2.12 0.84 3.67 0.00 0.00 -1.26 -4.29 105.19 106.28 2r1b n GLY 84 Ca -0.16 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 2r1b n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r1b s THR 85 N 0.00 3.12 -0.01 2.61 2.01 -1.26 -4.92 115.64 117.19 2r1b s THR 85 Ca 0.00 0.30 0.02 0.00 0.31 0.00 0.00 61.69 62.32 2r1b s THR 85 Cb 0.00 -3.19 -0.00 0.00 0.01 0.00 0.00 72.50 69.32 2r1b s THR 85 CO 0.00 -0.02 -0.07 0.28 -0.69 0.00 0.00 174.62 174.12 2r1b s THR 86 N 3.80 0.58 0.06 -0.82 -1.32 -1.26 -3.20 115.64 113.47 2r1b s THR 86 Ca 0.81 -0.28 0.09 0.00 -1.21 0.00 0.00 61.69 61.10 2r1b s THR 86 Cb -0.40 -0.51 -0.03 0.00 -1.51 0.00 0.00 72.50 70.05 2r1b s THR 86 CO 0.36 0.18 -0.26 -0.31 -2.21 0.00 0.00 174.62 172.38 2r1b s TYR 87 N 0.02 2.26 -0.14 9.09 1.51 -0.53 -1.42 117.35 128.14 2r1b s TYR 87 Ca 0.00 -0.41 -0.03 0.00 -1.01 0.00 0.00 57.07 55.63 2r1b s TYR 87 Cb -0.05 -1.34 -0.03 0.00 -0.11 0.00 0.00 41.96 40.43 2r1b s TYR 87 CO -0.00 0.15 -0.04 -1.50 -1.11 0.00 0.00 175.55 173.05 2r1b s ILE 88 N -0.84 3.88 -0.23 2.71 2.07 -0.31 -1.69 121.20 126.78 2r1b s ILE 88 Ca 0.12 -0.37 -0.08 0.00 -1.41 0.00 0.00 60.65 58.90 2r1b s ILE 88 Cb -0.10 -2.68 -0.04 0.00 0.13 0.00 0.00 42.46 39.77 2r1b s ILE 88 CO 0.03 0.51 0.10 -0.36 -1.91 0.00 0.00 174.94 173.31 2r1b s PHE 89 N 0.16 3.18 0.42 3.50 0.40 -0.07 -1.50 117.98 124.08 2r1b s PHE 89 Ca -0.02 -0.10 0.04 0.00 -0.60 0.00 0.00 56.93 56.26 2r1b s PHE 89 Cb -0.14 -2.21 -0.05 0.00 0.51 0.00 0.00 43.02 41.13 2r1b s PHE 89 CO 0.03 -0.11 0.03 -1.12 0.70 0.00 0.00 175.22 174.75 2r1b s SER 90 N 1.17 3.50 0.69 1.36 0.01 -0.93 -1.56 113.70 117.95 2r1b s SER 90 Ca 0.05 -1.50 0.00 0.00 1.31 0.00 0.00 55.95 55.81 2r1b s SER 90 Cb -0.14 0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.16 2r1b s SER 90 CO 0.04 -0.67 0.00 2.29 0.41 0.00 0.00 173.24 175.31 2r1b n LYS 91 N -0.99 0.00 0.00 12.44 -0.00 -1.26 0.10 118.16 128.45 2r1b n LYS 91 Ca -0.09 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.25 2r1b n LYS 91 Cb 0.67 0.00 0.13 0.00 -0.00 0.00 0.00 35.03 35.82 2r1b n LYS 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2r1b n GLY 92 N 0.00 -0.59 1.33 2.58 0.00 -1.26 -4.98 105.19 102.27 2r1b n GLY 92 Ca 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 46.02 46.01 2r1b n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1b n GLY 93 N -0.88 -2.21 0.64 -0.02 0.00 0.29 -4.94 105.19 98.07 2r1b n GLY 93 Ca 0.02 -1.50 -0.00 0.00 0.00 0.00 0.00 46.02 44.54 2r1b n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1b n GLY 94 N -0.97 1.01 3.38 -0.02 0.00 -1.26 -1.69 105.19 105.63 2r1b n GLY 94 Ca 0.00 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 2r1b n GLY 94 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2r1b s GLN 95 N -2.01 0.56 -0.14 1.61 0.74 -0.37 -4.48 119.66 115.58 2r1b s GLN 95 Ca 0.04 0.70 0.00 0.00 0.05 0.00 0.00 55.36 56.15 2r1b s GLN 95 Cb -0.00 0.26 -0.01 0.00 1.10 0.00 0.00 33.01 34.35 2r1b s GLN 95 CO 0.01 -0.08 -0.15 0.42 -0.55 0.00 0.00 175.29 174.94 2r1b s ILE 96 N 0.36 2.76 -0.15 -2.34 1.01 -0.77 -1.76 121.20 120.32 2r1b s ILE 96 Ca -0.01 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.90 2r1b s ILE 96 Cb -0.04 -2.15 0.02 0.00 0.01 0.00 0.00 42.46 40.30 2r1b s ILE 96 CO -0.01 0.52 -0.19 -0.89 0.00 0.00 0.00 174.94 174.38 2r1b s THR 97 N 0.56 1.90 -0.21 2.92 2.01 -0.13 -1.09 115.64 121.60 2r1b s THR 97 Ca -0.09 -0.86 -0.12 0.00 0.31 0.00 0.00 61.69 60.93 2r1b s THR 97 Cb -0.16 -1.71 -0.05 0.00 0.01 0.00 0.00 72.50 70.59 2r1b s THR 97 CO 0.04 0.52 0.23 -0.47 -0.69 0.00 0.00 174.62 174.24 2r1b s TYR 98 N 1.14 3.36 -0.21 4.92 5.04 -0.03 -1.40 117.35 130.18 2r1b s TYR 98 Ca -0.00 0.39 0.02 0.00 -2.44 0.00 0.00 57.07 55.03 2r1b s TYR 98 Cb -0.14 -2.32 0.03 0.00 0.35 0.00 0.00 41.96 39.88 2r1b s TYR 98 CO -0.08 0.11 -0.17 0.21 -1.34 0.00 0.00 175.55 174.29 2r1b s LYS 99 N 0.92 2.74 0.31 4.97 2.20 -0.64 -1.13 119.74 129.12 2r1b s LYS 99 Ca 0.12 -1.00 -0.29 0.00 -0.36 0.00 0.00 55.97 54.43 2r1b s LYS 99 Cb -0.13 -2.69 -0.10 0.00 -1.51 0.00 0.00 37.83 33.40 2r1b s LYS 99 CO 0.04 -0.33 1.29 -1.58 -0.36 0.00 0.00 175.35 174.40 2r1b s TRP 100 N 1.23 3.13 0.36 4.03 0.51 -1.11 -4.83 118.94 122.26 2r1b s TRP 100 Ca 0.00 1.42 -0.26 0.00 -2.12 0.00 0.00 56.10 55.14 2r1b s TRP 100 Cb -0.15 -3.63 -0.12 0.00 -0.81 0.00 0.00 33.47 28.76 2r1b s TRP 100 CO -0.10 -1.73 1.09 -2.30 -0.51 0.00 0.00 176.95 173.41 2r1b n PRO 101 N 1.08 1.58 -0.34 4.98 -0.02 -1.26 -4.86 135.00 136.16 2r1b n PRO 101 Ca 0.01 0.56 0.21 0.00 -2.02 0.00 0.00 63.50 62.25 2r1b n PRO 101 Cb 0.42 -2.07 0.46 0.00 -0.02 0.00 0.00 33.50 32.28 2r1b n PRO 101 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2r1b h PRO 102 N 1.96 0.45 -0.00 0.52 0.11 -1.98 -0.66 132.00 132.40 2r1b h PRO 102 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2r1b h PRO 102 Cb 1.32 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2r1b h PRO 102 CO 0.59 0.30 -0.09 0.09 -0.21 0.00 0.00 178.00 178.68 2r1b n ASN 103 N -4.75 0.39 -0.47 -2.05 3.02 -1.26 -3.91 115.26 106.23 2r1b n ASN 103 Ca 0.27 -0.51 0.05 0.00 -0.03 0.00 0.00 54.58 54.35 2r1b n ASN 103 Cb 0.84 -0.10 0.13 0.00 -0.61 0.00 0.00 39.78 40.03 2r1b n ASN 103 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2r1b n ASP 104 N -1.01 2.80 -4.68 6.41 8.00 -0.26 -5.02 116.55 122.78 2r1b n ASP 104 Ca 0.15 -2.26 -0.42 0.00 0.71 0.00 0.00 54.79 52.97 2r1b n ASP 104 Cb 0.27 -0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 41.10 2r1b n ASP 104 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2r1b s ARG 105 N -1.45 4.21 0.51 -1.24 0.52 -1.21 -4.86 118.95 115.42 2r1b s ARG 105 Ca 0.21 2.26 -0.18 0.00 -0.52 0.00 0.00 55.73 57.50 2r1b s ARG 105 Cb 0.14 -3.67 -0.08 0.00 0.52 0.00 0.00 34.95 31.86 2r1b s ARG 105 CO 0.09 -0.73 1.00 -1.25 0.02 0.00 0.00 175.30 174.43 2r1b s PRO 106 N 2.88 3.84 -0.17 3.54 0.04 -1.26 -4.68 135.00 139.20 2r1b s PRO 106 Ca 0.73 1.09 -0.00 0.00 0.04 0.00 0.00 61.00 62.86 2r1b s PRO 106 Cb -0.37 -2.12 0.04 0.00 0.04 0.00 0.00 34.50 32.09 2r1b s PRO 106 CO 0.31 -0.37 -0.07 -1.12 0.04 0.00 0.00 177.00 175.79 2r1b s SER 107 N -2.71 2.89 -0.04 6.66 0.01 -1.26 -0.96 113.70 118.29 2r1b s SER 107 Ca 0.62 -0.67 0.06 0.00 1.31 0.00 0.00 55.95 57.27 2r1b s SER 107 Cb -0.12 -0.99 -0.02 0.00 0.21 0.00 0.00 66.02 65.10 2r1b s SER 107 CO 0.28 -0.16 -0.22 0.42 0.41 0.00 0.00 173.24 173.97 2r1b s THR 108 N 1.58 2.37 0.07 1.44 -4.23 -0.78 -4.91 115.64 111.18 2r1b s THR 108 Ca 0.01 -0.98 0.16 0.00 -1.18 0.00 0.00 61.69 59.70 2r1b s THR 108 Cb -0.15 -1.87 0.06 0.00 1.34 0.00 0.00 72.50 71.88 2r1b s THR 108 CO -0.08 0.58 1.58 0.03 -0.54 0.00 0.00 174.62 176.19 2r1b h ARG 109 N 5.58 0.00 -3.87 3.99 3.08 -1.90 0.36 114.38 121.61 2r1b h ARG 109 Ca -0.42 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.41 2r1b h ARG 109 Cb 1.14 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 30.93 2r1b h ARG 109 CO 0.48 0.51 -0.72 0.00 -1.07 0.00 0.00 179.97 179.17 2r1b s ALA 110 N -3.29 0.08 0.06 0.04 0.00 -1.26 -1.26 121.76 116.12 2r1b s ALA 110 Ca 0.01 -0.21 0.05 0.00 0.00 0.00 0.00 51.96 51.81 2r1b s ALA 110 Cb 0.10 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 2r1b s ALA 110 CO 0.73 -0.04 -0.13 -0.51 0.00 0.00 0.00 175.76 175.81 2r1b s ASP 111 N -0.48 1.52 -0.03 0.00 1.01 -0.36 -4.99 116.67 113.35 2r1b s ASP 111 Ca -0.05 -0.56 -0.00 0.00 0.71 0.00 0.00 52.55 52.65 2r1b s ASP 111 Cb -0.03 -0.05 0.03 0.00 1.01 0.00 0.00 42.92 43.88 2r1b s ASP 111 CO -0.00 -0.07 0.03 -0.13 0.21 0.00 0.00 175.17 175.21 2r1b s ARG 112 N -1.54 0.01 -0.05 8.23 0.52 -1.26 -1.63 118.95 123.24 2r1b s ARG 112 Ca -0.02 0.20 0.01 0.00 -0.52 0.00 0.00 55.73 55.39 2r1b s ARG 112 Cb -0.09 -0.34 0.02 0.00 0.52 0.00 0.00 34.95 35.07 2r1b s ARG 112 CO 0.02 -0.19 -0.03 -1.17 0.02 0.00 0.00 175.30 173.95 2r1b s LEU 113 N 1.26 1.17 0.04 2.53 2.96 -0.47 -1.84 118.68 124.32 2r1b s LEU 113 Ca -0.07 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 53.77 2r1b s LEU 113 Cb -0.13 -0.40 -0.02 0.00 0.50 0.00 0.00 46.19 46.14 2r1b s LEU 113 CO -0.03 -0.09 -0.09 0.00 -1.32 0.00 0.00 176.35 174.83 2r1b s ALA 114 N 1.11 0.68 0.04 5.97 0.00 -0.76 -0.86 121.76 127.95 2r1b s ALA 114 Ca -0.08 -0.71 -0.21 0.00 0.00 0.00 0.00 51.96 50.96 2r1b s ALA 114 Cb -0.14 -0.02 0.05 0.00 0.00 0.00 0.00 23.12 23.01 2r1b s ALA 114 CO -0.01 0.05 0.49 -1.50 0.00 0.00 0.00 175.76 174.79 2r1b s ILE 115 N -1.10 0.04 -0.06 0.00 2.07 -0.98 -1.05 121.20 120.12 2r1b s ILE 115 Ca -0.06 -0.30 -0.02 0.00 -1.41 0.00 0.00 60.65 58.87 2r1b s ILE 115 Cb -0.08 -0.96 -0.04 0.00 0.13 0.00 0.00 42.46 41.51 2r1b s ILE 115 CO 0.01 -0.16 0.05 -0.83 -1.91 0.00 0.00 174.94 172.09 2r1b s GLY 116 N -1.96 1.95 0.11 1.50 0.00 -0.47 -1.68 107.32 106.78 2r1b s GLY 116 Ca -0.05 -0.81 -0.10 0.00 0.00 0.00 0.00 44.72 43.75 2r1b s GLY 116 CO -0.02 -0.61 0.26 -0.11 0.00 0.00 0.00 173.10 172.62 2r1b s PHE 117 N -1.01 0.12 -0.10 1.90 -0.12 -0.13 -1.60 117.98 117.03 2r1b s PHE 117 Ca 0.17 -0.51 -0.08 0.00 -0.05 0.00 0.00 56.93 56.46 2r1b s PHE 117 Cb -0.12 0.02 0.03 0.00 -0.63 0.00 0.00 43.02 42.32 2r1b s PHE 117 CO 0.07 -0.62 0.25 -1.54 -0.05 0.00 0.00 175.22 173.33 2r1b s SER 118 N -2.87 -0.27 0.06 1.98 1.04 -0.77 -1.27 113.70 111.60 2r1b s SER 118 Ca 0.07 0.52 -0.27 0.00 0.48 0.00 0.00 55.95 56.75 2r1b s SER 118 Cb 0.04 0.50 0.09 0.00 0.10 0.00 0.00 66.02 66.74 2r1b s SER 118 CO -0.09 -0.11 0.82 0.28 0.98 0.00 0.00 173.24 175.13 2r1b s THR 119 N 0.42 0.00 -1.47 2.02 -1.32 -1.26 -2.11 115.64 111.92 2r1b s THR 119 Ca -0.02 -0.09 0.14 0.00 -1.21 0.00 0.00 61.69 60.51 2r1b s THR 119 Cb -0.04 -1.12 0.26 0.00 -1.51 0.00 0.00 72.50 70.09 2r1b s THR 119 CO -0.02 0.00 1.15 1.33 -2.21 0.00 0.00 174.62 174.87 2r1b n VAL 120 N -0.30 0.53 -2.25 5.08 0.24 -1.26 -1.71 118.33 118.65 2r1b n VAL 120 Ca -0.10 -0.77 -0.41 0.00 -2.04 0.00 0.00 64.34 61.02 2r1b n VAL 120 Cb 0.62 0.87 -0.03 0.00 -1.47 0.00 0.00 33.84 33.84 2r1b n VAL 120 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2r1b s GLN 121 N -1.09 4.44 0.32 7.34 -0.21 -1.26 -4.89 119.66 124.30 2r1b s GLN 121 Ca 0.24 2.03 0.12 0.00 0.02 0.00 0.00 55.36 57.77 2r1b s GLN 121 Cb 0.14 -3.17 0.51 0.00 1.00 0.00 0.00 33.01 31.50 2r1b s GLN 121 CO 0.19 -0.14 1.70 0.87 -2.12 0.00 0.00 175.29 175.80 2r1b h LYS 122 N 4.58 0.00 -3.38 2.91 1.79 -1.95 -3.43 116.57 117.09 2r1b h LYS 122 Ca -0.46 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 57.76 2r1b h LYS 122 Cb 1.22 0.00 -0.31 0.00 -1.58 0.00 0.00 32.23 31.56 2r1b h LYS 122 CO 0.72 0.51 -0.63 -2.00 -1.08 0.00 0.00 179.45 176.97 2r1b s GLU 123 N -3.82 0.07 -0.15 3.15 2.12 -1.26 -1.42 118.70 117.39 2r1b s GLU 123 Ca -0.02 0.26 -0.30 0.00 0.36 0.00 0.00 54.97 55.27 2r1b s GLU 123 Cb 0.13 -0.13 0.13 0.00 0.26 0.00 0.00 34.13 34.53 2r1b s GLU 123 CO 0.74 -0.12 1.05 0.00 -0.54 0.00 0.00 175.26 176.39 2r1b s ALA 124 N 0.83 -1.95 -0.18 6.30 0.00 -0.83 -4.89 121.76 121.03 2r1b s ALA 124 Ca -0.06 1.52 -0.09 0.00 0.00 0.00 0.00 51.96 53.33 2r1b s ALA 124 Cb -0.09 -0.51 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 2r1b s ALA 124 CO -0.04 -0.41 0.12 0.08 0.00 0.00 0.00 175.76 175.51 2r1b s VAL 125 N -1.67 5.28 -0.24 0.00 1.01 -0.51 -0.53 120.40 123.74 2r1b s VAL 125 Ca 0.02 0.14 -0.15 0.00 0.00 0.00 0.00 61.98 61.99 2r1b s VAL 125 Cb -0.01 -3.38 -0.11 0.00 0.00 0.00 0.00 36.38 32.88 2r1b s VAL 125 CO -0.02 0.48 -0.29 0.18 0.00 0.00 0.00 175.10 175.44 2r1b n LEU 126 N 3.23 1.94 -3.86 3.92 4.32 -0.41 -2.96 117.00 123.17 2r1b n LEU 126 Ca -0.17 0.36 -0.14 0.00 -0.02 0.00 0.00 56.01 56.04 2r1b n LEU 126 Cb 0.53 -0.82 -0.15 0.00 -1.62 0.00 0.00 43.42 41.36 2r1b n LEU 126 CO 0.35 0.32 -0.37 -0.69 -1.22 0.00 0.00 177.39 175.78 2r1b s VAL 127 N -2.58 0.11 -0.02 4.08 1.01 -1.11 -1.38 120.40 120.51 2r1b s VAL 127 Ca -0.35 0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.65 2r1b s VAL 127 Cb 0.11 -0.14 0.01 0.00 0.00 0.00 0.00 36.38 36.36 2r1b s VAL 127 CO 0.48 0.06 -0.05 -0.60 0.00 0.00 0.00 175.10 174.99 2r1b s ARG 128 N 0.33 0.62 -0.19 2.72 3.52 -0.30 -1.06 118.95 124.59 2r1b s ARG 128 Ca -0.03 -0.16 -0.05 0.00 -0.13 0.00 0.00 55.73 55.37 2r1b s ARG 128 Cb -0.05 -0.62 -0.02 0.00 -1.56 0.00 0.00 34.95 32.69 2r1b s ARG 128 CO -0.01 0.03 -0.01 0.08 -0.81 0.00 0.00 175.30 174.58 2r1b s VAL 129 N 0.35 3.88 0.03 7.11 1.01 -0.06 -0.94 120.40 131.78 2r1b s VAL 129 Ca -0.04 -0.34 0.08 0.00 0.00 0.00 0.00 61.98 61.67 2r1b s VAL 129 Cb -0.08 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 2r1b s VAL 129 CO -0.00 0.44 -0.21 -1.81 0.00 0.00 0.00 175.10 173.52 2r1b s ASP 130 N 0.88 3.58 0.97 3.32 1.01 -0.94 -1.93 116.67 123.56 2r1b s ASP 130 Ca 0.00 -0.46 -0.12 0.00 0.71 0.00 0.00 52.55 52.68 2r1b s ASP 130 Cb -0.14 -0.51 0.17 0.00 1.01 0.00 0.00 42.92 43.45 2r1b s ASP 130 CO 0.02 0.27 1.11 -0.94 0.21 0.00 0.00 175.17 175.83 2r1b s SER 131 N -1.27 2.88 1.10 0.27 1.04 -1.07 -0.87 113.70 115.78 2r1b s SER 131 Ca 0.13 1.11 -0.12 0.00 0.48 0.00 0.00 55.95 57.55 2r1b s SER 131 Cb -0.10 -1.74 0.25 0.00 0.10 0.00 0.00 66.02 64.52 2r1b s SER 131 CO 0.03 -2.96 1.05 -0.44 0.98 0.00 0.00 173.24 171.90 2r1b s SER 132 N -3.64 1.49 0.44 7.02 0.01 -0.36 -4.60 113.70 114.06 2r1b s SER 132 Ca 0.65 1.58 -0.24 0.00 1.31 0.00 