#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d3r n ASP 2 N 0.00 -4.15 -4.75 0.00 8.00 -1.26 -5.10 116.55 109.29 2d3r n ASP 2 Ca 0.00 0.11 -0.42 0.00 0.71 0.00 0.00 54.79 55.20 2d3r n ASP 2 Cb 0.00 -2.59 -0.02 0.00 -0.02 0.00 0.00 41.12 38.49 2d3r n ASP 2 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2d3r s THR 3 N -2.14 2.03 -0.26 -3.53 2.01 -1.26 -5.06 115.64 107.44 2d3r s THR 3 Ca 0.06 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 61.91 2d3r s THR 3 Cb -0.02 -3.02 0.07 0.00 0.01 0.00 0.00 72.50 69.55 2d3r s THR 3 CO 0.28 0.00 0.66 -0.63 -0.69 0.00 0.00 174.62 174.24 2d3r s ILE 4 N 0.11 -0.00 -0.11 1.82 -1.09 -1.26 -4.19 121.20 116.48 2d3r s ILE 4 Ca 0.65 0.01 0.03 0.00 -2.23 0.00 0.00 60.65 59.10 2d3r s ILE 4 Cb -0.48 -0.95 0.01 0.00 -1.58 0.00 0.00 42.46 39.45 2d3r s ILE 4 CO 0.47 0.00 -0.20 -0.69 -1.23 0.00 0.00 174.94 173.29 2d3r s VAL 5 N 1.29 1.82 0.09 2.92 1.01 -0.64 -0.21 120.40 126.68 2d3r s VAL 5 Ca -0.07 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.04 2d3r s VAL 5 Cb -0.05 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 2d3r s VAL 5 CO -0.14 0.51 0.01 0.00 0.00 0.00 0.00 175.10 175.47 2d3r s ALA 6 N 0.70 0.70 -0.17 5.51 0.00 -0.49 -0.11 121.76 127.90 2d3r s ALA 6 Ca -0.11 -1.34 0.01 0.00 0.00 0.00 0.00 51.96 50.52 2d3r s ALA 6 Cb -0.16 0.54 0.02 0.00 0.00 0.00 0.00 23.12 23.51 2d3r s ALA 6 CO 0.02 -0.42 -0.20 0.08 0.00 0.00 0.00 175.76 175.25 2d3r s VAL 7 N -3.96 2.01 -0.14 0.00 1.01 0.49 -1.60 120.40 118.20 2d3r s VAL 7 Ca 0.15 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 61.18 2d3r s VAL 7 Cb 0.08 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 2d3r s VAL 7 CO -0.04 0.53 -0.01 -1.83 0.00 0.00 0.00 175.10 173.75 2d3r s GLU 8 N 1.21 3.53 -0.81 2.72 -1.05 0.94 -2.10 118.70 123.12 2d3r s GLU 8 Ca 0.02 -0.46 -0.13 0.00 -0.15 0.00 0.00 54.97 54.26 2d3r s GLU 8 Cb -0.14 -2.93 0.21 0.00 -0.44 0.00 0.00 34.13 30.84 2d3r s GLU 8 CO -0.10 0.38 0.74 -0.51 0.95 0.00 0.00 175.26 176.71 2d3r s LEU 9 N 0.01 6.59 -0.30 1.83 1.02 0.13 -0.75 118.68 127.21 2d3r s LEU 9 Ca 0.02 -2.74 -0.21 0.00 0.02 0.00 0.00 54.13 51.22 2d3r s LEU 9 Cb -0.13 -2.17 -0.01 0.00 0.02 0.00 0.00 46.19 43.90 2d3r s LEU 9 CO 0.02 -0.54 0.68 -0.62 0.02 0.00 0.00 176.35 175.91 2d3r s ASP 10 N 1.96 6.56 0.00 2.29 -1.08 -0.08 -2.28 116.67 124.05 2d3r s ASP 10 Ca 0.18 0.55 0.18 0.00 -0.52 0.00 0.00 52.55 52.94 2d3r s ASP 10 Cb -0.11 -2.36 0.10 0.00 -1.46 0.00 0.00 42.92 39.10 2d3r s ASP 10 CO -0.08 -0.50 1.02 0.35 0.52 0.00 0.00 175.17 176.47 2d3r n THR 11 N 5.40 0.00 -3.73 1.71 -2.24 -1.04 -1.73 114.28 112.64 2d3r n THR 11 Ca 0.01 -0.45 -0.16 0.00 -2.27 0.00 0.00 64.05 61.17 2d3r n THR 11 Cb 0.49 1.33 -0.16 0.00 -2.10 0.00 0.00 70.33 69.88 2d3r n THR 11 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2d3r s TYR 12 N -1.62 0.00 -0.60 4.78 5.04 -1.25 -4.58 117.35 119.12 2d3r s TYR 12 Ca 0.19 0.24 -0.21 0.00 -2.44 0.00 0.00 57.07 54.85 2d3r s TYR 12 Cb 0.15 -0.29 0.07 0.00 0.35 0.00 0.00 41.96 42.23 2d3r s TYR 12 CO 0.28 -0.14 0.83 -1.25 -1.34 0.00 0.00 175.55 173.93 2d3r s PRO 13 N 1.49 3.12 -1.06 4.97 0.05 -1.26 -4.98 135.00 137.34 2d3r s PRO 13 Ca -0.04 -0.90 -0.15 0.00 0.05 0.00 0.00 61.00 59.96 2d3r s PRO 13 Cb -0.12 -4.19 0.18 0.00 0.05 0.00 0.00 34.50 30.41 2d3r s PRO 13 CO -0.04 -1.60 1.20 -0.80 0.05 0.00 0.00 177.00 175.82 2d3r s ASN 14 N 3.39 6.93 0.66 6.66 -0.87 -1.26 -4.86 114.94 125.58 2d3r s ASN 14 Ca 0.19 -2.74 0.41 0.00 -1.57 0.00 0.00 52.86 49.15 2d3r s ASN 14 Cb -0.19 -2.35 2.27 0.00 -0.02 0.00 0.00 41.25 40.97 2d3r s ASN 14 CO 0.11 -0.76 2.31 0.71 -2.57 0.00 0.00 177.10 176.90 2d3r h THR 15 N 4.90 0.07 0.00 1.60 1.35 -1.87 0.17 112.91 119.13 2d3r h THR 15 Ca 0.22 0.00 -0.10 0.00 -0.55 0.00 0.00 66.41 65.98 2d3r h THR 15 Cb 0.94 0.96 -0.01 0.00 -1.73 0.00 0.00 68.15 68.31 2d3r h THR 15 CO 1.10 0.00 -0.48 -2.24 -0.25 0.00 0.00 175.52 173.66 2d3r h ASP 16 N 0.00 0.00 -0.74 5.36 2.03 -1.89 -3.04 116.42 118.14 2d3r h ASP 16 Ca 0.00 0.00 -0.43 0.00 -0.73 0.00 0.00 57.03 55.88 2d3r h ASP 16 Cb 0.09 0.00 -0.24 0.00 -0.83 0.00 0.00 39.33 38.35 2d3r h ASP 16 CO -0.00 0.48 0.30 2.30 -1.03 0.00 0.00 179.24 181.29 2d3r n ILE 17 N -3.94 2.99 -1.11 4.15 -5.35 0.02 -4.95 119.36 111.18 2d3r n ILE 17 Ca -0.01 -2.60 -0.04 0.00 -0.27 0.00 0.00 62.75 59.82 2d3r n ILE 17 Cb 0.50 -0.59 -0.02 0.00 -1.74 0.00 0.00 39.64 37.79 2d3r n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2d3r n GLY 18 N -1.07 0.65 3.77 3.28 0.00 -1.15 -4.63 105.19 106.05 2d3r n GLY 18 Ca 0.49 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 2d3r n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2d3r s ASP 19 N -2.54 6.60 0.67 1.61 1.01 -1.07 -4.78 116.67 118.17 2d3r s ASP 19 Ca 0.00 2.31 -0.14 0.00 0.71 0.00 0.00 52.55 55.43 2d3r s ASP 19 Cb 0.00 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.32 2d3r s ASP 19 CO 0.00 -0.62 1.10 -2.16 0.21 0.00 0.00 175.17 173.70 2d3r s PRO 20 N -2.26 2.76 0.00 8.23 0.04 -1.26 -4.03 135.00 138.48 2d3r s PRO 20 Ca 0.56 1.32 -0.04 0.00 0.04 0.00 0.00 61.00 62.88 2d3r s PRO 20 Cb -0.30 -1.95 -0.19 0.00 0.04 0.00 0.00 34.50 32.10 2d3r s PRO 20 CO 0.38 -1.27 3.01 -1.71 0.04 0.00 0.00 177.00 177.45 2d3r n ASN 21 N -2.59 4.77 -3.54 6.66 5.15 -1.26 -4.68 115.26 119.76 2d3r n ASN 21 Ca 0.10 -2.36 -0.09 0.00 -0.60 0.00 0.00 54.58 51.63 2d3r n ASN 21 Cb 0.52 -1.23 -0.03 0.00 -0.53 0.00 0.00 39.78 38.51 2d3r n ASN 21 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 2d3r s TYR 22 N 0.98 -0.33 0.43 1.20 -0.85 -1.26 -5.04 117.35 112.47 2d3r s TYR 22 Ca 0.48 0.37 -0.25 0.00 -0.52 0.00 0.00 57.07 57.14 2d3r s TYR 22 Cb 0.23 0.50 -0.09 0.00 0.38 0.00 0.00 41.96 42.97 2d3r s TYR 22 CO 0.00 -0.42 1.30 1.04 -1.52 0.00 0.00 175.55 175.95 2d3r n GLN 23 N 0.17 1.97 -3.99 -3.49 6.02 -1.26 -4.65 117.38 112.16 2d3r n GLN 23 Ca -0.08 0.70 -0.10 0.00 -0.01 0.00 0.00 57.00 57.51 2d3r n GLN 23 Cb 0.60 -2.43 -0.04 0.00 1.02 0.00 0.00 30.24 29.38 2d3r n GLN 23 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 177.06 172.67 2d3r s HIS 24 N -1.20 0.42 -0.09 1.08 -3.43 -0.71 -2.33 115.29 109.04 2d3r s HIS 24 Ca 0.61 -0.79 0.03 0.00 -0.80 0.00 0.00 55.06 54.11 2d3r s HIS 24 Cb -0.49 0.22 0.00 0.00 -1.43 0.00 0.00 32.58 30.88 2d3r s HIS 24 CO 0.58 -1.07 -0.20 -1.50 -2.00 0.00 0.00 174.74 170.55 2d3r s ILE 25 N -3.75 1.73 0.09 -5.38 -1.16 0.10 -0.90 121.20 111.93 2d3r s ILE 25 Ca 0.23 -0.83 -0.00 0.00 -0.51 0.00 0.00 60.65 59.54 2d3r s ILE 25 Cb -0.01 -1.51 -0.04 0.00 0.61 0.00 0.00 42.46 41.50 2d3r s ILE 25 CO 0.11 0.49 -0.00 -0.83 -2.81 0.00 0.00 174.94 171.89 2d3r s GLY 26 N 0.46 0.75 -0.21 1.50 0.00 0.07 -0.97 107.32 108.93 2d3r s GLY 26 Ca -0.17 -1.35 -0.04 0.00 0.00 0.00 0.00 44.72 43.16 2d3r s GLY 26 CO 0.07 -1.37 -0.04 -0.42 0.00 0.00 0.00 173.10 171.34 2d3r s ILE 27 N -3.90 3.49 -0.18 0.90 1.01 -0.32 -0.04 121.20 122.16 2d3r s ILE 27 Ca 0.15 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.29 2d3r s ILE 27 Cb 0.07 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 2d3r s ILE 27 CO -0.04 0.43 -0.00 0.20 0.00 0.00 0.00 174.94 175.53 2d3r s ASN 28 N 1.23 4.97 -0.37 3.58 0.01 -0.63 -0.13 114.94 123.60 2d3r s ASN 28 Ca 0.03 -0.12 0.02 0.00 -0.71 0.00 0.00 52.86 52.08 2d3r s ASN 28 Cb -0.14 -1.84 0.11 0.00 0.41 0.00 0.00 41.25 39.79 2d3r s ASN 28 CO -0.01 0.13 0.13 -0.63 -1.51 0.00 0.00 177.10 175.20 2d3r s ILE 29 N 0.64 1.68 0.00 0.60 1.01 -1.26 -1.39 121.20 122.47 2d3r s ILE 29 Ca -0.00 -2.19 0.00 0.00 0.00 0.00 0.00 60.65 58.46 2d3r s ILE 29 Cb -0.14 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.10 2d3r s ILE 29 CO 0.02 -0.70 0.00 0.29 0.00 0.00 0.00 174.94 174.55 2d3r n LYS 30 N 4.18 -0.46 -3.80 2.79 5.02 0.71 -4.95 118.16 121.66 2d3r n LYS 30 Ca 0.03 0.12 -0.12 0.00 -2.02 0.00 0.00 58.31 56.31 2d3r n LYS 30 Cb 0.39 -3.90 -0.09 0.00 -0.02 0.00 0.00 35.03 31.42 2d3r n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2d3r s SER 31 N -2.24 -0.10 0.45 4.39 0.15 -1.26 -4.93 113.70 110.14 2d3r s SER 31 Ca 0.00 -0.08 0.24 0.00 0.70 0.00 0.00 55.95 56.82 2d3r s SER 31 Cb 0.00 0.29 0.95 0.00 -1.71 0.00 0.00 66.02 65.55 2d3r s SER 31 CO 0.00 -0.46 1.84 -0.29 1.20 0.00 0.00 173.24 175.52 2d3r h ILE 32 N 3.83 0.55 -1.84 6.45 6.09 -1.84 -3.40 117.51 127.34 2d3r h ILE 32 Ca -0.30 -1.09 -0.49 0.00 -1.37 0.00 0.00 64.86 61.60 2d3r h ILE 32 Cb 1.18 1.74 -0.06 0.00 0.47 0.00 0.00 36.82 40.16 2d3r h ILE 32 CO 0.42 0.21 1.19 -0.13 -3.07 0.00 0.00 178.15 176.77 2d3r s ARG 33 N -3.67 2.89 0.14 2.19 0.52 -1.26 -4.91 118.95 114.83 2d3r s ARG 33 Ca 0.00 0.05 -0.35 0.00 -0.52 0.00 0.00 55.73 54.92 2d3r s ARG 33 Cb 0.10 -4.51 -0.15 0.00 0.52 0.00 0.00 34.95 30.92 2d3r s ARG 33 CO 0.63 -2.59 1.51 0.43 0.02 0.00 0.00 175.30 175.31 2d3r n SER 34 N 11.49 2.69 0.27 0.23 7.64 -1.26 -4.81 113.62 129.87 2d3r n SER 34 Ca 0.19 1.09 0.15 0.00 1.01 0.00 0.00 58.87 61.31 2d3r n SER 34 Cb 0.50 -1.36 0.75 0.00 -1.01 0.00 0.00 64.21 63.10 2d3r n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2d3r h LYS 35 N 5.58 0.00 -2.48 1.43 1.79 -0.86 -3.44 116.57 118.59 2d3r h LYS 35 Ca -0.46 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 57.92 2d3r h LYS 35 Cb 1.28 0.00 -0.22 0.00 -1.58 0.00 0.00 32.23 31.71 2d3r h LYS 35 CO 0.86 0.09 -0.08 0.00 -1.08 0.00 0.00 179.45 179.24 2d3r s ALA 36 N -3.97 -1.30 0.04 3.86 0.00 -1.22 -5.01 121.76 114.17 2d3r s ALA 36 Ca -0.02 1.26 0.01 0.00 0.00 0.00 0.00 51.96 53.21 2d3r s ALA 36 Cb 0.12 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.65 2d3r s ALA 36 CO 0.55 -0.27 -0.05 0.95 0.00 0.00 0.00 175.76 176.95 2d3r s THR 37 N -0.25 0.30 0.07 0.00 -4.23 -1.26 -1.18 115.64 109.09 2d3r s THR 37 Ca -0.04 -1.20 0.02 0.00 -1.18 0.00 0.00 61.69 59.29 2d3r s THR 37 Cb -0.03 -0.69 -0.03 0.00 1.34 0.00 0.00 72.50 73.08 2d3r s THR 37 CO 0.03 -0.58 -0.08 -0.89 -0.54 0.00 0.00 174.62 172.55 2d3r s THR 38 N -2.04 0.67 0.07 3.99 2.01 -0.14 -5.00 115.64 115.20 2d3r s THR 38 Ca -0.08 -1.38 -0.31 0.00 0.31 0.00 0.00 61.69 60.23 2d3r s THR 38 Cb -0.06 -1.01 -0.08 0.00 0.01 0.00 0.00 72.50 71.36 2d3r s THR 38 CO -0.02 -0.52 1.68 -0.60 -0.69 0.00 0.00 174.62 174.47 2d3r s ARG 39 N -2.32 4.19 0.20 4.92 3.52 -1.26 -0.73 118.95 127.47 2d3r s ARG 39 Ca -0.02 2.36 0.11 0.00 -0.13 0.00 0.00 55.73 58.05 2d3r s ARG 39 Cb -0.05 -3.64 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 2d3r s ARG 39 CO -0.01 -0.76 -0.22 -0.46 -0.81 0.00 0.00 175.30 173.04 2d3r s TRP 40 N 2.78 2.19 -0.29 5.12 -0.00 -0.98 -4.78 118.94 122.98 2d3r s TRP 40 Ca 0.75 -0.38 -0.00 0.00 -0.00 0.00 0.00 56.10 56.47 2d3r s TRP 40 Cb -0.40 -1.07 0.09 0.00 -0.00 0.00 0.00 33.47 32.09 2d3r s TRP 40 CO 0.33 0.49 0.06 -0.80 -0.00 0.00 0.00 176.95 177.03 2d3r s ASN 41 N -2.80 3.95 0.78 5.86 0.01 -1.26 -4.14 114.94 117.34 2d3r s ASN 41 Ca 0.21 -1.53 -0.15 0.00 -0.71 0.00 0.00 52.86 50.69 2d3r s ASN 41 Cb -0.07 -0.97 0.03 0.00 0.41 0.00 0.00 41.25 40.66 2d3r s ASN 41 CO 0.10 -0.37 0.92 0.52 -1.51 0.00 0.00 177.10 176.76 2d3r n VAL 42 N 4.78 2.00 -3.20 1.60 0.31 -1.26 -4.96 118.33 117.60 2d3r n VAL 42 Ca -0.04 -0.29 -0.24 0.00 -0.01 0.00 0.00 64.34 63.76 2d3r n VAL 42 Cb 0.43 -1.02 -0.07 0.00 -0.91 0.00 0.00 33.84 32.27 2d3r n VAL 42 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2d3r n GLN 43 N -2.20 0.83 -1.24 5.55 7.27 -1.26 -5.10 117.38 121.22 2d3r n GLN 43 Ca 0.12 -3.31 -0.48 0.00 0.07 0.00 0.00 57.00 53.39 2d3r n GLN 43 Cb 0.50 -1.28 -0.07 0.00 2.41 0.00 0.00 30.24 31.81 2d3r n GLN 43 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2d3r n ASP 44 N 1.36 0.37 0.00 1.69 -0.08 -1.26 -1.92 116.55 116.72 2d3r n ASP 44 Ca 0.22 0.91 0.00 0.00 -1.51 0.00 0.00 54.79 54.40 2d3r n ASP 44 Cb 0.52 -0.70 0.00 0.00 2.34 0.00 0.00 41.12 43.28 2d3r n ASP 44 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2d3r n GLY 45 N 1.93 2.15 3.89 0.27 0.00 -0.55 -4.95 105.19 107.93 2d3r n GLY 45 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 2d3r n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d3r s LYS 46 N -0.95 3.56 -0.16 1.61 -0.14 -0.81 -4.93 119.74 117.93 2d3r s LYS 46 Ca 0.00 -0.15 -0.29 0.00 -1.36 0.00 0.00 55.97 54.17 2d3r s LYS 46 Cb 0.00 -3.02 -0.01 0.00 -1.68 0.00 0.00 37.83 33.12 2d3r s LYS 46 CO 0.00 0.60 1.26 0.08 -0.76 0.00 0.00 175.35 176.53 2d3r s VAL 47 N -1.42 4.28 0.41 3.17 1.01 -1.26 -4.17 120.40 122.42 2d3r s VAL 47 Ca 0.32 1.55 0.08 0.00 0.00 0.00 0.00 61.98 63.93 2d3r s VAL 47 Cb -0.13 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.24 2d3r s VAL 47 CO 0.20 -0.13 0.45 -0.83 0.00 0.00 0.00 175.10 174.79 2d3r s GLY 48 N 1.95 2.03 0.02 4.51 0.00 0.87 -4.48 107.32 112.22 2d3r s GLY 48 Ca 0.55 -1.77 0.03 0.00 0.00 0.00 0.00 44.72 43.52 2d3r s GLY 48 CO 0.15 -1.60 -0.09 -1.59 0.00 0.00 0.00 173.10 169.97 2d3r s THR 49 N -2.40 0.70 -0.06 0.90 2.01 0.02 -1.72 115.64 115.08 2d3r s THR 49 Ca 0.50 -0.75 0.02 0.00 0.31 0.00 0.00 61.69 61.77 2d3r s THR 49 Cb -0.06 -0.66 0.02 0.00 0.01 0.00 0.00 72.50 71.81 2d3r s THR 49 CO 0.30 -0.07 -0.10 0.00 -0.69 0.00 0.00 174.62 174.06 2d3r s ALA 50 N -0.75 1.11 -0.16 7.40 0.00 -0.50 -0.23 121.76 128.62 2d3r s ALA 50 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.62 2d3r s ALA 50 Cb -0.06 -0.55 0.01 0.00 0.00 0.00 0.00 23.12 22.51 2d3r s ALA 50 CO 0.00 0.05 -0.17 -1.01 0.00 0.00 0.00 175.76 174.64 2d3r s HIS 51 N 0.79 2.78 -0.03 0.00 3.76 -0.11 -1.85 115.29 120.63 2d3r s HIS 51 Ca -0.13 -1.25 0.07 0.00 -0.15 0.00 0.00 55.06 53.60 2d3r s HIS 51 Cb -0.15 -1.90 -0.02 0.00 1.11 0.00 0.00 32.58 31.62 2d3r s HIS 51 CO 0.02 -0.60 -0.24 0.42 -0.85 0.00 0.00 174.74 173.50 2d3r s ILE 52 N 1.00 1.90 -0.01 0.60 1.01 0.18 -1.20 121.20 124.69 2d3r s ILE 52 Ca -0.02 -1.01 0.01 0.00 0.00 0.00 0.00 60.65 59.63 2d3r s ILE 52 Cb -0.15 -1.59 -0.00 0.00 0.01 0.00 0.00 42.46 40.73 2d3r s ILE 52 CO -0.04 0.54 -0.04 -0.44 0.00 0.00 0.00 174.94 174.95 2d3r s SER 53 N -0.41 0.53 -0.03 3.58 0.01 0.01 -0.70 113.70 116.69 2d3r s SER 53 Ca 0.05 -0.08 -0.08 0.00 1.31 0.00 0.00 55.95 57.15 2d3r s SER 53 Cb -0.11 -0.08 0.01 0.00 0.21 0.00 0.00 66.02 66.05 2d3r s SER 53 CO 0.01 0.04 0.18 -0.47 0.41 0.00 0.00 173.24 173.41 2d3r s TYR 54 N 0.00 -0.08 -0.04 2.43 5.04 -0.88 -1.15 117.35 122.67 2d3r s TYR 54 Ca 0.00 0.17 -0.00 0.00 -2.44 0.00 0.00 57.07 54.80 2d3r s TYR 54 Cb -0.03 0.02 0.03 0.00 0.35 0.00 0.00 41.96 42.32 2d3r s TYR 54 CO -0.00 -0.23 0.02 1.21 -1.34 0.00 0.00 175.55 175.21 2d3r s ASN 55 N -0.80 0.73 0.54 4.32 3.84 -1.26 -2.14 114.94 120.17 2d3r s ASN 55 Ca -0.09 -0.00 0.22 0.00 0.21 0.00 0.00 52.86 53.20 2d3r s ASN 55 Cb -0.05 -0.21 1.43 0.00 -0.55 0.00 0.00 41.25 41.87 2d3r s ASN 55 CO 0.01 -0.15 2.12 0.77 -2.79 0.00 0.00 177.10 177.06 2d3r h SER 56 N 7.71 0.00 0.00 -4.21 4.64 -0.82 0.51 113.55 121.38 2d3r h SER 56 Ca -0.32 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2d3r h SER 56 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2d3r h SER 56 CO 0.36 0.00 -0.00 0.58 -0.87 0.00 0.00 176.83 176.90 2d3r h VAL 57 N 0.00 1.62 0.00 0.95 2.07 -1.91 -3.31 116.25 115.67 2d3r h VAL 57 Ca 0.07 -2.12 -0.10 0.00 0.82 0.00 0.00 66.70 65.37 2d3r h VAL 57 Cb 0.31 3.02 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 2d3r h VAL 57 CO -0.00 0.53 -0.46 0.00 0.02 0.00 0.00 177.57 177.67 2d3r h ALA 58 N -0.03 0.96 -0.69 1.67 0.00 -1.92 -3.47 119.26 115.78 2d3r h ALA 58 Ca -0.00 -0.42 -0.30 0.00 0.00 0.00 0.00 54.91 54.20 2d3r h ALA 58 Cb 0.88 -0.07 -0.12 0.00 0.00 0.00 0.00 17.79 18.48 2d3r h ALA 58 CO 0.00 0.57 -0.27 1.63 0.00 0.00 0.00 179.25 181.18 2d3r n LYS 59 N -3.59 -1.58 -3.67 0.00 5.02 0.18 -4.96 118.16 109.57 2d3r n LYS 59 Ca -0.00 1.01 -0.37 0.00 -2.02 0.00 0.00 58.31 56.93 2d3r n LYS 59 Cb 0.56 -5.40 -0.10 0.00 -0.02 0.00 0.00 35.03 30.07 2d3r n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2d3r s ARG 60 N -3.21 4.03 -0.35 1.97 3.52 -1.26 -1.43 118.95 122.23 2d3r s ARG 60 Ca 0.00 -0.29 -0.14 0.00 -0.13 0.00 0.00 55.73 55.17 2d3r s ARG 60 Cb 0.00 -3.54 -0.01 0.00 -1.56 0.00 0.00 34.95 29.84 2d3r s ARG 60 CO 0.00 0.03 0.29 -1.17 -0.81 0.00 0.00 