#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x3u s VAL 10 N 0.00 3.97 0.26 5.18 1.01 -1.26 -4.98 120.40 124.58 2x3u s VAL 10 Ca 0.00 1.25 -0.30 0.00 0.00 0.00 0.00 61.98 62.93 2x3u s VAL 10 Cb 0.00 -3.81 -0.11 0.00 0.00 0.00 0.00 36.38 32.47 2x3u s VAL 10 CO 0.00 -0.06 1.53 -2.16 0.00 0.00 0.00 175.10 174.41 2x3u s PRO 11 N 3.12 4.19 -0.13 2.72 0.04 -1.26 -5.02 135.00 138.66 2x3u s PRO 11 Ca 0.61 2.45 -0.12 0.00 0.04 0.00 0.00 61.00 63.98 2x3u s PRO 11 Cb -0.27 -3.07 0.04 0.00 0.04 0.00 0.00 34.50 31.23 2x3u s PRO 11 CO 0.22 -0.54 0.35 0.14 0.04 0.00 0.00 177.00 177.21 2x3u s VAL 12 N 0.10 -0.00 -1.40 -0.36 -7.23 -1.26 -4.71 120.40 105.54 2x3u s VAL 12 Ca 0.62 0.01 -0.03 0.00 -1.81 0.00 0.00 61.98 60.77 2x3u s VAL 12 Cb -0.45 -0.49 0.02 0.00 0.56 0.00 0.00 36.38 36.02 2x3u s VAL 12 CO 0.44 0.00 0.61 0.59 -0.31 0.00 0.00 175.10 176.44 2x3u n ASN 13 N 2.97 -1.31 0.18 4.85 3.02 0.41 -4.80 115.26 120.56 2x3u n ASN 13 Ca -0.14 -0.91 0.02 0.00 -0.03 0.00 0.00 54.58 53.52 2x3u n ASN 13 Cb 0.57 -3.52 0.32 0.00 -0.61 0.00 0.00 39.78 36.55 2x3u n ASN 13 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2x3u h LEU 14 N -1.86 0.00 -8.31 3.41 3.38 -1.02 -3.43 115.31 107.49 2x3u h LEU 14 Ca -0.62 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 56.89 2x3u h LEU 14 Cb 1.37 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.86 2x3u h LEU 14 CO 0.62 0.42 -0.80 -0.31 0.09 0.00 0.00 178.44 178.45 2x3u s TYR 15 N -4.08 1.29 0.23 1.13 2.02 -0.54 -4.98 117.35 112.41 2x3u s TYR 15 Ca -0.02 -0.32 0.08 0.00 -0.37 0.00 0.00 57.07 56.43 2x3u s TYR 15 Cb 0.14 -0.78 -0.05 0.00 -0.40 0.00 0.00 41.96 40.87 2x3u s TYR 15 CO 0.73 0.02 -0.13 1.03 -1.57 0.00 0.00 175.55 175.64 2x3u s ARG 16 N -0.89 1.41 0.54 -0.62 0.52 -1.26 -0.66 118.95 117.99 2x3u s ARG 16 Ca 0.03 -1.65 0.26 0.00 -0.52 0.00 0.00 55.73 53.85 2x3u s ARG 16 Cb -0.07 -1.17 1.43 0.00 0.52 0.00 0.00 34.95 35.66 2x3u s ARG 16 CO 0.01 0.16 2.01 -1.35 0.02 0.00 0.00 175.30 176.15 2x3u h PRO 17 N 2.47 0.00 0.00 3.54 0.11 -1.98 -1.47 132.00 134.67 2x3u h PRO 17 Ca -0.39 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.65 2x3u h PRO 17 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2x3u h PRO 17 CO 0.63 0.00 -0.34 -2.95 -0.21 0.00 0.00 178.00 175.13 2x3u h ASN 18 N 0.00 0.00 -1.67 -2.05 -1.07 -2.01 -3.36 115.58 105.43 2x3u h ASN 18 Ca 0.21 0.00 -0.49 0.00 0.07 0.00 0.00 56.30 56.10 2x3u h ASN 18 Cb 0.91 0.00 -0.33 0.00 -2.07 0.00 0.00 38.32 36.82 2x3u h ASN 18 CO -0.00 0.34 -0.95 0.00 0.07 0.00 0.00 177.43 176.89 2x3u n ALA 19 N -2.27 1.63 -1.36 4.14 0.00 -0.59 -5.15 120.51 116.91 2x3u n ALA 19 Ca 0.00 -2.89 -0.30 0.00 0.00 0.00 0.00 53.44 50.25 2x3u n ALA 19 Cb 0.50 -0.92 0.10 0.00 0.00 0.00 0.00 19.45 19.13 2x3u n ALA 19 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2x3u s PRO 20 N -0.55 2.01 0.07 0.00 0.04 -0.96 -4.05 135.00 131.55 2x3u s PRO 20 Ca 0.34 0.91 -0.30 0.00 0.04 0.00 0.00 61.00 61.98 2x3u s PRO 20 Cb 0.15 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.75 2x3u s PRO 20 CO -0.15 -1.74 1.00 0.12 0.04 0.00 0.00 177.00 176.27 2x3u s PHE 21 N -2.99 3.69 -0.61 0.56 5.36 0.11 -4.81 117.98 119.29 2x3u s PHE 21 Ca 0.61 1.69 -0.21 0.00 -0.96 0.00 0.00 56.93 58.07 2x3u s PHE 21 Cb -0.16 -3.14 0.09 0.00 -0.34 0.00 0.00 43.02 39.47 2x3u s PHE 21 CO 0.56 -0.10 0.81 0.42 -1.46 0.00 0.00 175.22 175.45 2x3u s ILE 22 N 0.50 4.61 0.38 3.12 -1.09 -1.26 -0.01 121.20 127.45 2x3u s ILE 22 Ca 0.50 -0.68 0.02 0.00 -2.23 0.00 0.00 60.65 58.27 2x3u s ILE 22 Cb -0.23 -4.56 -0.02 0.00 -1.58 0.00 0.00 42.46 36.07 2x3u s ILE 22 CO 0.29 -1.25 0.57 -0.83 -1.23 0.00 0.00 174.94 172.50 2x3u s GLY 23 N 3.58 1.46 -0.09 6.18 0.00 0.05 -4.86 107.32 113.64 2x3u s GLY 23 Ca 0.16 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.80 2x3u s GLY 23 CO 0.08 -0.99 -0.10 0.54 0.00 0.00 0.00 173.10 172.64 2x3u s LYS 24 N -4.36 3.01 0.13 2.90 1.02 -1.22 -0.09 119.74 121.14 2x3u s LYS 24 Ca 0.44 -0.61 -0.31 0.00 0.02 0.00 0.00 55.97 55.50 2x3u s LYS 24 Cb -0.10 -2.61 -0.09 0.00 -0.52 0.00 0.00 37.83 34.51 2x3u s LYS 24 CO 0.35 0.47 1.56 0.08 -0.92 0.00 0.00 175.35 176.89 2x3u s VAL 25 N -0.30 2.84 -0.23 3.17 1.01 0.02 0.21 120.40 127.13 2x3u s VAL 25 Ca 0.03 0.54 -0.17 0.00 0.00 0.00 0.00 61.98 62.38 2x3u s VAL 25 Cb -0.13 -3.34 -0.17 0.00 0.00 0.00 0.00 36.38 32.74 2x3u s VAL 25 CO 0.03 0.03 0.02 -0.38 0.00 0.00 0.00 175.10 174.79 2x3u n ILE 26 N 4.17 1.55 -3.81 2.22 5.41 0.98 -0.77 119.36 129.12 2x3u n ILE 26 Ca 0.14 -0.23 -0.10 0.00 1.00 0.00 0.00 62.75 63.56 2x3u n ILE 26 Cb 0.40 -1.93 -0.08 0.00 -0.71 0.00 0.00 39.64 37.32 2x3u n ILE 26 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2x3u s SER 27 N -7.07 -0.01 -0.26 4.38 1.04 -1.16 -4.73 113.70 105.89 2x3u s SER 27 Ca -0.32 -0.38 -0.03 0.00 0.48 0.00 0.00 55.95 55.70 2x3u s SER 27 Cb 0.09 0.33 0.11 0.00 0.10 0.00 0.00 66.02 66.65 2x3u s SER 27 CO 0.57 -0.63 0.20 0.21 0.98 0.00 0.00 173.24 174.57 2x3u s ASN 28 N -2.31 2.27 -0.02 7.02 3.04 -1.26 -1.48 114.94 122.20 2x3u s ASN 28 Ca -0.02 -0.79 0.06 0.00 0.04 0.00 0.00 52.86 52.15 2x3u s ASN 28 Cb 0.01 0.13 -0.01 0.00 -1.54 0.00 0.00 41.25 39.83 2x3u s ASN 28 CO -0.06 -0.39 -0.20 -1.61 -3.04 0.00 0.00 177.10 171.80 2x3u s GLU 29 N 2.25 1.73 0.27 0.43 0.41 -0.29 -4.94 118.70 118.55 2x3u s GLU 29 Ca 0.08 -0.72 -0.29 0.00 -0.41 0.00 0.00 54.97 53.63 2x3u s GLU 29 Cb -0.15 -1.62 -0.09 0.00 -1.78 0.00 0.00 34.13 30.48 2x3u s GLU 29 CO -0.27 0.40 1.15 -1.25 -0.49 0.00 0.00 175.26 174.80 2x3u s PRO 30 N -0.37 4.57 -0.02 0.39 0.04 -1.26 0.06 135.00 138.40 2x3u s PRO 30 Ca 0.05 1.88 0.15 0.00 0.04 0.00 0.00 61.00 63.12 2x3u s PRO 30 Cb -0.09 -3.18 -0.22 0.00 0.04 0.00 0.00 34.50 31.05 2x3u s PRO 30 CO -0.00 0.09 0.33 1.28 0.04 0.00 0.00 177.00 178.74 2x3u n LEU 31 N 1.41 0.04 -4.63 -3.56 4.77 0.12 -4.84 117.00 110.30 2x3u n LEU 31 Ca 0.00 -0.03 -0.41 0.00 -0.03 0.00 0.00 56.01 55.54 2x3u n LEU 31 Cb 0.44 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.48 2x3u n LEU 31 CO 0.55 0.01 0.52 -0.69 -1.33 0.00 0.00 177.39 176.45 2x3u s VAL 32 N -2.97 4.91 0.69 4.08 1.01 -1.24 -4.65 120.40 122.23 2x3u s VAL 32 Ca -0.05 1.33 -0.11 0.00 0.00 0.00 0.00 61.98 63.15 2x3u s VAL 32 Cb 0.09 -4.03 0.01 0.00 0.00 0.00 0.00 36.38 32.46 2x3u s VAL 32 CO 0.60 -0.03 1.08 -0.54 0.00 0.00 0.00 175.10 176.20 2x3u s LYS 33 N 2.68 2.85 0.41 2.72 -0.14 -0.61 -4.91 119.74 122.73 2x3u s LYS 33 Ca 0.30 0.40 -0.25 0.00 -1.36 0.00 0.00 55.97 55.07 2x3u s LYS 33 Cb -0.15 -2.05 -0.11 0.00 -1.68 0.00 0.00 37.83 33.84 2x3u s LYS 33 CO 0.08 -1.01 1.08 -0.85 -0.76 0.00 0.00 175.35 173.89 2x3u n GLU 34 N -2.97 1.51 -0.77 1.68 0.28 -1.26 -1.62 120.64 117.49 2x3u n GLU 34 Ca 0.07 0.54 0.00 0.00 -0.16 0.00 0.00 57.16 57.61 2x3u n GLU 34 Cb 0.57 -2.11 0.00 0.00 1.43 0.00 0.00 31.44 31.33 2x3u n GLU 34 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2x3u n GLY 35 N 1.09 0.82 3.94 -1.84 0.00 -1.26 -4.78 105.19 103.16 2x3u n GLY 35 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2x3u n GLY 35 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2x3u s GLY 36 N -1.82 1.71 -0.22 -0.02 0.00 -0.64 -4.84 107.32 101.48 2x3u s GLY 36 Ca 0.00 -1.01 -0.09 0.00 0.00 0.00 0.00 44.72 43.61 2x3u s GLY 36 CO 0.00 -0.68 0.12 -0.42 0.00 0.00 0.00 173.10 172.11 2x3u s ILE 37 N -3.01 5.07 0.00 0.90 1.01 -1.26 -5.01 121.20 118.91 2x3u s ILE 37 Ca 0.57 0.08 0.00 0.00 0.00 0.00 0.00 60.65 61.30 2x3u s ILE 37 Cb -0.11 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 39.03 2x3u s ILE 37 CO 0.42 0.39 0.00 0.61 0.00 0.00 0.00 174.94 176.36 2x3u n GLY 38 N 4.07 -2.07 2.99 6.18 0.00 -1.26 -4.91 105.19 110.19 2x3u n GLY 38 Ca -0.16 -1.42 -0.25 0.00 0.00 0.00 0.00 46.02 44.20 2x3u n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x3u s ILE 39 N -0.05 1.07 -0.06 -0.61 1.01 -1.26 -4.88 121.20 116.41 2x3u s ILE 39 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 60.65 60.24 2x3u s ILE 39 Cb 0.00 -1.01 0.02 0.00 0.01 0.00 0.00 42.46 41.49 2x3u s ILE 39 CO 0.00 0.35 -0.04 -0.69 0.00 0.00 0.00 174.94 174.56 2x3u s VAL 40 N 0.94 0.58 -0.00 2.92 1.01 -1.26 -1.14 120.40 123.44 2x3u s VAL 40 Ca -0.09 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 61.87 2x3u s VAL 40 Cb -0.15 -0.64 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 2x3u s VAL 40 CO 0.00 0.26 -0.16 -1.10 0.00 0.00 0.00 175.10 174.11 2x3u s GLN 41 N 1.40 2.29 -0.36 2.72 -1.52 0.32 0.11 119.66 124.61 2x3u s GLN 41 Ca -0.03 -0.84 -0.15 0.00 -1.95 0.00 0.00 55.36 52.38 2x3u s GLN 41 Cb -0.13 -2.28 -0.00 0.00 -0.22 0.00 0.00 33.01 30.38 2x3u s GLN 41 CO -0.03 0.58 0.37 -1.58 -0.25 0.00 0.00 175.29 174.38 2x3u s HIS 42 N -0.83 3.20 -0.18 0.91 5.65 0.11 -0.97 115.29 123.19 2x3u s HIS 42 Ca 0.13 -0.13 0.00 0.00 0.25 0.00 0.00 55.06 55.32 2x3u s HIS 42 Cb -0.11 -2.70 0.01 0.00 -1.18 0.00 0.00 32.58 28.61 2x3u s HIS 42 CO 0.03 -0.49 -0.17 0.42 -0.65 0.00 0.00 174.74 173.88 2x3u s ILE 43 N 2.01 2.30 -0.14 0.89 1.01 -0.55 -1.14 121.20 125.58 2x3u s ILE 43 Ca 0.11 -0.86 -0.04 0.00 0.00 0.00 0.00 60.65 59.85 2x3u s ILE 43 Cb -0.17 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 2x3u s ILE 43 CO 0.12 0.52 0.01 -0.75 0.00 0.00 0.00 174.94 174.84 2x3u s LYS 44 N 1.26 3.56 0.04 2.79 2.20 -0.55 -0.71 119.74 128.33 2x3u s LYS 44 Ca 0.04 -0.41 0.07 0.00 -0.36 0.00 0.00 55.97 55.31 2x3u s LYS 44 Cb -0.13 -2.99 -0.03 0.00 -1.51 0.00 0.00 37.83 33.17 2x3u s LYS 44 CO -0.10 0.41 -0.18 -0.06 -0.36 0.00 0.00 175.35 175.07 2x3u s PHE 45 N -0.07 2.57 -0.14 4.03 0.40 0.78 -0.02 117.98 125.53 2x3u s PHE 45 Ca 0.04 -0.25 -0.27 0.00 -0.60 0.00 0.00 56.93 55.85 2x3u s PHE 45 Cb -0.13 -1.47 -0.01 0.00 0.51 0.00 0.00 43.02 41.92 2x3u s PHE 45 CO 0.02 0.25 0.91 0.34 0.70 0.00 0.00 175.22 177.44 2x3u s ASP 46 N -1.40 7.08 0.00 1.36 -1.08 0.13 -1.77 116.67 121.00 2x3u s ASP 46 Ca 0.14 1.33 0.24 0.00 -0.52 0.00 0.00 52.55 53.75 2x3u s ASP 46 Cb -0.10 -2.50 0.35 0.00 -1.46 0.00 0.00 42.92 39.21 2x3u s ASP 46 CO 0.05 -0.43 1.36 0.18 0.52 0.00 0.00 175.17 176.85 