0.00 55.95 59.25 2r1b s SER 132 Cb -0.17 -2.29 -0.08 0.00 0.21 0.00 0.00 66.02 63.69 2r1b s SER 132 CO 0.56 -3.89 1.21 -0.94 0.41 0.00 0.00 173.24 170.59 2r1b s SER 133 N -2.67 6.21 0.00 2.44 1.04 -1.26 -2.39 113.70 117.07 2r1b s SER 133 Ca 0.68 2.41 0.00 0.00 0.48 0.00 0.00 55.95 59.52 2r1b s SER 133 Cb -0.24 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.27 2r1b s SER 133 CO 0.63 -0.89 0.00 0.61 0.98 0.00 0.00 173.24 174.56 2r1b n GLY 134 N 0.56 1.43 3.80 7.32 0.00 -1.26 -5.04 105.19 112.01 2r1b n GLY 134 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 2r1b n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r1b s LEU 135 N 0.00 3.88 0.00 0.99 1.43 -1.01 -5.07 118.68 118.90 2r1b s LEU 135 Ca 0.00 -0.02 0.22 0.00 -1.03 0.00 0.00 54.13 53.30 2r1b s LEU 135 Cb 0.00 -2.52 -0.21 0.00 0.03 0.00 0.00 46.19 43.49 2r1b s LEU 135 CO 0.00 0.13 0.77 0.61 0.23 0.00 0.00 176.35 178.09 2r1b n GLY 136 N 0.12 -1.05 3.78 -3.19 0.00 -1.26 -4.79 105.19 98.79 2r1b n GLY 136 Ca -0.08 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.06 2r1b n GLY 136 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2r1b s ASP 137 N -3.82 6.12 0.16 1.61 1.01 -1.26 -4.88 116.67 115.61 2r1b s ASP 137 Ca 0.01 2.19 -0.24 0.00 0.71 0.00 0.00 52.55 55.21 2r1b s ASP 137 Cb 0.15 -2.59 0.06 0.00 1.01 0.00 0.00 42.92 41.55 2r1b s ASP 137 CO 0.87 -0.94 0.79 -0.72 0.21 0.00 0.00 175.17 175.38 2r1b s TYR 138 N -1.68 -0.29 -0.07 4.23 -0.85 -0.70 -2.58 117.35 115.40 2r1b s TYR 138 Ca 0.66 0.01 -0.03 0.00 -0.52 0.00 0.00 57.07 57.19 2r1b s TYR 138 Cb -0.25 0.62 0.04 0.00 0.38 0.00 0.00 41.96 42.75 2r1b s TYR 138 CO 0.30 -0.89 0.15 -1.17 -1.52 0.00 0.00 175.55 172.42 2r1b s LEU 139 N -2.79 0.76 -0.02 -3.49 2.96 -0.81 -1.74 118.68 113.55 2r1b s LEU 139 Ca 0.08 0.32 0.01 0.00 -0.22 0.00 0.00 54.13 54.31 2r1b s LEU 139 Cb -0.02 0.41 0.02 0.00 0.50 0.00 0.00 46.19 47.09 2r1b s LEU 139 CO -0.03 -0.14 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.15 2r1b s GLU 140 N 1.08 0.32 -0.21 1.98 2.12 -0.37 -0.88 118.70 122.74 2r1b s GLU 140 Ca -0.08 0.01 -0.04 0.00 0.36 0.00 0.00 54.97 55.22 2r1b s GLU 140 Cb -0.10 -0.44 -0.01 0.00 0.26 0.00 0.00 34.13 33.84 2r1b s GLU 140 CO -0.06 -0.08 -0.04 -1.17 -0.54 0.00 0.00 175.26 173.38 2r1b s LEU 141 N 0.71 2.94 0.24 2.70 2.96 -0.22 -1.85 118.68 126.17 2r1b s LEU 141 Ca -0.07 -0.35 -0.03 0.00 -0.22 0.00 0.00 54.13 53.45 2r1b s LEU 141 Cb -0.10 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 2r1b s LEU 141 CO -0.01 0.01 0.27 -1.38 -1.32 0.00 0.00 176.35 173.92 2r1b s HIS 142 N 1.31 1.03 -0.08 5.38 -3.43 -0.55 -1.29 115.29 117.66 2r1b s HIS 142 Ca 0.04 -1.25 0.05 0.00 -0.80 0.00 0.00 55.06 53.10 2r1b s HIS 142 Cb -0.14 -0.35 -0.00 0.00 -1.43 0.00 0.00 32.58 30.66 2r1b s HIS 142 CO -0.02 -0.81 -0.24 0.42 -2.00 0.00 0.00 174.74 172.10 2r1b s ILE 143 N -3.92 2.01 -0.02 -5.38 1.01 0.31 -1.18 121.20 114.03 2r1b s ILE 143 Ca 0.34 -1.01 -0.00 0.00 0.00 0.00 0.00 60.65 59.98 2r1b s ILE 143 Cb 0.04 -1.73 0.03 0.00 0.01 0.00 0.00 42.46 40.81 2r1b s ILE 143 CO 0.14 0.55 0.03 -2.28 0.00 0.00 0.00 174.94 173.38 2r1b s HIS 144 N 0.20 0.08 -1.34 3.97 2.46 -0.52 -1.97 115.29 118.17 2r1b s HIS 144 Ca -0.14 0.13 -0.08 0.00 0.47 0.00 0.00 55.06 55.44 2r1b s HIS 144 Cb -0.17 -0.30 0.06 0.00 -0.13 0.00 0.00 32.58 32.04 2r1b s HIS 144 CO 0.07 -0.11 0.51 1.04 -2.47 0.00 0.00 174.74 173.78 2r1b n GLN 145 N 4.35 -3.73 -1.04 2.88 6.02 -0.84 -1.36 117.38 123.66 2r1b n GLN 145 Ca -0.24 0.57 -0.01 0.00 -0.01 0.00 0.00 57.00 57.31 2r1b n GLN 145 Cb 0.50 -5.31 -0.01 0.00 1.02 0.00 0.00 30.24 26.44 2r1b n GLN 145 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2r1b n GLY 146 N -1.25 0.51 3.31 1.08 0.00 -0.50 -5.00 105.19 103.33 2r1b n GLY 146 Ca -0.04 -0.41 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 2r1b n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r1b s LYS 147 N -1.14 2.49 0.29 1.61 -0.14 -0.47 -1.26 119.74 121.12 2r1b s LYS 147 Ca 0.00 -0.88 -0.25 0.00 -1.36 0.00 0.00 55.97 53.49 2r1b s LYS 147 Cb 0.00 -2.18 -0.09 0.00 -1.68 0.00 0.00 37.83 33.87 2r1b s LYS 147 CO 0.00 0.44 0.89 0.96 -0.76 0.00 0.00 175.35 176.88 2r1b s ILE 148 N -0.30 4.29 0.27 2.17 -5.25 -1.26 -1.44 121.20 119.68 2r1b s ILE 148 Ca 0.01 1.71 -0.16 0.00 -0.99 0.00 0.00 60.65 61.21 2r1b s ILE 148 Cb -0.13 -3.99 0.01 0.00 2.95 0.00 0.00 42.46 41.30 2r1b s ILE 148 CO 0.02 0.18 0.60 -0.83 -1.79 0.00 0.00 174.94 173.13 2r1b s GLY 149 N -1.60 0.30 0.07 6.27 0.00 -0.33 -1.62 107.32 110.41 2r1b s GLY 149 Ca 0.48 -0.66 0.03 0.00 0.00 0.00 0.00 44.72 44.57 2r1b s GLY 149 CO 0.23 -0.39 -0.09 -1.34 0.00 0.00 0.00 173.10 171.51 2r1b s VAL 150 N -3.82 0.77 -0.01 1.40 -7.23 0.20 -1.48 120.40 110.22 2r1b s VAL 150 Ca 0.17 -1.38 0.02 0.00 -1.81 0.00 0.00 61.98 58.99 2r1b s VAL 150 Cb -0.03 -1.03 -0.01 0.00 0.56 0.00 0.00 36.38 35.87 2r1b s VAL 150 CO 0.09 -0.47 -0.08 -0.75 -0.31 0.00 0.00 175.10 173.58 2r1b s LYS 151 N -2.23 0.64 0.13 4.82 2.20 -0.77 -1.23 119.74 123.30 2r1b s LYS 151 Ca -0.02 -0.28 -0.11 0.00 -0.36 0.00 0.00 55.97 55.20 2r1b s LYS 151 Cb -0.06 -0.62 0.01 0.00 -1.51 0.00 0.00 37.83 35.65 2r1b s LYS 151 CO -0.00 0.17 0.29 -0.59 -0.36 0.00 0.00 175.35 174.86 2r1b s PHE 152 N -0.17 0.10 -0.09 4.03 -0.12 -0.14 -1.24 117.98 120.36 2r1b s PHE 152 Ca 0.03 -0.48 -0.04 0.00 -0.05 0.00 0.00 56.93 56.38 2r1b s PHE 152 Cb -0.03 0.06 0.04 0.00 -0.63 0.00 0.00 43.02 42.46 2r1b s PHE 152 CO -0.00 -0.66 0.20 1.21 -0.05 0.00 0.00 175.22 175.92 2r1b s ASN 153 N -2.88 -0.15 -0.01 1.98 3.84 -0.71 -0.96 114.94 116.07 2r1b s ASN 153 Ca 0.08 0.43 0.01 0.00 0.21 0.00 0.00 52.86 53.59 2r1b s ASN 153 Cb 0.03 0.32 0.01 0.00 -0.55 0.00 0.00 41.25 41.07 2r1b s ASN 153 CO -0.08 -0.16 0.98 1.33 -2.79 0.00 0.00 177.10 176.38 2r1b n VAL 154 N 4.30 0.99 0.00 -5.21 0.24 -1.26 -1.73 118.33 115.66 2r1b n VAL 154 Ca -0.25 -1.00 0.00 0.00 -2.04 0.00 0.00 64.34 61.05 2r1b n VAL 154 Cb 0.52 0.49 0.00 0.00 -1.47 0.00 0.00 33.84 33.38 2r1b n VAL 154 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2r1b n GLY 155 N -0.52 -0.04 0.00 7.63 0.00 -1.26 -4.19 105.19 106.82 2r1b n GLY 155 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2r1b n GLY 155 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2r1b n THR 156 N 0.00 0.00 -4.15 2.61 -1.04 -1.26 -4.96 114.28 105.48 2r1b n THR 156 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.78 2r1b n THR 156 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 2r1b n THR 156 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2r1b s ASP 157 N 0.86 5.31 0.27 8.00 -0.00 -1.26 -5.08 116.67 124.76 