#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i23 s VAL 3 N 0.00 5.04 0.28 1.08 1.01 -0.94 -4.97 120.40 121.89 3i23 s VAL 3 Ca 0.00 0.87 -0.27 0.00 0.00 0.00 0.00 61.98 62.58 3i23 s VAL 3 Cb 0.00 -3.87 -0.09 0.00 0.00 0.00 0.00 36.38 32.42 3i23 s VAL 3 CO 0.00 0.03 0.92 -0.54 0.00 0.00 0.00 175.10 175.51 3i23 s LYS 4 N 2.37 4.65 0.14 2.72 -0.14 -1.26 -1.98 119.74 126.25 3i23 s LYS 4 Ca 0.22 1.34 -0.24 0.00 -1.36 0.00 0.00 55.97 55.94 3i23 s LYS 4 Cb -0.16 -2.99 0.08 0.00 -1.68 0.00 0.00 37.83 33.08 3i23 s LYS 4 CO 0.10 0.39 1.10 0.20 -0.76 0.00 0.00 175.35 176.37 3i23 s GLY 6 N -1.44 0.06 -0.03 -3.33 0.00 -0.55 -1.12 107.32 100.91 3i23 s GLY 6 Ca 0.46 -0.26 -0.00 0.00 0.00 0.00 0.00 44.72 44.92 3i23 s GLY 6 CO 0.26 3.26 0.02 -1.36 0.00 0.00 0.00 173.10 175.28 3i23 s PHE 7 N -2.11 0.24 -1.02 1.90 0.08 -0.34 -2.60 117.98 114.12 3i23 s PHE 7 Ca 0.24 0.06 -0.14 0.00 0.12 0.00 0.00 56.93 57.21 3i23 s PHE 7 Cb -0.02 -0.43 0.19 0.00 -0.57 0.00 0.00 43.02 42.19 3i23 s PHE 7 CO 0.04 -0.16 1.13 0.42 -0.10 0.00 0.00 175.22 176.55 3i23 s ILE 8 N 1.37 5.28 0.00 0.64 -1.09 0.19 1.00 121.20 128.60 3i23 s ILE 8 Ca -0.05 -2.46 0.00 0.00 -2.23 0.00 0.00 60.65 55.91 3i23 s ILE 8 Cb -0.13 -4.71 0.00 0.00 -1.58 0.00 0.00 42.46 36.04 3i23 s ILE 8 CO -0.03 -1.36 0.00 0.61 -1.23 0.00 0.00 174.94 172.93 3i23 n GLY 9 N 4.18 4.00 0.72 6.18 0.00 0.44 -1.37 105.19 119.33 3i23 n GLY 9 Ca 0.25 -1.26 0.06 0.00 0.00 0.00 0.00 46.02 45.07 3i23 n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3i23 n PHE 10 N -0.31 0.00 -0.39 1.61 7.35 -1.26 -4.68 117.46 119.79 3i23 n PHE 10 Ca 0.00 -1.28 0.00 0.00 -0.76 0.00 0.00 57.45 55.41 3i23 n PHE 10 Cb 0.00 -0.22 0.00 0.00 0.35 0.00 0.00 39.48 39.61 3i23 n PHE 10 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3i23 n GLY 11 N -0.85 -2.67 0.15 7.13 0.00 -1.26 -4.75 105.19 102.93 3i23 n GLY 11 Ca 0.16 -1.40 -0.02 0.00 0.00 0.00 0.00 46.02 44.76 3i23 n GLY 11 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3i23 h LYS 12 N 0.00 0.05 -0.43 1.61 2.10 -1.96 -2.31 116.57 115.62 3i23 h LYS 12 Ca 0.00 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.61 3i23 h LYS 12 Cb 0.00 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.31 3i23 h LYS 12 CO 0.00 0.63 0.26 1.03 -2.00 0.00 0.00 179.45 179.36 3i23 h SER 13 N 0.03 0.52 1.24 7.07 0.87 -1.91 0.42 113.55 121.79 3i23 h SER 13 Ca -0.01 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 3i23 h SER 13 Cb 1.06 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.88 3i23 h SER 13 CO 0.08 0.43 -0.12 0.00 -0.53 0.00 0.00 176.83 176.69 3i23 h ALA 14 N 1.11 0.98 0.00 6.23 0.00 -1.79 -2.95 119.26 122.84 3i23 h ALA 14 Ca 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3i23 h ALA 14 Cb 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3i23 h ALA 14 CO -0.03 0.15 -0.76 0.09 0.00 0.00 0.00 179.25 178.70 3i23 n ASN 15 N -3.21 0.62 -0.04 0.00 3.02 -0.55 -2.14 115.26 112.96 3i23 n ASN 15 Ca 0.01 -0.22 -0.04 0.00 -0.03 0.00 0.00 54.58 54.30 3i23 n ASN 15 Cb 0.43 0.50 -0.07 0.00 -0.61 0.00 0.00 39.78 40.03 3i23 n ASN 15 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 3i23 n ARG 16 N -1.80 2.42 -0.00 3.52 0.63 0.14 -4.60 116.66 116.96 3i23 n ARG 16 Ca 0.04 -0.01 0.03 0.00 -0.92 0.00 0.00 57.85 56.99 3i23 n ARG 16 Cb 0.39 -1.24 -0.04 0.00 0.45 0.00 0.00 32.46 32.02 3i23 n ARG 16 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3i23 n TYR 17 N -2.33 0.00 -0.03 -0.14 4.01 -1.12 -4.75 117.16 112.80 3i23 n TYR 17 Ca -0.15 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.56 3i23 n TYR 17 Cb 0.78 -0.10 -0.01 0.00 -0.31 0.00 0.00 39.34 39.71 3i23 n TYR 17 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 3i23 n HIS 18 N -1.55 0.00 0.04 -0.72 8.25 -1.23 -4.67 115.22 115.34 3i23 n HIS 18 Ca -0.00 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.49 3i23 n HIS 18 Cb 0.14 -0.17 0.43 0.00 1.12 0.00 0.00 29.99 31.51 3i23 n HIS 18 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3i23 h LEU 19 N -0.35 0.40 -2.20 2.41 3.38 -1.72 -1.33 115.31 115.90 3i23 h LEU 19 Ca 0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3i23 h LEU 19 Cb 0.35 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 3i23 h LEU 19 CO 0.00 0.33 -0.01 -0.65 0.09 0.00 0.00 178.44 178.20 3i23 h PRO 20 N 0.46 0.00 0.02 1.13 0.11 -1.85 -3.12 132.00 128.76 3i23 h PRO 20 Ca 0.12 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.84 3i23 h PRO 20 Cb 0.02 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.07 3i23 h PRO 20 CO -0.02 0.01 -2.27 0.66 -0.21 0.00 0.00 178.00 176.17 3i23 n TYR 21 N -3.13 0.34 0.09 0.65 4.01 -0.95 -4.27 117.16 113.90 3i23 n TYR 21 Ca -0.01 0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 3i23 n TYR 21 Cb 0.19 -1.04 0.00 0.00 -0.31 0.00 0.00 39.34 38.18 3i23 n TYR 21 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3i23 n VAL 22 N -3.76 0.07 0.00 -0.72 0.31 -0.54 -3.46 118.33 110.24 3i23 n VAL 22 Ca -0.45 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 3i23 n VAL 22 Cb 0.93 -0.45 0.00 0.00 -0.91 0.00 0.00 33.84 33.41 3i23 n VAL 22 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3i23 n ILE 24 N 0.85 0.00 -3.56 2.52 5.41 -1.26 -4.70 119.36 118.62 3i23 n ILE 24 Ca 0.00 0.00 -0.40 0.00 1.00 0.00 0.00 62.75 63.35 3i23 n ILE 24 Cb 0.04 0.00 -0.11 0.00 -0.71 0.00 0.00 39.64 38.86 3i23 n ILE 24 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 3i23 s ARG 25 N 0.00 3.58 0.00 0.38 0.52 -1.22 -4.93 118.95 117.27 3i23 s ARG 25 Ca 0.00 -0.58 0.18 0.00 -0.52 0.00 0.00 55.73 54.81 3i23 s ARG 25 Cb 0.00 -3.74 1.01 0.00 0.52 0.00 0.00 34.95 32.74 3i23 s ARG 25 CO 0.00 -0.38 1.49 0.39 0.02 0.00 0.00 175.30 176.82 3i23 n GLU 26 N 5.08 0.45 0.09 3.54 1.02 -1.26 -1.66 120.64 127.90 3i23 n GLU 26 Ca -0.13 0.04 0.12 0.00 -0.02 0.00 0.00 57.16 57.17 