2x3u n LEU 47 N 5.17 3.04 -4.77 -1.34 4.77 0.59 -3.40 117.00 121.05 2x3u n LEU 47 Ca 0.07 -1.15 -0.37 0.00 -0.03 0.00 0.00 56.01 54.53 2x3u n LEU 47 Cb 0.49 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 2x3u n LEU 47 CO 0.50 0.57 0.82 0.42 -1.33 0.00 0.00 177.39 178.37 2x3u s THR 48 N -1.80 3.20 0.00 -5.08 -4.23 -1.25 -2.64 115.64 103.85 2x3u s THR 48 Ca 0.33 0.91 0.00 0.00 -1.18 0.00 0.00 61.69 61.75 2x3u s THR 48 Cb 0.21 -3.47 0.00 0.00 1.34 0.00 0.00 72.50 70.58 2x3u s THR 48 CO 0.31 -0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.00 2x3u n GLY 49 N 0.44 0.94 3.37 3.99 0.00 -1.26 -5.01 105.19 107.67 2x3u n GLY 49 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 2x3u n GLY 49 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2x3u s GLY 50 N -1.71 2.37 -0.21 -0.02 0.00 -1.08 -5.08 107.32 101.58 2x3u s GLY 50 Ca 0.00 -1.72 0.13 0.00 0.00 0.00 0.00 44.72 43.14 2x3u s GLY 50 CO 0.00 -1.61 1.35 1.16 0.00 0.00 0.00 173.10 174.00 2x3u n ASN 51 N -1.34 2.71 -4.64 1.64 6.94 -1.26 -5.00 115.26 114.30 2x3u n ASN 51 Ca 0.02 -3.45 -0.42 0.00 -0.02 0.00 0.00 54.58 50.71 2x3u n ASN 51 Cb 0.64 -0.55 -0.03 0.00 -2.36 0.00 0.00 39.78 37.48 2x3u n ASN 51 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2x3u s LEU 52 N -3.06 4.09 0.20 -4.53 2.96 -1.26 -4.97 118.68 112.12 2x3u s LEU 52 Ca 0.40 2.27 0.09 0.00 -0.22 0.00 0.00 54.13 56.68 2x3u s LEU 52 Cb 0.36 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.48 2x3u s LEU 52 CO 0.02 -1.30 -0.19 -0.54 -1.32 0.00 0.00 176.35 173.02 2x3u s LYS 53 N 4.92 1.41 0.23 1.98 1.02 -1.26 -5.04 119.74 122.99 2x3u s LYS 53 Ca 0.87 -1.54 -0.21 0.00 0.02 0.00 0.00 55.97 55.11 2x3u s LYS 53 Cb -0.36 -1.45 0.04 0.00 -0.52 0.00 0.00 37.83 35.54 2x3u s LYS 53 CO 0.37 0.28 0.65 1.52 -0.92 0.00 0.00 175.35 177.25 2x3u s TYR 54 N -2.31 -0.27 0.36 3.18 1.13 -1.26 -4.45 117.35 113.72 2x3u s TYR 54 Ca 0.21 -0.09 0.04 0.00 -1.41 0.00 0.00 57.07 55.82 2x3u s TYR 54 Cb -0.05 0.60 -0.05 0.00 -1.10 0.00 0.00 41.96 41.36 2x3u s TYR 54 CO 0.09 -1.07 0.07 0.96 -2.51 0.00 0.00 175.55 173.09 2x3u s ILE 55 N -3.86 1.11 0.29 -3.49 -4.36 -1.26 -4.43 121.20 105.19 2x3u s ILE 55 Ca 0.08 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.17 2x3u s ILE 55 Cb -0.04 -2.68 -0.11 0.00 1.25 0.00 0.00 42.46 40.89 2x3u s ILE 55 CO -0.01 0.00 1.47 -1.61 0.24 0.00 0.00 174.94 175.03 2x3u s GLU 56 N -3.85 4.22 0.00 0.37 8.01 -1.26 -2.80 118.70 123.40 2x3u s GLU 56 Ca 0.32 2.40 0.00 0.00 0.01 0.00 0.00 54.97 57.70 2x3u s GLU 56 Cb 0.07 -3.06 0.00 0.00 -4.31 0.00 0.00 34.13 26.83 2x3u s GLU 56 CO 0.15 -0.46 0.00 0.41 0.01 0.00 0.00 175.26 175.37 2x3u n GLY 57 N 1.77 0.64 3.94 -1.39 0.00 -1.26 -4.32 105.19 104.58 2x3u n GLY 57 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 2x3u n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2x3u s GLN 58 N -0.78 1.92 0.28 1.61 -0.21 -1.12 -4.41 119.66 116.94 2x3u s GLN 58 Ca 0.00 -0.45 0.08 0.00 0.02 0.00 0.00 55.36 55.01 2x3u s GLN 58 Cb 0.00 -2.17 -0.06 0.00 1.00 0.00 0.00 33.01 31.78 2x3u s GLN 58 CO 0.00 -1.40 -0.09 -1.12 -2.12 0.00 0.00 175.29 170.56 2x3u s SER 59 N -4.60 2.95 0.14 5.90 0.01 0.31 -1.00 113.70 117.41 2x3u s SER 59 Ca 0.63 -1.15 0.07 0.00 1.31 0.00 0.00 55.95 56.81 2x3u s SER 59 Cb -0.09 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.90 2x3u s SER 59 CO 0.45 -0.26 -0.15 0.27 0.41 0.00 0.00 173.24 173.97 2x3u s ILE 60 N -2.90 1.49 0.12 1.44 -4.36 -0.31 -0.33 121.20 116.35 2x3u s ILE 60 Ca 0.29 -1.85 -0.11 0.00 -0.26 0.00 0.00 60.65 58.72 2x3u s ILE 60 Cb 0.02 -1.69 -0.06 0.00 1.25 0.00 0.00 42.46 41.98 2x3u s ILE 60 CO 0.12 -0.43 0.46 -0.83 0.24 0.00 0.00 174.94 174.49 2x3u s GLY 61 N -2.65 2.36 -0.08 6.27 0.00 -0.30 -0.51 107.32 112.40 2x3u s GLY 61 Ca 0.13 -0.32 0.04 0.00 0.00 0.00 0.00 44.72 44.57 2x3u s GLY 61 CO 0.04 -0.10 -0.20 -0.42 0.00 0.00 0.00 173.10 172.42 2x3u s ILE 62 N -1.49 1.74 -0.41 0.90 -1.09 -0.26 -0.94 121.20 119.64 2x3u s ILE 62 Ca 0.37 -0.84 -0.12 0.00 -2.23 0.00 0.00 60.65 57.83 2x3u s ILE 62 Cb -0.14 -1.52 0.05 0.00 -1.58 0.00 0.00 42.46 39.28 2x3u s ILE 62 CO 0.19 0.49 0.27 -0.63 -1.23 0.00 0.00 174.94 174.03 2x3u s ILE 63 N 0.39 4.64 0.54 2.92 1.01 -0.77 -1.35 121.20 128.59 2x3u s ILE 63 Ca -0.16 -1.07 -0.17 0.00 0.00 0.00 0.00 60.65 59.25 2x3u s ILE 63 Cb -0.17 -3.71 -0.06 0.00 0.01 0.00 0.00 42.46 38.53 2x3u s ILE 63 CO 0.07 -0.41 1.02 -2.16 0.00 0.00 0.00 174.94 173.46 2x3u s PRO 64 N 1.54 3.67 0.88 2.79 0.04 -1.26 -4.39 135.00 138.26 2x3u s PRO 64 Ca 0.03 1.12 -0.12 0.00 0.04 0.00 0.00 61.00 62.06 2x3u s PRO 64 Cb -0.22 -2.09 0.12 0.00 0.04 0.00 0.00 34.50 32.36 2x3u s PRO 64 CO 0.05 -0.52 1.13 -1.25 0.04 0.00 0.00 177.00 176.46 2x3u s PRO 65 N -3.94 1.41 0.00 0.56 0.04 -1.26 -4.56 135.00 127.25 2x3u s PRO 65 Ca 0.62 0.35 0.00 0.00 0.04 0.00 0.00 61.00 62.01 2x3u s PRO 65 Cb -0.13 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.54 2x3u s PRO 65 CO 0.32 -2.03 0.00 0.41 0.04 0.00 0.00 177.00 175.74 2x3u n GLY 66 N -2.27 0.37 3.55 0.56 0.00 -1.26 -4.83 105.19 101.31 2x3u n GLY 66 Ca 0.07 -1.98 -0.27 0.00 0.00 0.00 0.00 46.02 43.84 2x3u n GLY 66 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2x3u s VAL 67 N -1.36 3.07 0.78 1.61 -7.23 -1.26 -2.24 120.40 113.76 2x3u s VAL 67 Ca 0.00 -1.70 -0.13 0.00 -1.81 0.00 0.00 61.98 58.34 2x3u s VAL 67 Cb 0.00 -2.51 0.19 0.00 0.56 0.00 0.00 36.38 34.62 2x3u s VAL 67 CO 0.00 -0.10 0.90 -0.90 -0.31 0.00 0.00 175.10 174.69 2x3u n ASP 68 N 0.10 -0.66 0.29 4.85 5.68 0.64 -4.83 116.55 122.61 2x3u n ASP 68 Ca -0.11 -1.20 0.15 0.00 -0.50 0.00 0.00 54.79 53.12 2x3u n ASP 68 Cb 0.55 -0.73 0.90 0.00 -1.14 0.00 0.00 41.12 40.70 2x3u n ASP 68 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2x3u h LYS 69 N 0.00 0.00 -0.25 0.11 2.10 -2.01 -0.21 116.57 116.31 2x3u h LYS 69 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 2x3u h LYS 69 Cb 0.88 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.21 2x3u h LYS 69 CO 0.21 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.75 2x3u n ASN 70 N -3.86 2.03 -0.02 7.07 3.02 -1.26 -4.93 115.26 117.31 2x3u n ASN 70 Ca -0.02 -1.81 -0.00 0.00 -0.03 0.00 0.00 54.58 52.71 2x3u n ASN 70 Cb 0.11 -0.16 -0.00 0.00 -0.61 0.00 0.00 39.78 39.12 2x3u n ASN 70 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2x3u n GLY 71 N 1.19 0.47 3.85 7.41 0.00 -0.09 -5.04 105.19 112.98 2x3u n GLY 71 Ca 0.16 -0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 2x3u n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x3u s LYS 72 N -0.46 3.86 0.37 1.61 -0.14 -1.26 -4.76 119.74 118.95 2x3u s LYS 72 Ca 0.00 0.33 -0.27 0.00 -1.36 0.00 0.00 55.97 54.67 2x3u s LYS 72 Cb 0.00 -3.16 -0.12 0.00 -1.68 0.00 0.00 37.83 32.88 2x3u s LYS 72 CO 0.00 0.66 1.17 -2.30 -0.76 0.00 0.00 175.35 174.12 2x3u n PRO 73 N 1.57 1.78 -1.96 -1.68 -0.02 -1.26 -0.26 135.00 133.16 2x3u n PRO 73 Ca -0.13 0.63 -0.41 0.00 -2.02 0.00 0.00 63.50 61.57 2x3u n PRO 73 Cb 0.52 -2.19 -0.01 0.00 -0.02 0.00 0.00 33.50 31.80 2x3u n PRO 73 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2x3u s GLU 74 N -1.93 4.23 0.62 -0.52 0.41 -0.95 -4.73 118.70 115.85 2x3u s GLU 74 Ca 0.59 2.39 -0.03 0.00 -0.41 0.00 0.00 54.97 57.51 2x3u s GLU 74 Cb -0.57 -3.03 0.04 0.00 -1.78 0.00 0.00 34.13 28.79 2x3u s GLU 74 CO 0.60 -0.38 0.89 0.15 -0.49 0.00 0.00 175.26 176.04 2x3u s LYS 75 N -1.69 2.40 0.64 1.61 1.02 -1.26 -4.71 119.74 117.75 2x3u s LYS 75 Ca 0.52 -0.48 -0.17 0.00 0.02 0.00 0.00 55.97 55.85 2x3u s LYS 75 Cb -0.43 -2.32 -0.01 0.00 -0.52 0.00 0.00 37.83 34.54 2x3u s LYS 75 CO 0.56 -0.96 1.22 -0.48 -0.92 0.00 0.00 175.35 174.77 2x3u s LEU 76 N -5.00 3.54 0.01 3.17 0.05 -1.26 -4.48 118.68 114.70 2x3u s LEU 76 Ca 0.58 2.40 0.08 0.00 0.05 0.00 0.00 54.13 57.24 2x3u s LEU 76 Cb -0.11 -4.60 -0.02 0.00 -2.05 0.00 0.00 46.19 39.41 2x3u s LEU 76 CO 0.42 -1.84 -0.24 -0.13 -0.55 0.00 0.00 176.35 174.01 2x3u s ARG 77 N -3.53 2.04 0.10 1.48 3.00 -0.45 -4.92 118.95 116.66 2x3u s ARG 77 Ca 0.77 -0.98 -0.17 0.00 0.00 0.00 0.00 55.73 55.36 2x3u s ARG 77 Cb -0.31 -2.07 -0.07 0.00 0.00 0.00 0.00 34.95 32.51 2x3u s ARG 77 CO 0.38 0.55 0.54 -0.51 0.00 0.00 0.00 175.30 176.26 2x3u s LEU 78 N -0.92 4.44 -0.03 2.53 1.43 -1.26 -1.11 118.68 123.76 2x3u s LEU 78 Ca 0.11 1.15 0.01 0.00 -1.03 0.00 0.00 54.13 54.37 2x3u s LEU 78 Cb -0.10 -3.02 0.02 0.00 0.03 0.00 0.00 46.19 43.12 2x3u s LEU 78 CO 0.01 0.21 -0.03 -0.31 0.23 0.00 0.00 176.35 176.45 2x3u s TYR 79 N -1.26 0.54 0.26 0.29 2.02 0.33 -4.98 117.35 114.55 2x3u s TYR 79 Ca 0.32 -0.11 -0.31 0.00 -0.37 0.00 0.00 57.07 56.60 2x3u s TYR 79 Cb -0.17 -0.50 -0.11 0.00 -0.40 0.00 0.00 41.96 40.78 2x3u s TYR 79 CO 0.18 -0.13 1.63 -1.12 -1.57 0.00 0.00 175.55 174.54 2x3u s SER 80 N 0.70 6.40 0.26 2.29 0.01 -1.26 -1.16 113.70 120.93 2x3u s SER 80 Ca -0.08 2.90 -0.30 0.00 1.31 0.00 0.00 55.95 59.78 2x3u s SER 80 Cb -0.11 -2.62 -0.10 0.00 0.21 0.00 0.00 66.02 63.40 2x3u s SER 80 CO -0.00 -0.92 1.34 -0.63 0.41 0.00 0.00 173.24 173.44 2x3u s ILE 81 N 0.41 2.88 -1.05 1.44 1.01 -0.17 -4.38 121.20 121.34 2x3u s ILE 81 Ca 0.67 0.78 0.15 0.00 0.00 0.00 0.00 60.65 62.25 2x3u s ILE 81 Cb -0.48 -3.50 -0.08 0.00 0.01 0.00 0.00 42.46 38.41 2x3u s ILE 81 CO 0.42 0.14 0.73 0.00 0.00 0.00 0.00 174.94 176.23 2x3u n ALA 82 N 1.88 3.54 -2.69 9.38 0.00 0.16 -3.82 120.51 128.96 2x3u n ALA 82 Ca 0.04 -0.47 -0.28 0.00 0.00 0.00 0.00 53.44 52.73 2x3u n ALA 82 Cb 0.42 -0.54 -0.08 0.00 0.00 0.00 0.00 19.45 19.25 2x3u n ALA 82 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2x3u s SER 83 N -2.12 4.98 1.30 0.00 1.04 -1.24 -3.90 113.70 113.76 2x3u s SER 83 Ca 0.09 -0.26 -0.18 0.00 0.48 0.00 0.00 55.95 56.08 2x3u s SER 83 Cb 0.12 -1.15 0.33 0.00 0.10 0.00 0.00 66.02 65.41 2x3u s SER 83 CO 0.50 0.13 0.98 0.42 0.98 0.00 0.00 173.24 176.25 2x3u s THR 84 N -1.52 1.58 0.60 2.02 -4.23 -1.26 -4.76 115.64 108.06 2x3u s THR 84 Ca 0.27 0.00 0.30 0.00 -1.18 0.00 0.00 61.69 61.08 2x3u s THR 84 Cb -0.11 -2.10 0.36 0.00 1.34 0.00 0.00 72.50 71.99 2x3u s THR 84 CO 0.19 0.00 