2r1b s ASP 157 Ca 0.00 -0.31 -0.29 0.00 -0.00 0.00 0.00 52.55 51.94 2r1b s ASP 157 Cb 0.00 -1.29 -0.09 0.00 -0.00 0.00 0.00 42.92 41.54 2r1b s ASP 157 CO 0.00 -0.01 1.23 -1.81 -0.00 0.00 0.00 175.17 174.59 2r1b s ASP 158 N -3.65 6.98 -0.04 0.27 1.11 -1.26 -4.65 116.67 115.42 2r1b s ASP 158 Ca 0.32 2.45 0.06 0.00 0.18 0.00 0.00 52.55 55.56 2r1b s ASP 158 Cb -0.08 -2.63 -0.01 0.00 1.07 0.00 0.00 42.92 41.27 2r1b s ASP 158 CO 0.23 -0.40 -0.24 -0.63 1.18 0.00 0.00 175.17 175.31 2r1b s ILE 159 N -0.73 1.99 -0.02 0.77 1.01 -0.13 -4.98 121.20 119.11 2r1b s ILE 159 Ca 0.50 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 60.14 2r1b s ILE 159 Cb -0.36 -1.67 -0.01 0.00 0.01 0.00 0.00 42.46 40.44 2r1b s ILE 159 CO 0.44 0.56 -0.11 0.00 0.00 0.00 0.00 174.94 175.82 2r1b s ALA 160 N -0.28 0.98 -0.02 9.38 0.00 -1.26 -0.96 121.76 129.59 2r1b s ALA 160 Ca 0.01 -0.47 0.01 0.00 0.00 0.00 0.00 51.96 51.50 2r1b s ALA 160 Cb -0.12 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.73 2r1b s ALA 160 CO 0.02 0.22 -0.01 0.42 0.00 0.00 0.00 175.76 176.40 2r1b s ILE 161 N -0.13 0.22 0.01 0.00 1.01 -0.37 -5.01 121.20 116.94 2r1b s ILE 161 Ca 0.02 -0.01 0.02 0.00 0.00 0.00 0.00 60.65 60.67 2r1b s ILE 161 Cb -0.06 -0.26 -0.01 0.00 0.01 0.00 0.00 42.46 42.14 2r1b s ILE 161 CO -0.00 0.12 -0.05 -0.70 0.00 0.00 0.00 174.94 174.30 2r1b s GLU 162 N 0.57 0.40 -0.99 2.79 2.12 -1.26 -0.63 118.70 121.70 2r1b s GLU 162 Ca -0.06 -0.37 -0.21 0.00 0.36 0.00 0.00 54.97 54.70 2r1b s GLU 162 Cb -0.09 -0.30 0.08 0.00 0.26 0.00 0.00 34.13 34.09 2r1b s GLU 162 CO -0.01 0.07 1.33 -2.00 -0.54 0.00 0.00 175.26 174.11 2r1b s GLU 163 N -0.63 3.61 0.00 4.30 2.56 -0.64 -4.87 118.70 123.03 2r1b s GLU 163 Ca -0.03 -1.42 0.26 0.00 0.00 0.00 0.00 54.97 53.78 2r1b s GLU 163 Cb -0.05 -5.18 1.26 0.00 2.00 0.00 0.00 34.13 32.16 2r1b s GLU 163 CO -0.00 -2.03 1.87 0.43 -0.56 0.00 0.00 175.26 174.97 2r1b n SER 164 N 7.89 0.00 -0.26 -1.70 7.64 -1.26 -3.89 113.62 122.03 2r1b n SER 164 Ca 0.30 0.08 0.08 0.00 1.01 0.00 0.00 58.87 60.34 2r1b n SER 164 Cb 0.50 -0.35 0.15 0.00 -1.01 0.00 0.00 64.21 63.50 2r1b n SER 164 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2r1b n ASN 165 N -1.35 2.66 -3.62 6.43 3.02 -1.26 -4.90 115.26 116.24 2r1b n ASN 165 Ca 0.11 -2.89 -0.25 0.00 -0.03 0.00 0.00 54.58 51.51 2r1b n ASN 165 Cb 0.24 -0.39 -0.17 0.00 -0.61 0.00 0.00 39.78 38.84 2r1b n ASN 165 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2r1b s ALA 166 N -2.55 0.42 -0.02 5.41 0.00 -1.25 -5.12 121.76 118.65 2r1b s ALA 166 Ca 0.30 -0.26 -0.30 0.00 0.00 0.00 0.00 51.96 51.70 2r1b s ALA 166 Cb 0.25 -0.99 -0.05 0.00 0.00 0.00 0.00 23.12 22.33 2r1b s ALA 166 CO 0.04 -1.10 1.33 0.42 0.00 0.00 0.00 175.76 176.46 2r1b s ILE 167 N 2.13 3.90 0.00 0.00 1.01 -1.26 -4.66 121.20 122.32 2r1b s ILE 167 Ca 0.02 1.27 0.00 0.00 0.00 0.00 0.00 60.65 61.94 2r1b s ILE 167 Cb -0.16 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.50 2r1b s ILE 167 CO -0.08 -0.00 0.77 2.30 0.00 0.00 0.00 174.94 177.92 2r1b n ILE 168 N 4.64 0.55 -1.39 2.92 -6.64 -0.39 -4.71 119.36 114.33 2r1b n ILE 168 Ca 0.12 -0.75 -0.28 0.00 -1.77 0.00 0.00 62.75 60.06 2r1b n ILE 168 Cb 0.45 0.74 0.01 0.00 -1.44 0.00 0.00 39.64 39.40 2r1b n ILE 168 CO 0.00 0.00 0.00 -0.46 -1.77 0.00 0.00 176.55 174.32 2r1b n ASN 169 N -0.27 6.93 -1.27 7.28 6.94 -1.25 -4.47 115.26 129.14 2r1b n ASN 169 Ca 0.00 -3.41 0.12 0.00 -0.02 0.00 0.00 54.58 51.27 2r1b n ASN 169 Cb 0.15 -1.11 0.29 0.00 -2.36 0.00 0.00 39.78 36.75 2r1b n ASN 169 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2r1b n ASP 170 N 0.11 3.73 0.00 0.53 5.75 -1.22 -4.41 116.55 121.04 2r1b n ASP 170 Ca 0.48 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 53.26 2r1b n ASP 170 Cb 0.52 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2r1b n ASP 170 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2r1b n GLY 171 N 1.60 0.44 3.88 6.12 0.00 -0.69 -4.96 105.19 111.57 2r1b n GLY 171 Ca 0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 2r1b n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r1b s LYS 172 N -0.39 2.93 0.15 1.61 1.02 -1.26 -4.68 119.74 119.11 2r1b s LYS 172 Ca 0.00 -1.12 -0.30 0.00 0.02 0.00 0.00 55.97 54.57 2r1b s LYS 172 Cb 0.00 -2.60 -0.07 0.00 -0.52 0.00 0.00 37.83 34.64 2r1b s LYS 172 CO 0.00 0.22 1.07 -0.47 -0.92 0.00 0.00 175.35 175.25 2r1b s TYR 173 N -2.20 3.64 0.10 3.18 5.04 -1.26 -4.46 117.35 121.39 2r1b s TYR 173 Ca 0.38 1.63 0.02 0.00 -2.44 0.00 0.00 57.07 56.66 2r1b s TYR 173 Cb -0.07 -3.23 -0.04 0.00 0.35 0.00 0.00 41.96 38.97 2r1b s TYR 173 CO 0.27 -0.45 -0.08 -1.01 -1.34 0.00 0.00 175.55 172.94 2r1b s HIS 174 N -0.06 0.93 0.04 4.97 3.76 -0.40 -5.00 115.29 119.54 2r1b s HIS 174 Ca 0.50 -0.81 0.09 0.00 -0.15 0.00 0.00 55.06 54.68 2r1b s HIS 174 Cb -0.28 -0.53 -0.03 0.00 1.11 0.00 0.00 32.58 32.86 2r1b s HIS 174 CO 0.33 -0.09 -0.24 0.14 -0.85 0.00 0.00 174.74 174.02 2r1b s VAL 175 N -3.15 1.97 -0.01 -0.90 -7.23 -1.26 -0.96 120.40 108.86 2r1b s VAL 175 Ca 0.09 -1.32 0.04 0.00 -1.81 0.00 0.00 61.98 58.98 2r1b s VAL 175 Cb 0.02 -1.69 -0.01 0.00 0.56 0.00 0.00 36.38 35.25 2r1b s VAL 175 CO -0.03 0.32 -0.13 0.54 -0.31 0.00 0.00 175.10 175.49 2r1b s VAL 176 N -0.80 1.02 -0.08 1.32 0.11 -0.68 -0.95 120.40 120.35 2r1b s VAL 176 Ca 0.10 -0.58 0.03 0.00 -2.93 0.00 0.00 61.98 58.60 2r1b s VAL 176 Cb -0.10 -0.86 0.01 0.00 -1.53 0.00 0.00 36.38 33.90 2r1b s VAL 176 CO 0.02 0.26 -0.17 -0.13 -3.33 0.00 0.00 175.10 171.75 2r1b s ARG 177 N -0.37 2.26 -0.02 1.54 0.52 -0.10 -2.33 118.95 120.44 2r1b s ARG 177 Ca 0.05 -0.62 0.04 0.00 -0.52 0.00 0.00 55.73 54.68 2r1b s ARG 177 Cb -0.05 -1.78 -0.01 0.00 0.52 0.00 0.00 34.95 33.63 2r1b s ARG 177 CO -0.00 0.11 -0.14 0.12 0.02 0.00 0.00 175.30 175.40 2r1b s PHE 178 N 0.47 1.37 0.08 -0.53 5.36 -0.04 -1.04 117.98 123.66 2r1b s PHE 178 Ca -0.15 -0.32 0.03 0.00 -0.96 0.00 0.00 56.93 55.53 2r1b s PHE 178 Cb -0.16 -0.91 -0.03 0.00 -0.34 0.00 0.00 43.02 41.57 2r1b s PHE 178 CO 0.06 -0.08 -0.09 0.95 -1.46 0.00 0.00 175.22 174.60 2r1b s THR 179 N -0.13 0.79 0.00 0.12 -4.23 -0.83 -1.37 115.64 110.00 2r1b s THR 179 Ca 0.01 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 2r1b s THR 179 Cb -0.08 -1.24 -0.00 0.00 1.34 0.00 0.00 72.50 72.52 2r1b s THR 179 CO 0.00 -0.57 -0.02 -0.60 -0.54 0.00 0.00 174.62 172.89 2r1b s ARG 180 N -2.69 0.14 -0.24 3.99 3.52 -0.64 -0.96 118.95 122.07 2r1b s ARG 180 Ca 0.03 -0.12 -0.04 0.00 -0.13 0.00 0.00 55.73 55.47 2r1b s ARG 180 Cb -0.03 -0.10 0.08 0.00 -1.56 0.00 0.00 34.95 33.35 2r1b s ARG 180 CO -0.01 0.02 0.12 -1.12 -0.81 0.00 0.00 175.30 173.50 2r1b