3i23 n GLU 26 Cb 0.50 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.47 3i23 n GLU 26 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3i23 h THR 27 N 0.00 0.00 -1.86 2.62 1.35 -1.92 -3.47 112.91 109.63 3i23 h THR 27 Ca 0.00 -0.82 -0.48 0.00 -0.55 0.00 0.00 66.41 64.55 3i23 h THR 27 Cb 0.06 1.33 -0.03 0.00 -1.73 0.00 0.00 68.15 67.77 3i23 h THR 27 CO 0.00 0.00 -0.43 -0.76 -0.25 0.00 0.00 175.52 174.08 3i23 s LEU 28 N -4.95 3.71 -0.25 3.87 2.01 -0.67 -2.22 118.68 120.17 3i23 s LEU 28 Ca 0.02 -0.41 -0.05 0.00 0.01 0.00 0.00 54.13 53.70 3i23 s LEU 28 Cb 0.11 -2.35 0.13 0.00 0.01 0.00 0.00 46.19 44.09 3i23 s LEU 28 CO 0.77 -0.35 0.50 -0.70 1.01 0.00 0.00 176.35 177.58 3i23 s GLU 29 N -4.03 0.44 -0.33 1.70 2.12 -0.83 -4.83 118.70 112.94 3i23 s GLU 29 Ca 0.41 1.00 -0.14 0.00 0.36 0.00 0.00 54.97 56.61 3i23 s GLU 29 Cb -0.07 0.30 -0.02 0.00 0.26 0.00 0.00 34.13 34.61 3i23 s GLU 29 CO 0.28 -0.42 0.30 0.08 -0.54 0.00 0.00 175.26 174.96 3i23 s VAL 30 N 2.71 5.22 -0.06 3.70 1.01 -1.26 -4.33 120.40 127.40 3i23 s VAL 30 Ca 0.06 0.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 3i23 s VAL 30 Cb -0.14 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 3i23 s VAL 30 CO -0.17 0.01 -0.09 1.17 0.00 0.00 0.00 175.10 176.01 3i23 n LYS 31 N 5.25 0.17 -5.08 2.72 4.81 -1.26 -4.58 118.16 120.19 3i23 n LYS 31 Ca -0.11 0.20 -0.32 0.00 -0.87 0.00 0.00 58.31 57.21 3i23 n LYS 31 Cb 0.50 -0.94 -0.15 0.00 0.02 0.00 0.00 35.03 34.46 3i23 n LYS 31 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3i23 s THR 32 N -1.56 2.52 -0.12 3.15 2.01 -1.25 0.03 115.64 120.42 3i23 s THR 32 Ca -0.08 -0.90 -0.03 0.00 0.31 0.00 0.00 61.69 60.99 3i23 s THR 32 Cb 0.01 -1.96 -0.03 0.00 0.01 0.00 0.00 72.50 70.53 3i23 s THR 32 CO 0.12 0.57 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.97 3i23 s ILE 33 N -0.28 4.17 -0.27 1.82 -1.09 0.06 -1.20 121.20 124.40 3i23 s ILE 33 Ca 0.01 -0.28 0.02 0.00 -2.23 0.00 0.00 60.65 58.16 3i23 s ILE 33 Cb -0.13 -2.79 0.07 0.00 -1.58 0.00 0.00 42.46 38.04 3i23 s ILE 33 CO 0.03 0.55 -0.03 0.12 -1.23 0.00 0.00 174.94 174.38 3i23 s PHE 34 N -0.32 2.88 -0.02 3.97 5.36 0.28 -2.41 117.98 127.72 3i23 s PHE 34 Ca 0.06 -2.20 0.03 0.00 -0.96 0.00 0.00 56.93 53.86 3i23 s PHE 34 Cb -0.12 -1.99 -0.00 0.00 -0.34 0.00 0.00 43.02 40.56 3i23 s PHE 34 CO 0.02 -0.85 -0.09 0.34 -1.46 0.00 0.00 175.22 173.18 3i23 s ASP 35 N 1.22 1.17 0.32 6.13 -1.08 -1.20 0.17 116.67 123.40 3i23 s ASP 35 Ca -0.02 -0.18 0.09 0.00 -0.52 0.00 0.00 52.55 51.92 3i23 s ASP 35 Cb -0.19 -0.23 0.54 0.00 -1.46 0.00 0.00 42.92 41.58 3i23 s ASP 35 CO -0.08 0.09 1.74 0.25 0.52 0.00 0.00 175.17 177.69 3i23 h LEU 36 N 6.17 0.17 -6.31 -1.34 5.85 -1.88 -3.32 115.31 114.64 3i23 h LEU 36 Ca -0.32 -0.06 -0.59 0.00 0.84 0.00 0.00 57.88 57.75 3i23 h LEU 36 Cb 1.17 -0.05 -0.40 0.00 0.37 0.00 0.00 40.66 41.76 3i23 h LEU 36 CO 0.49 0.55 -0.85 1.41 -0.34 0.00 0.00 178.44 