2.14 0.08 -0.54 0.00 0.00 174.62 176.49 2x3u h ARG 85 N -3.03 0.00 -0.00 3.99 0.11 -1.88 -1.01 114.38 112.56 2x3u h ARG 85 Ca -0.52 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.56 2x3u h ARG 85 Cb 1.34 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.42 2x3u h ARG 85 CO 0.39 0.00 -0.33 0.72 0.10 0.00 0.00 179.97 180.85 2x3u n HIS 86 N -3.73 0.00 -0.20 4.08 8.25 -1.26 -4.72 115.22 117.64 2x3u n HIS 86 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.49 2x3u n HIS 86 Cb 0.27 -0.19 -0.01 0.00 1.12 0.00 0.00 29.99 31.18 2x3u n HIS 86 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x3u n GLY 87 N 1.40 -2.17 0.31 -1.41 0.00 -0.38 -0.42 105.19 102.52 2x3u n GLY 87 Ca 0.10 -1.44 0.17 0.00 0.00 0.00 0.00 46.02 44.85 2x3u n GLY 87 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2x3u h ASP 88 N -0.19 0.00 -0.62 1.61 3.32 -1.85 -0.87 116.42 117.82 2x3u h ASP 88 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2x3u h ASP 88 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2x3u h ASP 88 CO 0.01 0.01 0.00 0.47 -1.72 0.00 0.00 179.24 178.01 2x3u n ASP 89 N -3.59 3.74 -4.00 6.45 8.00 -1.26 -4.96 116.55 120.93 2x3u n ASP 89 Ca -0.03 -1.99 -0.28 0.00 0.71 0.00 0.00 54.79 53.20 2x3u n ASP 89 Cb 0.09 -0.41 -0.02 0.00 -0.02 0.00 0.00 41.12 40.77 2x3u n ASP 89 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2x3u n VAL 90 N 1.50 -2.60 -0.07 2.53 0.31 -0.33 -4.87 118.33 114.80 2x3u n VAL 90 Ca 0.22 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 2x3u n VAL 90 Cb 0.60 -2.50 0.00 0.00 -0.91 0.00 0.00 33.84 31.03 2x3u n VAL 90 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2x3u n ASP 91 N -2.91 0.93 -2.18 4.52 5.68 -0.66 -5.00 116.55 116.93 2x3u n ASP 91 Ca -0.20 -1.01 -0.21 0.00 -0.50 0.00 0.00 54.79 52.87 2x3u n ASP 91 Cb 0.63 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.58 2x3u n ASP 91 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2x3u n ASP 92 N -0.00 -5.82 -0.01 -1.12 8.00 0.44 -4.86 116.55 113.18 2x3u n ASP 92 Ca 0.00 0.12 0.01 0.00 0.71 0.00 0.00 54.79 55.63 2x3u n ASP 92 Cb 0.02 -4.91 -0.01 0.00 -0.02 0.00 0.00 41.12 36.21 2x3u n ASP 92 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2x3u n LYS 93 N -2.85 5.78 -4.27 -1.24 5.02 -1.26 -4.98 118.16 114.37 2x3u n LYS 93 Ca -0.24 -0.05 -0.15 0.00 -2.02 0.00 0.00 58.31 55.84 2x3u n LYS 93 Cb 0.69 -0.62 -0.10 0.00 -0.02 0.00 0.00 35.03 34.98 2x3u n LYS 93 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2x3u s THR 94 N -1.08 0.18 -0.06 -0.18 -4.23 -1.26 -0.30 115.64 108.71 2x3u s THR 94 Ca 0.01 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.44 2x3u s THR 94 Cb 0.01 -2.53 0.02 0.00 1.34 0.00 0.00 72.50 71.34 2x3u s THR 94 CO 0.07 0.00 0.21 -0.51 -0.54 0.00 0.00 174.62 173.85 2x3u s ILE 95 N -3.86 0.02 0.11 2.99 2.07 -0.73 -4.07 121.20 117.74 2x3u s ILE 95 Ca 0.38 -0.19 0.09 0.00 -1.41 0.00 0.00 60.65 59.53 2x3u s ILE 95 Cb 0.06 -0.36 -0.04 0.00 0.13 0.00 0.00 42.46 42.26 2x3u s ILE 95 CO 0.16 -0.10 -0.24 -0.44 -1.91 0.00 0.00 174.94 172.41 2x3u s SER 96 N -0.32 2.89 0.23 4.50 0.01 -1.26 -0.15 113.70 119.59 2x3u s SER 96 Ca -0.04 -0.71 0.10 0.00 1.31 0.00 0.00 55.95 56.61 2x3u s SER 96 Cb -0.03 -0.18 -0.05 0.00 0.21 0.00 0.00 66.02 65.97 2x3u s SER 96 CO 0.01 0.12 -0.19 -0.76 0.41 0.00 0.00 173.24 172.83 2x3u s LEU 97 N -1.95 2.54 -0.36 2.44 1.43 0.11 -0.67 118.68 122.22 2x3u s LEU 97 Ca 0.10 -0.98 0.03 0.00 -1.03 0.00 0.00 54.13 52.25 2x3u s LEU 97 Cb -0.10 -0.96 0.11 0.00 0.03 0.00 0.00 46.19 45.27 2x3u s LEU 97 CO 0.05 -0.01 0.10 0.00 0.23 0.00 0.00 176.35 176.71 2x3u s VAL 99 N 0.85 2.91 0.01 0.00 1.01 -0.14 -4.87 120.40 120.16 2x3u s VAL 99 Ca 0.12 -0.73 -0.23 0.00 0.00 0.00 0.00 61.98 61.15 2x3u s VAL 99 Cb -0.20 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 2x3u s VAL 99 CO -0.10 0.41 0.68 -0.60 0.00 0.00 0.00 175.10 175.49 2x3u s ARG 100 N 1.40 4.41 -0.15 2.72 3.52 -1.26 -0.52 118.95 129.06 2x3u s ARG 100 Ca 0.04 0.89 -0.29 0.00 -0.13 0.00 0.00 55.73 56.24 2x3u s ARG 100 Cb -0.14 -3.37 -0.03 0.00 -1.56 0.00 0.00 34.95 29.85 2x3u s ARG 100 CO -0.06 0.29 1.46 -1.14 -0.81 0.00 0.00 175.30 175.04 2x3u s GLN 101 N 0.02 4.09 -0.00 5.12 0.74 -0.29 -4.81 119.66 124.53 2x3u s GLN 101 Ca 0.35 1.79 -0.30 0.00 0.05 0.00 0.00 55.36 57.25 2x3u s GLN 101 Cb -0.19 -3.90 -0.05 0.00 1.10 0.00 0.00 33.01 29.96 2x3u s GLN 101 CO 0.20 -0.91 1.37 -1.17 -0.55 0.00 0.00 175.29 174.22 2x3u s LEU 102 N 4.11 4.32 -0.08 3.68 2.96 -1.26 -4.71 118.68 127.69 2x3u s LEU 102 Ca 0.64 2.08 -0.04 0.00 -0.22 0.00 0.00 54.13 56.59 2x3u s LEU 102 Cb -0.26 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 42.91 2x3u s LEU 102 CO 0.23 -0.69 0.19 -0.70 -1.32 0.00 0.00 176.35 174.06 2x3u s GLU 103 N 2.28 0.16 0.37 1.98 2.12 -1.26 -0.94 118.70 123.42 2x3u s GLU 103 Ca 0.63 0.42 -0.08 0.00 0.36 0.00 0.00 54.97 56.30 2x3u s GLU 103 Cb -0.31 -0.11 0.03 0.00 0.26 0.00 0.00 34.13 34.01 2x3u s GLU 103 CO 0.26 -0.14 0.63 2.48 -0.54 0.00 0.00 175.26 177.95 2x3u n TYR 104 N 4.00 -1.87 -0.61 5.30 4.11 -0.58 -4.96 117.16 122.56 2x3u n TYR 104 Ca -0.24 -2.13 -0.31 0.00 -0.00 0.00 0.00 57.90 55.23 2x3u n TYR 104 Cb 0.53 0.72 0.20 0.00 -0.00 0.00 0.00 39.34 40.80 2x3u n TYR 104 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.86 177.22 2x3u n LYS 105 N -0.56 -1.62 -0.04 -3.48 2.85 -1.26 -0.87 118.16 113.17 2x3u n LYS 105 Ca -0.04 -0.44 -0.09 0.00 -1.05 0.00 0.00 58.31 56.69 2x3u n LYS 105 Cb 0.59 -2.01 -0.02 0.00 -0.65 0.00 0.00 35.03 32.94 2x3u n LYS 105 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 2x3u h HIS 106 N -2.23 -0.76 0.00 5.58 -0.00 -1.80 -3.36 115.15 112.57 2x3u h HIS 106 Ca -0.54 0.04 -0.09 0.00 -0.00 0.00 0.00 60.37 59.78 2x3u h HIS 106 Cb 1.33 0.37 0.02 0.00 -0.00 0.00 0.00 27.41 29.13 2x3u h HIS 106 CO 0.28 -0.36 0.55 -2.30 -0.00 0.00 0.00 177.93 176.11 2x3u n PRO 107 N -5.39 0.00 0.00 5.26 -0.02 -1.26 -2.92 135.00 130.66 2x3u n PRO 107 Ca -0.01 -0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.21 2x3u n PRO 107 Cb 0.31 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 2x3u n PRO 107 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2x3u n GLU 108 N 4.12 0.00 -2.32 -0.52 -0.58 -1.26 -5.13 120.64 114.95 2x3u n GLU 108 Ca 0.07 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.80 2x3u n GLU 108 Cb 0.13 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 30.99 2x3u n GLU 108 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2x3u n SER 109 N 0.00 -8.50 0.00 1.62 7.64 -1.15 -4.92 113.62 108.31 2x3u n SER 109 Ca 0.00 1.76 0.00 0.00 1.01 0.00 0.00 58.87 61.64 2x3u n SER 109 Cb 0.00 -5.07 0.00 0.00 -1.01 0.00 0.00 64.21 58.13 2x3u n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2x3u n GLY 110 N 1.75 -1.16 0.00 0.23 0.00 -1.26 -4.91 105.19 99.84 2x3u n GLY 110 Ca -0.04 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.21 2x3u n GLY 110 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2x3u n GLU 111 N 0.00 0.00 -1.98 1.61 0.00 -1.26 -4.65 120.64 114.36 2x3u n GLU 111 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 57.16 56.75 2x3u n GLU 111 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 31.44 31.42 2x3u n GLU 111 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2x3u s THR 112 N 2.00 2.54 -0.09 6.31 2.01 -1.26 -3.03 115.64 124.12 2x3u s THR 112 Ca 0.00 0.47 0.00 0.00 0.31 0.00 0.00 61.69 62.47 2x3u s THR 112 Cb 0.00 -3.30 -0.03 0.00 0.01 0.00 0.00 72.50 69.18 2x3u s THR 112 CO 0.00 0.08 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.25 2x3u s VAL 113 N -0.18 3.62 -0.16 3.82 1.01 -0.05 -4.94 120.40 123.51 2x3u s VAL 113 Ca 0.58 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 2x3u s VAL 113 Cb -0.43 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.44 2x3u s VAL 113 CO 0.46 0.57 -0.10 -0.31 0.00 0.00 0.00 175.10 175.72 2x3u s TYR 114 N -0.45 2.87 0.35 5.22 2.02 -1.26 -1.52 117.35 124.58 2x3u s TYR 114 Ca 0.06 -0.81 -0.28 0.00 -0.37 0.00 0.00 57.07 55.67 2x3u s TYR 114 Cb -0.12 -1.94 -0.11 0.00 -0.40 0.00 0.00 41.96 39.39 2x3u s TYR 114 CO 0.02 -0.36 1.47 0.20 -1.57 0.00 0.00 175.55 175.31 2x3u s GLY 115 N 0.79 2.82 0.03 0.71 0.00 -0.11 -4.94 107.32 106.61 2x3u s GLY 115 Ca -0.04 1.51 -0.25 0.00 0.00 0.00 0.00 44.72 45.94 2x3u s GLY 115 CO 0.01 2.24 1.22 -2.08 0.00 0.00 0.00 173.10 174.49 2x3u h VAL 116 N 3.07 0.00 -0.34 1.40 2.07 -1.99 -2.07 116.25 118.38 2x3u h VAL 116 Ca -0.50 -0.13 -0.14 0.00 0.82 0.00 0.00 66.70 66.75 2x3u h VAL 116 Cb 1.23 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2x3u h VAL 116 CO 0.67 0.00 -0.36 0.00 0.02 0.00 0.00 177.57 177.90 2x3u h SER 118 N 0.65 0.22 -0.25 0.00 4.64 -1.88 -1.22 113.55 115.71 2x3u h SER 118 Ca 0.06 -0.12 -0.12 0.00 -0.47 0.00 0.00 61.79 61.15 2x3u h SER 118 Cb 0.91 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2x3u h SER 118 CO 0.08 0.73 -0.31 0.74 -0.87 0.00 0.00 176.83 177.21 2x3u h THR 119 N 0.15 1.31 -0.30 2.95 2.02 -1.32 -0.37 112.91 117.35 2x3u h THR 119 Ca -0.00 -1.49 0.06 0.00 0.77 0.00 0.00 66.41 65.75 2x3u h THR 119 Cb 1.03 1.69 -0.06 0.00 -1.74 0.00 0.00 68.15 69.08 2x3u h THR 119 CO 0.08 0.47 -0.06 0.22 0.37 0.00 0.00 175.52 176.61 2x3u h TYR 120 N 0.36 -0.13 -0.01 3.16 3.20 -1.26 -1.69 116.97 120.61 2x3u h TYR 120 Ca 0.03 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 2x3u h TYR 120 Cb 0.88 0.10 -0.00 0.00 1.54 0.00 0.00 36.73 39.25 2x3u h TYR 120 CO 0.08 -0.11 -0.00 -0.07 -1.64 0.00 0.00 178.16 176.41 2x3u h LEU 121 N 0.02 0.01 -1.96 2.82 3.38 -1.20 -2.19 115.31 116.19 2x3u h LEU 121 Ca 0.14 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 2x3u h LEU 121 Cb 0.22 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2x3u h LEU 121 CO -0.29 0.38 -0.11 0.71 0.09 0.00 0.00 178.44 179.22 2x3u h THR 122 N -0.36 0.58 -0.41 0.22 1.35 -0.95 -2.12 112.91 111.21 2x3u h THR 122 Ca 0.00 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 2x3u h THR 122 Cb 0.38 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 2x3u h THR 122 CO 0.00 0.11 0.00 1.41 -0.25 0.00 0.00 175.52 176.79 2x3u n HIS 123 N -3.68 0.53 -2.27 4.73 8.25 -0.64 -4.97 115.22 117.16 2x3u n HIS 123 Ca -0.02 -0.30 -0.39 0.00 -0.26 0.00 0.00 57.72 56.75 2x3u n HIS 123 Cb 0.22 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.30 2x3u n HIS 123 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2x3u s ILE 124 N -1.30 3.08 0.01 1.59 2.07 -0.80 -5.02 121.20 120.84 2x3u s ILE 124 Ca 0.36 0.99 -0.08 0.00 -1.41 0.00 0.00 60.65 60.51 2x3u s ILE 124 Cb 0.21 -3.59 -0.05 0.00 0.13 0.00 0.00 42.46 39.15 2x3u s ILE 124 CO 0.29 0.16 0.31 -1.61 -1.91 0.00 0.00 174.94 172.18 2x3u s GLU 125 N -2.00 3.66 0.34 3.50 0.41 -1.26 -4.82 118.70 118.52 2x3u s GLU 125 Ca 0.52 0.05 -0.28 0.00 -0.41 0.00 0.00 54.97 54.85 2x3u s GLU 125 Cb -0.34 -3.09 -0.12 0.00 -1.78 0.00 0.00 34.13 28.80 2x3u s GLU 125 CO 0.43 0.64 1.23 -2.30 -0.49 0.00 0.00 175.26 174.78 2x3u n PRO 126 N 1.24 1.97 0.00 0.39 -0.02 -1.26 -2.04 135.00 135.28 2x3u n PRO 126 Ca -0.12 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 2x3u n PRO 126 Cb 0.53 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2x3u n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x3u n GLY 127 N 0.86 3.42 3.77 -1.23 0.00 0.05 -4.98 105.19 107.08 2x3u n GLY 127 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 2x3u n GLY 127 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x3u s SER 128 N -0.77 6.30 0.08 1.61 0.01 -0.86 -4.68 113.70 115.38 2x3u s SER 128 Ca 0.00 2.50 -0.22 0.00 1.31 0.00 0.00 55.95 59.54 2x3u s SER 128 Cb 0.00 -2.62 -0.07 0.00 0.21 0.00 0.00 66.02 63.54 2x3u s SER 128 CO 0.00 -0.84 0.64 -1.61 0.41 0.00 0.00 173.24 171.84 2x3u s GLU 129 N -2.37 4.34 0.01 12.44 2.02 -1.26 -0.80 118.70 133.08 2x3u s GLU 129 Ca 0.59 0.87 0.05 0.00 0.02 0.00 0.00 54.97 56.50 2x3u s GLU 129 Cb -0.34 -3.27 -0.02 0.00 0.10 0.00 0.00 34.13 30.60 2x3u s GLU 129 CO 0.43 0.54 -0.16 0.08 0.02 0.00 0.00 175.26 176.17 2x3u s VAL 130 N -0.86 1.26 -0.31 2.63 1.01 0.87 -4.96 120.40 120.05 2x3u s VAL 130 Ca 0.32 -0.83 -0.23 0.00 0.00 0.00 0.00 61.98 61.24 2x3u s VAL 130 Cb -0.20 -1.08 -0.00 0.00 0.00 0.00 0.00 36.38 35.09 2x3u s VAL 130 CO 0.21 0.24 0.75 -0.54 0.00 0.00 0.00 175.10 175.75 2x3u s LYS 131 N -0.69 3.94 -0.06 2.72 1.02 -1.26 -0.77 119.74 124.64 2x3u s LYS 131 Ca 0.05 0.50 0.04 0.00 0.02 0.00 0.00 55.97 56.59 2x3u s LYS 131 Cb -0.07 -3.73 -0.02 0.00 -0.52 0.00 0.00 37.83 33.49 2x3u s LYS 131 CO 0.00 -0.66 -0.19 0.42 -0.92 0.00 0.00 175.35 174.01 2x3u s ILE 132 N 2.87 2.63 0.24 2.17 1.01 0.99 -1.85 121.20 129.27 2x3u s ILE 132 Ca 0.30 -0.87 0.09 0.00 0.00 0.00 0.00 60.65 60.18 2x3u s ILE 132 Cb -0.14 -2.01 -0.05 0.00 0.01 0.00 0.00 42.46 40.27 2x3u s ILE 132 CO 0.12 0.57 -0.16 0.42 0.00 0.00 0.00 174.94 175.90 2x3u s THR 133 N -0.37 2.02 -0.13 2.92 -4.23 -0.11 0.05 115.64 115.79 2x3u s THR 133 Ca 0.03 -2.28 0.00 0.00 -1.18 0.00 0.00 61.69 58.26 2x3u s THR 133 Cb -0.12 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.54 2x3u s THR 133 CO 0.02 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.21 2x3u n GLY 134 N -0.49 0.31 3.77 3.99 0.00 0.16 -1.14 105.19 111.79 2x3u n GLY 134 Ca -0.07 -2.08 -0.29 0.00 0.00 0.00 0.00 46.02 43.59 2x3u n GLY 134 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2x3u s PRO 135 N -0.05 1.00 -0.00 1.61 0.04 -1.26 -0.45 135.00 135.89 2x3u s PRO 135 Ca 0.00 0.28 0.02 0.00 0.04 0.00 0.00 61.00 61.34 2x3u s PRO 135 Cb 0.00 -1.82 -0.01 0.00 0.04 0.00 0.00 34.50 32.71 2x3u s PRO 135 CO 0.00 -2.29 -0.06 0.08 0.04 0.00 0.00 177.00 174.77 2x3u s VAL 136 N -3.26 0.49 0.00 -0.36 1.01 0.55 -0.45 120.40 118.38 2x3u s VAL 136 Ca 0.64 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.31 2x3u s VAL 136 Cb -0.15 -0.42 0.00 0.00 0.00 0.00 0.00 36.38 35.81 2x3u s VAL 136 CO 0.54 0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.35 2x3u n GLY 137 N 2.84 3.10 0.00 4.51 0.00 -1.26 -0.53 105.19 113.85 2x3u n GLY 137 Ca -0.14 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.51 2x3u n GLY 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x3u n LYS 138 N 1.09 1.02 0.02 1.61 5.02 -1.26 -4.71 118.16 120.95 2x3u n LYS 138 Ca 0.00 -0.88 0.11 0.00 -2.02 0.00 0.00 58.31 55.52 2x3u n LYS 138 Cb 0.00 -0.86 0.06 0.00 -0.02 0.00 0.00 35.03 34.21 2x3u n LYS 138 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2x3u n GLU 139 N -0.22 0.19 -1.12 1.97 4.07 -1.26 -4.21 120.64 120.07 2x3u n GLU 139 Ca 0.00 0.00 -0.09 0.00 -0.06 0.00 0.00 57.16 57.01 2x3u n GLU 139 Cb 0.22 -1.56 0.15 0.00 -0.06 0.00 0.00 31.44 30.18 2x3u n GLU 139 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 2x3u n MET 140 N -1.81 2.30 -3.00 5.31 2.81 -1.26 -4.49 117.12 116.98 2x3u n MET 140 Ca 0.03 -3.50 -0.37 0.00 -1.81 0.00 0.00 57.70 52.05 2x3u n MET 140 Cb 0.40 -1.92 -0.06 0.00 -0.71 0.00 0.00 33.22 30.93 2x3u n MET 140 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2x3u s LEU 141 N -3.38 4.38 0.14 4.03 1.43 -1.26 -4.17 118.68 119.86 2x3u s LEU 141 Ca 0.46 1.56 -0.25 0.00 -1.03 0.00 0.00 54.13 54.88 2x3u s LEU 141 Cb 0.40 -3.65 -0.08 0.00 0.03 0.00 0.00 46.19 42.90 2x3u s LEU 141 CO -0.01 0.04 0.75 -0.22 0.23 0.00 0.00 176.35 177.13 2x3u s LEU 142 N -1.86 4.58 0.52 1.79 2.96 -1.26 -5.04 118.68 120.37 2x3u s LEU 142 Ca 0.44 1.58 -0.20 0.00 -0.22 0.00 0.00 54.13 55.72 2x3u s LEU 142 Cb -0.18 -3.24 -0.06 0.00 0.50 0.00 0.00 46.19 43.21 2x3u s LEU 142 CO 0.23 0.20 1.14 -2.16 -1.32 0.00 0.00 176.35 174.44 2x3u s PRO 143 N -1.05 3.45 0.24 0.98 0.04 -1.26 -4.91 135.00 132.50 2x3u s PRO 143 Ca 0.35 1.67 0.24 0.00 0.04 0.00 0.00 61.00 63.30 2x3u s PRO 143 Cb -0.22 -2.12 0.94 0.00 0.04 0.00 0.00 34.50 33.14 2x3u s PRO 143 CO 0.25 -0.78 1.73 -0.25 0.04 0.00 0.00 177.00 177.99 2x3u n ASP 144 N -1.08 0.69 -4.62 6.66 8.00 -1.26 -4.75 116.55 120.18 2x3u n ASP 144 Ca 0.10 0.64 -0.43 0.00 0.71 0.00 0.00 54.79 55.82 2x3u n ASP 144 Cb 0.50 -0.80 -0.03 0.00 -0.02 0.00 0.00 41.12 40.78 2x3u n ASP 144 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2x3u s ASP 145 N -4.28 6.31 0.05 -2.24 -1.08 -1.26 -4.88 116.67 109.29 2x3u s ASP 145 Ca 0.06 1.55 0.18 0.00 -0.52 0.00 0.00 52.55 53.82 2x3u s ASP 145 Cb 0.10 -2.53 0.77 0.00 -1.46 0.00 0.00 42.92 39.80 2x3u s ASP 145 CO 0.44 -1.33 1.58 -0.81 0.52 0.00 0.00 175.17 175.57 2x3u n PRO 146 N 7.79 0.04 -0.12 4.34 -0.05 -1.26 -2.42 135.00 143.32 2x3u n PRO 146 Ca 0.19 0.25 0.11 0.00 -0.05 0.00 0.00 63.50 64.00 2x3u n PRO 146 Cb 0.45 -1.58 0.17 0.00 -0.05 0.00 0.00 33.50 32.50 2x3u n PRO 146 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 175.50 175.84 2x3u n GLU 147 N -1.66 2.33 -1.88 0.54 1.02 -1.26 -0.87 120.64 118.86 2x3u n GLU 147 Ca 0.04 -2.11 -0.38 0.00 -0.02 0.00 0.00 57.16 54.69 2x3u n GLU 147 Cb 0.21 -1.47 0.03 0.00 -0.02 0.00 0.00 31.44 30.20 2x3u n GLU 147 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2x3u s ALA 148 N -1.56 2.81 0.03 0.62 0.00 -1.01 -4.52 121.76 118.13 2x3u s ALA 148 Ca 0.33 1.24 -0.12 0.00 0.00 0.00 0.00 51.96 53.42 2x3u s ALA 148 Cb 0.21 -3.53 -0.06 0.00 0.00 0.00 0.00 23.12 19.74 2x3u s ALA 148 CO 0.29 -1.24 0.39 -0.80 0.00 0.00 0.00 175.76 174.39 2x3u s ASN 149 N -1.08 6.69 -0.19 0.00 0.02 -1.12 -3.77 114.94 115.49 2x3u s ASN 149 Ca 0.71 0.84 -0.01 0.00 -1.02 0.00 0.00 52.86 53.38 2x3u s ASN 149 Cb -0.38 -2.20 0.05 0.00 0.02 0.00 0.00 41.25 38.75 2x3u s ASN 149 CO 0.44 0.25 -0.02 -0.69 0.02 0.00 0.00 177.10 177.10 2x3u s VAL 150 N -1.25 0.97 -0.14 1.60 1.01 0.18 -0.77 120.40 122.00 2x3u s VAL 150 Ca 0.28 -0.73 -0.15 0.00 0.00 0.00 0.00 61.98 61.38 2x3u s VAL 150 Cb -0.15 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 2x3u s VAL 150 CO 0.15 -0.05 0.36 -0.63 0.00 0.00 0.00 175.10 174.93 2x3u s ILE 151 N 1.67 5.26 -0.18 2.22 1.01 -0.28 -0.89 121.20 130.01 2x3u s ILE 151 Ca -0.01 0.69 0.00 0.00 0.00 0.00 0.00 60.65 61.33 2x3u s ILE 151 Cb -0.17 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 38.64 2x3u s ILE 151 CO -0.07 0.37 -0.10 -0.04 0.00 0.00 0.00 174.94 175.10 2x3u s MET 152 N 0.49 1.99 -0.30 2.79 -1.94 0.80 -0.44 119.30 122.69 2x3u s MET 152 Ca 0.20 -0.69 0.00 0.00 -1.71 0.00 0.00 55.69 53.49 2x3u s MET 152 Cb -0.14 -2.23 0.06 0.00 2.01 0.00 0.00 34.83 34.53 2x3u s MET 152 CO 0.06 -0.37 -0.02 -0.51 -0.01 0.00 0.00 175.02 174.17 2x3u s LEU 153 N 1.47 3.90 0.02 -0.03 1.43 0.37 -0.44 118.68 125.41 2x3u s LEU 153 Ca 0.01 -1.42 0.03 0.00 -1.03 0.00 0.00 54.13 51.72 2x3u s LEU 153 Cb -0.15 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.39 2x3u s LEU 153 CO -0.09 -0.26 -0.10 0.00 0.23 0.00 0.00 176.35 176.13 2x3u s ALA 154 N 1.17 0.79 -0.02 4.21 0.00 -0.36 -1.79 121.76 125.77 2x3u s ALA 154 Ca -0.04 -0.59 0.05 0.00 0.00 0.00 0.00 51.96 51.38 2x3u s ALA 154 Cb -0.20 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 2x3u s ALA 154 CO -0.03 0.13 -0.17 0.95 0.00 0.00 0.00 175.76 176.64 2x3u s THR 155 N -0.68 1.37 0.00 0.00 -4.23 -1.02 -0.68 115.64 110.40 2x3u s THR 155 Ca -0.01 -0.74 0.00 0.00 -1.18 0.00 0.00 61.69 59.77 2x3u s THR 155 Cb -0.06 -1.14 0.00 0.00 1.34 0.00 0.00 72.50 72.64 2x3u s THR 155 CO 0.00 0.39 0.00 0.61 -0.54 0.00 0.00 174.62 175.08 2x3u n GLY 156 N 2.69 3.25 0.00 3.99 0.00 -0.81 -0.79 105.19 113.52 2x3u n GLY 156 Ca -0.15 -0.02 0.05 0.00 0.00 0.00 0.00 46.02 45.90 2x3u n GLY 156 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2x3u n THR 157 N 0.00 1.15 0.22 2.61 -2.24 -1.26 -1.78 114.28 112.97 2x3u n THR 157 Ca 0.00 0.29 0.13 0.00 -2.27 0.00 0.00 64.05 62.20 2x3u n THR 157 Cb 0.00 -1.10 0.70 0.00 -2.10 0.00 0.00 70.33 67.82 2x3u n THR 157 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2x3u h GLY 158 N 1.84 0.00 2.00 3.38 0.00 -1.15 -0.27 103.07 108.87 2x3u h GLY 158 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2x3u h GLY 158 CO 0.00 0.00 -0.01 1.19 0.00 0.00 0.00 176.54 177.72 2x3u h ILE 159 N 0.00 0.40 0.26 2.60 6.09 -1.52 -3.35 117.51 122.00 2x3u h ILE 159 Ca 0.00 -0.04 0.01 0.00 -1.37 0.00 0.00 64.86 63.46 2x3u h ILE 159 Cb 0.18 1.03 -0.03 0.00 0.47 0.00 0.00 36.82 38.46 2x3u h ILE 159 CO 0.00 0.01 -0.39 0.00 -3.07 0.00 0.00 178.15 174.69 2x3u h ALA 160 N 1.99 -0.78 -0.13 0.18 0.00 -1.30 0.12 119.26 119.34 2x3u h ALA 160 Ca -0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2x3u h ALA 160 Cb 0.02 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2x3u h ALA 160 CO 0.00 -0.99 -0.07 -1.00 0.00 0.00 0.00 179.25 177.20 2x3u h PRO 161 N -0.72 0.20 -0.77 0.00 0.13 -1.69 -2.26 132.00 126.89 2x3u h PRO 161 Ca -0.01 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 65.07 2x3u h PRO 161 Cb 0.69 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.75 2x3u h PRO 161 CO -0.14 0.28 0.39 0.52 -0.23 0.00 0.00 178.00 178.81 2x3u h MET 162 N 0.19 1.10 -0.57 0.86 2.86 -1.40 -1.64 114.93 116.33 2x3u h MET 162 Ca 0.04 -0.15 0.03 0.00 -2.06 0.00 0.00 59.70 57.56 2x3u h MET 162 Cb 0.25 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.67 2x3u h MET 162 CO 0.01 0.84 0.34 -0.09 1.06 0.00 0.00 176.91 179.07 2x3u h ARG 163 N 1.08 0.64 -0.99 1.72 2.43 -0.25 0.77 114.38 119.77 2x3u h ARG 163 Ca 0.27 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.44 2x3u h ARG 163 Cb 0.09 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.44 2x3u h ARG 163 CO -0.04 0.42 0.65 1.79 -1.51 0.00 0.00 179.97 181.29 2x3u h THR 164 N 0.66 1.16 -0.03 0.20 1.35 -1.03 0.59 112.91 115.81 2x3u h THR 164 Ca 0.23 -0.43 -0.01 0.00 -0.55 0.00 0.00 66.41 65.66 2x3u h THR 164 Cb 0.05 -0.19 -0.00 0.00 -1.73 0.00 0.00 68.15 66.28 2x3u h THR 164 CO -0.11 0.23 -0.02 1.88 -0.25 0.00 0.00 175.52 177.24 2x3u h TYR 165 N 1.25 0.08 -0.16 4.73 0.05 -0.72 -2.75 116.97 119.45 2x3u h TYR 165 Ca 0.40 -0.02 -0.14 0.00 0.05 0.00 0.00 58.73 59.02 2x3u h TYR 165 Cb 0.02 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 2x3u h TYR 165 CO -0.00 0.50 -0.48 -0.07 -1.05 0.00 0.00 178.16 177.05 2x3u h LEU 166 N -0.36 0.44 -0.23 3.88 3.38 -0.63 -0.30 115.31 121.50 2x3u h LEU 166 Ca 0.01 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 2x3u h LEU 166 Cb 0.48 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2x3u h LEU 166 CO 0.01 0.86 -0.02 -0.50 0.09 0.00 0.00 178.44 178.88 2x3u h TRP 167 N 0.33 0.45 -0.91 1.13 -0.00 -0.97 -0.06 115.95 115.93 2x3u h TRP 167 Ca 0.02 -0.09 0.02 0.00 -0.00 0.00 0.00 58.89 58.84 2x3u h TRP 167 Cb 0.97 -0.12 -0.05 0.00 -0.00 0.00 0.00 29.16 29.97 2x3u h TRP 167 CO 0.03 0.61 0.60 -0.09 -0.00 0.00 0.00 178.44 179.59 2x3u h ARG 168 N 0.16 1.16 -0.19 0.49 2.43 -1.23 0.47 114.38 117.67 2x3u h ARG 168 Ca 0.06 -0.07 -0.19 0.00 -0.81 0.00 0.00 59.98 58.98 2x3u h ARG 168 Cb 0.44 -0.26 -0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2x3u h ARG 168 CO 0.02 0.76 -0.63 0.52 -1.51 0.00 0.00 179.97 179.13 2x3u h MET 169 N 1.19 0.69 0.00 0.20 2.86 -0.87 -3.41 114.93 115.59 2x3u h MET 169 Ca 0.35 -0.48 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2x3u h MET 169 Cb -0.07 0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.67 2x3u h MET 169 CO -0.09 1.10 -0.61 1.19 1.06 0.00 0.00 176.91 179.56 2x3u n PHE 170 N -3.95 0.00 -2.31 -0.22 3.72 -0.05 -4.40 117.46 110.25 2x3u n PHE 170 Ca -0.05 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.94 2x3u n PHE 170 Cb 0.66 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.17 2x3u n PHE 170 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2x3u s LYS 171 N -1.29 4.46 0.17 -1.08 -0.14 0.13 -4.93 119.74 117.06 2x3u s LYS 171 Ca 0.00 1.95 -0.16 0.00 -1.36 0.00 0.00 55.97 56.40 2x3u s LYS 171 Cb 0.00 -3.21 0.11 0.00 -1.68 0.00 0.00 37.83 33.05 2x3u s LYS 171 CO 0.00 -0.12 1.70 -0.44 -0.76 0.00 0.00 175.35 175.73 2x3u h ASP 172 N 4.97 -0.17 0.45 2.83 3.32 -1.96 -1.19 116.42 124.67 2x3u h ASP 172 Ca -0.45 0.09 -0.08 0.00 0.02 0.00 0.00 57.03 56.61 2x3u h ASP 172 Cb 1.21 0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.92 2x3u h ASP 172 CO 0.74 -0.05 -0.38 0.00 -1.72 0.00 0.00 179.24 177.83 2x3u h ALA 173 N 1.35 1.29 -0.09 3.45 0.00 -1.95 -1.76 119.26 121.56 2x3u h ALA 173 Ca 0.19 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2x3u h ALA 173 Cb 0.28 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2x3u h ALA 173 CO -0.33 0.47 -0.04 0.93 0.00 0.00 0.00 179.25 180.28 2x3u h GLU 174 N 0.00 0.18 -0.99 0.00 4.39 -1.66 -1.88 114.58 114.63 2x3u h GLU 174 Ca -0.00 -0.08 0.06 0.00 0.34 0.00 0.00 59.36 59.68 2x3u h GLU 174 Cb 0.70 -0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.28 2x3u h GLU 174 CO 0.05 0.55 0.64 0.00 -1.16 0.00 0.00 179.01 179.09 2x3u h ARG 175 N -0.19 1.13 -0.15 2.33 3.08 -0.93 0.22 114.38 119.86 2x3u h ARG 175 Ca 0.02 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 59.94 2x3u h ARG 175 Cb 0.50 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 2x3u h ARG 175 CO 0.01 0.75 -0.20 0.00 -1.07 0.00 0.00 179.97 179.46 2x3u h ALA 176 N 1.44 1.38 0.00 0.04 0.00 -1.31 -3.11 119.26 117.71 2x3u h ALA 176 Ca 0.42 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2x3u h ALA 176 Cb 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2x3u h ALA 176 CO -0.17 0.42 -0.81 0.00 0.00 0.00 0.00 179.25 178.69 2x3u h ALA 177 N 1.56 0.62 -2.56 0.00 0.00 -0.17 -3.41 119.26 115.30 2x3u h ALA 177 Ca 0.04 -0.09 -0.64 0.00 0.00 0.00 0.00 54.91 54.22 2x3u h ALA 177 Cb 0.49 0.02 -0.40 0.00 0.00 0.00 0.00 17.79 17.91 2x3u h ALA 177 CO 0.03 0.10 -0.40 0.09 0.00 0.00 0.00 179.25 179.08 2x3u n ASN 178 N -2.80 3.82 -0.07 0.00 3.02 0.57 -4.93 115.26 114.86 2x3u n ASN 178 Ca 0.00 -3.32 0.15 0.00 -0.03 0.00 0.00 54.58 51.37 2x3u n ASN 178 Cb 0.58 -0.81 0.55 0.00 -0.61 0.00 0.00 39.78 39.49 2x3u n ASN 178 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2x3u h PRO 179 N 4.94 0.30 -0.00 3.52 0.11 -1.81 -1.57 132.00 137.49 2x3u h PRO 179 Ca 0.18 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2x3u h PRO 179 Cb 0.71 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.75 2x3u h PRO 179 CO 0.84 0.20 -0.08 0.39 -0.21 0.00 0.00 178.00 179.14 2x3u n GLU 180 N -4.45 0.63 -3.59 1.05 -0.58 -1.26 -4.44 120.64 108.00 2x3u n GLU 180 Ca 0.11 -0.16 -0.28 0.00 -0.42 0.00 0.00 57.16 56.40 2x3u n GLU 180 Cb 0.46 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.71 2x3u n GLU 180 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 2x3u s TYR 181 N -2.49 1.64 -0.58 -0.32 5.04 -0.59 -4.90 117.35 115.16 2x3u s TYR 181 Ca 0.29 -2.33 -0.08 0.00 -2.44 0.00 0.00 57.07 52.52 2x3u s TYR 181 Cb 0.20 -1.49 0.15 0.00 0.35 0.00 0.00 41.96 41.17 2x3u s TYR 181 CO 0.47 -0.78 0.44 -0.65 -1.34 0.00 0.00 175.55 173.70 2x3u s GLN 182 N 0.20 2.68 0.13 4.97 -1.52 -1.26 -4.87 119.66 119.99 2x3u s GLN 182 Ca 0.23 -2.14 -0.31 0.00 -1.95 0.00 0.00 55.36 51.19 2x3u s GLN 182 Cb -0.13 -3.94 -0.09 0.00 -0.22 0.00 0.00 33.01 28.63 2x3u s GLN 182 CO -0.07 -1.20 1.50 0.12 -0.25 0.00 0.00 175.29 175.39 2x3u s PHE 183 N 0.68 3.06 -0.00 0.91 5.36 -1.26 -4.85 117.98 121.88 2x3u s PHE 183 Ca 0.12 0.73 0.00 0.00 -0.96 0.00 0.00 56.93 56.81 2x3u s PHE 183 Cb -0.21 -3.83 0.00 0.00 -0.34 0.00 0.00 43.02 38.64 2x3u s PHE 183 CO -0.03 -3.03 0.66 0.36 -1.46 0.00 0.00 175.22 171.71 2x3u n LYS 184 N 4.18 0.94 0.00 10.12 2.85 -0.05 -5.05 118.16 131.15 2x3u n LYS 184 Ca 0.13 -0.82 0.00 0.00 -1.05 0.00 0.00 58.31 56.58 2x3u n LYS 184 Cb 0.40 -0.66 0.00 0.00 -0.65 0.00 0.00 35.03 34.13 2x3u n LYS 184 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2x3u n GLY 185 N -0.16 -0.00 3.16 2.58 0.00 -0.91 -4.90 105.19 104.96 2x3u n GLY 185 Ca 0.00 -1.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 2x3u n GLY 185 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2x3u s PHE 186 N 0.22 2.19 -0.04 1.61 5.36 -1.25 -4.51 117.98 121.56 2x3u s PHE 186 Ca 0.00 -0.85 0.06 0.00 -0.96 0.00 0.00 56.93 55.19 2x3u s PHE 186 Cb 0.00 -1.49 -0.02 0.00 -0.34 0.00 0.00 43.02 41.17 2x3u s PHE 186 CO 0.00 -0.35 -0.23 -1.12 -1.46 0.00 0.00 175.22 172.06 2x3u s SER 187 N 0.37 3.29 -0.14 6.13 0.01 0.94 -0.65 113.70 123.65 2x3u s SER 187 Ca -0.16 -0.42 -0.02 0.00 1.31 0.00 0.00 55.95 56.67 2x3u s SER 187 Cb -0.17 -0.66 0.04 0.00 0.21 0.00 0.00 66.02 65.44 2x3u s SER 187 CO 0.07 0.29 -0.00 0.86 0.41 0.00 0.00 173.24 174.87 2x3u s TRP 188 N -0.44 1.12 -0.25 2.43 -0.11 -0.07 -0.87 118.94 120.76 2x3u s TRP 188 Ca 0.05 -0.70 -0.09 0.00 1.22 0.00 0.00 56.10 56.58 2x3u s TRP 188 Cb -0.12 -1.05 -0.04 0.00 -1.50 0.00 0.00 33.47 30.77 2x3u s TRP 188 CO 0.01 -0.52 0.13 -1.17 -4.62 0.00 0.00 176.95 170.78 2x3u s LEU 189 N 1.82 3.85 -0.28 5.86 2.96 -0.16 -0.14 118.68 132.59 2x3u s LEU 189 Ca 0.02 -0.02 -0.05 0.00 -0.22 0.00 0.00 54.13 53.85 2x3u s LEU 189 Cb -0.15 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 44.52 2x3u s LEU 189 CO -0.07 0.02 0.05 -0.69 -1.32 0.00 0.00 176.35 174.34 2x3u s VAL 190 N 1.32 3.70 -0.15 1.68 1.01 0.42 -0.33 120.40 128.05 2x3u s VAL 190 Ca 0.06 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.26 2x3u s VAL 190 Cb -0.15 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.35 2x3u s VAL 190 CO 0.06 0.10 -0.14 0.12 0.00 0.00 0.00 175.10 175.24 2x3u s PHE 191 N 1.45 2.16 -0.21 5.22 5.36 0.06 -1.22 117.98 130.79 2x3u s PHE 191 Ca 0.02 -1.20 -0.05 0.00 -0.96 0.00 0.00 56.93 54.74 2x3u s PHE 191 Cb -0.17 -1.59 -0.02 0.00 -0.34 0.00 0.00 43.02 40.91 2x3u s PHE 191 CO 0.01 -0.66 -0.02 0.20 -1.46 0.00 0.00 175.22 173.29 2x3u s GLY 192 N 1.46 1.66 0.12 13.12 0.00 0.14 -0.53 107.32 123.29 2x3u s GLY 192 Ca 0.04 -1.09 -0.03 0.00 0.00 0.00 0.00 44.72 43.65 2x3u s GLY 192 CO -0.10 0.35 0.08 -1.34 0.00 0.00 0.00 173.10 172.08 2x3u s VAL 193 N 1.28 0.13 0.23 1.40 -7.23 -0.59 -1.92 120.40 113.69 2x3u s VAL 193 Ca 0.04 -1.78 0.08 0.00 -1.81 0.00 0.00 61.98 58.51 2x3u s VAL 193 Cb -0.14 -1.86 -0.08 0.00 0.56 0.00 0.00 36.38 34.86 2x3u s VAL 193 CO -0.00 -0.57 1.52 1.55 -0.31 0.00 0.00 175.10 177.29 2x3u h PRO 194 N 2.88 0.04 -4.26 4.82 0.13 -1.89 -2.45 132.00 131.28 2x3u h PRO 194 Ca -0.34 -0.04 -0.14 0.00 -0.87 0.00 0.00 66.00 64.60 2x3u h PRO 194 Cb 1.19 0.01 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 2x3u h PRO 194 CO 0.59 0.74 -0.62 0.95 -0.23 0.00 0.00 178.00 179.43 2x3u s THR 195 N -3.41 0.15 0.19 1.56 -4.23 -1.26 -0.71 115.64 107.93 2x3u s THR 195 Ca -0.01 -1.77 -0.13 0.00 -1.18 0.00 0.00 61.69 58.60 2x3u s THR 195 Cb 0.12 -1.75 0.09 0.00 1.34 0.00 0.00 72.50 72.31 2x3u s THR 195 CO 0.78 -0.70 1.85 0.74 -0.54 0.00 0.00 174.62 176.75 2x3u h THR 196 N 2.96 1.13 -0.13 3.99 2.02 -1.95 -1.42 112.91 119.52 2x3u h THR 196 Ca -0.34 -0.27 0.04 0.00 0.77 0.00 0.00 66.41 66.61 2x3u h THR 196 Cb 1.18 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 2x3u h THR 196 CO 0.61 0.14 0.15 -0.65 0.37 0.00 0.00 175.52 176.14 2x3u h PRO 197 N 0.78 0.00 -0.01 6.66 0.11 -1.87 -1.05 132.00 136.62 2x3u h PRO 197 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2x3u h PRO 197 Cb -0.