s SER 181 N -0.19 2.95 1.58 -2.12 0.01 -0.50 -1.22 113.70 114.21 2r1b s SER 181 Ca -0.01 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.28 2r1b s SER 181 Cb -0.02 -0.27 0.00 0.00 0.21 0.00 0.00 66.02 65.95 2r1b s SER 181 CO -0.00 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 173.86 2r1b n GLY 182 N 5.27 3.35 0.10 3.44 0.00 -0.39 -1.60 105.19 115.36 2r1b n GLY 182 Ca -0.06 0.25 0.12 0.00 0.00 0.00 0.00 46.02 46.33 2r1b n GLY 182 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2r1b h GLY 183 N 0.00 0.00 -2.08 -0.02 0.00 -1.91 -3.47 103.07 95.60 2r1b h GLY 183 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 2r1b h GLY 183 CO 0.00 0.00 0.24 -1.31 0.00 0.00 0.00 176.54 175.47 2r1b s ASN 184 N -4.83 6.53 0.15 0.19 0.02 -0.63 -4.84 114.94 111.53 2r1b s ASN 184 Ca 0.05 1.32 -0.19 0.00 -1.02 0.00 0.00 52.86 53.01 2r1b s ASN 184 Cb 0.11 -2.40 0.05 0.00 0.02 0.00 0.00 41.25 39.03 2r1b s ASN 184 CO 0.71 -0.52 0.51 0.00 0.02 0.00 0.00 177.10 177.82 2r1b s ALA 185 N -2.55 -1.24 0.03 0.60 0.00 -0.79 -1.42 121.76 116.39 2r1b s ALA 185 Ca 0.54 0.17 -0.00 0.00 0.00 0.00 0.00 51.96 52.67 2r1b s ALA 185 Cb -0.10 0.80 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 2r1b s ALA 185 CO 0.34 -0.72 -0.03 0.95 0.00 0.00 0.00 175.76 176.29 2r1b s THR 186 N -3.79 0.17 -0.00 0.00 -4.23 -0.13 -0.73 115.64 106.92 2r1b s THR 186 Ca 0.03 -1.18 0.01 0.00 -1.18 0.00 0.00 61.69 59.37 2r1b s THR 186 Cb 0.00 -0.65 -0.00 0.00 1.34 0.00 0.00 72.50 73.19 2r1b s THR 186 CO -0.11 -0.64 -0.03 -0.22 -0.54 0.00 0.00 174.62 173.07 2r1b s LEU 187 N -1.90 1.97 -0.09 4.79 2.96 -0.61 -1.96 118.68 123.85 2r1b s LEU 187 Ca -0.09 -0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 53.72 2r1b s LEU 187 Cb -0.05 -0.18 0.05 0.00 0.50 0.00 0.00 46.19 46.51 2r1b s LEU 187 CO -0.04 0.04 0.18 -1.58 -1.32 0.00 0.00 176.35 173.63 2r1b s GLN 188 N -0.03 0.10 -0.16 1.98 0.74 -0.20 -1.16 119.66 120.92 2r1b s GLN 188 Ca 0.01 0.50 -0.05 0.00 0.05 0.00 0.00 55.36 55.86 2r1b s GLN 188 Cb -0.02 -0.18 -0.03 0.00 1.10 0.00 0.00 33.01 33.88 2r1b s GLN 188 CO -0.00 -0.22 0.01 0.08 -0.55 0.00 0.00 175.29 174.61 2r1b s VAL 189 N 1.67 4.33 0.00 1.34 1.01 -1.26 -0.93 120.40 126.57 2r1b s VAL 189 Ca -0.04 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2r1b s VAL 189 Cb -0.12 -2.92 0.00 0.00 0.00 0.00 0.00 36.38 33.34 2r1b s VAL 189 CO -0.07 0.48 0.00 0.47 0.00 0.00 0.00 175.10 175.99 2r1b n ASP 190 N 3.47 0.00 -1.03 3.32 8.00 -0.13 -1.91 116.55 128.28 2r1b n ASP 190 Ca -0.17 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.41 2r1b n ASP 190 Cb 0.52 0.00 0.27 0.00 -0.02 0.00 0.00 41.12 41.89 2r1b n ASP 190 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2r1b n SER 191 N 2.25 4.04 -4.72 -2.24 7.64 -1.26 -4.96 113.62 114.36 2r1b n SER 191 Ca 0.00 -2.82 -0.31 0.00 1.01 0.00 0.00 58.87 56.76 2r1b n SER 191 Cb 0.00 -0.52 0.13 0.00 -1.01 0.00 0.00 64.21 62.81 2r1b n SER 191 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2r1b s TRP 192 N -2.48 2.20 0.42 1.43 0.52 -0.80 -4.96 118.94 115.27 2r1b s TRP 192 Ca 0.42 1.55 -0.24 0.00 0.02 0.00 0.00 56.10 57.85 2r1b s TRP 192 Cb 0.32 -3.15 -0.11 0.00 -1.15 0.00 0.00 33.47 29.38 2r1b s TRP 192 CO 0.12 -2.29 0.96 -2.30 0.02 0.00 0.00 176.95 173.46 2r1b n PRO 193 N -3.85 1.25 -2.09 4.98 -0.02 -1.26 -4.64 135.00 129.36 2r1b n PRO 193 Ca 0.09 0.45 -0.41 0.00 -2.02 0.00 0.00 63.50 61.61 2r1b n PRO 193 Cb 0.53 -1.98 -0.03 0.00 -0.02 0.00 0.00 33.50 32.00 2r1b n PRO 193 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2r1b s VAL 194 N -1.29 2.87 -0.26 -1.45 1.01 -1.26 -4.77 120.40 115.25 2r1b s VAL 194 Ca 0.63 0.73 -0.14 0.00 0.00 0.00 0.00 61.98 63.21 2r1b s VAL 194 Cb -0.56 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2r1b s VAL 194 CO 0.57 0.11 0.31 -0.63 0.00 0.00 0.00 175.10 175.46 2r1b s ILE 195 N 0.05 5.23 -0.13 2.22 1.01 -0.31 -4.97 121.20 124.30 2r1b s ILE 195 Ca 0.58 0.45 -0.03 0.00 0.00 0.00 0.00 60.65 61.66 2r1b s ILE 195 Cb -0.40 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.40 2r1b s ILE 195 CO 0.41 0.21 -0.03 -1.61 0.00 0.00 0.00 174.94 173.92 2r1b s GLU 196 N 1.79 3.42 -0.08 2.79 2.02 -1.26 -1.58 118.70 125.80 2r1b s GLU 196 Ca 0.13 -0.49 0.04 0.00 0.02 0.00 0.00 54.97 54.67 2r1b s GLU 196 Cb -0.15 -2.86 -0.00 0.00 0.10 0.00 0.00 34.13 31.22 2r1b s GLU 196 CO 0.09 0.40 -0.23 0.50 0.02 0.00 0.00 175.26 176.04 2r1b s ARG 197 N -0.06 2.77 0.27 1.61 3.52 0.09 -5.02 118.95 122.13 2r1b s ARG 197 Ca 0.02 -0.83 0.06 0.00 -0.13 0.00 0.00 55.73 54.85 2r1b s ARG 197 Cb -0.13 -2.16 -0.03 0.00 -1.56 0.00 0.00 34.95 31.07 2r1b s ARG 197 CO 0.02 0.22 0.32 1.52 -0.81 0.00 0.00 175.30 176.57 2r1b s TYR 198 N 0.24 3.25 0.00 5.12 -0.85 -1.26 -1.89 117.35 121.96 2r1b s TYR 198 Ca -0.14 -0.10 0.00 0.00 -0.52 0.00 0.00 57.07 56.30 2r1b s TYR 198 Cb -0.17 -1.60 0.00 0.00 0.38 0.00 0.00 41.96 40.57 2r1b s TYR 198 CO 0.07 0.37 0.00 -0.35 -1.52 0.00 0.00 175.55 174.12 2r1b n PRO 216 N -1.37 0.00 0.00 -3.49 -0.05 -1.26 -4.77 135.00 124.06 2r1b n PRO 216 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.38 2r1b n PRO 216 Cb 0.58 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 34.03 2r1b n PRO 216 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 175.50 177.93 2r1b n TYR 217 N 0.00 0.00 0.10 0.54 -0.00 -1.26 -5.04 117.16 111.50 2r1b n TYR 217 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.90 57.75 2r1b n TYR 217 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 39.34 39.25 2r1b n TYR 217 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.86 176.77 2r1b h ARG 218 N 0.00 -0.67 -0.53 -3.48 2.43 -2.06 -2.55 114.38 107.51 2r1b h ARG 218 Ca 0.00 0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2r1b h ARG 218 Cb 0.00 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 2r1b h ARG 218 CO 0.00 -0.45 0.23 1.25 -1.51 0.00 0.00 179.97 179.49 2r1b h LEU 219 N -0.70 0.73 -0.95 3.80 5.85 -2.00 -2.25 115.31 119.78 2r1b h LEU 219 Ca -0.00 -0.16 0.09 0.00 0.84 0.00 0.00 57.88 58.65 2r1b h LEU 219 Cb 0.71 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.47 2r1b h LEU 219 CO -0.28 0.69 0.59 1.23 -0.34 0.00 0.00 178.44 180.34 2r1b h GLY 220 N 0.72 1.50 0.83 3.75 0.00 -1.94 -1.97 103.07 105.96 2r1b h GLY 220 Ca 0.18 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 2r1b h GLY 220 CO -0.02 0.22 0.02 0.07 0.00 0.00 0.00 176.54 176.83 2r1b h ARG 221 N 1.01 0.09 -0.25 4.80 -0.00 -0.99 -1.34 114.38 117.70 2r1b h ARG 221 Ca 0.44 -0.02 0.03 0.00 -0.00 0.00 0.00 59.98 60.43 2r1b h ARG 221 Cb 0.33 -0.01 -0.03 0.00 -0.00 0.00 0.00 29.97 30.26 2r1b h ARG 