179.70 3i23 n HIS 37 N -4.05 1.19 -0.67 1.25 8.25 -1.26 -4.87 115.22 115.07 3i23 n HIS 37 Ca -0.01 -3.79 -0.29 0.00 -0.26 0.00 0.00 57.72 53.36 3i23 n HIS 37 Cb 0.45 -0.32 0.22 0.00 1.12 0.00 0.00 29.99 31.46 3i23 n HIS 37 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3i23 s VAL 38 N -1.32 2.10 -0.10 1.59 1.01 -1.25 -5.05 120.40 117.39 3i23 s VAL 38 Ca 0.34 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.39 3i23 s VAL 38 Cb 0.10 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 3i23 s VAL 38 CO -0.11 -0.04 -0.21 0.21 0.00 0.00 0.00 175.10 174.94 3i23 s ASN 39 N -2.68 3.35 0.06 3.32 3.84 -1.26 -5.07 114.94 116.51 3i23 s ASN 39 Ca 0.67 -0.48 -0.15 0.00 0.21 0.00 0.00 52.86 53.11 3i23 s ASN 39 Cb -0.23 -1.35 -0.22 0.00 -0.55 0.00 0.00 41.25 38.90 3i23 s ASN 39 CO 0.62 0.18 1.19 -0.33 -2.79 0.00 0.00 177.10 175.97 3i23 h GLU 40 N 6.55 0.64 0.00 0.43 3.07 -1.96 -2.31 114.58 121.00 3i23 h GLU 40 Ca -0.24 -0.65 -0.12 0.00 -0.50 0.00 0.00 59.36 57.85 3i23 h GLU 40 Cb 1.22 0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 29.29 3i23 h GLU 40 CO 0.49 1.25 -0.56 0.87 -1.40 0.00 0.00 179.01 179.67 3i23 h LYS 41 N 0.28 0.00 0.16 2.33 6.56 -1.98 1.20 116.57 125.13 3i23 h LYS 41 Ca -0.10 0.00 -0.25 0.00 -1.06 0.00 0.00 60.65 59.24 3i23 h LYS 41 Cb 1.54 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 33.23 3i23 h LYS 41 CO 0.17 0.56 -1.06 0.00 -2.06 0.00 0.00 179.45 177.06 3i23 h ALA 42 N 1.44 -0.09 0.00 3.86 0.00 -2.02 -3.28 119.26 119.18 3i23 h ALA 42 Ca -0.01 -0.75 -0.10 0.00 0.00 0.00 0.00 54.91 54.06 3i23 h ALA 42 Cb 1.22 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 3i23 h ALA 42 CO 0.07 0.51 -0.49 0.00 0.00 0.00 0.00 179.25 179.34 3i23 h ALA 43 N 0.15 0.75 -0.85 0.00 0.00 -1.38 -3.34 119.26 114.59 3i23 h ALA 43 Ca -0.18 -0.45 0.15 0.00 0.00 0.00 0.00 54.91 54.44 3i23 h ALA 43 Cb 1.82 -0.08 -0.15 0.00 0.00 0.00 0.00 17.79 19.37 3i23 h ALA 43 CO 0.20 0.62 -0.30 0.00 0.00 0.00 0.00 179.25 179.77 3i23 h ALA 44 N 1.51 0.32 0.00 0.00 0.00 0.14 0.47 119.26 121.70 3i23 h ALA 44 Ca -0.00 0.28 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 3i23 h ALA 44 Cb 1.25 0.80 -0.01 0.00 0.00 0.00 0.00 17.79 19.83 3i23 h ALA 44 CO 0.06 -0.53 -0.25 -1.00 0.00 0.00 0.00 179.25 177.54 3i23 h PRO 45 N -0.04 0.00 0.01 0.00 0.13 -1.74 -2.81 132.00 127.56 3i23 h PRO 45 Ca 0.36 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 65.25 3i23 h PRO 45 Cb 0.61 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.76 3i23 h PRO 45 CO -0.88 0.25 -0.95 0.74 -0.23 0.00 0.00 178.00 176.92 3i23 h PHE 46 N 0.00 0.94 -0.19 1.56 0.04 -0.35 -3.19 116.94 115.75 3i23 h PHE 46 Ca -0.00 -0.52 -0.08 0.00 2.80 0.00 0.00 57.97 60.17 3i23 h PHE 46 Cb 0.60 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.63 3i23 h PHE 46 CO 0.00 1.35 -0.22 0.87 -0.60 0.00 0.00 178.31 179.71 3i23 h LYS 47 N 0.26 0.33 0.00 1.51 1.57 -0.87 -0.26 116.57 119.11 3i23 h LYS 47 Ca -0.12 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 3i23 h LYS 47 Cb 1.62 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.90 3i23 h LYS 47 CO 0.19 0.54 0.00 -1.91 -0.57 0.00 0.00 179.45 177.70 3i23 n GLU 48 N -4.17 0.31 0.00 3.15 2.13 -1.06 -1.12 120.64 119.88 3i23 n GLU 48 Ca -0.01 0.10 0.10 0.00 0.66 0.00 0.00 57.16 58.01 3i23 n GLU 48 Cb 0.36 -1.50 0.06 0.00 0.27 0.00 0.00 31.44 30.62 3i23 n GLU 48 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3i23 n LYS 49 N -1.25 1.71 -0.02 5.31 4.76 -0.18 -4.94 118.16 123.56 3i23 n LYS 49 Ca 0.10 -1.44 0.00 0.00 -2.87 0.00 0.00 58.31 54.09 3i23 n LYS 49 Cb 0.14 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 31.94 3i23 n LYS 49 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i23 n GLY 50 N 1.19 0.47 3.74 0.72 0.00 -0.27 -5.06 105.19 105.99 3i23 n GLY 50 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3i23 n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i23 s VAL 51 N -2.03 3.34 -0.19 1.61 1.01 -0.78 -4.96 120.40 118.39 3i23 s VAL 51 Ca 0.00 1.15 -0.08 0.00 0.00 0.00 0.00 61.98 63.05 3i23 s VAL 51 Cb 0.00 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 3i23 s VAL 51 CO 0.00 0.20 0.08 0.21 0.00 0.00 0.00 175.10 175.58 3i23 s ASN 52 N 0.07 5.77 0.20 3.32 3.84 0.10 -4.07 114.94 124.17 3i23 s ASN 52 Ca 0.53 0.12 0.07 0.00 0.21 0.00 0.00 52.86 53.79 3i23 s ASN 52 Cb -0.35 -1.99 -0.04 0.00 -0.55 0.00 0.00 41.25 38.32 3i23 s ASN 52 CO 0.39 0.18 0.05 -0.36 -2.79 0.00 0.00 177.10 174.57 3i23 s PHE 53 N 0.37 2.91 -0.19 0.43 0.08 -1.26 -0.76 117.98 119.55 3i23 s PHE 53 Ca 0.04 -0.13 -0.31 0.00 0.12 0.00 0.00 56.93 56.66 3i23 s PHE 53 Cb -0.12 -1.37 0.15 0.00 -0.57 0.00 0.00 43.02 41.10 3i23 s PHE 53 CO -0.00 0.54 1.15 -0.08 -0.10 0.00 0.00 175.22 176.72 3i23 s THR 54 N -1.88 0.00 -0.70 0.64 -1.32 -1.01 -4.91 115.64 106.46 3i23 s THR 54 Ca 0.29 0.00 0.13 0.00 -1.21 0.00 0.00 61.69 60.91 3i23 s THR 54 Cb -0.09 -1.00 0.41 0.00 -1.51 0.00 0.00 72.50 70.31 3i23 s THR 54 CO 0.20 0.00 1.34 0.00 -2.21 0.00 0.00 174.62 173.95 3i23 n ALA 55 N 0.37 2.51 -2.96 11.08 0.00 -1.26 -3.27 120.51 126.98 3i23 n ALA 55 Ca -0.04 -1.57 -0.42 0.00 0.00 0.00 0.00 53.44 51.41 3i23 n ALA 55 Cb 0.59 -0.57 -0.10 0.00 0.00 0.00 0.00 19.45 19.37 3i23 n ALA 55 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3i23 s ASP 56 N -1.31 5.84 0.22 0.00 2.15 -1.26 -4.85 116.67 117.47 3i23 s ASP 56 Ca 0.32 -1.25 -0.07 0.00 0.43 0.00 0.00 52.55 51.97 3i23 s ASP 56 Cb 0.21 -2.07 0.19 0.00 -0.30 0.00 0.00 42.92 40.95 3i23 s ASP 56 CO 0.14 -0.51 1.78 0.25 -0.17 0.00 0.00 175.17 176.66 3i23 h LEU 57 N 8.53 1.07 -1.08 -1.34 5.85 -1.99 -2.73 115.31 123.63 3i23 h LEU 57 Ca -0.25 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.29 3i23 h LEU 57 Cb 1.10 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.85 3i23 h LEU 57 CO 0.76 0.96 0.00 0.78 -0.34 0.00 0.00 178.44 180.60 3i23 h ASN 58 N 1.12 0.00 0.93 1.25 -0.26 -1.97 -0.83 115.58 115.82 3i23 h ASN 58 Ca 0.25 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.99 3i23 h ASN 58 Cb 0.24 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.50 3i23 h ASN 58 CO -0.02 0.00 0.00 -0.08 -1.06 0.00 0.00 177.43 176.27 3i23 h GLU 59 N 0.00 0.00 0.00 0.81 4.81 -1.91 0.13 114.58 118.42 3i23 h GLU 59 Ca 0.00 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.86 3i23 h GLU 59 Cb 0.57 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.88 3i23 h GLU 59 CO 0.00 0.00 -2.39 -0.11 -0.73 0.00 0.00 179.01 175.78 3i23 n LEU 60 N -3.04 2.53 0.10 1.64 7.94 -0.75 -3.85 117.00 121.57 3i23 n LEU 60 Ca 0.00 -0.11 -0.05 0.00 -1.11 0.00 0.00 56.01 54.74 3i23 n LEU 60 Cb 0.28 -0.66 0.03 0.00 0.53 0.00 0.00 43.42 43.60 3i23 n LEU 60 CO 0.26 0.85 0.32 -0.07 -1.11 0.00 0.00 177.39 177.64 3i23 h LEU 61 N 0.00 0.04 0.00 -1.96 3.38 -1.07 -3.19 115.31 112.51 3i23 h LEU 61 Ca -0.55 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.35 3i23 h LEU 61 Cb 1.91 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.64 3i23 h LEU 61 CO -0.07 0.83 -0.78 0.71 0.09 0.00 0.00 178.44 179.22 3i23 h THR 62 N 0.02 0.20 -1.13 0.22 1.35 -0.97 -3.45 112.91 109.15 3i23 h THR 62 Ca -0.01 -1.33 -0.67 0.00 -0.55 0.00 0.00 66.41 63.84 3i23 h THR 62 Cb 1.42 1.83 -0.02 0.00 -1.73 0.00 0.00 68.15 69.65 3i23 h THR 62 CO 0.11 0.11 1.41 -0.67 -0.25 0.00 0.00 175.52 176.23 3i23 n ASP 63 N -2.89 2.18 0.22 5.36 -0.08 -1.21 -4.81 116.55 115.32 3i23 n ASP 63 Ca -0.01 0.42 0.10 0.00 -1.51 0.00 0.00 54.79 53.79 3i23 n ASP 63 Cb 0.62 -1.27 0.45 0.00 2.34 0.00 0.00 41.12 43.26 3i23 n ASP 63 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3i23 h PRO 64 N 12.35 0.00 0.00 -0.67 0.13 -1.89 -3.21 132.00 138.71 3i23 h PRO 64 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3i23 h PRO 64 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3i23 h PRO 64 CO 1.02 0.23 0.00 -1.91 -0.23 0.00 0.00 178.00 177.11 3i23 n GLU 65 N -3.39 0.13 -3.42 0.86 2.13 -1.26 -4.80 120.64 110.89 3i23 n GLU 65 Ca 0.00 0.13 -0.38 0.00 0.66 0.00 0.00 57.16 57.58 3i23 n GLU 65 Cb 0.44 -1.66 -0.06 0.00 0.27 0.00 0.00 31.44 30.43 3i23 n GLU 65 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3i23 s ILE 66 N -3.06 4.92 0.00 6.31 1.01 -1.22 -4.61 121.20 124.55 3i23 s ILE 66 Ca 0.12 0.94 0.00 0.00 0.00 0.00 0.00 60.65 61.71 3i23 s ILE 66 Cb 0.15 -3.77 0.00 0.00 0.01 0.00 0.00 42.46 38.85 3i23 s ILE 66 CO 0.54 0.52 0.00 -1.84 0.00 0.00 0.00 174.94 174.16 3i23 n GLU 67 N 1.63 2.31 -4.33 2.79 0.28 -0.27 -4.89 120.64 118.16 3i23 n GLU 67 Ca -0.12 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.58 3i23 n GLU 67 Cb 0.52 -0.85 -0.11 0.00 1.43 0.00 0.00 31.44 32.43 3i23 n GLU 67 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 3i23 s LEU 68 N -2.59 2.90 -0.13 -1.84 2.96 -1.10 0.15 118.68 