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.05 2x3u h PRO 197 CO -0.06 0.00 -0.02 0.09 -0.21 0.00 0.00 178.00 177.79 2x3u n ASN 198 N -3.76 0.58 -4.55 -2.05 4.13 -0.55 -1.58 115.26 107.48 2x3u n ASN 198 Ca 0.00 -1.04 -0.36 0.00 1.68 0.00 0.00 54.58 54.86 2x3u n ASN 198 Cb 0.26 -0.02 -0.03 0.00 -1.54 0.00 0.00 39.78 38.44 2x3u n ASN 198 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2x3u s ILE 199 N -2.12 3.45 0.19 2.41 1.01 -0.40 -4.86 121.20 120.88 2x3u s ILE 199 Ca 0.40 0.04 -0.31 0.00 0.00 0.00 0.00 60.65 60.78 2x3u s ILE 199 Cb 0.21 -4.13 -0.10 0.00 0.01 0.00 0.00 42.46 38.45 2x3u s ILE 199 CO 0.38 -1.09 1.54 -0.76 0.00 0.00 0.00 174.94 175.01 2x3u s LEU 200 N 8.71 4.37 -1.67 2.97 1.43 -1.26 -2.21 118.68 131.02 2x3u s LEU 200 Ca 0.63 2.64 0.00 0.00 -1.03 0.00 0.00 54.13 56.37 2x3u s LEU 200 Cb -0.10 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.52 2x3u s LEU 200 CO 0.13 -0.80 0.00 -1.22 0.23 0.00 0.00 176.35 174.70 2x3u n TYR 201 N 3.48 -0.40 -0.18 0.29 4.01 -1.26 -4.91 117.16 118.18 2x3u n TYR 201 Ca 0.12 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.82 2x3u n TYR 201 Cb 0.39 -3.23 0.02 0.00 -0.31 0.00 0.00 39.34 36.21 2x3u n TYR 201 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 2x3u h LYS 202 N 0.00 -0.12 -0.56 -0.72 3.64 -1.82 -0.31 116.57 116.68 2x3u h LYS 202 Ca -0.38 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2x3u h LYS 202 Cb 1.22 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 2x3u h LYS 202 CO 0.51 -0.08 0.36 0.93 -2.27 0.00 0.00 179.45 178.90 2x3u h GLU 203 N -0.12 0.74 -0.33 1.90 3.07 -1.91 -0.60 114.58 117.32 2x3u h GLU 203 Ca 0.24 -0.05 -0.15 0.00 -0.50 0.00 0.00 59.36 58.90 2x3u h GLU 203 Cb 0.51 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 2x3u h GLU 203 CO -0.63 0.50 -0.39 0.93 -1.40 0.00 0.00 179.01 178.03 2x3u h GLU 204 N 0.75 0.80 -0.39 2.33 5.08 -1.77 -0.99 114.58 120.38 2x3u h GLU 204 Ca 0.20 -0.41 -0.02 0.00 -1.00 0.00 0.00 59.36 58.13 2x3u h GLU 204 Cb -0.07 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2x3u h GLU 204 CO -0.04 1.04 0.16 -0.07 -1.00 0.00 0.00 179.01 179.10 2x3u h LEU 205 N 0.65 0.54 -0.95 1.33 3.38 -0.77 -1.24 115.31 118.25 2x3u h LEU 205 Ca 0.06 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 2x3u h LEU 205 Cb 0.95 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 2x3u h LEU 205 CO 0.09 0.56 -0.17 -0.33 0.09 0.00 0.00 178.44 178.68 2x3u h GLU 206 N 0.49 0.58 -0.56 1.13 5.08 -1.07 -2.20 114.58 118.03 2x3u h GLU 206 Ca 0.13 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2x3u h GLU 206 Cb 0.18 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 2x3u h GLU 206 CO -0.01 0.72 0.33 1.49 -1.00 0.00 0.00 179.01 180.54 2x3u h GLU 207 N 0.52 0.77 -0.13 2.33 4.81 -0.95 -1.72 114.58 120.20 2x3u h GLU 207 Ca 0.09 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2x3u h GLU 207 Cb 0.59 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 2x3u h GLU 207 CO 0.04 0.56 0.05 0.82 -0.73 0.00 0.00 179.01 179.75 2x3u h ILE 208 N 0.76 0.99 -0.91 2.32 2.04 -0.88 -1.43 117.51 120.38 2x3u h ILE 208 Ca 0.20 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 66.01 2x3u h ILE 208 Cb -0.01 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 2x3u h ILE 208 CO -0.04 0.02 0.53 -0.61 0.00 0.00 0.00 178.15 178.05 2x3u h GLN 209 N 0.12 1.26 -0.76 2.37 4.15 -1.25 0.31 115.11 121.31 2x3u h GLN 209 Ca 0.05 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.31 2x3u h GLN 209 Cb 0.02 -0.25 -0.03 0.00 0.21 0.00 0.00 27.48 27.42 2x3u h GLN 209 CO -0.05 0.90 0.35 0.37 -1.93 0.00 0.00 178.83 178.47 2x3u h GLN 210 N 1.27 1.11 0.11 1.69 5.75 -1.19 -2.58 115.11 121.27 2x3u h GLN 210 Ca 0.32 -0.17 -0.28 0.00 -0.15 0.00 0.00 58.65 58.37 2x3u h GLN 210 Cb -0.02 -0.19 0.02 0.00 1.07 0.00 0.00 27.48 28.36 2x3u h GLN 210 CO -0.06 0.87 -1.20 -0.22 -2.65 0.00 0.00 178.83 175.58 2x3u h LYS 211 N 1.08 0.44 -2.23 1.69 3.64 -0.71 -3.38 116.57 117.10 2x3u h LYS 211 Ca 0.26 -0.62 -0.58 0.00 -1.27 0.00 0.00 60.65 58.44 2x3u h LYS 211 Cb 0.15 0.21 -0.42 0.00 -0.41 0.00 0.00 32.23 31.76 2x3u h LYS 211 CO -0.03 1.27 -0.70 0.66 -2.27 0.00 0.00 179.45 178.38 2x3u n TYR 212 N -3.68 3.45 0.31 1.91 4.01 0.10 -4.92 117.16 118.34 2x3u n TYR 212 Ca -0.11 -4.00 0.20 0.00 -0.16 0.00 0.00 57.90 53.83 2x3u n TYR 212 Cb 0.98 -0.49 0.94 0.00 -0.31 0.00 0.00 39.34 40.45 2x3u n TYR 212 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2x3u h PRO 213 N 3.29 0.00 -0.01 -0.72 0.13 -1.65 -0.61 132.00 132.43 2x3u h PRO 213 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2x3u h PRO 213 Cb 0.60 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.73 2x3u h PRO 213 CO 0.78 0.01 -0.40 -0.25 -0.23 0.00 0.00 178.00 177.91 2x3u n ASP 214 N -3.13 1.70 -0.00 1.44 8.00 -1.26 -4.34 116.55 118.96 2x3u n ASP 214 Ca -0.01 -1.31 0.00 0.00 0.71 0.00 0.00 54.79 54.18 2x3u n ASP 214 Cb 0.19 0.36 -0.01 0.00 -0.02 0.00 0.00 41.12 41.65 2x3u n ASP 214 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2x3u n ASN 215 N -0.22 1.29 -3.70 -2.24 4.13 -0.71 -4.79 115.26 109.03 2x3u n ASN 215 Ca 0.10 -0.38 -0.17 0.00 1.68 0.00 0.00 54.58 55.81 2x3u n ASN 215 Cb 0.43 1.01 -0.16 0.00 -1.54 0.00 0.00 39.78 39.52 2x3u n ASN 215 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2x3u s PHE 216 N -1.34 -0.10 -0.09 3.10 5.36 -0.32 -0.04 117.98 124.55 2x3u s PHE 216 Ca 0.00 0.44 0.02 0.00 -0.96 0.00 0.00 56.93 56.43 2x3u s PHE 216 Cb 0.01 -0.27 -0.02 0.00 -0.34 0.00 0.00 43.02 42.40 2x3u s PHE 216 CO 0.04 -0.21 -0.14 0.50 -1.46 0.00 0.00 175.22 173.95 2x3u s ARG 217 N 1.86 2.99 -0.20 10.12 3.52 -0.05 -4.60 118.95 132.60 2x3u s ARG 217 Ca -0.01 -0.69 -0.01 0.00 -0.13 0.00 0.00 55.73 54.89 2x3u s ARG 217 Cb -0.12 -2.52 0.01 0.00 -1.56 0.00 0.00 34.95 30.76 2x3u s ARG 217 CO -0.05 0.40 -0.13 -1.17 -0.81 0.00 0.00 175.30 173.54 2x3u s LEU 218 N -0.13 2.47 -0.08 -0.88 2.96 -1.26 -0.99 118.68 120.77 2x3u s LEU 218 Ca -0.01 -0.54 0.04 0.00 -0.22 0.00 0.00 54.13 53.39 2x3u s LEU 218 Cb -0.14 -1.59 0.00 0.00 0.50 0.00 0.00 46.19 44.97 2x3u s LEU 218 CO 0.03 -0.01 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.97 2x3u s THR 219 N 1.37 1.67 -0.00 3.68 2.01 0.55 -5.00 115.64 119.92 2x3u s THR 219 Ca 0.05 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.25 2x3u s THR 219 Cb -0.14 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 70.88 2x3u s THR 219 CO -0.09 0.47 0.07 -0.31 -0.69 0.00 0.00 174.62 174.07 2x3u s TYR 220 N 0.36 3.25 -0.27 4.92 2.02 -1.26 -0.76 117.35 125.61 2x3u s TYR 220 Ca -0.14 0.18 0.03 0.00 -0.37 0.00 0.00 57.07 56.77 2x3u s TYR 220 Cb -0.16 -1.72 0.07 0.00 -0.40 0.00 0.00 41.96 39.74 2x3u s TYR 220 CO 0.06 0.54 -0.07 0.00 -1.57 0.00 0.00 175.55 174.51 2x3u s ALA 221 N -1.18 2.50 -0.41 3.71 0.00 0.31 -4.89 121.76 121.80 2x3u s ALA 221 Ca 0.22 -1.83 -0.03 0.00 0.00 0.00 0.00 51.96 50.32 2x3u s ALA 221 Cb -0.12 -1.63 0.11 0.00 0.00 0.00 0.00 23.12 21.48 2x3u s ALA 221 CO 0.14 -1.29 0.21 0.42 0.00 0.00 0.00 175.76 175.23 2x3u s ILE 222 N 1.13 3.36 0.32 0.00 -1.09 -1.26 -1.54 121.20 122.13 2x3u s ILE 222 Ca -0.05 -1.99 0.04 0.00 -2.23 0.00 0.00 60.65 56.42 2x3u s ILE 222 Cb -0.20 -3.28 0.12 0.00 -1.58 0.00 0.00 42.46 37.53 2x3u s ILE 222 CO -0.06 -0.67 1.82 0.77 -1.23 0.00 0.00 174.94 175.57 2x3u h SER 223 N 8.08 0.46 0.15 3.58 4.64 -1.33 -0.13 113.55 129.00 2x3u h SER 223 Ca -0.14 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 2x3u h SER 223 Cb 1.05 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 2x3u h SER 223 CO 0.70 0.61 -0.10 0.54 -0.87 0.00 0.00 176.83 177.72 2x3u n ARG 224 N -4.22 1.13 0.00 4.77 5.12 0.11 -4.03 116.66 119.55 2x3u n ARG 224 Ca 0.01 -0.55 0.00 0.00 -1.93 0.00 0.00 57.85 55.37 2x3u n ARG 224 Cb 0.31 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.12 2x3u n ARG 224 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 2x3u n GLU 225 N -0.45 4.78 -4.05 5.56 1.02 -0.83 -5.05 120.64 121.61 2x3u n GLU 225 Ca 0.17 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.17 2x3u n GLU 225 Cb 0.31 -0.47 -0.13 0.00 -0.02 0.00 0.00 31.44 31.13 2x3u n GLU 225 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2x3u s GLN 226 N -0.91 0.39 -0.05 3.49 -0.21 -0.12 -5.05 119.66 117.20 2x3u s GLN 226 Ca 0.00 -0.45 0.04 0.00 0.02 0.00 0.00 55.36 54.96 2x3u s GLN 226 Cb 0.00 -0.23 -0.02 0.00 1.00 0.00 0.00 33.01 33.76 2x3u s GLN 226 CO 0.00 0.05 -0.15 0.15 -2.12 0.00 0.00 175.29 173.22 2x3u s LYS 227 N -0.89 2.54 0.89 2.91 -0.14 -1.26 -1.39 119.74 122.40 2x3u s LYS 227 Ca -0.06 -0.71 -0.12 0.00 -1.36 0.00 0.00 55.97 53.72 2x3u s LYS 227 Cb -0.06 -2.37 0.12 0.00 -1.68 0.00 0.00 37.83 33.84 2x3u s LYS 227 CO -0.00 0.59 1.10 0.54 -0.76 0.00 0.00 175.35 176.82 2x3u s ASN 228 N -0.64 3.64 0.50 2.83 2.20 0.91 -4.77 114.94 119.61 2x3u s ASN 228 Ca 0.09 1.28 0.29 0.00 -0.94 0.00 0.00 52.86 53.59 2x3u s ASN 228 Cb -0.11 -1.96 1.60 0.00 -2.00 0.00 0.00 41.25 38.78 2x3u s ASN 228 CO 0.01 -2.51 1.89 -0.65 -2.94 0.00 0.00 177.10 172.90 2x3u h PRO 229 N -1.46 0.00 -0.01 3.55 0.11 -1.97 0.11 132.00 132.33 2x3u h PRO 229 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2x3u h PRO 229 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2x3u h PRO 229 CO 0.58 0.00 -0.19 1.04 -0.21 0.00 0.00 178.00 179.22 2x3u n GLN 230 N -2.62 0.83 -0.29 1.05 3.00 -1.26 -4.92 117.38 113.17 2x3u n GLN 230 Ca -0.02 -0.42 0.00 0.00 -0.01 0.00 0.00 57.00 56.55 2x3u n GLN 230 Cb 0.16 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 28.91 2x3u n GLN 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2x3u n GLY 231 N 1.31 0.88 3.85 1.08 0.00 0.38 -5.06 105.19 107.64 2x3u n GLY 231 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 2x3u n GLY 231 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2x3u s GLY 232 N -1.60 1.62 0.47 -0.02 0.00 -1.26 -4.76 107.32 101.77 2x3u s GLY 232 Ca 0.00 -0.35 -0.24 0.00 0.00 0.00 0.00 44.72 44.13 2x3u s GLY 232 CO 0.00 0.07 1.36 0.50 0.00 0.00 0.00 173.10 175.02 2x3u s ARG 233 N -5.32 3.59 -0.15 2.90 0.52 -1.26 -0.06 118.95 119.16 2x3u s ARG 233 Ca 0.60 2.25 -0.29 0.00 -0.52 0.00 0.00 55.73 57.76 2x3u s ARG 233 Cb -0.12 -2.54 -0.01 0.00 0.52 0.00 0.00 34.95 32.80 2x3u s ARG 233 CO 0.52 -0.83 1.15 1.41 0.02 0.00 0.00 175.30 177.57 2x3u s MET 234 N -2.56 4.29 0.37 3.54 -2.45 -0.49 -4.44 119.30 117.56 2x3u s MET 234 Ca 0.63 1.54 0.06 0.00 -1.25 0.00 0.00 55.69 56.67 2x3u s MET 234 Cb -0.40 -3.65 -0.07 0.00 1.25 0.00 0.00 34.83 31.95 2x3u s MET 234 CO 0.50 -0.57 0.01 0.71 1.05 0.00 0.00 175.02 176.71 2x3u s TYR 235 N 2.93 2.31 0.45 4.11 2.02 -1.26 -2.98 117.35 124.93 2x3u s TYR 235 Ca 0.51 -0.73 0.12 0.00 -0.37 0.00 0.00 57.07 56.59 2x3u s TYR 235 Cb -0.20 -1.55 1.02 0.00 -0.40 0.00 0.00 41.96 40.84 2x3u s TYR 235 CO 0.14 0.33 2.06 -0.84 -1.57 0.00 0.00 175.55 175.68 2x3u h ILE 236 N 1.93 1.02 0.00 2.71 3.07 -1.92 0.02 117.51 124.34 2x3u h ILE 236 Ca -0.43 -0.12 -0.03 0.00 1.55 0.00 0.00 64.86 65.83 2x3u h ILE 236 Cb 1.24 0.63 -0.00 0.00 -0.27 0.00 0.00 36.82 38.41 2x3u h ILE 236 CO 0.76 0.07 -0.15 0.06 -1.05 0.00 0.00 178.15 177.83 2x3u h GLN 237 N 0.36 0.00 -0.30 0.16 3.07 -1.93 0.68 115.11 117.14 2x3u h GLN 237 Ca 0.14 0.00 -0.17 0.00 0.09 0.00 0.00 58.65 58.71 2x3u h GLN 237 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.68 2x3u h GLN 237 CO -0.03 0.15 -0.49 -0.44 0.09 0.00 0.00 178.83 178.11 2x3u h ASP 238 N 0.00 0.90 -0.48 0.06 3.32 -1.37 -0.50 116.42 118.35 2x3u h ASP 238 Ca -0.00 -0.45 -0.11 0.00 0.02 0.00 0.00 57.03 56.48 2x3u h ASP 238 Cb 0.28 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2x3u h ASP 238 CO 0.02 1.23 -0.14 0.03 -1.72 0.00 0.00 179.24 178.66 2x3u h ARG 239 N 0.65 0.96 -0.61 3.56 2.47 -1.13 -0.51 114.38 119.77 2x3u h ARG 239 Ca 0.03 -0.36 -0.03 0.00 -1.26 0.00 0.00 59.98 58.36 2x3u h ARG 239 Cb 1.07 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 29.31 2x3u h ARG 239 CO 0.11 1.03 0.28 0.28 0.56 0.00 0.00 179.97 182.23 2x3u h VAL 240 N 0.85 1.22 -0.39 2.04 2.07 -0.81 -0.65 116.25 120.57 2x3u h VAL 240 Ca 0.13 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 67.02 2x3u h VAL 240 Cb 0.69 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2x3u h VAL 240 CO 0.05 0.25 0.26 0.00 0.02 0.00 0.00 177.57 178.15 2x3u h ALA 241 N 1.11 0.50 -1.00 1.67 0.00 -0.90 0.17 119.26 120.82 2x3u h ALA 241 Ca 0.21 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.12 2x3u h ALA 241 Cb 0.14 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 2x3u h ALA 241 CO -0.02 -0.05 0.66 1.49 0.00 0.00 0.00 179.25 181.32 2x3u h GLU 242 N 0.52 1.25 -0.41 0.00 4.81 -0.80 -2.82 114.58 117.14 2x3u h GLU 242 Ca 0.14 -0.08 -0.18 0.00 -0.13 0.00 0.00 59.36 59.12 2x3u h GLU 242 Cb -0.05 -0.28 -0.10 0.00 0.63 0.00 0.00 28.75 28.94 2x3u h GLU 242 CO -0.04 0.83 0.03 0.72 -0.73 0.00 0.00 179.01 179.82 2x3u n HIS 243 N -4.42 1.31 -0.20 0.92 8.25 -0.28 -4.78 115.22 116.02 2x3u n HIS 243 Ca 0.13 -1.45 -0.03 0.00 -0.26 0.00 0.00 57.72 56.12 2x3u n HIS 243 Cb 0.07 -0.51 0.08 0.00 1.12 0.00 0.00 29.99 30.75 2x3u n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2x3u h ALA 244 N 1.24 0.76 -0.22 -1.41 0.00 -0.39 -0.83 119.26 118.41 2x3u h ALA 244 Ca 0.22 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2x3u h ALA 244 Cb 1.76 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 2x3u h ALA 244 CO 0.44 -0.04 0.07 -0.44 0.00 0.00 0.00 179.25 179.27 2x3u h ASP 245 N 0.57 0.32 -0.90 0.00 3.32 -1.86 0.05 116.42 117.92 2x3u h ASP 245 Ca 0.26 -0.21 0.01 0.00 0.02 0.00 0.00 57.03 57.11 2x3u h ASP 245 Cb 0.17 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 2x3u h ASP 245 CO -0.18 0.44 0.58 -0.33 -1.72 0.00 0.00 179.24 178.04 2x3u h GLU 246 N 0.18 1.20 -0.26 3.56 5.08 -1.88 -0.10 114.58 122.35 2x3u h GLU 246 Ca 0.07 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 2x3u h GLU 246 Cb 0.24 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2x3u h GLU 246 CO -0.00 0.80 -0.09 -0.07 -1.00 0.00 0.00 179.01 178.66 2x3u h LEU 247 N 1.23 0.53 -0.65 1.33 3.38 -0.92 -1.77 115.31 118.44 2x3u h LEU 247 Ca 0.33 -0.38 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2x3u h LEU 247 Cb -0.12 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 2x3u h LEU 247 CO -0.07 0.79 0.43 -0.25 0.09 0.00 0.00 178.44 179.43 2x3u h TRP 248 N 0.27 0.82 -0.75 1.13 2.91 -0.81 0.05 115.95 119.56 2x3u h TRP 248 Ca 0.06 0.02 0.03 0.00 1.13 0.00 0.00 58.89 60.13 2x3u h TRP 248 Cb 0.57 -0.28 -0.05 0.00 -0.51 0.00 0.00 29.16 28.90 2x3u h TRP 248 CO 0.05 0.51 0.48 1.96 -1.03 0.00 0.00 178.44 180.41 2x3u h GLN 249 N 0.88 0.90 -0.39 2.65 4.20 -0.89 -1.61 115.11 120.85 2x3u h GLN 249 Ca 0.24 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.83 2x3u h GLN 249 Cb -0.09 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.47 2x3u h GLN 249 CO -0.06 0.60 -0.01 -0.07 -0.67 0.00 0.00 178.83 178.62 2x3u h LEU 250 N 0.93 0.68 -1.93 1.46 3.38 -0.98 -3.10 115.31 115.75 2x3u h LEU 250 Ca 0.30 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2x3u h LEU 250 Cb 0.02 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2x3u h LEU 250 CO -0.11 0.83 0.10 0.40 0.09 0.00 0.00 178.44 179.75 2x3u h ILE 251 N 0.51 0.98 0.00 1.22 2.04 -0.51 -2.17 117.51 119.59 2x3u h ILE 251 Ca 0.11 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.93 2x3u h ILE 251 Cb 0.49 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2x3u h ILE 251 CO 0.02 0.02 -0.02 0.11 0.00 0.00 0.00 178.15 178.28 2x3u h LYS 252 N 0.09 0.00 -6.55 2.37 1.57 -1.22 -3.43 116.57 109.39 2x3u h LYS 252 Ca 0.06 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.31 2x3u h LYS 252 Cb 0.13 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.47 2x3u h LYS 252 CO -0.01 0.02 0.77 1.21 -0.57 0.00 0.00 179.45 180.88 2x3u s ASN 253 N -5.92 6.76 0.61 0.86 3.84 -0.82 -4.90 114.94 115.37 2x3u s ASN 253 Ca -0.04 2.39 0.29 0.00 0.21 0.00 0.00 52.86 55.71 2x3u s ASN 253 Cb 0.14 -2.59 1.56 0.00 -0.55 0.00 0.00 41.25 39.82 2x3u s ASN 253 CO 0.52 -0.70 1.95 0.06 -2.79 0.00 0.00 177.10 176.14 2x3u h GLN 254 N 6.87 0.00 -0.30 0.43 3.07 -1.89 -1.57 115.11 121.72 2x3u h GLN 254 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.32 2x3u h GLN 254 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.77 2x3u h GLN 254 CO 0.88 0.00 0.00 1.63 0.09 0.00 0.00 178.83 181.43 2x3u n LYS 255 N -3.54 2.38 -2.95 0.06 5.02 -1.26 -4.95 118.16 112.92 2x3u n LYS 255 Ca 0.04 -2.16 -0.40 0.00 -2.02 0.00 0.00 58.31 53.77 2x3u n LYS 255 Cb 0.52 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 34.00 2x3u n LYS 255 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2x3u s THR 256 N -1.52 4.71 0.01 -0.18 2.01 -0.59 -2.80 115.64 117.28 2x3u s THR 256 Ca 0.35 1.68 0.08 0.00 0.31 0.00 0.00 61.69 64.11 2x3u s THR 256 Cb 0.21 -4.14 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 2x3u s THR 256 CO 0.30 0.36 -0.24 -1.00 -0.69 0.00 0.00 174.62 173.34 2x3u s HIS 257 N -0.03 2.38 -0.04 4.92 3.76 0.05 -4.88 115.29 121.45 2x3u s HIS 257 Ca 0.39 -0.38 0.07 0.00 -0.15 0.00 0.00 55.06 54.99 2x3u s HIS 257 Cb -0.21 -1.46 -0.01 0.00 1.11 0.00 0.00 32.58 32.01 2x3u s HIS 257 CO 0.24 0.08 -0.25 0.99 -0.85 0.00 0.00 174.74 174.95 2x3u s THR 258 N -0.74 2.12 -0.07 1.30 2.01 -0.33 -1.12 115.64 118.81 2x3u s THR 258 Ca 0.11 -1.06 0.04 0.00 0.31 0.00 0.00 61.69 61.09 2x3u s THR 258 Cb -0.10 -1.76 0.00 0.00 0.01 0.00 0.00 72.50 70.65 2x3u s THR 258 CO 0.01 0.57 -0.20 -0.31 -0.69 0.00 0.00 174.62 174.01 2x3u s TYR 259 N -0.35 2.10 -0.10 4.92 1.51 0.42 -0.37 117.35 125.49 2x3u s TYR 259 Ca 0.02 -0.76 0.02 0.00 -1.01 0.00 0.00 57.07 55.34 2x3u s TYR 259 Cb -0.12 -1.43 0.01 0.00 -0.11 0.00 0.00 41.96 40.31 2x3u s TYR 259 CO 0.02 -0.30 -0.16 0.42 -1.11 0.00 0.00 175.55 174.42 2x3u s ILE 260 N 0.27 1.49 -0.08 2.71 1.01 0.33 -0.48 121.20 126.46 2x3u s ILE 260 Ca -0.12 -0.65 -0.10 0.00 0.00 0.00 0.00 60.65 59.78 2x3u s ILE 260 Cb -0.15 -1.35 0.02 0.00 0.01 0.00 0.00 42.46 40.99 2x3u s ILE 260 CO 0.05 0.44 0.26 0.00 0.00 0.00 0.00 174.94 175.69 2x3u n GLY 262 N 2.53 0.54 3.76 0.00 0.00 -1.12 -2.43 105.19 108.48 2x3u n GLY 262 Ca -0.15 -1.82 -0.39 0.00 0.00 0.00 0.00 46.02 43.65 2x3u n GLY 262 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x3u s LEU 263 N 0.00 4.09 0.69 0.99 1.43 -1.26 -1.73 118.68 122.89 2x3u s LEU 263 Ca 0.00 2.80 -0.17 0.00 -1.03 0.00 0.00 54.13 55.73 2x3u s LEU 263 Cb 0.00 -4.00 0.01 0.00 0.03 0.00 0.00 46.19 42.23 2x3u s LEU 263 CO 0.00 -1.15 1.20 0.54 0.23 0.00 0.00 176.35 177.16 2x3u n ARG 264 N -0.28 0.78 0.00 1.70 1.74 -1.26 -4.50 116.66 114.85 2x3u n ARG 264 Ca 0.06 0.33 0.00 0.00 -0.77 0.00 0.00 57.85 57.47 2x3u n ARG 264 Cb 0.43 -2.43 0.00 0.00 -1.02 0.00 0.00 32.46 29.44 2x3u n ARG 264 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2x3u n GLY 265 N 0.89 0.98 0.01 -0.13 0.00 -1.26 -5.00 105.19 100.68 2x3u n GLY 265 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 2x3u n GLY 265 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2x3u n MET 266 N 0.00 0.57 -0.32 1.61 2.81 -1.26 -4.57 117.12 115.96 2x3u n MET 266 Ca 0.00 -0.13 0.06 0.00 -1.81 0.00 0.00 57.70 55.81 2x3u n MET 266 Cb 0.00 -1.36 0.25 0.00 -0.71 0.00 0.00 33.22 31.40 2x3u n MET 266 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 2x3u h GLU 267 N 0.00 0.96 -0.17 0.03 5.08 -1.95 -1.30 114.58 117.24 2x3u h GLU 267 Ca 0.00 