221 CO -0.22 0.25 0.08 0.28 -0.00 0.00 0.00 179.97 180.36 2r1b h VAL 222 N -0.09 0.92 -0.36 0.08 2.07 -1.20 -1.51 116.25 116.16 2r1b h VAL 222 Ca 0.02 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 2r1b h VAL 222 Cb 0.20 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2r1b h VAL 222 CO -0.00 0.03 0.08 0.58 0.02 0.00 0.00 177.57 178.29 2r1b h VAL 223 N 0.19 1.23 -0.99 2.57 2.07 -1.36 -0.62 116.25 119.34 2r1b h VAL 223 Ca 0.11 -0.78 0.06 0.00 0.82 0.00 0.00 66.70 66.92 2r1b h VAL 223 Cb 0.09 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 30.83 2r1b h VAL 223 CO -0.12 0.26 0.64 0.44 0.02 0.00 0.00 177.57 178.81 2r1b h ASP 224 N 0.44 1.03 0.08 0.57 3.32 -1.06 -0.09 116.42 120.70 2r1b h ASP 224 Ca 0.11 0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.02 2r1b h ASP 224 Cb 0.31 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2r1b h ASP 224 CO 0.00 0.67 -0.51 -0.33 -1.72 0.00 0.00 179.24 177.35 2r1b h GLU 225 N 1.17 0.48 -0.71 3.56 4.39 -1.02 -1.07 114.58 121.38 2r1b h GLU 225 Ca 0.42 -0.28 -0.07 0.00 0.34 0.00 0.00 59.36 59.77 2r1b h GLU 225 Cb 0.13 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 2r1b h GLU 225 CO -0.16 0.87 0.17 -1.49 -1.16 0.00 0.00 179.01 177.24 2r1b h TRP 226 N 0.38 1.20 -0.41 4.33 6.55 -0.53 0.64 115.95 128.11 2r1b h TRP 226 Ca 0.02 -0.14 -0.12 0.00 0.95 0.00 0.00 58.89 59.59 2r1b h TRP 226 Cb 1.02 -0.34 -0.01 0.00 -0.86 0.00 0.00 29.16 28.97 2r1b h TRP 226 CO 0.04 0.97 -0.23 1.25 -1.05 0.00 0.00 178.44 179.41 2r1b h LEU 227 N 1.08 0.85 -0.74 -4.49 5.85 -0.88 -1.93 115.31 115.05 2r1b h LEU 227 Ca 0.22 -0.32 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 2r1b h LEU 227 Cb 0.38 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2r1b h LEU 227 CO 0.00 1.05 -0.05 -0.07 -0.34 0.00 0.00 178.44 179.03 2r1b h LEU 228 N 0.72 0.89 -0.58 2.25 3.38 -0.99 -2.84 115.31 118.14 2r1b h LEU 228 Ca 0.09 -0.25 0.04 0.00 0.09 0.00 0.00 57.88 57.85 2r1b h LEU 228 Cb 0.77 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 2r1b h LEU 228 CO 0.06 0.98 0.33 -0.78 0.09 0.00 0.00 178.44 179.12 2r1b h ASP 229 N 0.83 0.49 0.12 -0.43 1.82 -0.68 -0.58 116.42 118.00 2r1b h ASP 229 Ca 0.15 0.02 0.02 0.00 -0.39 0.00 0.00 57.03 56.82 2r1b h ASP 229 Cb 0.56 -0.08 -0.03 0.00 0.68 0.00 0.00 39.33 40.47 2r1b h ASP 229 CO 0.03 0.33 -0.22 0.50 -1.61 0.00 0.00 179.24 178.28 2r1b h LYS 230 N 0.62 -0.40 0.00 0.28 3.64 -1.22 -2.96 116.57 116.54 2r1b h LYS 230 Ca 0.25 0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.57 2r1b h LYS 230 Cb 0.12 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 2r1b h LYS 230 CO -0.15 -0.26 -0.41 0.78 -2.27 0.00 0.00 179.45 177.14 2r1b h GLY 231 N -0.41 0.00 1.93 5.01 0.00 -1.22 -2.84 103.07 105.54 2r1b h GLY 231 Ca 0.03 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.31 2r1b h GLY 231 CO -0.12 0.00 -0.21 3.21 0.00 0.00 0.00 176.54 179.42 2r1b h ARG 232 N 0.00 0.08 -0.01 4.80 3.08 -0.97 -2.73 114.38 118.65 2r1b h ARG 232 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2r1b h ARG 232 Cb 0.74 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.78 2r1b h ARG 232 CO 0.05 0.29 0.01 1.96 -1.07 0.00 0.00 179.97 181.22 2r1b h GLN 233 N 0.08 0.00 0.00 0.04 1.08 -1.35 -1.64 115.11 113.32 2r1b h GLN 233 Ca 0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2r1b h GLN 233 Cb 0.41 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 2r1b h GLN 233 CO 0.03 0.00 0.00 1.28 -0.95 0.00 0.00 178.83 179.19 2r1b n LEU 234 N -3.57 0.37 -0.55 1.46 4.77 -1.03 -2.16 117.00 116.30 2r1b n LEU 234 Ca -0.03 0.61 0.06 0.00 -0.03 0.00 0.00 56.01 56.62 2r1b n LEU 234 Cb 0.09 -0.58 0.15 0.00 -2.33 0.00 0.00 43.42 40.75 2r1b n LEU 234 CO 0.25 -0.51 0.38 0.35 -1.33 0.00 0.00 177.39 176.53 2r1b n THR 235 N -1.92 1.64 -5.15 -5.08 -2.24 -0.62 -4.05 114.28 96.86 2r1b n THR 235 Ca 0.02 -2.39 -0.30 0.00 -2.27 0.00 0.00 64.05 59.11 2r1b n THR 235 Cb 0.16 -0.02 -0.16 0.00 -2.10 0.00 0.00 70.33 68.22 2r1b n THR 235 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2r1b s ILE 236 N -2.44 1.98 -0.76 2.28 1.01 -0.92 -4.26 121.20 118.10 2r1b s ILE 236 Ca 0.33 -1.13 -0.21 0.00 0.00 0.00 0.00 60.65 59.63 2r1b s ILE 236 Cb 0.31 -1.66 0.09 0.00 0.01 0.00 0.00 42.46 41.22 2r1b s ILE 236 CO -0.05 0.50 1.03 0.12 0.00 0.00 0.00 174.94 176.54 2r1b s PHE 237 N -0.64 2.81 0.18 3.97 2.19 0.12 -4.79 117.98 121.82 2r1b s PHE 237 Ca 0.10 -0.83 -0.28 0.00 0.33 0.00 0.00 56.93 56.25 2r1b s PHE 237 Cb -0.10 -4.30 -0.08 0.00 -1.31 0.00 0.00 43.02 37.23 2r1b s PHE 237 CO -0.00 -1.61 0.86 -0.80 1.83 0.00 0.00 175.22 175.50 2r1b s ASN 238 N 3.73 7.50 -1.20 6.13 -0.87 -1.26 -1.87 114.94 127.10 2r1b s ASN 238 Ca 0.26 1.77 -0.05 0.00 -1.57 0.00 0.00 52.86 53.27 2r1b s ASN 238 Cb -0.13 -2.55 -0.02 0.00 -0.02 0.00 0.00 41.25 38.53 2r1b s ASN 238 CO 0.03 0.14 0.82 -0.24 -2.57 0.00 0.00 177.10 175.28 2r1b n SER 239 N 1.77 -3.41 -4.71 -1.22 2.88 -1.08 -4.61 113.62 103.25 2r1b n SER 239 Ca -0.03 -0.80 -0.42 0.00 -1.33 0.00 0.00 58.87 56.29 2r1b n SER 239 Cb 0.48 -4.38 -0.03 0.00 -0.75 0.00 0.00 64.21 59.53 2r1b n SER 239 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2r1b s GLN 240 N -5.49 4.19 -0.03 -1.46 -0.21 -0.14 -1.23 119.66 115.29 2r1b s GLN 240 Ca 0.20 2.42 0.01 0.00 0.02 0.00 0.00 55.36 58.01 2r1b s GLN 240 Cb -0.05 -3.32 -0.03 0.00 1.00 0.00 0.00 33.01 30.62 2r1b s GLN 240 CO 0.79 -0.69 -0.01 0.00 -2.12 0.00 0.00 175.29 173.26 2r1b n ALA 241 N 4.64 1.94 -3.08 6.09 0.00 -0.05 -4.02 120.51 126.02 2r1b n ALA 241 Ca 0.15 -0.15 -0.11 0.00 0.00 0.00 0.00 53.44 53.34 2r1b n ALA 241 Cb 0.39 0.32 -0.10 0.00 0.00 0.00 0.00 19.45 20.06 2r1b n ALA 241 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2r1b s THR 242 N -2.06 0.09 -0.22 0.00 -4.23 -1.15 -2.74 115.64 105.32 2r1b s THR 242 Ca -0.03 -0.73 -0.01 0.00 -1.18 0.00 0.00 61.69 59.74 2r1b s THR 242 Cb 0.01 -0.39 0.02 0.00 1.34 0.00 0.00 72.50 73.47 2r1b s THR 242 CO 0.09 -0.40 -0.10 -0.63 -0.54 0.00 0.00 174.62 173.04 2r1b s ILE 243 N -1.38 2.75 -0.16 2.99 1.01 -0.28 -2.22 121.20 123.91 2r1b s ILE 243 Ca -0.15 -0.87 -0.00 0.00 0.00 0.00 0.00 60.65 59.63 2r1b s ILE 243 Cb -0.08 -2.30 0.00 0.00 0.01 0.00 0.00 42.46 40.09 2r1b s ILE 243 CO 0.01 0.35 -0.15 -0.63 0.00 0.00 0.00 174.94 174.53 2r1b s ILE 244 N 1.35 2.65 -0.14 2.92 1.01 -0.11 -0.85 121.20 128.03 2r1b s ILE 244 Ca 0.03 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.90 2r1b s ILE 244 Cb -0.15 -2.13 -0.02 0.00 0.01 0.00 0.00 42.46 40.18 2r1b s ILE 244 CO -0.07 0.51 -0.11 -0.63 0.00 0.00 0.00 174.94 174.64 2r1b s ILE 245 N 0.93 3.21 0.00 2.92 1.01 -0.25 -1.15 121.20 127.87 2r1b s ILE 245 Ca -0.03 -0.60 0.00 0.00 0.00 0.00 0.00 60.65 60.02 2r1b s ILE 245 Cb -0.15 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 39.96 2r1b s ILE 245 CO -0.02 0.51 0.00 0.61 0.00 0.00 0.00 174.94 176.04 2r1b n GLY 246 N 3.60 1.74 3.42 6.18 0.00 -0.48 -1.84 105.19 117.82 2r1b n GLY 246 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2r1b n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1b n GLY 247 N 0.00 0.76 0.24 -0.02 0.00 -1.16 -0.59 105.19 104.42 2r1b n GLY 247 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2r1b n GLY 247 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2r1b h LYS 248 N 1.79 0.78 -0.02 1.61 3.64 -1.79 -1.61 116.57 120.97 2r1b h LYS 248 Ca 0.00 -0.21 -0.04 0.00 -1.27 0.00 0.00 60.65 59.14 2r1b h LYS 248 Cb 0.00 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2r1b h LYS 248 CO 0.00 0.79 -0.16 1.49 -2.27 0.00 0.00 179.45 179.30 2r1b h GLU 249 N 0.65 0.03 -0.09 1.90 4.81 -1.93 -1.10 114.58 118.86 2r1b h GLU 249 Ca 0.14 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2r1b h GLU 249 Cb 0.38 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2r1b h GLU 249 CO 0.01 0.19 0.00 1.04 -0.73 0.00 0.00 179.01 179.52 2r1b n GLN 250 N -4.34 1.35 -0.99 1.92 3.00 -1.04 -4.94 117.38 112.34 2r1b n GLN 250 Ca -0.02 -0.53 0.00 0.00 -0.01 0.00 0.00 57.00 56.44 2r1b n GLN 250 Cb 0.23 -1.32 0.00 0.00 0.00 0.00 0.00 30.24 29.15 2r1b n GLN 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2r1b n GLY 251 N 0.93 0.40 2.36 1.08 0.00 -0.42 -4.96 105.19 104.59 2r1b n GLY 251 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 2r1b n GLY 251 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2r1b n GLN 252 N -2.04 1.67 -1.94 1.61 6.02 -0.63 -5.02 117.38 117.05 2r1b n GLN 252 Ca 0.00 -3.94 -0.41 0.00 -0.01 0.00 0.00 57.00 52.64 2r1b n GLN 252 Cb 0.11 -1.76 -0.02 0.00 1.02 0.00 0.00 30.24 29.59 2r1b n GLN 252 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2r1b s PRO 253 N -2.08 4.22 0.24 -1.09 0.04 -1.22 -1.43 135.00 133.68 2r1b s PRO 253 Ca 0.39 2.39 -0.30 0.00 0.04 0.00 0.00 61.00 63.53 2r1b s PRO 253 Cb 0.20 -3.06 -0.09 0.00 0.04 0.00 0.00 34.50 31.59 2r1b s PRO 253 CO -0.08 -0.46 1.01 0.12 0.04 0.00 0.00 177.00 177.64 2r1b s PHE 254 N -0.31 3.81 -0.10 0.56 5.36 0.24 -4.79 117.98 122.76 2r1b s PHE 254 Ca 0.58 1.82 0.00 0.00 -0.96 0.00 0.00 56.93 58.37 2r1b s PHE 254 Cb -0.44 -3.11 0.02 0.00 -0.34 0.00 0.00 43.02 39.16 2r1b s PHE 254 CO 0.48 0.03 -0.09 -0.65 -1.46 0.00 0.00 175.22 173.53 2r1b s GLN 255 N -1.15 1.64 0.00 10.12 -0.21 -1.26 -4.65 119.66 124.15 2r1b s GLN 255 Ca 0.43 -0.32 0.00 0.00 0.02 0.00 0.00 55.36 55.49 2r1b s GLN 255 Cb -0.28 -1.57 0.00 0.00 1.00 0.00 0.00 33.01 32.16 2r1b s GLN 255 CO 0.35 -0.18 0.00 0.41 -2.12 0.00 0.00 175.29 173.75 2r1b n GLY 256 N 4.60 0.44 3.30 3.09 0.00 -0.60 -4.53 105.19 111.49 2r1b n GLY 256 Ca -0.16 -1.61 -0.29 0.00 0.00 0.00 0.00 46.02 43.96 2r1b n GLY 256 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r1b s GLN 257 N -2.00 1.81 -0.01 1.61 -0.21 -0.90 -0.89 119.66 119.07 2r1b s GLN 257 Ca 0.00 -0.97 0.05 0.00 0.02 0.00 0.00 55.36 54.46 2r1b s GLN 257 Cb 0.00 -1.87 -0.01 0.00 1.00 0.00 0.00 33.01 32.13 2r1b s GLN 257 CO 0.00 0.50 -0.17 -0.51 -2.12 0.00 0.00 175.29 172.99 2r1b s LEU 258 N -0.92 2.03 0.14 2.90 1.43 -0.68 -1.84 118.68 121.73 2r1b s LEU 258 Ca 0.10 -0.30 -0.09 0.00 -1.03 0.00 0.00 54.13 52.81 2r1b s LEU 258 Cb -0.09 -0.86 -0.01 0.00 0.03 0.00 0.00 46.19 45.26 2r1b s LEU 258 CO 0.01 0.20 0.25 -0.94 0.23 0.00 0.00 176.35 176.10 2r1b s SER 259 N -0.39 0.07 -1.39 2.29 1.04 -0.63 -1.45 113.70 113.24 2r1b s SER 259 Ca 0.06 -0.79 -0.07 0.00 0.48 0.00 0.00 55.95 55.63 2r1b s SER 259 Cb -0.06 0.40 0.05 0.00 0.10 0.00 0.00 66.02 66.50 2r1b s SER 259 CO -0.01 -0.83 0.54 0.61 0.98 0.00 0.00 173.24 174.53 2r1b n GLY 260 N -0.16 -0.50 3.72 7.32 0.00 -1.19 -1.37 105.19 113.01 2r1b n GLY 260 Ca -0.10 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2r1b n GLY 260 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2r1b s LEU 261 N -6.56 4.38 -0.04 0.99 2.96 -1.26 -4.48 118.68 114.67 2r1b s LEU 261 Ca 0.36 2.43 0.02 0.00 -0.22 0.00 0.00 54.13 56.73 2r1b s LEU 261 Cb -0.18 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 42.92 2r1b s LEU 261 CO 0.44 -0.68 -0.10 -0.47 -1.32 0.00 0.00 176.35 174.23 2r1b s TYR 262 N 0.87 1.08 -0.20 5.38 5.04 -0.21 -2.95 117.35 126.35 2r1b s TYR 262 Ca 0.64 -0.30 -0.04 0.00 -2.44 0.00 0.00 57.07 54.92 2r1b s TYR 262 Cb -0.39 -0.79 0.08 0.00 0.35 0.00 0.00 41.96 41.22 2r1b s TYR 262 CO 0.33 -0.15 0.17 -0.47 -1.34 0.00 0.00 175.55 174.09 2r1b s TYR 263 N 0.34 -0.05 -1.56 4.97 5.04 -0.69 -1.82 117.35 123.58 2r1b s TYR 263 Ca -0.06 -0.10 -0.12 0.00 -2.44 0.00 0.00 57.07 54.34 2r1b s TYR 263 Cb -0.11 -0.54 0.09 0.00 0.35 0.00 0.00 41.96 41.75 2r1b s TYR 263 CO 0.01 -0.60 0.82 0.09 -1.34 0.00 0.00 175.55 174.53 2r1b n ASN 264 N 5.30 -3.39 0.00 4.32 3.02 -0.77 -1.85 115.26 121.89 2r1b n ASN 264 Ca -0.06 -0.89 0.00 0.00 -0.03 0.00 0.00 54.58 53.60 2r1b n ASN 264 Cb 0.49 -3.41 0.00 0.00 -0.61 0.00 0.00 39.78 36.24 2r1b n ASN 264 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2r1b n GLY 265 N -1.62 0.44 3.52 7.41 0.00 -1.26 -5.07 105.19 108.61 2r1b n GLY 265 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 2r1b n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r1b s LEU 266 N 0.00 3.64 -1.04 0.99 1.43 -0.77 -5.04 118.68 117.89 2r1b s LEU 266 Ca 0.00 -0.10 -0.16 0.00 -1.03 0.00 0.00 54.13 52.84 2r1b s LEU 266 Cb 0.00 -1.97 0.16 0.00 0.03 0.00 0.00 46.19 44.42 2r1b s LEU 266 CO 0.00 0.02 1.21 -0.54 0.23 0.00 0.00 176.35 177.27 2r1b s LYS 267 N 1.32 3.83 0.23 1.70 1.02 -1.26 -1.69 119.74 124.89 2r1b s LYS 267 Ca 0.05 -2.24 -0.05 0.00 0.02 0.00 0.00 55.97 53.76 2r1b s LYS 267 Cb -0.15 -4.91 0.23 0.00 -0.52 0.00 0.00 37.83 32.48 2r1b s LYS 267 CO 0.04 -1.69 1.71 0.28 -0.92 0.00 0.00 175.35 174.77 2r1b h VAL 268 N 5.14 1.25 -0.22 3.17 2.07 -1.92 -1.84 116.25 123.90 2r1b h VAL 268 Ca 0.22 -1.07 -0.11 0.00 0.82 0.00 0.00 66.70 66.55 2r1b h VAL 268 Cb 0.96 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 2r1b h VAL 268 CO 1.12 0.38 -0.34 -0.07 0.02 0.00 0.00 177.57 178.69 2r1b h LEU 269 N 0.84 0.49 -0.67 2.57 3.38 -1.91 -1.64 115.31 118.36 2r1b h LEU 269 Ca 0.16 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2r1b h LEU 269 Cb 0.50 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2r1b h LEU 269 CO 0.02 0.79 0.15 -1.13 0.09 0.00 0.00 178.44 178.37 2r1b h ASN 270 N 0.40 1.03 -0.85 -0.43 -0.73 -1.74 -2.00 115.58 111.26 