119.03 3i23 s LEU 68 Ca 0.00 -0.42 -0.07 0.00 -0.22 0.00 0.00 54.13 53.42 3i23 s LEU 68 Cb 0.00 -1.71 0.05 0.00 0.50 0.00 0.00 46.19 45.03 3i23 s LEU 68 CO 0.00 0.20 0.32 -0.63 -1.32 0.00 0.00 176.35 174.92 3i23 s ILE 69 N -1.14 -0.03 -0.11 6.68 1.01 -0.01 -1.49 121.20 126.12 3i23 s ILE 69 Ca 0.19 0.12 -0.03 0.00 0.00 0.00 0.00 60.65 60.93 3i23 s ILE 69 Cb -0.11 -0.48 -0.03 0.00 0.01 0.00 0.00 42.46 41.85 3i23 s ILE 69 CO 0.11 0.05 0.01 -0.89 0.00 0.00 0.00 174.94 174.22 3i23 s THR 70 N 1.28 4.40 -0.30 2.92 2.01 -1.07 -0.03 115.64 124.86 3i23 s THR 70 Ca -0.09 -0.20 -0.08 0.00 0.31 0.00 0.00 61.69 61.63 3i23 s THR 70 Cb -0.09 -2.88 0.00 0.00 0.01 0.00 0.00 72.50 69.54 3i23 s THR 70 CO -0.10 0.57 0.10 -0.63 -0.69 0.00 0.00 174.62 173.87 3i23 s ILE 71 N -0.58 4.14 -0.31 1.82 1.01 -0.03 0.54 121.20 127.79 3i23 s ILE 71 Ca 0.10 -0.60 0.12 0.00 0.00 0.00 0.00 60.65 60.27 3i23 s ILE 71 Cb -0.12 -3.12 0.47 0.00 0.01 0.00 0.00 42.46 39.70 3i23 s ILE 71 CO 0.02 0.09 1.13 0.00 0.00 0.00 0.00 174.94 176.18 3i23 s THR 73 N -4.39 1.75 0.39 0.00 -4.23 -1.23 -4.43 115.64 103.49 3i23 s THR 73 Ca 0.41 -1.40 -0.24 0.00 -1.18 0.00 0.00 61.69 59.29 3i23 s THR 73 Cb 0.39 -2.14 -0.12 0.00 1.34 0.00 0.00 72.50 71.97 3i23 s THR 73 CO -0.02 0.00 0.75 -2.65 -0.54 0.00 0.00 174.62 172.15 3i23 n PRO 74 N -1.86 0.86 -0.37 3.99 -0.02 -1.26 -4.85 135.00 131.50 3i23 n PRO 74 Ca 0.02 0.31 0.31 0.00 -2.02 0.00 0.00 63.50 62.11 3i23 n PRO 74 Cb 0.64 -1.68 0.62 0.00 -0.02 0.00 0.00 33.50 33.05 3i23 n PRO 74 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i23 h ALA 75 N 1.18 2.65 0.00 3.55 0.00 -1.95 -1.47 119.26 123.22 3i23 h ALA 75 Ca -0.41 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3i23 h ALA 75 Cb 1.38 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.26 3i23 h ALA 75 CO 0.55 -1.10 0.00 -2.39 0.00 0.00 0.00 179.25 176.31 3i23 n HIS 76 N -4.49 0.22 0.97 0.00 1.44 -1.26 -3.51 115.22 108.58 3i23 n HIS 76 Ca 0.29 0.07 0.10 0.00 -2.01 0.00 0.00 57.72 56.17 3i23 n HIS 76 Cb 1.15 -0.61 -0.08 0.00 0.12 0.00 0.00 29.99 30.56 3i23 n HIS 76 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 3i23 n THR 77 N -1.68 0.00 -0.13 0.61 -2.24 -0.55 -4.58 114.28 105.71 3i23 n THR 77 Ca 0.06 -0.02 0.12 0.00 -2.27 0.00 0.00 64.05 61.94 3i23 n THR 77 Cb 0.33 0.89 0.46 0.00 -2.10 0.00 0.00 70.33 69.92 3i23 n THR 77 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 3i23 h HIS 78 N 0.00 0.54 -0.08 4.78 3.86 -1.64 -2.53 115.15 120.09 3i23 h HIS 78 Ca 0.00 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.14 3i23 h HIS 78 Cb 0.52 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.82 3i23 h HIS 78 CO 0.00 0.25 -0.29 -0.92 0.86 0.00 0.00 177.93 177.83 3i23 h TYR 79 N 0.50 0.44 0.00 2.45 5.03 -1.81 -2.92 116.97 120.66 3i23 h TYR 79 Ca 0.32 -0.18 -0.11 0.00 2.58 0.00 0.00 58.73 61.33 3i23 h TYR 79 Cb 0.57 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.76 