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2x3u h GLU 267 Cb 0.69 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2x3u h GLU 267 CO 0.00 0.64 0.09 1.49 -1.00 0.00 0.00 179.01 180.23 2x3u h GLU 268 N 0.99 0.23 -0.24 2.33 4.81 -2.00 0.58 114.58 121.28 2x3u h GLU 268 Ca 0.42 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.51 2x3u h GLU 268 Cb 0.32 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2x3u h GLU 268 CO -0.18 0.22 -0.34 0.78 -0.73 0.00 0.00 179.01 178.76 2x3u h GLY 269 N 0.17 0.57 0.98 1.92 0.00 -1.76 -1.41 103.07 103.54 2x3u h GLY 269 Ca 0.06 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 2x3u h GLY 269 CO -0.01 0.47 0.26 -2.22 0.00 0.00 0.00 176.54 175.04 2x3u h ILE 270 N 0.44 1.19 -0.70 2.60 2.04 -1.02 -2.23 117.51 119.83 2x3u h ILE 270 Ca 0.05 -0.52 -0.06 0.00 1.00 0.00 0.00 64.86 65.33 2x3u h ILE 270 Cb 0.80 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2x3u h ILE 270 CO 0.07 0.21 0.21 0.44 0.00 0.00 0.00 178.15 179.07 2x3u h ASP 271 N 0.69 1.03 -0.70 1.72 3.32 -0.63 -1.81 116.42 120.05 2x3u h ASP 271 Ca 0.18 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 2x3u h ASP 271 Cb 0.10 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 2x3u h ASP 271 CO -0.02 0.97 0.42 0.00 -1.72 0.00 0.00 179.24 178.89 2x3u h ALA 272 N 1.10 0.89 -0.09 3.45 0.00 -1.09 0.96 119.26 124.48 2x3u h ALA 272 Ca 0.22 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2x3u h ALA 272 Cb 0.32 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2x3u h ALA 272 CO -0.00 0.36 0.01 0.00 0.00 0.00 0.00 179.25 179.62 2x3u h ALA 273 N 1.22 0.12 -0.09 0.00 0.00 -1.25 -2.44 119.26 116.82 2x3u h ALA 273 Ca 0.25 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2x3u h ALA 273 Cb -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2x3u h ALA 273 CO -0.05 -0.23 -0.39 -0.07 0.00 0.00 0.00 179.25 178.51 2x3u h LEU 274 N -0.10 0.19 -0.41 0.00 3.38 -1.21 -2.68 115.31 114.49 2x3u h LEU 274 Ca 0.03 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2x3u h LEU 274 Cb 0.30 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2x3u h LEU 274 CO 0.00 0.57 0.18 -1.28 0.09 0.00 0.00 178.44 178.00 2x3u h SER 275 N 0.16 0.56 -0.74 -0.43 0.87 -0.73 -1.32 113.55 111.92 2x3u h SER 275 Ca 0.02 -0.16 -0.05 0.00 -1.23 0.00 0.00 61.79 60.37 2x3u h SER 275 Cb 0.77 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.55 2x3u h SER 275 CO 0.06 0.56 0.29 0.00 -0.53 0.00 0.00 176.83 177.21 2x3u h ALA 276 N 1.02 1.09 -0.05 6.23 0.00 -1.27 -0.90 119.26 125.39 2x3u h ALA 276 Ca 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2x3u h ALA 276 Cb 0.17 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2x3u h ALA 276 CO -0.01 0.64 0.01 0.00 0.00 0.00 0.00 179.25 179.89 2x3u h ALA 277 N 1.22 0.06 -0.36 0.00 0.00 -1.31 -3.19 119.26 115.68 2x3u h ALA 277 Ca 0.25 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2x3u h ALA 277 Cb 0.22 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2x3u h ALA 277 CO -0.02 -0.30 -0.05 0.00 0.00 0.00 0.00 179.25 178.87 2x3u h ALA 278 N 0.77 1.24 0.00 0.00 0.00 -1.15 -2.81 119.26 117.31 2x3u h ALA 278 Ca 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2x3u h ALA 278 Cb 0.26 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2x3u h ALA 278 CO 0.00 0.50 -0.04 0.00 0.00 0.00 0.00 179.25 179.71 2x3u h ALA 279 N 1.39 1.86 0.00 0.00 0.00 -0.97 -1.05 119.26 120.49 2x3u h ALA 279 Ca 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2x3u h ALA 279 Cb 0.44 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2x3u h ALA 279 CO 0.02 0.05 -0.06 0.87 0.00 0.00 0.00 179.25 180.13 2x3u h LYS 280 N 0.00 0.00 -0.41 0.00 1.57 -1.49 -1.50 116.57 114.74 2x3u h LYS 280 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2x3u h LYS 280 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 2x3u h LYS 280 CO 0.01 0.06 0.01 0.39 -0.57 0.00 0.00 179.45 179.34 2x3u n GLU 281 N -3.96 3.80 -2.58 3.15 1.02 -0.48 -4.95 120.64 116.63 2x3u n GLU 281 Ca -0.03 -3.00 -0.17 0.00 -0.02 0.00 0.00 57.16 53.95 2x3u n GLU 281 Cb 0.15 -2.04 0.01 0.00 -0.02 0.00 0.00 31.44 29.54 2x3u n GLU 281 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x3u n GLY 282 N -0.02 -0.27 3.45 0.62 0.00 -0.56 -5.02 105.19 103.39 2x3u n GLY 282 Ca 0.25 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2x3u n GLY 282 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x3u s VAL 283 N -2.92 3.30 -0.47 1.61 1.01 -0.72 -4.99 120.40 117.21 2x3u s VAL 283 Ca 0.12 -0.60 -0.23 0.00 0.00 0.00 0.00 61.98 61.28 2x3u s VAL 283 Cb -0.05 -2.37 0.03 0.00 0.00 0.00 0.00 36.38 33.99 2x3u s VAL 283 CO 0.15 0.55 0.78 -0.89 0.00 0.00 0.00 175.10 175.68 2x3u s THR 284 N -0.06 4.65 0.19 3.92 2.01 -1.26 -2.76 115.64 122.33 2x3u s THR 284 Ca -0.01 0.29 -0.12 0.00 0.31 0.00 0.00 61.69 62.15 2x3u s THR 284 Cb -0.14 -4.34 0.10 0.00 0.01 0.00 0.00 72.50 68.14 2x3u s THR 284 CO 0.03 -0.77 1.74 -0.25 -0.69 0.00 0.00 174.62 174.69 2x3u h TRP 285 N 9.02 0.31 -0.85 4.92 -0.00 -1.88 -1.31 115.95 126.15 2x3u h TRP 285 Ca -0.25 0.03 0.13 0.00 -0.00 0.00 0.00 58.89 58.80 2x3u h TRP 285 Cb 1.09 -0.06 -0.06 0.00 -0.00 0.00 0.00 29.16 30.12 2x3u h TRP 285 CO 0.80 0.09 0.55 0.66 -0.00 0.00 0.00 178.44 180.54 2x3u h SER 286 N 0.35 0.62 -0.01 2.65 4.64 -1.94 0.58 113.55 120.43 2x3u h SER 286 Ca 0.25 0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.59 2x3u h SER 286 Cb 0.29 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2x3u h SER 286 CO -0.27 0.33 -0.06 0.44 -0.87 0.00 0.00 176.83 176.40 2x3u h ASP 287 N 0.66 0.07 -0.61 4.97 3.32 -1.71 -2.24 116.42 120.89 2x3u h ASP 287 Ca 0.42 -0.66 0.07 0.00 0.02 0.00 0.00 57.03 56.87 2x3u h ASP 287 Cb 0.68 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.15 2x3u h ASP 287 CO -0.18 0.72 0.30 0.22 -1.72 0.00 0.00 179.24 178.58 2x3u h TYR 288 N -0.57 0.54 -0.70 4.55 3.20 -0.60 -2.26 116.97 121.12 2x3u h TYR 288 Ca -0.00 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2x3u h TYR 288 Cb 0.72 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.81 2x3u h TYR 288 CO 0.15 0.22 0.42 0.37 -1.64 0.00 0.00 178.16 177.69 2x3u h GLN 289 N 0.54 0.95 -0.81 1.82 4.15 0.09 0.03 115.11 121.89 2x3u h GLN 289 Ca 0.28 -0.09 0.09 0.00 0.77 0.00 0.00 58.65 59.70 2x3u h GLN 289 Cb 0.24 -0.20 -0.07 0.00 0.21 0.00 0.00 27.48 27.67 2x3u h GLN 289 CO -0.22 0.68 0.47 0.87 -1.93 0.00 0.00 178.83 178.70 2x3u h LYS 290 N 0.95 0.78 -0.36 1.69 1.57 -0.92 0.12 116.57 120.41 2x3u h LYS 290 Ca 0.25 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.84 2x3u h LYS 290 Cb -0.02 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 2x3u h LYS 290 CO -0.05 0.52 -0.34 -0.44 -0.57 0.00 0.00 179.45 178.57 2x3u h ASP 291 N 0.80 0.85 -0.70 0.86 3.32 -0.82 -1.87 116.42 118.86 2x3u h ASP 291 Ca 0.38 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2x3u h ASP 291 Cb 0.32 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 2x3u h ASP 291 CO -0.23 1.11 0.45 -0.07 -1.72 0.00 0.00 179.24 178.77 2x3u h LEU 292 N 0.67 0.81 -0.55 1.55 3.38 -0.21 -1.12 115.31 119.84 2x3u h LEU 292 Ca 0.07 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 2x3u h LEU 292 Cb 0.89 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2x3u h LEU 292 CO 0.08 0.61 0.22 0.11 0.09 0.00 0.00 178.44 179.55 2x3u h LYS 293 N 0.94 0.82 -0.86 1.13 1.57 -0.61 0.92 116.57 120.48 2x3u h LYS 293 Ca 0.25 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 2x3u h LYS 293 Cb -0.08 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.06 2x3u h LYS 293 CO -0.05 0.71 0.43 -0.22 -0.57 0.00 0.00 179.45 179.75 2x3u h LYS 294 N 0.75 1.23 0.00 3.15 3.64 -1.18 -2.18 116.57 121.97 2x3u h LYS 294 Ca 0.18 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2x3u h LYS 294 Cb 0.19 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 2x3u h LYS 294 CO -0.02 0.93 0.00 0.00 -2.27 0.00 0.00 179.45 178.09 2x3u n ALA 295 N -2.42 2.27 -2.01 5.00 0.00 -0.44 -4.91 120.51 118.00 2x3u n ALA 295 Ca 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 2x3u n ALA 295 Cb 0.13 -1.42 -0.00 0.00 0.00 0.00 0.00 19.45 18.15 2x3u n ALA 295 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x3u n GLY 296 N 1.03 0.32 0.15 0.00 0.00 -0.64 -4.95 105.19 101.09 2x3u n GLY 296 Ca 0.10 -0.84 0.02 0.00 0.00 0.00 0.00 46.02 45.30 2x3u n GLY 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x3u n ARG 297 N -1.15 -0.14 -4.05 1.61 1.74 0.22 -4.86 116.66 110.02 2x3u n ARG 297 Ca -0.02 -0.70 -0.32 0.00 -0.77 0.00 0.00 57.85 56.05 2x3u n ARG 297 Cb 0.50 -1.06 -0.15 0.00 -1.02 0.00 0.00 32.46 30.74 2x3u n ARG 297 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 2x3u s TRP 298 N -0.38 3.41 -0.21 -1.55 -0.11 -1.16 -1.18 118.94 117.76 2x3u s TRP 298 Ca 0.04 -2.50 -0.03 0.00 1.22 0.00 0.00 56.10 54.83 2x3u s TRP 298 Cb 0.03 -2.22 -0.00 0.00 -1.50 0.00 0.00 33.47 29.77 2x3u s TRP 298 CO 0.05 -0.90 -0.07 -1.01 -4.62 0.00 0.00 176.95 170.41 2x3u s HIS 299 N 1.05 2.92 -0.08 5.86 3.76 0.51 -4.62 115.29 124.70 2x3u s HIS 299 Ca -0.03 -1.03 0.02 0.00 -0.15 0.00 0.00 55.06 53.87 2x3u s HIS 299 Cb -0.20 -2.06 0.01 0.00 1.11 0.00 0.00 32.58 31.44 2x3u s HIS 299 CO -0.06 -0.57 -0.14 0.08 -0.85 0.00 0.00 174.74 173.20 2x3u s VAL 300 N 1.39 1.30 -0.45 -0.90 1.01 -1.26 -0.51 120.40 120.98 2x3u s VAL 300 Ca 0.05 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.49 2x3u s VAL 300 Cb -0.14 -1.18 0.15 0.00 0.00 0.00 0.00 36.38 35.21 2x3u s VAL 300 CO -0.04 0.39 0.29 -0.70 0.00 0.00 0.00 175.10 175.04 2x3u s GLU 301 N 0.68 1.20 -0.00 2.72 2.56 0.10 -4.95 118.70 121.01 2x3u s GLU 301 Ca -0.14 -2.08 0.05 0.00 0.00 0.00 0.00 54.97 52.80 2x3u s GLU 301 Cb -0.16 -2.03 -0.03 0.00 2.00 0.00 0.00 34.13 33.91 2x3u s GLU 301 CO 0.04 -1.25 -0.13 0.95 -0.56 0.00 0.00 175.26 174.31 2x3u s THR 302 N 0.17 3.17 0.00 -1.70 -4.23 -1.26 -2.78 115.64 109.01 2x3u s THR 302 Ca 0.23 -0.89 0.00 0.00 -1.18 0.00 0.00 61.69 59.85 2x3u s THR 302 Cb -0.14 -2.32 0.00 0.00 1.34 0.00 0.00 72.50 71.38 2x3u s THR 302 CO -0.07 0.45 0.05 2.22 -0.54 0.00 0.00 174.62 176.72