2r1b h ASN 270 Ca 0.05 -0.24 0.00 0.00 1.87 0.00 0.00 56.30 57.98 2r1b h ASN 270 Cb 0.79 -0.27 -0.04 0.00 0.27 0.00 0.00 38.32 39.06 2r1b h ASN 270 CO 0.06 1.00 0.55 0.24 -0.37 0.00 0.00 177.43 178.91 2r1b h MET 271 N 1.01 1.13 -0.26 6.67 2.86 -1.08 -1.87 114.93 123.40 2r1b h MET 271 Ca 0.21 -0.08 0.03 0.00 -2.06 0.00 0.00 59.70 57.80 2r1b h MET 271 Cb 0.38 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 2r1b h MET 271 CO 0.00 0.77 0.08 0.00 1.06 0.00 0.00 176.91 178.82 2r1b h ALA 272 N 1.30 0.29 0.00 6.32 0.00 -1.04 -1.76 119.26 124.36 2r1b h ALA 272 Ca 0.31 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2r1b h ALA 272 Cb -0.10 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2r1b h ALA 272 CO -0.06 -0.34 -0.07 0.00 0.00 0.00 0.00 179.25 178.78 2r1b h ALA 273 N 1.18 1.29 -0.58 0.00 0.00 -0.95 -2.48 119.26 117.71 2r1b h ALA 273 Ca 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2r1b h ALA 273 Cb 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2r1b h ALA 273 CO -0.14 0.08 0.00 0.39 0.00 0.00 0.00 179.25 179.59 2r1b n GLU 274 N -3.58 3.51 -3.67 0.00 1.02 -0.74 -4.96 120.64 112.22 2r1b n GLU 274 Ca -0.02 -2.58 -0.23 0.00 -0.02 0.00 0.00 57.16 54.30 2r1b n GLU 274 Cb 0.18 -1.85 0.05 0.00 -0.02 0.00 0.00 31.44 29.80 2r1b n GLU 274 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2r1b n ASN 275 N 0.98 -3.27 -4.70 1.62 3.02 -0.93 -4.94 115.26 107.03 2r1b n ASN 275 Ca 0.23 -0.71 -0.41 0.00 -0.03 0.00 0.00 54.58 53.66 2r1b n ASN 275 Cb 0.83 -4.44 0.01 0.00 -0.61 0.00 0.00 39.78 35.56 2r1b n ASN 275 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2r1b n ASP 276 N -3.01 2.68 0.19 6.41 -0.08 -0.69 -4.89 116.55 117.15 2r1b n ASP 276 Ca -0.15 1.14 0.04 0.00 -1.51 0.00 0.00 54.79 54.31 2r1b n ASP 276 Cb 0.62 -1.50 0.46 0.00 2.34 0.00 0.00 41.12 43.04 2r1b n ASP 276 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2r1b h ALA 277 N 2.25 1.64 -0.43 -1.67 0.00 -1.92 -2.88 119.26 116.25 2r1b h ALA 277 Ca -0.48 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2r1b h ALA 277 Cb 1.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2r1b h ALA 277 CO 0.61 0.27 0.00 0.09 0.00 0.00 0.00 179.25 180.22 2r1b n ASN 278 N -4.31 2.54 -4.49 0.00 4.13 -1.26 -4.90 115.26 106.96 2r1b n ASN 278 Ca -0.02 -2.07 -0.33 0.00 1.68 0.00 0.00 54.58 53.84 2r1b n ASN 278 Cb 0.25 -0.33 -0.13 0.00 -1.54 0.00 0.00 39.78 38.03 2r1b n ASN 278 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2r1b s ILE 279 N -1.49 3.21 -0.02 2.41 -1.09 -1.09 -1.62 121.20 121.51 2r1b s ILE 279 Ca 0.30 -0.67 0.05 0.00 -2.23 0.00 0.00 60.65 58.10 2r1b s ILE 279 Cb 0.16 -2.27 -0.01 0.00 -1.58 0.00 0.00 42.46 38.76 2r1b s ILE 279 CO 0.19 0.59 -0.17 0.00 -1.23 0.00 0.00 174.94 174.31 2r1b s ALA 280 N -0.69 1.45 -0.11 9.38 0.00 -0.50 -4.92 121.76 126.38 2r1b s ALA 280 Ca 0.10 -0.74 0.03 0.00 0.00 0.00 0.00 51.96 51.36 2r1b s ALA 280 Cb -0.11 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.63 2r1b s ALA 280 CO 0.01 0.35 -0.23 0.42 0.00 0.00 0.00 175.76 176.31 2r1b s ILE 281 N -0.36 2.14 0.04 0.00 1.01 -1.26 -0.95 121.20 121.81 2r1b s ILE 281 Ca 0.06 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.73 2r1b s ILE 281 Cb -0.07 -1.83 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 2r1b s ILE 281 CO -0.00 0.56 -0.06 0.68 0.00 0.00 0.00 174.94 176.11 2r1b s VAL 282 N 0.43 0.43 0.00 2.92 -7.23 -0.72 -5.03 120.40 111.20 2r1b s VAL 282 Ca -0.16 -1.15 0.00 0.00 -1.81 0.00 0.00 61.98 58.85 2r1b s VAL 282 Cb -0.17 -0.67 0.00 0.00 0.56 0.00 0.00 36.38 36.10 2r1b s VAL 282 CO 0.07 -0.49 0.00 0.61 -0.31 0.00 0.00 175.10 174.98 2r1b n GLY 283 N 1.29 -1.29 2.96 2.32 0.00 -1.26 -1.23 105.19 107.98 2r1b n GLY 283 Ca -0.22 -1.32 -0.43 0.00 0.00 0.00 0.00 46.02 44.06 2r1b n GLY 283 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2r1b n ASN 284 N 0.20 5.15 -3.98 1.61 2.85 -0.68 -4.88 115.26 115.51 2r1b n ASN 284 Ca 0.00 -3.10 -0.25 0.00 -0.11 0.00 0.00 54.58 51.12 2r1b n ASN 284 Cb 0.00 -1.49 -0.17 0.00 1.24 0.00 0.00 39.78 39.37 2r1b n ASN 284 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2r1b s VAL 285 N 0.47 1.08 -0.02 3.44 1.01 -1.26 -2.19 120.40 122.93 2r1b s VAL 285 Ca 0.40 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.99 2r1b s VAL 285 Cb 0.08 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.43 2r1b s VAL 285 CO 0.01 0.35 -0.08 -0.13 0.00 0.00 0.00 175.10 175.25 2r1b s ARG 286 N 1.01 0.87 -0.14 2.72 0.52 -0.56 -4.98 118.95 118.39 2r1b s ARG 286 Ca -0.08 -0.27 -0.29 0.00 -0.52 0.00 0.00 55.73 54.57 2r1b s ARG 286 Cb -0.15 -0.82 -0.01 0.00 0.52 0.00 0.00 34.95 34.49 2r1b s ARG 286 CO -0.00 0.09 1.10 -1.17 0.02 0.00 0.00 175.30 175.33 2r1b s LEU 287 N 0.23 4.20 -0.04 2.53 2.96 -1.26 -1.16 118.68 126.14 2r1b s LEU 287 Ca -0.03 1.58 -0.30 0.00 -0.22 0.00 0.00 54.13 55.15 2r1b s LEU 287 Cb -0.08 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.02 2r1b s LEU 287 CO 0.00 -0.58 1.25 -0.69 -1.32 0.00 0.00 176.35 175.01 2r1b s VAL 288 N 2.59 4.13 1.14 1.68 1.01 -0.51 -4.98 120.40 125.46 2r1b s VAL 288 Ca 0.50 1.47 -0.19 0.00 0.00 0.00 0.00 61.98 63.76 2r1b s VAL 288 Cb -0.19 -3.94 0.29 0.00 0.00 0.00 0.00 36.38 32.53 2r1b s VAL 288 CO 0.15 -0.00 0.81 0.61 0.00 0.00 0.00 175.10 176.67 2r1b n GLY 289 N 3.43 -3.40 3.86 4.51 0.00 -1.26 -4.69 105.19 107.65 2r1b n GLY 289 Ca 0.11 -1.37 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 2r1b n GLY 289 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r1b s GLU 290 N -4.89 3.89 0.40 1.61 0.41 -1.26 -5.05 118.70 113.82 2r1b s GLU 290 Ca 0.57 0.45 -0.27 0.00 -0.41 0.00 0.00 54.97 55.32 2r1b s GLU 290 Cb -0.08 -2.56 -0.09 0.00 -1.78 0.00 0.00 34.13 29.62 2r1b s GLU 290 CO 0.46 0.25 1.36 0.08 -0.49 0.00 0.00 175.26 176.93 2r1b s VAL 291 N -1.88 2.41 -1.41 2.63 1.01 -1.26 -4.84 120.40 117.06 2r1b s VAL 291 Ca 0.50 0.38 0.02 0.00 0.00 0.00 0.00 61.98 62.88 2r1b s VAL 291 Cb -0.11 -3.23 0.04 0.00 0.00 0.00 0.00 36.38 33.08 2r1b s VAL 291 CO 0.19 0.07 0.89 -0.81 0.00 0.00 0.00 175.10 175.44 2r1b n PRO 292 N 0.22 0.03 0.00 2.72 -0.04 -1.26 -4.84 135.00 131.84 2r1b n PRO 292 Ca 0.03 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.76 2r1b n PRO 292 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 2r1b n PRO 292 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2r1b n SER 293 N -1.30 0.00 0.00 3.54 3.41 -1.26 -5.36 113.62 112.65 2r1b n SER 293 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2r1b n SER 293 Cb 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 2r1b n SER 293 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64