175.30 173.63 2d3r s LEU 61 N 1.15 4.53 0.03 -0.88 2.96 0.14 -4.02 118.68 122.60 2d3r s LEU 61 Ca 0.07 -0.38 0.05 0.00 -0.22 0.00 0.00 54.13 53.65 2d3r s LEU 61 Cb -0.14 -2.21 -0.02 0.00 0.50 0.00 0.00 46.19 44.32 2d3r s LEU 61 CO 0.05 -0.29 -0.14 -0.94 -1.32 0.00 0.00 176.35 173.71 2d3r s SER 62 N 1.73 1.67 0.07 3.68 1.04 -0.30 -0.53 113.70 121.06 2d3r s SER 62 Ca 0.08 -0.43 0.01 0.00 0.48 0.00 0.00 55.95 56.09 2d3r s SER 62 Cb -0.17 -0.12 -0.03 0.00 0.10 0.00 0.00 66.02 65.80 2d3r s SER 62 CO 0.11 0.05 -0.06 0.00 0.98 0.00 0.00 173.24 174.32 2d3r s ALA 63 N -0.78 0.75 -0.08 5.32 0.00 0.11 -0.81 121.76 126.26 2d3r s ALA 63 Ca 0.02 -1.11 -0.04 0.00 0.00 0.00 0.00 51.96 50.83 2d3r s ALA 63 Cb -0.08 0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.22 2d3r s ALA 63 CO 0.01 -0.18 0.19 -1.50 0.00 0.00 0.00 175.76 174.28 2d3r s ILE 64 N -2.83 -0.04 -0.07 0.00 2.07 -0.34 -1.26 121.20 118.73 2d3r s ILE 64 Ca 0.03 0.14 0.04 0.00 -1.41 0.00 0.00 60.65 59.45 2d3r s ILE 64 Cb -0.00 -0.30 0.00 0.00 0.13 0.00 0.00 42.46 42.30 2d3r s ILE 64 CO -0.04 0.06 -0.17 0.68 -1.91 0.00 0.00 174.94 173.56 2d3r s VAL 65 N 1.06 1.50 -0.02 4.00 -7.23 -0.44 -0.93 120.40 118.35 2d3r s VAL 65 Ca -0.08 -0.72 0.02 0.00 -1.81 0.00 0.00 61.98 59.39 2d3r s VAL 65 Cb -0.10 -1.31 0.00 0.00 0.56 0.00 0.00 36.38 35.53 2d3r s VAL 65 CO -0.06 0.43 -0.07 -0.94 -0.31 0.00 0.00 175.10 174.15 2d3r s SER 66 N 0.33 0.89 0.02 4.85 1.04 0.67 -1.34 113.70 120.17 2d3r s SER 66 Ca -0.11 -0.13 0.02 0.00 0.48 0.00 0.00 55.95 56.20 2d3r s SER 66 Cb -0.15 -0.19 -0.04 0.00 0.10 0.00 0.00 66.02 65.75 2d3r s SER 66 CO 0.04 0.06 0.01 -0.31 0.98 0.00 0.00 173.24 174.03 2d3r s TYR 67 N 0.09 3.09 0.31 5.02 2.02 -0.78 -0.80 117.35 126.31 2d3r s TYR 67 Ca -0.01 0.08 -0.29 0.00 -0.37 0.00 0.00 57.07 56.47 2d3r s TYR 67 Cb -0.06 -1.65 -0.11 0.00 -0.40 0.00 0.00 41.96 39.74 2d3r s TYR 67 CO -0.00 0.48 1.50 -2.14 -1.57 0.00 0.00 175.55 173.81 2d3r s PRO 68 N -1.74 4.18 0.00 -1.71 0.02 -1.26 -3.40 135.00 131.08 2d3r s PRO 68 Ca 0.21 2.47 0.00 0.00 0.02 0.00 0.00 61.00 63.71 2d3r s PRO 68 Cb -0.12 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.37 2d3r s PRO 68 CO 0.13 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 2d3r n GLY 69 N 1.54 1.09 0.00 0.52 0.00 -1.26 -4.77 105.19 102.31 2d3r n GLY 69 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2d3r n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d3r n GLY 70 N 0.00 2.09 3.59 -0.02 0.00 -1.22 -5.03 105.19 104.60 2d3r n GLY 70 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2d3r n GLY 70 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d3r s SER 71 N -1.42 6.09 0.06 1.61 0.15 -1.24 -4.96 113.70 113.98 2d3r s SER 71 Ca 0.00 0.65 -0.13 0.00 0.70 0.00 0.00 55.95 57.17 2d3r s SER 71 Cb 0.00 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 61.79 2d3r s SER 71 CO 0.00 -1.67 0.28 -0.94 1.20 0.00 0.00 173.24 172.11 2d3r s SER 72 N 4.84 -0.08 0.05 5.45 1.04 -1.26 -1.86 113.70 121.89 2d3r s SER 72 Ca 0.61 -0.30 0.08 0.00 0.48 0.00 0.00 55.95 56.82 2d3r s SER 72 Cb -0.14 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 2d3r s SER 72 CO 0.29 -0.65 -0.22 0.00 0.98 0.00 0.00 173.24 173.64 2d3r s ALA 73 N -2.89 1.86 0.08 5.32 0.00 -0.45 -4.98 121.76 120.70 2d3r s ALA 73 Ca -0.03 -1.13 0.08 0.00 0.00 0.00 0.00 51.96 50.89 2d3r s ALA 73 Cb 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 2d3r s ALA 73 CO -0.06 0.42 -0.21 0.95 0.00 0.00 0.00 175.76 176.86 2d3r s THR 74 N -0.85 1.74 -0.04 0.00 -4.23 -1.26 -1.32 115.64 109.67 2d3r s THR 74 Ca 0.08 -1.44 -0.11 0.00 -1.18 0.00 0.00 61.69 59.05 2d3r s THR 74 Cb -0.09 -1.55 0.02 0.00 1.34 0.00 0.00 72.50 72.21 2d3r s THR 74 CO 0.02 0.05 0.25 0.54 -0.54 0.00 0.00 174.62 174.94 2d3r s VAL 75 N -1.02 0.04 -0.18 2.29 0.11 -0.39 -4.73 120.40 116.52 2d3r s VAL 75 Ca 0.07 -0.36 -0.15 0.00 -2.93 0.00 0.00 61.98 58.61 2d3r s VAL 75 Cb -0.10 -0.48 0.05 0.00 -1.53 0.00 0.00 36.38 34.32 2d3r s VAL 75 CO 0.03 -0.20 0.46 -0.94 -3.33 0.00 0.00 175.10 171.13 2d3r s SER 76 N -0.80 -0.50 0.29 3.54 1.04 -1.26 0.05 113.70 116.07 2d3r s SER 76 Ca -0.09 0.94 0.01 0.00 0.48 0.00 0.00 55.95 57.29 2d3r s SER 76 Cb -0.05 0.94 -0.00 0.00 0.10 0.00 0.00 66.02 67.01 2d3r s SER 76 CO 0.02 -0.17 0.03 0.00 0.98 0.00 0.00 173.24 174.10 2d3r n TYR 77 N 3.00 0.52 -3.18 5.02 9.36 0.31 -4.98 117.16 127.22 2d3r n TYR 77 Ca -0.14 -1.56 0.02 0.00 3.32 0.00 0.00 57.90 59.54 2d3r n TYR 77 Cb 0.57 -0.14 -0.02 0.00 -0.63 0.00 0.00 39.34 39.12 2d3r n TYR 77 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2d3r s ASP 78 N -2.66 -1.21 -0.25 2.98 -1.08 -1.26 0.29 116.67 113.48 2d3r s ASP 78 Ca 0.04 0.38 -0.26 0.00 -0.52 0.00 0.00 52.55 52.19 2d3r s ASP 78 Cb 0.00 1.93 0.12 0.00 -1.46 0.00 0.00 42.92 43.51 2d3r s ASP 78 CO 0.03 -0.29 0.99 0.54 0.52 0.00 0.00 175.17 176.96 2d3r s VAL 79 N 2.79 0.00 -0.67 1.11 0.11 -0.51 -5.01 120.40 118.22 2d3r s VAL 79 Ca 0.14 0.00 -0.18 0.00 -2.93 0.00 0.00 61.98 59.01 2d3r s VAL 79 Cb -0.12 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 33.85 2d3r s VAL 79 CO -0.24 0.00 0.77 -0.62 -3.33 0.00 0.00 175.10 171.68 2d3r s ASP 80 N -0.07 6.32 0.40 3.54 -1.08 -1.26 -4.55 116.67 119.96 2d3r s ASP 80 Ca 0.02 -1.67 0.28 0.00 -0.52 0.00 0.00 52.55 50.66 2d3r s ASP 80 Cb -0.04 -2.30 1.22 0.00 -1.46 0.00 0.00 42.92 40.34 2d3r s ASP 80 CO -0.04 -1.05 1.85 -0.07 0.52 0.00 0.00 175.17 176.39 2d3r h LEU 81 N 9.78 0.00 -1.28 -1.34 3.38 -1.94 -2.28 115.31 121.63 2d3r h LEU 81 Ca -0.18 0.00 0.20 0.00 0.09 0.00 0.00 57.88 57.98 2d3r h LEU 81 Cb 1.07 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.74 2d3r h LEU 81 CO 1.06 0.00 0.61 0.78 0.09 0.00 0.00 178.44 180.98 2d3r h ASN 82 N 0.00 0.59 0.78 -0.43 4.21 -1.91 0.10 115.58 118.92 2d3r h ASN 82 Ca 0.00 0.06 -0.20 0.00 1.21 0.00 0.00 56.30 57.37 2d3r h ASN 82 Cb 0.37 -0.04 -0.03 0.00 -1.12 0.00 0.00 38.32 37.50 2d3r h ASN 82 CO 0.00 0.23 -1.32 0.78 -1.29 0.00 0.00 177.43 175.82 2d3r h ASN 83 N 0.58 0.00 0.00 5.81 2.35 -1.84 -3.38 115.58 119.10 2d3r h ASN 83 Ca 0.52 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.26 2d3r h ASN 83 Cb 1.04 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.41 2d3r h ASN 83 CO -0.27 0.74 -0.06 0.40 -1.65 0.00 0.00 177.43 176.60 2d3r h ILE 84 N 0.00 1.25 -3.99 2.81 1.08 -1.54 -3.47 117.51 113.65 2d3r h ILE 84 Ca -0.16 -1.96 -0.45 0.00 -0.39 0.00 0.00 64.86 61.90 2d3r h ILE 84 Cb 1.70 2.38 -0.02 0.00 -3.07 0.00 0.00 36.82 37.82 2d3r h ILE 84 CO 0.07 0.42 0.30 -0.76 -0.69 0.00 0.00 178.15 177.50 2d3r s LEU 85 N -8.30 4.00 1.08 1.44 1.43 -0.01 -4.99 118.68 113.33 2d3r s LEU 85 Ca -0.14 1.64 -0.13 0.00 -1.03 0.00 0.00 54.13 54.47 2d3r s LEU 85 Cb -0.02 -4.42 0.23 0.00 0.03 0.00 0.00 46.19 42.02 2d3r s LEU 85 CO 0.49 -0.31 1.07 -2.16 0.23 0.00 0.00 176.35 175.67 2d3r s PRO 86 N -3.04 -0.21 0.19 1.29 0.04 -1.26 -4.84 135.00 127.17 2d3r s PRO 86 Ca 0.60 0.59 -0.07 0.00 0.04 0.00 0.00 61.00 62.16 2d3r s PRO 86 Cb -0.10 -1.66 0.11 0.00 0.04 0.00 0.00 34.50 32.89 2d3r s PRO 86 CO 0.15 -3.18 1.58 0.93 0.04 0.00 0.00 177.00 176.51 2d3r h GLU 87 N -2.22 0.83 -6.27 4.56 5.08 -1.94 -3.43 114.58 111.19 2d3r h GLU 87 Ca -0.58 -0.37 -0.68 0.00 -1.00 0.00 0.00 59.36 56.73 2d3r h GLU 87 Cb 1.34 -0.02 -0.20 0.00 0.50 0.00 0.00 28.75 30.37 2d3r h GLU 87 CO 0.55 1.00 -0.72 -1.58 -1.00 0.00 0.00 179.01 177.26 2d3r s TRP 88 N -4.54 2.83 0.26 4.33 0.52 -1.26 -0.93 118.94 120.15 2d3r s TRP 88 Ca -0.10 -0.06 -0.00 0.00 0.02 0.00 0.00 56.10 55.96 2d3r s TRP 88 Cb 0.12 -1.64 -0.03 0.00 -1.15 0.00 0.00 33.47 30.78 2d3r s TRP 88 CO 0.85 0.30 0.26 0.14 0.02 0.00 0.00 176.95 178.52 2d3r s VAL 89 N -0.86 0.00 -0.02 4.03 -7.23 -0.83 -4.43 120.40 111.06 2d3r s VAL 89 Ca 0.14 -1.88 0.07 0.00 -1.81 0.00 0.00 61.98 58.50 2d3r s VAL 89 Cb -0.11 -2.49 -0.02 0.00 0.56 0.00 0.00 36.38 34.33 2d3r s VAL 89 CO 0.03 0.00 -0.24 -0.13 -0.31 0.00 0.00 175.10 174.46 2d3r s ARG 90 N -3.79 1.94 0.10 4.82 0.52 -0.45 -0.24 118.95 121.84 2d3r s ARG 90 Ca 0.37 -0.85 0.01 0.00 -0.52 0.00 0.00 55.73 54.74 2d3r s ARG 90 Cb 0.04 -1.87 -0.04 0.00 0.52 0.00 0.00 34.95 33.60 2d3r s ARG 90 CO 0.17 0.51 0.21 0.14 0.02 0.00 0.00 175.30 176.35 2d3r s VAL 91 N -0.55 5.21 0.32 3.52 -7.23 -1.26 -2.48 120.40 117.92 2d3r s VAL 91 Ca 0.09 -0.57 -0.16 0.00 -1.81 0.00 0.00 61.98 59.53 2d3r s VAL 91 Cb -0.09 -3.59 0.06 0.00 0.56 0.00 0.00 36.38 33.32 2d3r s VAL 91 CO -0.01 0.05 0.84 0.61 -0.31 0.00 0.00 175.10 176.28 2d3r n GLY 92 N 0.02 0.89 3.10 2.32 0.00 -0.05 -0.83 105.19 110.65 2d3r n GLY 92 Ca -0.06 -1.22 -0.23 0.00 0.00 0.00 0.00 46.02 44.51 2d3r n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d3r s LEU 93 N 0.00 1.96 0.05 0.99 1.43 0.52 -0.13 118.68 123.51 2d3r s LEU 93 Ca 0.17 -0.27 -0.01 0.00 -1.03 0.00 0.00 54.13 53.00 2d3r s LEU 93 Cb -0.04 -0.76 -0.04 0.00 0.03 0.00 0.00 46.19 45.38 2d3r s LEU 93 CO 0.10 0.15 -0.03 -0.94 0.23 0.00 0.00 176.35 175.86 2d3r s SER 94 N -0.18 0.47 0.15 2.29 1.04 0.70 0.36 113.70 118.53 2d3r s SER 94 Ca 0.02 -0.93 -0.20 0.00 0.48 0.00 0.00 55.95 55.32 2d3r s SER 94 Cb -0.07 0.18 0.05 0.00 0.10 0.00 0.00 66.02 66.28 2d3r s SER 94 CO 0.00 -0.55 0.52 0.00 0.98 0.00 0.00 173.24 174.19 2d3r s ALA 95 N -3.56 -1.30 0.03 5.32 0.00 -0.11 -0.15 121.76 121.98 2d3r s ALA 95 Ca 0.04 0.24 -0.09 0.00 0.00 0.00 0.00 51.96 52.15 2d3r s ALA 95 Cb 0.05 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.99 2d3r s ALA 95 CO -0.09 -0.72 0.18 -1.54 0.00 0.00 0.00 175.76 173.59 2d3r s SER 96 N -2.78 0.02 0.31 0.00 1.04 -1.19 -1.87 113.70 109.23 2d3r s SER 96 Ca 0.02 -0.30 0.10 0.00 0.48 0.00 0.00 55.95 56.25 2d3r s SER 96 Cb 0.00 0.27 -0.05 0.00 0.10 0.00 0.00 66.02 66.34 2d3r s SER 96 CO -0.12 -0.50 -0.04 0.42 0.98 0.00 0.00 173.24 173.98 2d3r s THR 97 N -2.18 2.83 0.00 2.02 -4.23 -0.18 -1.57 115.64 112.32 2d3r s THR 97 Ca -0.08 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.38 2d3r s THR 97 Cb -0.03 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 71.10 2d3r s THR 97 CO -0.02 -0.29 0.00 0.61 -0.54 0.00 0.00 174.62 174.38 2d3r n GLY 98 N -0.87 4.17 0.24 3.99 0.00 -1.26 -3.38 105.19 108.09 2d3r n GLY 98 Ca -0.05 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.30 2d3r n GLY 98 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2d3r h LEU 99 N 0.00 0.78 -9.93 0.99 5.85 -1.96 0.04 115.31 111.08 2d3r h LEU 99 Ca 0.00 -0.28 -0.48 0.00 0.84 0.00 0.00 57.88 57.96 2d3r h LEU 99 Cb 0.00 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 2d3r h LEU 99 CO 0.00 0.86 0.22 -0.31 -0.34 0.00 0.00 178.44 178.87 2d3r s TYR 100 N -5.12 3.55 0.18 1.25 2.02 -1.26 -4.82 117.35 113.14 2d3r s TYR 100 Ca -0.13 1.51 0.01 0.00 -0.37 0.00 0.00 57.07 58.10 2d3r s TYR 100 Cb 0.11 -2.73 -0.05 0.00 -0.40 0.00 0.00 41.96 38.89 2d3r s TYR 100 CO 0.80 0.17 0.02 -1.59 -1.57 0.00 0.00 175.55 173.39 2d3r s LYS 101 N -2.41 1.13 0.10 -0.62 -2.85 -1.26 -3.90 119.74 109.94 2d3r s LYS 101 Ca 0.51 -1.56 -0.25 0.00 -1.00 0.00 0.00 55.97 53.66 2d3r s LYS 101 Cb -0.15 -0.20 0.08 0.00 -2.06 0.00 0.00 37.83 35.51 2d3r s LYS 101 CO 0.20 -0.18 0.77 -1.83 0.10 0.00 0.00 175.35 174.41 2d3r s GLU 102 N -3.95 1.13 0.08 1.78 -1.05 -1.22 -4.03 118.70 111.44 2d3r s GLU 102 Ca 0.26 -0.48 -0.30 0.00 -0.15 0.00 0.00 54.97 54.31 2d3r s GLU 102 Cb 0.06 0.48 -0.05 0.00 -0.44 0.00 0.00 34.13 34.19 2d3r s GLU 102 CO 0.05 -0.50 1.03 0.95 0.95 0.00 0.00 175.26 177.74 2d3r s THR 103 N -3.46 4.43 -0.77 1.83 -4.23 0.58 -4.73 115.64 109.31 2d3r s THR 103 Ca 0.05 1.89 0.03 0.00 -1.18 0.00 0.00 61.69 62.48 2d3r s THR 103 Cb -0.02 -4.21 0.26 0.00 1.34 0.00 0.00 72.50 69.88 2d3r s THR 103 CO -0.08 0.23 0.94 0.59 -0.54 0.00 0.00 174.62 175.76 2d3r n ASN 104 N 3.24 4.47 -4.69 3.99 4.13 -1.26 -3.69 115.26 121.46 2d3r n ASN 104 Ca 0.05 -3.43 -0.39 0.00 1.68 0.00 0.00 54.58 52.49 2d3r n ASN 104 Cb 0.49 -0.84 -0.06 0.00 -1.54 0.00 0.00 39.78 37.83 2d3r n ASN 104 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2d3r s THR 105 N -2.52 5.09 -0.23 3.41 2.01 -1.00 -2.44 115.64 119.96 2d3r s THR 105 Ca 0.37 1.16 -0.10 0.00 0.31 0.00 0.00 61.69 63.43 2d3r s THR 105 Cb 0.11 -3.92 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 2d3r s THR 105 CO 0.01 0.22 0.14 -0.63 -0.69 0.00 0.00 174.62 173.68 2d3r s ILE 106 N 1.18 5.25 -0.35 1.82 -1.09 0.57 -0.30 121.20 128.29 2d3r s ILE 106 Ca 0.30 0.14 0.22 0.00 -2.23 0.00 0.00 60.65 59.08 2d3r s ILE 106 Cb -0.16 -3.44 -0.19 0.00 -1.58 0.00 0.00 42.46 37.10 2d3r s ILE 106 CO 0.12 0.36 0.81 0.18 -1.23 0.00 0.00 174.94 175.19 2d3r n LEU 107 N 4.18 0.46 -3.59 2.97 4.32 0.12 -0.58 117.00 124.88 2d3r n LEU 107 Ca -0.15 0.02 -0.09 0.00 -0.02 0.00 0.00 56.01 55.77 2d3r n LEU 107 Cb 0.52 -0.04 -0.05 0.00 -1.62 0.00 0.00 43.42 42.23 2d3r n LEU 107 CO 0.35 -0.00 0.84 -0.94 -1.22 0.00 0.00 177.39 176.42 2d3r s SER 108 N -4.37 -0.31 -0.23 -1.43 1.04 -1.22 -4.45 113.70 102.74 2d3r s SER 108 Ca -0.01 0.35 -0.11 0.00 0.48 0.00 0.00 55.95 56.66 2d3r s SER 108 Cb 0.13 0.26 0.08 0.00 0.10 0.00 0.00 66.02 66.60 2d3r s SER 108 CO 0.85 -0.28 0.53 0.86 0.98 0.00 0.00 173.24 176.18 2d3r s TRP 109 N -1.06 -0.91 0.14 5.02 -0.00 0.43 -0.52 118.94 122.05 2d3r s TRP 109 Ca 0.00 1.77 0.08 0.00 -0.00 0.00 0.00 56.10 57.95 2d3r s TRP 109 Cb -0.01 0.48 -0.04 0.00 -0.00 0.00 0.00 33.47 33.90 2d3r s TRP 109 CO -0.00 -0.48 -0.18 -1.54 -0.00 0.00 0.00 176.95 174.74 2d3r s SER 110 N 2.00 2.57 -0.21 5.86 1.04 0.47 -0.03 113.70 125.40 2d3r s SER 110 Ca -0.07 -0.81 -0.15 0.00 0.48 0.00 0.00 55.95 55.39 2d3r s SER 110 Cb -0.09 -0.14 0.06 0.00 0.10 0.00 0.00 66.02 65.95 2d3r s SER 110 CO -0.16 -0.02 0.54 0.12 0.98 0.00 0.00 173.24 174.70 2d3r s PHE 111 N -1.84 -0.71 -0.02 5.02 5.36 -0.27 -0.18 117.98 125.35 2d3r s PHE 111 Ca 0.13 1.57 0.06 0.00 -0.96 0.00 0.00 56.93 57.72 2d3r s PHE 111 Cb -0.07 0.32 -0.01 0.00 -0.34 0.00 0.00 43.02 42.92 2d3r s PHE 111 CO 0.06 -0.36 -0.20 0.99 -1.46 0.00 0.00 175.22 174.25 2d3r s THR 112 N 0.93 1.57 -0.04 0.12 2.01 -0.16 -1.84 115.64 118.22 2d3r s THR 112 Ca -0.05 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.12 2d3r s THR 112 Cb -0.05 -1.31 0.02 0.00 0.01 0.00 0.00 72.50 71.17 2d3r s THR 112 CO -0.08 0.44 -0.03 -0.55 -0.69 0.00 0.00 174.62 173.71 2d3r s SER 113 N -0.36 0.74 -0.09 3.53 0.15 0.24 -1.96 113.70 115.96 2d3r s SER 113 Ca 0.05 -0.10 0.03 0.00 0.70 0.00 0.00 55.95 56.64 2d3r s SER 113 Cb -0.09 -0.35 0.00 0.00 -1.71 0.00 0.00 66.02 63.88 2d3r s SER 113 CO 0.00 -0.06 -0.20 -0.54 1.20 0.00 0.00 173.24 173.64 2d3r s LYS 114 N 0.85 2.65 -0.66 5.44 3.01 -0.54 0.42 119.74 130.92 2d3r s LYS 114 Ca -0.10 -0.74 0.03 0.00 -1.01 0.00 0.00 55.97 54.15 2d3r s LYS 114 Cb -0.13 -2.06 0.16 0.00 -1.01 0.00 0.00 37.83 34.79 2d3r s LYS 114 CO -0.00 0.11 0.44 -1.17 0.51 0.00 0.00 175.35 175.24 2d3r s LEU 115 N 0.50 4.76 0.69 3.17 0.20 0.22 -2.28 118.68 125.94 2d3r s LEU 115 Ca -0.16 -3.48 0.01 0.00 0.69 0.00 0.00 54.13 51.19 2d3r s LEU 115 Cb -0.17 -1.69 0.12 0.00 -0.43 0.00 0.00 46.19 44.02 2d3r s LEU 115 CO 0.06 -0.17 0.95 -1.59 -0.29 0.00 0.00 176.35 175.32 2d3r s LYS 116 N -0.94 1.81 0.00 1.98 -2.85 -1.14 -1.31 119.74 117.28 2d3r s LYS 116 Ca 0.22 -1.23 0.00 0.00 -1.00 0.00 0.00 55.97 53.96 2d3r s LYS 116 Cb -0.13 -2.40 0.00 0.00 -2.06 0.00 0.00 37.83 33.24 2d3r s LYS 116 CO -0.09 -1.32 0.00 0.25 0.10 0.00 0.00 175.35 174.28 2d3r n THR 117 N -2.71 0.00 -3.61 3.79 -2.24 -1.26 -3.38 114.28 104.88 2d3r n THR 117 Ca 0.15 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.81 2d3r n THR 117 Cb 0.61 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.79 2d3r n THR 117 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2d3r s ASN 118 N 1.55 -0.32 -1.82 3.42 2.47 -1.26 -4.51 114.94 114.47 2d3r s ASN 118 Ca 0.00 -0.13 0.00 0.00 0.42 0.00 0.00 52.86 53.15 2d3r s ASN 118 Cb 0.00 0.48 0.00 0.00 -1.45 0.00 0.00 41.25 40.28 2d3r s ASN 118 CO 0.00 -0.80 0.00 -1.20 -3.72 0.00 0.00 177.10 171.38 2d3r n SER 119 N 0.02 -5.60 0.00 -4.21 7.64 -1.26 -4.81 113.62 105.40 2d3r n SER 119 Ca -0.17 0.42 0.00 0.00 1.01 0.00 0.00 58.87 60.13 2d3r n SER 119 Cb 0.62 -4.61 0.00 0.00 -1.01 0.00 0.00 64.21 59.21 2d3r n SER 119 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2d3r n THR 120 N -2.32 0.00 -1.56 0.44 -2.24 -1.26 -4.93 114.28 102.41 2d3r n THR 120 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2d3r n THR 120 Cb 0.65 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 2d3r n THR 120 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d3r n ALA 121 N 3.45 0.00 -3.78 6.98 0.00 -1.26 -4.62 120.51 121.28 2d3r n ALA 121 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 2d3r n ALA 121 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.28 2d3r n ALA 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2d3r s ASP 122 N -4.00 2.19 0.20 0.00 1.11 -1.26 -4.57 116.67 110.34 2d3r s ASP 122 Ca 0.00 -0.40 -0.09 0.00 0.18 0.00 0.00 52.55 52.24 2d3r s ASP 122 Cb 0.00 -0.56 0.12 0.00 1.07 0.00 0.00 42.92 43.55 2d3r s ASP 122 CO 0.00 -0.23 1.75 0.00 1.18 0.00 0.00 175.17 177.87 2d3r h ALA 123 N 8.27 0.94 -2.48 5.23 0.00 -1.73 -3.44 119.26 126.05 2d3r h ALA 123 Ca -0.20 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 2d3r h ALA 123 Cb 1.12 -0.28 -0.22 0.00 0.00 0.00 0.00 17.79 18.41 2d3r h ALA 123 CO 0.31 0.58 -0.12 -1.14 0.00 0.00 0.00 179.25 178.88 2d3r s GLN 124 N -5.50 0.64 0.05 0.00 0.74 -0.43 -5.02 119.66 110.14 2d3r s GLN 124 Ca -0.12 0.51 -0.17 0.00 0.05 0.00 0.00 55.36 55.62 2d3r s GLN 124 Cb 0.15 0.31 0.03 0.00 1.10 0.00 0.00 33.01 34.60 2d3r s GLN 124 CO 0.83 -0.11 0.40 -1.54 -0.55 0.00 0.00 175.29 174.31 2d3r s SER 125 N -0.12 -0.26 0.00 6.67 1.04 -1.26 0.70 113.70 120.47 2d3r s SER 125 Ca -0.03 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2d3r s SER 125 Cb -0.03 0.42 -0.00 0.00 0.10 0.00 0.00 66.02 66.50 2d3r s SER 125 CO 0.02 -0.67 -0.02 -0.22 0.98 0.00 0.00 173.24 173.34 2d3r s LEU 126 N -2.06 2.02 -0.07 2.42 2.96 0.17 -4.96 118.68 119.15 2d3r s LEU 126 Ca -0.05 -0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 53.76 2d3r s LEU 126 Cb -0.01 -0.07 0.03 0.00 0.50 0.00 0.00 46.19 46.65 2d3r s LEU 126 CO -0.03 -0.00 0.17 -2.28 -1.32 0.00 0.00 176.35 172.89 2d3r s HIS 127 N -0.13 -0.20 0.00 5.38 5.65 -1.26 0.82 115.29 125.55 2d3r s HIS 127 Ca -0.00 0.54 0.01 0.00 0.25 0.00 0.00 55.06 55.85 2d3r s HIS 127 Cb -0.01 -0.02 -0.01 0.00 -1.18 0.00 0.00 32.58 31.37 2d3r s HIS 127 CO -0.00 -0.16 -0.03 -0.59 -0.65 0.00 0.00 174.74 173.31 2d3r s PHE 128 N 0.92 0.24 0.00 3.88 -0.12 -0.77 -5.02 117.98 117.11 2d3r s PHE 128 Ca -0.07 -0.12 0.06 0.00 -0.05 0.00 0.00 56.93 56.75 2d3r s PHE 128 Cb -0.09 -0.15 -0.02 0.00 -0.63 0.00 0.00 43.02 42.14 2d3r s PHE 128 CO -0.05 -0.03 -0.18 0.95 -0.05 0.00 0.00 175.22 175.86 2d3r s THR 129 N -0.29 1.45 -0.14 -4.49 -4.23 -1.26 -1.11 115.64 105.56 2d3r s THR 129 Ca -0.02 -0.88 0.01 0.00 -1.18 0.00 0.00 61.69 59.63 2d3r s THR 129 Cb -0.02 -1.23 0.02 0.00 1.34 0.00 0.00 72.50 72.61 2d3r s THR 129 CO -0.00 0.33 -0.17 -0.36 -0.54 0.00 0.00 174.62 173.88 2d3r s PHE 130 N -0.53 2.32 -0.06 3.99 0.08 0.96 -4.98 117.98 119.75 2d3r s PHE 130 Ca 0.07 -1.26 0.13 0.00 0.12 0.00 0.00 56.93 55.98 2d3r s PHE 130 Cb -0.07 -1.65 -0.19 0.00 -0.57 0.00 0.00 43.02 40.53 2d3r s PHE 130 CO -0.00 -0.65 0.30 0.09 -0.10 0.00 0.00 175.22 174.86 2d3r n ASN 131 N 4.52 1.98 -4.09 1.36 3.02 -1.26 -0.43 115.26 120.36 2d3r n ASN 131 Ca -0.19 -0.06 -0.15 0.00 -0.03 0.00 0.00 54.58 54.15 2d3r n ASN 131 Cb 0.50 1.54 -0.12 0.00 -0.61 0.00 0.00 39.78 41.09 2d3r n ASN 131 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2d3r s GLN 132 N -2.83 0.62 -0.21 3.52 -2.07 -1.26 -4.67 119.66 112.76 2d3r s GLN 132 Ca -0.04 -0.77 -0.07 0.00 -1.82 0.00 0.00 55.36 52.66 2d3r s GLN 132 Cb 0.08 -0.47 -0.04 0.00 -1.09 0.00 0.00 33.01 31.50 2d3r s GLN 132 CO 0.53 0.10 0.06 -0.06 -1.32 0.00 0.00 175.29 174.59 2d3r s PHE 133 N -1.24 3.16 0.58 9.60 0.08 -0.70 -5.01 117.98 124.45 2d3r s PHE 133 Ca -0.07 -0.15 -0.19 0.00 0.12 0.00 0.00 56.93 56.64 2d3r s PHE 133 Cb -0.09 -2.13 -0.05 0.00 -0.57 0.00 0.00 43.02 40.17 2d3r s PHE 133 CO 0.01 -0.07 1.00 0.45 -0.10 0.00 0.00 175.22 176.51 2d3r n SER 134 N 4.10 0.99 -0.17 1.36 2.88 -1.26 -4.32 113.62 117.20 2d3r n SER 134 Ca -0.16 0.84 0.04 0.00 -1.33 0.00 0.00 58.87 58.26 2d3r n SER 134 Cb 0.52 -1.40 0.32 0.00 -0.75 0.00 0.00 64.21 62.90 2d3r n SER 134 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2d3r h GLN 135 N 0.66 0.80 -3.13 -1.46 4.15 -1.91 -3.26 115.11 110.95 2d3r h GLN 135 Ca -0.48 -0.05 -0.64 0.00 0.77 0.00 0.00 58.65 58.25 2d3r h GLN 135 Cb 1.36 -0.18 -0.41 0.00 0.21 0.00 0.00 27.48 28.46 2d3r h GLN 135 CO 0.52 0.53 -0.48 -0.80 -1.93 0.00 0.00 178.83 176.67 2d3r s ASN 136 N -6.32 5.06 -1.10 -0.69 0.01 -1.26 -4.68 114.94 105.96 2d3r s ASN 136 Ca -0.10 -3.83 -0.23 0.00 -0.71 0.00 0.00 52.86 47.99 2d3r s ASN 136 Cb 0.19 -1.69 -0.08 0.00 0.41 0.00 0.00 41.25 40.08 2d3r s ASN 136 CO 0.77 -0.10 1.94 -2.16 -1.51 0.00 0.00 177.10 176.04 2d3r s PRO 137 N -1.44 2.50 0.00 -0.60 0.04 -1.23 -4.80 135.00 129.48 2d3r s PRO 137 Ca 0.25 -0.89 0.15 0.00 0.04 0.00 0.00 61.00 60.56 2d3r s PRO 137 Cb -0.05 -5.19 0.73 0.00 0.04 0.00 0.00 34.50 30.03 2d3r s PRO 137 CO -0.16 -3.81 1.45 1.63 0.04 0.00 0.00 177.00 176.16 2d3r n LYS 138 N 8.46 0.14 -0.63 4.56 4.76 -1.26 -1.28 118.16 132.90 2d3r n LYS 138 Ca 0.43 0.18 0.05 0.00 -2.87 0.00 0.00 58.31 56.10 2d3r n LYS 138 Cb 0.47 -1.50 0.28 0.00 -1.84 0.00 0.00 35.03 32.44 2d3r n LYS 138 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2d3r n ASP 139 N -1.36 4.15 -4.02 4.39 5.75 -1.26 -4.95 116.55 119.24 2d3r n ASP 139 Ca 0.06 -3.12 -0.24 0.00 -0.01 0.00 0.00 54.79 51.48 2d3r n ASP 139 Cb 0.14 -0.61 -0.16 0.00 -1.03 0.00 0.00 41.12 39.46 2d3r n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2d3r s LEU 140 N -2.90 1.66 -0.73 -2.12 1.43 -0.41 -1.41 118.68 114.21 2d3r s LEU 140 Ca 0.46 -0.28 -0.26 0.00 -1.03 0.00 0.00 54.13 53.03 2d3r s LEU 140 Cb 0.37 -0.79 0.04 0.00 0.03 0.00 0.00 46.19 45.85 2d3r s LEU 140 CO 0.10 0.04 1.20 -0.63 0.23 0.00 0.00 176.35 177.29 2d3r s ILE 141 N 0.58 3.89 -0.01 -0.59 1.09 -0.36 -4.88 121.20 120.92 2d3r s ILE 141 Ca -0.12 0.16 -0.27 0.00 -1.10 0.00 0.00 60.65 59.32 2d3r s ILE 141 Cb -0.15 -4.86 -0.04 0.00 -1.06 0.00 0.00 42.46 36.35 2d3r s ILE 141 CO 0.03 -1.76 0.85 -0.76 -0.10 0.00 0.00 174.94 173.21 2d3r s LEU 142 N 5.26 4.37 -0.03 2.97 1.43 -1.26 -2.25 118.68 129.17 2d3r s LEU 142 Ca 0.32 1.48 0.03 0.00 -1.03 0.00 0.00 54.13 54.93 2d3r s LEU 142 Cb -0.10 -3.36 0.00 0.00 0.03 0.00 0.00 46.19 42.76 2d3r s LEU 142 CO 0.13 -0.15 -0.12 -1.10 0.23 0.00 0.00 176.35 175.33 2d3r s GLN 143 N 0.70 1.28 7.25 1.70 -0.21 0.31 -4.99 119.66 125.70 2d3r s GLN 143 Ca 0.45 -0.43 0.00 0.00 0.02 0.00 0.00 55.36 55.40 2d3r s GLN 143 Cb -0.20 -1.16 0.00 0.00 1.00 0.00 0.00 33.01 32.65 2d3r s GLN 143 CO 0.24 0.17 0.00 0.41 -2.12 0.00 0.00 175.29 173.99 2d3r n GLY 144 N 3.21 2.35 0.74 3.09 0.00 -1.26 -1.14 105.19 112.19 2d3r n GLY 144 Ca -0.18 -0.33 0.07 0.00 0.00 0.00 0.00 46.02 45.58 2d3r n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2d3r n ASP 145 N 6.24 2.16 -4.66 1.61 8.00 0.21 -4.90 116.55 125.21 2d3r n ASP 145 Ca 0.00 -2.00 -0.42 0.00 0.71 0.00 0.00 54.79 53.08 2d3r n ASP 145 Cb 0.00 -0.27 -0.03 0.00 -0.02 0.00 0.00 41.12 40.81 2d3r n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2d3r s ALA 146 N -1.46 3.61 0.21 2.24 0.00 -1.10 -4.30 121.76 120.97 2d3r s ALA 146 Ca 0.27 0.85 -0.00 0.00 0.00 0.00 0.00 51.96 53.08 2d3r s ALA 146 Cb 0.14 -3.73 -0.04 0.00 0.00 0.00 0.00 23.12 19.48 2d3r s ALA 146 CO 0.19 -1.39 0.11 -1.54 0.00 0.00 0.00 175.76 173.13 2d3r s SER 147 N 3.21 0.51 -0.15 0.00 1.04 -0.10 -4.66 113.70 113.54 2d3r s SER 147 Ca 0.71 -1.37 -0.06 0.00 0.48 0.00 0.00 55.95 55.70 2d3r s SER 147 Cb -0.31 0.30 -0.04 0.00 0.10 0.00 0.00 66.02 66.07 2d3r s SER 147 CO 0.27 -0.79 0.06 0.42 0.98 0.00 0.00 173.24 174.18 2d3r s THR 148 N -4.02 4.82 0.85 2.02 -4.23 -1.26 -0.38 115.64 113.44 2d3r s THR 148 Ca 0.37 -0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.74 2d3r s THR 148 Cb 0.07 -3.13 0.19 0.00 1.34 0.00 0.00 72.50 70.97 2d3r s THR 148 CO 0.12 0.51 1.16 -0.90 -0.54 0.00 0.00 174.62 174.97 2d3r n ASP 149 N 3.01 0.43 0.00 3.99 5.68 -0.78 -4.91 116.55 123.97 2d3r n ASP 149 Ca -0.17 -1.63 0.12 0.00 -0.50 0.00 0.00 54.79 52.61 2d3r n ASP 149 Cb 0.53 -0.85 0.74 0.00 -1.14 0.00 0.00 41.12 40.39 2d3r n ASP 149 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2d3r n SER 150 N -3.55 0.00 -0.60 -1.12 3.41 -1.26 -3.05 113.62 107.45 2d3r n SER 150 Ca 0.16 -0.85 0.12 0.00 -0.26 0.00 0.00 58.87 58.04 2d3r n SER 150 Cb 0.54 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.70 2d3r n SER 150 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2d3r n ASP 151 N -0.98 2.06 -1.57 4.04 8.00 -1.26 -4.94 116.55 121.89 2d3r n ASP 151 Ca 0.19 -1.56 -0.09 0.00 0.71 0.00 0.00 54.79 54.04 2d3r n ASP 151 Cb 0.09 0.16 0.03 0.00 -0.02 0.00 0.00 41.12 41.37 2d3r n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d3r n GLY 152 N 1.33 0.36 3.40 0.44 0.00 -1.17 -4.92 105.19 104.62 2d3r n GLY 152 Ca 0.13 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.53 2d3r n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2d3r s ASN 153 N -3.07 3.28 -0.42 1.61 0.01 -1.26 -1.72 114.94 113.38 2d3r s ASN 153 Ca 0.20 -0.81 -0.16 0.00 -0.71 0.00 0.00 52.86 51.37 2d3r s ASN 153 Cb -0.09 -0.23 0.02 0.00 0.41 0.00 0.00 41.25 41.37 2d3r s ASN 153 CO 0.24 0.13 0.38 -0.22 -1.51 0.00 0.00 177.10 176.12 2d3r s LEU 154 N -2.39 4.99 -0.72 0.60 2.96 0.25 -1.87 118.68 122.50 2d3r s LEU 154 Ca 0.17 -0.79 -0.22 0.00 -0.22 0.00 0.00 54.13 53.07 2d3r s LEU 154 Cb -0.09 -2.29 0.08 0.00 0.50 0.00 0.00 46.19 44.39 2d3r s LEU 154 CO 0.08 -0.54 1.02 -1.10 -1.32 0.00 0.00 176.35 174.49 2d3r s GLN 155 N 1.94 3.21 0.17 1.98 -1.52 0.49 -0.31 119.66 125.61 2d3r s GLN 155 Ca 0.09 -0.98 -0.15 0.00 -1.95 0.00 0.00 55.36 52.38 2d3r s GLN 155 Cb -0.18 -4.38 0.07 0.00 -0.22 0.00 0.00 33.01 28.30 2d3r s GLN 155 CO 0.12 -1.83 1.80 -0.07 -0.25 0.00 0.00 175.29 175.06 2d3r h LEU 156 N 11.30 0.42 -9.55 2.90 3.38 -1.70 -0.23 115.31 121.82 2d3r h LEU 156 Ca -0.20 0.01 -0.58 0.00 0.09 0.00 0.00 57.88 57.20 2d3r h LEU 156 Cb 1.06 -0.08 -0.10 0.00 0.09 0.00 0.00 40.66 41.63 2d3r h LEU 156 CO 1.18 0.30 -0.64 0.42 0.09 0.00 0.00 178.44 179.78 2d3r s THR 157 N -6.15 3.68 0.46 0.22 -4.23 -1.26 -2.70 115.64 105.66 2d3r s THR 157 Ca -0.13 -1.60 -0.25 0.00 -1.18 0.00 0.00 61.69 58.54 2d3r s THR 157 Cb 0.12 -2.90 -0.08 0.00 1.34 0.00 0.00 72.50 70.98 2d3r s THR 157 CO 0.73 -0.22 1.41 -0.60 -0.54 0.00 0.00 174.62 175.39 2d3r s ARG 158 N -3.27 3.65 -0.13 3.99 3.52 -1.26 -4.75 118.95 120.70 2d3r s ARG 158 Ca 0.29 2.37 -0.04 0.00 -0.13 0.00 0.00 55.73 58.22 2d3r s ARG 158 Cb -0.08 -2.62 0.06 0.00 -1.56 0.00 0.00 34.95 30.75 2d3r s ARG 158 CO 0.19 -0.83 0.13 0.08 -0.81 0.00 0.00 175.30 174.06 2d3r s VAL 159 N -1.22 -0.18 -0.21 7.11 1.01 -1.26 -3.09 120.40 122.55 2d3r s VAL 159 Ca 0.62 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.65 2d3r s VAL 159 Cb -0.43 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 2d3r s VAL 159 CO 0.54 -0.06 -0.00 -0.44 0.00 0.00 0.00 175.10 175.14 2d3r s SER 160 N 2.22 4.70 -1.28 3.32 0.01 0.12 -4.71 113.70 118.08 2d3r s SER 160 Ca 0.04 -0.26 -0.15 0.00 1.31 0.00 0.00 55.95 56.89 2d3r s SER 160 Cb -0.14 -1.81 0.01 0.00 0.21 0.00 0.00 66.02 64.29 2d3r s SER 160 CO -0.08 0.03 0.57 0.59 0.41 0.00 0.00 173.24 174.76 2d3r n ASN 161 N 4.48 -2.80 0.00 2.44 3.02 -1.26 -0.83 115.26 120.31 2d3r n ASN 161 Ca -0.17 -1.10 0.00 0.00 -0.03 0.00 0.00 54.58 53.28 2d3r n ASN 161 Cb 0.51 -2.74 0.00 0.00 -0.61 0.00 0.00 39.78 36.95 2d3r n ASN 161 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2d3r n GLY 162 N -1.96 0.80 3.43 7.41 0.00 -1.26 -4.99 105.19 108.62 2d3r n GLY 162 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 2d3r n GLY 162 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d3r s SER 163 N -2.70 4.24 1.29 1.61 0.15 -0.01 -5.05 113.70 113.23 2d3r s SER 163 Ca 0.00 -0.24 -0.18 0.00 0.70 0.00 0.00 55.95 56.24 2d3r s SER 163 Cb 0.00 -1.50 0.31 0.00 -1.71 0.00 0.00 66.02 63.12 2d3r s SER 163 CO 0.00 0.21 0.83 -2.65 1.20 0.00 0.00 173.24 172.83 2d3r n PRO 164 N 3.24 -3.35 -4.04 5.44 -0.02 -1.26 0.12 135.00 135.12 2d3r n PRO 164 Ca -0.18 -0.97 -0.11 0.00 -2.02 0.00 0.00 63.50 60.22 2d3r n PRO 164 Cb 0.53 -1.99 -0.11 0.00 -0.02 0.00 0.00 33.50 31.90 2d3r n PRO 164 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2d3r s GLN 165 N -4.48 0.48 0.59 -0.52 -1.52 -1.18 -4.63 119.66 108.40 2d3r s GLN 165 Ca 0.65 -0.78 -0.15 0.00 -1.95 0.00 0.00 55.36 53.13 2d3r s GLN 165 Cb -0.19 -0.12 -0.04 0.00 -0.22 0.00 0.00 33.01 32.45 2d3r s GLN 165 CO 0.61 0.00 1.04 -1.12 -0.25 0.00 0.00 175.29 175.57 2d3r s SER 166 N -1.74 5.94 -1.54 5.90 0.01 -1.26 -4.32 113.70 116.69 2d3r s SER 166 Ca -0.09 1.70 -0.09 0.00 1.31 0.00 0.00 55.95 58.78 2d3r s SER 166 Cb -0.08 -2.52 0.07 0.00 0.21 0.00 0.00 66.02 63.71 2d3r s SER 166 CO -0.01 -1.06 0.66 0.59 0.41 0.00 0.00 173.24 173.83 2d3r n ASN 167 N -2.15 -2.21 -4.82 2.44 3.02 -0.00 -4.94 115.26 106.59 2d3r n ASN 167 Ca 0.08 -0.96 -0.35 0.00 -0.03 0.00 0.00 54.58 53.32 2d3r n ASN 167 Cb 0.53 -3.12 -0.07 0.00 -0.61 0.00 0.00 39.78 36.52 2d3r n ASN 167 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2d3r s SER 168 N -3.79 5.98 -0.04 6.41 0.15 -1.22 -4.91 113.70 116.29 2d3r s SER 168 Ca 0.39 0.29 0.01 0.00 0.70 0.00 0.00 55.95 57.34 2d3r s SER 168 Cb -0.21 -1.83 0.02 0.00 -1.71 0.00 0.00 66.02 62.30 2d3r s SER 168 CO 0.89 0.33 -0.02 0.68 1.20 0.00 0.00 173.24 176.32 2d3r s VAL 169 N -1.12 0.34 0.01 4.45 -7.23 -1.26 -1.02 120.40 114.57 2d3r s VAL 169 Ca 0.20 -0.00 0.01 0.00 -1.81 0.00 0.00 61.98 60.38 2d3r s VAL 169 Cb -0.12 -0.41 -0.01 0.00 0.56 0.00 0.00 36.38 36.40 2d3r s VAL 169 CO 0.10 0.19 -0.04 -0.83 -0.31 0.00 0.00 175.10 174.21 2d3r s GLY 170 N 1.03 0.23 0.02 2.32 0.00 -0.78 0.67 107.32 110.82 2d3r s GLY 170 Ca -0.10 -0.33 0.02 0.00 0.00 0.00 0.00 44.72 44.32 2d3r s GLY 170 CO -0.01 -0.34 -0.07 0.50 0.00 0.00 0.00 173.10 173.19 2d3r s ARG 171 N -0.59 0.49 -0.03 2.90 0.52 -0.29 -0.93 118.95 121.03 2d3r s ARG 171 Ca -0.04 -0.54 0.04 0.00 -0.52 0.00 0.00 55.73 54.67 2d3r s ARG 171 Cb -0.04 -0.35 -0.00 0.00 0.52 0.00 0.00 34.95 35.08 2d3r s ARG 171 CO -0.00 0.08 -0.13 0.00 0.02 0.00 0.00 175.30 175.26 2d3r s ALA 172 N -0.89 1.20 0.09 2.13 0.00 0.16 -0.53 121.76 123.92 2d3r s ALA 172 Ca -0.05 -0.54 0.08 0.00 0.00 0.00 0.00 51.96 51.45 2d3r s ALA 172 Cb -0.07 -0.38 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 2d3r s ALA 172 CO 0.00 0.23 -0.21 -0.51 0.00 0.00 0.00 175.76 175.28 2d3r s LEU 173 N -0.01 2.27 -0.04 0.00 1.02 -0.96 -0.35 118.68 120.62 2d3r s LEU 173 Ca -0.01 -0.65 -0.30 0.00 0.02 0.00 0.00 54.13 53.19 2d3r s LEU 173 Cb -0.09 -0.89 -0.04 0.00 0.02 0.00 0.00 46.19 45.18 2d3r s LEU 173 CO 0.01 0.08 1.34 -0.47 0.02 0.00 0.00 176.35 177.32 2d3r s TYR 174 N -1.09 2.91 0.27 0.29 5.04 -0.01 -1.22 117.35 123.55 2d3r s TYR 174 Ca 0.06 0.93 -0.05 0.00 -2.44 0.00 0.00 57.07 55.58 2d3r s TYR 174 Cb -0.10 -3.59 0.53 0.00 0.35 0.00 0.00 41.96 39.16 2d3r s TYR 174 CO 0.04 -2.09 1.60 -0.92 -1.34 0.00 0.00 175.55 172.84 2d3r h TYR 175 N 7.83 -0.13 -3.65 4.97 3.20 -1.58 -3.41 116.97 124.20 2d3r h TYR 175 Ca -0.36 0.07 -0.51 0.00 3.14 0.00 0.00 58.73 61.07 2d3r h TYR 175 Cb 1.17 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 2d3r h TYR 175 CO 0.76 -0.33 0.40 0.00 -1.64 0.00 0.00 178.16 177.34 2d3r s ALA 176 N -6.11 3.33 0.56 1.82 0.00 -1.26 -4.99 121.76 115.11 2d3r s ALA 176 Ca -0.14 0.69 -0.19 0.00 0.00 0.00 0.00 51.96 52.33 2d3r s ALA 176 Cb 0.25 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 20.04 2d3r s ALA 176 CO 0.77 -0.01 1.12 -2.14 0.00 0.00 0.00 175.76 175.49 2d3r s PRO 177 N -0.65 3.30 -0.16 0.00 0.02 -1.26 -4.76 135.00 131.48 2d3r s PRO 177 Ca 0.45 1.55 0.00 0.00 0.02 0.00 0.00 61.00 63.03 2d3r s PRO 177 Cb -0.27 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.25 2d3r s PRO 177 CO 0.33 -0.88 -0.16 0.08 -0.33 0.00 0.00 177.00 176.04 2d3r s VAL 178 N -1.89 2.54 -1.19 3.83 1.01 0.67 -4.93 120.40 120.44 2d3r s VAL 178 Ca 0.71 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 61.70 2d3r s VAL 178 Cb -0.23 -2.07 0.08 0.00 0.00 0.00 0.00 36.38 34.17 2d3r s VAL 178 CO 0.29 0.52 1.58 -2.28 0.00 0.00 0.00 175.10 175.21 2d3r s HIS 179 N 0.90 2.84 0.03 5.22 2.46 -1.26 -1.96 115.29 123.51 2d3r s HIS 179 Ca -0.04 -1.48 0.23 0.00 0.47 0.00 0.00 55.06 54.24 2d3r s HIS 179 Cb -0.15 -4.65 0.75 0.00 -0.13 0.00 0.00 32.58 28.40 2d3r s HIS 179 CO -0.02 -1.76 1.75 0.28 -2.47 0.00 0.00 174.74 172.52 2d3r h VAL 180 N 5.78 0.51 -2.18 0.89 2.07 -1.34 -3.44 116.25 118.54 2d3r h VAL 180 Ca 0.35 -1.25 -0.07 0.00 0.82 0.00 0.00 66.70 66.54 2d3r h VAL 180 Cb 0.92 1.88 -0.20 0.00 -1.52 0.00 0.00 31.29 32.37 2d3r h VAL 180 CO 1.40 0.23 0.10 0.86 0.02 0.00 0.00 177.57 180.17 2d3r s TRP 181 N -3.49 -0.59 -0.01 1.57 -0.00 -1.01 -4.81 118.94 110.59 2d3r s TRP 181 Ca 0.02 1.09 -0.08 0.00 -0.00 0.00 0.00 56.10 57.12 2d3r s TRP 181 Cb 0.09 0.34 0.01 0.00 -0.00 0.00 0.00 33.47 33.90 2d3r s TRP 181 CO 0.65 -0.54 0.16 0.34 -0.00 0.00 0.00 176.95 177.57 2d3r s ASP 182 N -0.99 -0.02 0.33 5.86 -1.08 -1.26 -4.60 116.67 114.92 2d3r s ASP 182 Ca -0.10 -0.12 0.06 0.00 -0.52 0.00 0.00 52.55 51.87 2d3r s ASP 182 Cb -0.01 0.23 0.72 0.00 -1.46 0.00 0.00 42.92 42.40 2d3r s ASP 182 CO 0.08 -0.36 1.87 0.07 0.52 0.00 0.00 175.17 177.35 2d3r h LYS 183 N 4.35 0.78 -0.14 4.34 5.09 -2.03 -0.71 116.57 128.26 2d3r h LYS 183 Ca -0.30 -0.05 0.00 0.00 0.09 0.00 0.00 60.65 60.39 2d3r h LYS 183 Cb 1.19 -0.18 0.00 0.00 0.10 0.00 0.00 32.23 33.35 2d3r h LYS 183 CO 0.40 0.52 0.00 -1.13 -2.09 0.00 0.00 179.45 177.15 2d3r n SER 184 N -4.57 0.87 -4.73 7.07 3.41 -1.26 -4.88 113.62 109.53 2d3r n SER 184 Ca 0.17 -1.87 -0.41 0.00 -0.26 0.00 0.00 58.87 56.50 2d3r n SER 184 Cb 0.41 -0.09 -0.05 0.00 -0.26 0.00 0.00 64.21 64.22 2d3r n SER 184 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d3r s ALA 185 N -1.81 3.26 -0.22 7.33 0.00 -0.27 -4.89 121.76 125.15 2d3r s ALA 185 Ca 0.17 0.56 -0.20 0.00 0.00 0.00 0.00 51.96 52.49 2d3r s ALA 185 Cb 0.09 -3.25 -0.18 0.00 0.00 0.00 0.00 23.12 19.78 2d3r s ALA 185 CO 0.12 0.00 0.09 0.28 0.00 0.00 0.00 175.76 176.25 2d3r n VAL 186 N 2.68 1.53 -4.45 0.00 0.31 -1.22 -4.96 118.33 112.23 2d3r n VAL 186 Ca 0.02 -0.11 -0.22 0.00 -0.01 0.00 0.00 64.34 64.02 2d3r n VAL 186 Cb 0.49 -2.01 -0.14 0.00 -0.91 0.00 0.00 33.84 31.28 2d3r n VAL 186 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2d3r s VAL 187 N -2.40 1.25 -0.01 2.52 1.01 -1.24 -4.91 120.40 116.63 2d3r s VAL 187 Ca -0.31 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 60.67 2d3r s VAL 187 Cb 0.08 -1.12 -0.00 0.00 0.00 0.00 0.00 36.38 35.34 2d3r s VAL 187 CO 0.57 0.08 -0.07 0.00 0.00 0.00 0.00 175.10 175.68 2d3r s ALA 188 N -0.80 0.60 0.02 5.51 0.00 -1.26 -2.90 121.76 122.93 2d3r s ALA 188 Ca 0.03 -0.27 -0.14 0.00 0.00 0.00 0.00 51.96 51.58 2d3r s ALA 188 Cb -0.08 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 22.88 2d3r s ALA 188 CO 0.01 0.13 0.30 -1.54 0.00 0.00 0.00 175.76 174.66 2d3r s SER 189 N -0.03 -0.14 0.04 0.00 1.04 -0.97 -0.00 113.70 113.65 2d3r s SER 189 Ca 0.01 -0.10 -0.04 0.00 0.48 0.00 0.00 55.95 56.30 2d3r s SER 189 Cb -0.04 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.39 2d3r s SER 189 CO -0.00 -0.55 0.05 0.72 0.98 0.00 0.00 173.24 174.44 2d3r s PHE 190 N -2.10 0.30 -0.08 5.02 -0.12 -0.91 -1.47 117.98 118.61 2d3r s PHE 190 Ca -0.08 -0.69 -0.04 0.00 -0.05 0.00 0.00 56.93 56.08 2d3r s PHE 190 Cb -0.02 -0.22 0.05 0.00 -0.63 0.00 0.00 43.02 42.20 2d3r s PHE 190 CO -0.01 -0.36 0.18 -0.51 -0.05 0.00 0.00 175.22 174.47 2d3r s ASP 191 N -2.35 0.30 -0.03 1.98 1.01 -0.83 -2.08 116.67 114.68 2d3r s ASP 191 Ca -0.02 0.37 0.04 0.00 0.71 0.00 0.00 52.55 53.66 2d3r s ASP 191 Cb 0.01 0.31 -0.01 0.00 1.01 0.00 0.00 42.92 44.24 2d3r s ASP 191 CO -0.06 -0.20 -0.16 0.00 0.21 0.00 0.00 175.17 174.96 2d3r s ALA 192 N 1.82 1.37 -0.02 5.23 0.00 0.12 -0.99 121.76 129.29 2d3r s ALA 192 Ca -0.03 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.31 2d3r s ALA 192 Cb -0.12 -0.42 0.00 0.00 0.00 0.00 0.00 23.12 22.59 2d3r s ALA 192 CO -0.06 0.28 -0.06 0.99 0.00 0.00 0.00 175.76 176.90 2d3r s THR 193 N -0.11 0.55 -0.01 0.00 2.01 0.75 0.51 115.64 119.34 2d3r s THR 193 Ca 0.00 -0.26 -0.10 0.00 0.31 0.00 0.00 61.69 61.65 2d3r s THR 193 Cb -0.09 -0.50 0.01 0.00 0.01 0.00 0.00 72.50 71.93 2d3r s THR 193 CO 0.01 0.18 0.21 0.72 -0.69 0.00 0.00 174.62 175.04 2d3r s PHE 194 N 0.12 -0.06 -0.10 4.92 -0.71 -0.77 0.18 117.98 121.56 2d3r s PHE 194 Ca -0.01 0.08 -0.01 0.00 -1.04 0.00 0.00 56.93 55.95 2d3r s PHE 194 Cb -0.06 0.02 -0.03 0.00 -1.21 0.00 0.00 43.02 41.74 2d3r s PHE 194 CO -0.00 -0.31 -0.06 0.95 -1.34 0.00 0.00 175.22 174.47 2d3r s THR 195 N -1.22 3.79 0.20 -4.49 -4.23 0.33 -1.41 115.64 108.61 2d3r s THR 195 Ca -0.13 -0.43 0.08 0.00 -1.18 0.00 0.00 61.69 60.03 2d3r s THR 195 Cb -0.06 -2.59 -0.05 0.00 1.34 0.00 0.00 72.50 71.15 2d3r s THR 195 CO 0.02 0.57 -0.15 0.72 -0.54 0.00 0.00 174.62 175.24 2d3r s PHE 196 N -0.45 1.75 -0.19 3.99 -0.12 -0.70 -0.70 117.98 121.55 2d3r s PHE 196 Ca 0.07 -0.55 -0.03 0.00 -0.05 0.00 0.00 56.93 56.37 2d3r s PHE 196 Cb -0.12 -0.82 0.06 0.00 -0.63 0.00 0.00 43.02 41.51 2d3r s PHE 196 CO 0.02 0.38 0.05 -1.17 -0.05 0.00 0.00 175.22 174.45 2d3r s LEU 197 N -3.25 0.97 -0.31 -1.99 2.96 0.59 -0.09 118.68 117.55 2d3r s LEU 197 Ca 0.22 -0.79 -0.05 0.00 -0.22 0.00 0.00 54.13 53.29 2d3r s LEU 197 Cb -0.02 -0.50 0.03 0.00 0.50 0.00 0.00 46.19 46.21 2d3r s LEU 197 CO 0.07 -0.32 0.06 -0.63 -1.32 0.00 0.00 176.35 174.22 2d3r s ILE 198 N 1.93 3.59 0.04 6.68 1.01 -1.25 -2.37 121.20 130.82 2d3r s ILE 198 Ca 0.00 -1.08 0.03 0.00 0.00 0.00 0.00 60.65 59.60 2d3r s ILE 198 Cb -0.17 -2.98 -0.02 0.00 0.01 0.00 0.00 42.46 39.30 2d3r s ILE 198 CO -0.09 -0.08 -0.09 -0.75 0.00 0.00 0.00 174.94 173.93 2d3r s LYS 199 N 1.39 0.59 0.19 2.79 2.20 -1.24 -1.48 119.74 124.18 2d3r s LYS 199 Ca -0.01 -0.67 -0.17 0.00 -0.36 0.00 0.00 55.97 54.77 2d3r s LYS 199 Cb -0.19 -0.46 0.02 0.00 -1.51 0.00 0.00 37.83 35.70 2d3r s LYS 199 CO 0.01 0.10 0.50 0.45 -0.36 0.00 0.00 175.35 176.05 2d3r s SER 200 N -1.25 -0.23 0.16 1.43 0.15 -1.26 -0.30 113.70 112.40 2d3r s SER 200 Ca -0.05 -0.53 0.05 0.00 0.70 0.00 0.00 55.95 56.12 2d3r s SER 200 Cb -0.08 0.57 -0.05 0.00 -1.71 0.00 0.00 66.02 64.75 2d3r s SER 200 CO 0.01 -1.04 1.36 0.74 1.20 0.00 0.00 173.24 175.50 2d3r h THR 201 N 2.23 1.58 -3.24 6.45 2.02 -1.96 -3.46 112.91 116.53 2d3r h THR 201 Ca -0.29 -2.90 -0.50 0.00 0.77 0.00 0.00 66.41 63.50 2d3r h THR 201 Cb 1.26 2.60 0.00 0.00 -1.74 0.00 0.00 68.15 70.28 2d3r h THR 201 CO 0.38 0.83 -0.08 -1.81 0.37 0.00 0.00 175.52 175.22 2d3r s ASP 202 N -6.84 6.39 0.08 4.18 1.01 -1.26 -5.01 116.67 115.21 2d3r s ASP 202 Ca -0.01 0.74 0.06 0.00 0.71 0.00 0.00 52.55 54.05 2d3r s ASP 202 Cb 0.10 -2.16 -0.22 0.00 1.01 0.00 0.00 42.92 41.65 2d3r s ASP 202 CO 0.82 -0.31 1.14 0.77 0.21 0.00 0.00 175.17 177.80 2d3r h SER 203 N 1.16 0.07 -3.03 0.27 4.64 -1.98 -3.43 113.55 111.25 2d3r h SER 203 Ca -0.48 -0.08 -0.56 0.00 -0.47 0.00 0.00 61.79 60.20 2d3r h SER 203 Cb 1.20 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 63.23 2d3r h SER 203 CO 0.64 1.06 0.79 -1.81 -0.87 0.00 0.00 176.83 176.65 2d3r s ASP 204 N -6.67 7.03 0.11 4.97 -0.00 -1.26 -5.04 116.67 115.82 2d3r s ASP 204 Ca -0.01 1.65 0.04 0.00 -0.00 0.00 0.00 52.55 54.23 2d3r s ASP 204 Cb 0.09 -2.55 -0.04 0.00 -0.00 0.00 0.00 42.92 40.43 2d3r s ASP 204 CO 0.83 -0.66 -0.10 0.27 -0.00 0.00 0.00 175.17 175.50 2d3r s ILE 205 N 2.92 1.03 0.01 0.77 -4.36 -1.26 -4.52 121.20 115.80 2d3r s ILE 205 Ca 0.52 -1.77 -0.24 0.00 -0.26 0.00 0.00 60.65 58.90 2d3r s ILE 205 Cb -0.21 -1.52 0.06 0.00 1.25 0.00 0.00 42.46 42.03 2d3r s ILE 205 CO 0.15 -0.60 0.55 0.00 0.24 0.00 0.00 174.94 175.28 2d3r s ALA 206 N -2.69 -1.42 0.00 2.27 0.00 -1.25 -4.31 121.76 114.36 2d3r s ALA 206 Ca 0.09 0.80 0.00 0.00 0.00 0.00 0.00 51.96 52.85 2d3r s ALA 206 Cb -0.01 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.34 2d3r s ALA 206 CO 0.00 -0.44 0.00 -0.25 0.00 0.00 0.00 175.76 175.07 2d3r n ASP 207 N 0.65 2.03 0.00 0.00 8.00 -0.61 -3.41 116.55 123.21 2d3r n ASP 207 Ca -0.19 -0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.14 2d3r n ASP 207 Cb 0.59 0.75 0.00 0.00 -0.02 0.00 0.00 41.12 42.44 2d3r n ASP 207 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d3r n GLY 208 N 1.36 2.08 3.22 0.44 0.00 -1.24 -2.51 105.19 108.54 2d3r n GLY 208 Ca 0.00 -1.93 -0.27 0.00 0.00 0.00 0.00 46.02 43.83 2d3r n GLY 208 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d3r s ILE 209 N -1.52 1.62 0.02 -0.61 1.01 -0.97 -3.17 121.20 117.59 2d3r s ILE 209 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.69 2d3r s ILE 209 Cb 0.00 -1.37 -0.02 0.00 0.01 0.00 0.00 42.46 41.09 2d3r s ILE 209 CO 0.00 0.39 -0.03 0.00 0.00 0.00 0.00 174.94 175.30 2d3r s ALA 210 N -0.57 0.16 -0.15 9.38 0.00 0.79 0.17 121.76 131.54 2d3r s ALA 210 Ca 0.08 -0.46 -0.09 0.00 0.00 0.00 0.00 51.96 51.49 2d3r s ALA 210 Cb -0.08 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 2d3r s ALA 210 CO -0.00 -0.10 0.14 0.12 0.00 0.00 0.00 175.76 175.93 2d3r s PHE 211 N -1.06 3.52 0.00 0.00 5.36 -0.89 -0.21 117.98 124.69 2d3r s PHE 211 Ca -0.11 0.46 -0.01 0.00 -0.96 0.00 0.00 56.93 56.31 2d3r s PHE 211 Cb -0.07 -2.05 -0.01 0.00 -0.34 0.00 0.00 43.02 40.55 2d3r s PHE 211 CO -0.01 0.54 0.01 -0.59 -1.46 0.00 0.00 175.22 173.72 2d3r s PHE 212 N -0.42 0.11 -0.10 10.12 -0.71 0.82 -0.38 117.98 127.42 2d3r s PHE 212 Ca 0.12 -0.22 0.01 0.00 -1.04 0.00 0.00 56.93 55.80 2d3r s PHE 212 Cb -0.12 -0.09 -0.02 0.00 -1.21 0.00 0.00 43.02 41.58 2d3r s PHE 212 CO 0.02 -0.12 -0.10 0.42 -1.34 0.00 0.00 175.22 174.09 2d3r s ILE 213 N -0.78 3.35 0.28 -4.49 1.01 0.84 -0.87 121.20 120.53 2d3r s ILE 213 Ca -0.09 -0.59 -0.05 0.00 0.00 0.00 0.00 60.65 59.93 2d3r s ILE 213 Cb -0.05 -2.38 0.02 0.00 0.01 0.00 0.00 42.46 40.05 2d3r s ILE 213 CO -0.00 0.56 0.45 0.00 0.00 0.00 0.00 174.94 175.94 2d3r n ALA 214 N 2.86 -0.61 -1.63 9.38 0.00 -1.04 -1.63 120.51 127.85 2d3r n ALA 214 Ca -0.18 -1.14 -0.32 0.00 0.00 0.00 0.00 53.44 51.80 2d3r n ALA 214 Cb 0.53 0.92 0.02 0.00 0.00 0.00 0.00 19.45 20.91 2d3r n ALA 214 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2d3r s ASN 215 N -2.62 5.63 0.31 0.00 0.01 -1.26 -1.34 114.94 115.68 2d3r s ASN 215 Ca 0.19 1.81 0.05 0.00 -0.71 0.00 0.00 52.86 54.20 2d3r s ASN 215 Cb -0.02 -2.53 0.70 0.00 0.41 0.00 0.00 41.25 39.81 2d3r s ASN 215 CO 0.14 -1.27 1.83 0.71 -1.51 0.00 0.00 177.10 177.00 2d3r h THR 216 N 0.22 0.84 -0.01 1.60 1.35 -1.83 -1.25 112.91 113.82 2d3r h THR 216 Ca -0.46 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 2d3r h THR 216 Cb 1.22 -0.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 2d3r h THR 216 CO 0.57 0.15 -0.00 -0.90 -0.25 0.00 0.00 175.52 175.09 2d3r n ASP 217 N -4.63 1.29 -4.64 5.36 5.75 -1.26 -4.76 116.55 113.66 2d3r n ASP 217 Ca 0.20 -1.42 -0.47 0.00 -0.01 0.00 0.00 54.79 53.09 2d3r n ASP 217 Cb 0.45 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.51 2d3r n ASP 217 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2d3r n SER 218 N 0.01 2.41 -4.23 -1.12 2.88 -0.47 -5.00 113.62 108.09 2d3r n SER 218 Ca 0.20 1.13 -0.18 0.00 -1.33 0.00 0.00 58.87 58.69 2d3r n SER 218 Cb 0.32 -1.36 -0.10 0.00 -0.75 0.00 0.00 64.21 62.32 2d3r n SER 218 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d3r s SER 219 N 0.36 1.41 -0.12 -3.46 1.04 -1.26 -5.02 113.70 106.64 2d3r s SER 219 Ca 0.73 -1.44 -0.29 0.00 0.48 0.00 0.00 55.95 55.43 2d3r s SER 219 Cb -0.73 0.22 -0.06 0.00 0.10 0.00 0.00 66.02 65.56 2d3r s SER 219 CO 0.48 -0.77 1.99 -0.63 0.98 0.00 0.00 173.24 175.29 2d3r s ILE 220 N -3.67 3.16 0.00 -1.02 1.01 -1.26 -4.99 121.20 114.43 2d3r s ILE 220 Ca 0.37 0.18 0.00 0.00 0.00 0.00 0.00 60.65 61.20 2d3r s ILE 220 Cb 0.07 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.38 2d3r s ILE 220 CO 0.15 -0.07 0.00 -2.65 0.00 0.00 0.00 174.94 172.37 2d3r n PRO 221 N 8.06 1.19 -0.09 2.79 -0.02 -1.26 -5.02 135.00 140.65 2d3r n PRO 221 Ca 0.24 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.59 2d3r n PRO 221 Cb 0.44 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.87 2d3r n PRO 221 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 2d3r n HIS 222 N -1.11 0.41 -0.44 6.00 1.44 -1.26 -4.37 115.22 115.89 2d3r n HIS 222 Ca 0.00 0.18 -0.15 0.00 -2.01 0.00 0.00 57.72 55.74 2d3r n HIS 222 Cb 0.00 -0.73 0.07 0.00 0.12 0.00 0.00 29.99 29.45 2d3r n HIS 222 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2d3r n GLY 223 N 1.48 3.65 0.34 -1.39 0.00 -1.25 -4.63 105.19 103.39 2d3r n GLY 223 Ca -0.20 -0.80 0.04 0.00 0.00 0.00 0.00 46.02 45.06 2d3r n GLY 223 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2d3r h SER 224 N 0.89 0.70 -0.34 1.61 0.02 -1.76 -3.43 113.55 111.23 2d3r h SER 224 Ca 0.33 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2d3r h SER 224 Cb 1.58 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.96 2d3r h SER 224 CO 0.67 0.48 0.00 0.61 -1.14 0.00 0.00 176.83 177.45 2d3r n GLY 225 N -1.44 -2.58 4.71 -3.77 0.00 -1.26 -1.94 105.19 98.91 2d3r n GLY 225 Ca 0.09 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.24 2d3r n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d3r n GLY 226 N 0.00 0.43 0.45 -0.02 0.00 -1.24 -0.25 105.19 104.57 2d3r n GLY 226 Ca 0.00 0.51 0.04 0.00 0.00 0.00 0.00 46.02 46.57 2d3r n GLY 226 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2d3r n ARG 227 N 0.00 2.24 -0.03 1.61 1.85 -1.26 -3.28 116.66 117.78 2d3r n ARG 227 Ca 0.00 -1.70 0.12 0.00 -1.00 0.00 0.00 57.85 55.28 2d3r n ARG 227 Cb 0.00 -1.19 0.24 0.00 -1.05 0.00 0.00 32.46 30.46 2d3r n ARG 227 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2d3r n LEU 228 N 0.32 2.60 -2.29 2.89 4.77 0.65 -4.98 117.00 120.97 2d3r n LEU 228 Ca 0.08 -0.92 -0.12 0.00 -0.03 0.00 0.00 56.01 55.02 2d3r n LEU 228 Cb 0.34 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.38 2d3r n LEU 228 CO 0.06 0.46 -0.15 0.18 -1.33 0.00 0.00 177.39 176.61 2d3r n LEU 229 N 1.00 -1.08 0.00 2.23 4.77 -0.99 -0.22 117.00 122.72 2d3r n LEU 229 Ca 0.16 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 2d3r n LEU 229 Cb 0.52 -2.07 0.00 0.00 -2.33 0.00 0.00 43.42 39.54 2d3r n LEU 229 CO 0.15 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.63 2d3r n GLY 230 N -0.71 0.39 0.13 -0.72 0.00 -0.82 -4.28 105.19 99.18 2d3r n GLY 230 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 2d3r n GLY 230 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d3r n LEU 231 N 0.00 2.00 -4.39 0.99 4.77 0.69 -4.35 117.00 116.71 2d3r n LEU 231 Ca 0.00 0.33 -0.25 0.00 -0.03 0.00 0.00 56.01 56.07 2d3r n LEU 231 Cb 0.13 -0.86 -0.11 0.00 -2.33 0.00 0.00 43.42 40.24 2d3r n LEU 231 CO 0.00 0.53 -0.51 -0.36 -1.33 0.00 0.00 177.39 175.72 2d3r s PHE 232 N -2.48 2.12 -0.18 -1.77 0.08 -1.19 -4.76 117.98 109.80 2d3r s PHE 232 Ca -0.36 -0.40 0.18 0.00 0.12 0.00 0.00 56.93 56.47 2d3r s PHE 232 Cb 0.12 -1.04 -0.02 0.00 -0.57 0.00 0.00 43.02 41.51 2d3r s PHE 232 CO 0.52 0.45 1.08 -1.00 -0.10 0.00 0.00 175.22 176.18 2d3r h PRO 233 N 3.16 0.00 -4.85 0.24 0.13 -1.92 -3.35 132.00 125.40 2d3r h PRO 233 Ca -0.44 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.32 2d3r h PRO 233 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 2d3r h PRO 233 CO 0.50 0.24 -0.59 0.16 -0.23 0.00 0.00 178.00 178.08 2d3r s ASP 234 N -5.86 1.23 0.00 1.44 1.47 -1.26 -3.86 116.67 109.82 2d3r s ASP 234 Ca 0.00 -1.46 0.21 0.00 1.18 0.00 0.00 52.55 52.48 2d3r s ASP 234 Cb 0.08 0.28 0.71 0.00 -0.34 0.00 0.00 42.92 43.65 2d3r s ASP 234 CO 0.78 -0.81 1.53 0.00 0.68 0.00 0.00 175.17 177.35 2d3r n ALA 235 N -0.49 2.51 0.19 2.11 0.00 -1.26 -4.69 120.51 118.87 2d3r n ALA 235 Ca 0.01 -0.56 0.02 0.00 0.00 0.00 0.00 53.44 52.90 2d3r n ALA 235 Cb 0.66 -1.07 0.09 0.00 0.00 0.00 0.00 19.45 19.13 2d3r n ALA 235 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59