3i23 h TYR 79 CO -0.00 0.90 -0.52 -0.44 -1.32 0.00 0.00 178.16 176.79 3i23 h ASP 80 N -0.15 0.00 -0.14 -2.11 3.32 -1.86 -2.05 116.42 113.43 3i23 h ASP 80 Ca -0.01 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.82 3i23 h ASP 80 Cb 0.92 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.48 3i23 h ASP 80 CO 0.06 0.52 -0.74 -0.07 -1.72 0.00 0.00 179.24 177.29 3i23 h LEU 81 N 0.00 0.89 -1.51 1.55 3.38 -1.55 0.12 115.31 118.19 3i23 h LEU 81 Ca -0.01 -0.64 -0.05 0.00 0.09 0.00 0.00 57.88 57.28 3i23 h LEU 81 Cb 1.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 3i23 h LEU 81 CO 0.07 1.39 -0.25 0.00 0.09 0.00 0.00 178.44 179.73 3i23 h ALA 82 N 0.53 1.36 0.01 1.53 0.00 -1.46 0.18 119.26 121.40 3i23 h ALA 82 Ca -0.05 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 3i23 h ALA 82 Cb 1.38 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3i23 h ALA 82 CO 0.15 0.31 -0.00 -0.22 0.00 0.00 0.00 179.25 179.49 3i23 h LYS 83 N 0.00 -0.01 -0.57 0.00 3.64 -1.15 -2.06 116.57 116.41 3i23 h LYS 83 Ca -0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 3i23 h LYS 83 Cb 0.51 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 3i23 h LYS 83 CO 0.03 0.72 0.29 1.96 -2.27 0.00 0.00 179.45 180.18 3i23 h GLN 84 N -0.77 0.80 -0.11 1.90 4.20 -0.44 -2.92 115.11 117.77 3i23 h GLN 84 Ca -0.00 -0.09 -0.16 0.00 0.06 0.00 0.00 58.65 58.46 3i23 h GLN 84 Cb 0.74 -0.16 0.01 0.00 0.30 0.00 0.00 27.48 28.37 3i23 h GLN 84 CO 0.00 0.61 -0.55 0.00 -0.67 0.00 0.00 178.83 178.23 3i23 h ALA 85 N 1.51 0.22 -0.96 3.87 0.00 -0.72 -2.89 119.26 120.29 3i23 h ALA 85 Ca 0.20 -0.52 0.06 0.00 0.00 0.00 0.00 54.91 54.65 3i23 h ALA 85 Cb 0.07 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 3i23 h ALA 85 CO -0.03 0.43 0.62 0.82 0.00 0.00 0.00 179.25 181.09 3i23 h ILE 86 N 0.19 1.10 -0.44 0.00 2.04 -1.28 -2.31 117.51 116.81 3i23 h ILE 86 Ca -0.04 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 3i23 h ILE 86 Cb 1.19 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 3i23 h ILE 86 CO 0.11 0.21 0.14 -0.07 0.00 0.00 0.00 178.15 178.54 3i23 h LEU 87 N 1.15 0.63 0.00 1.44 -0.00 -1.54 -2.06 115.31 114.93 3i23 h LEU 87 Ca 0.41 -0.20 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 3i23 h LEU 87 Cb 0.12 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 40.62 3i23 h LEU 87 CO -0.16 0.67 0.02 0.00 -0.00 0.00 0.00 178.44 178.96 3i23 n ALA 88 N -2.34 1.12 -1.11 1.53 0.00 -0.89 -4.78 120.51 114.06 3i23 n ALA 88 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3i23 n ALA 88 Cb 0.18 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3i23 n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i23 n GLY 89 N -1.29 0.74 3.46 0.00 0.00 -0.77 -4.97 105.19 102.34 3i23 n GLY 89 Ca 0.00 -0.69 -0.27 0.00 0.00 0.00 0.00 46.02 45.07 3i23 n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i23 s LYS 90 N -2.38 1.64 0.19 1.61 3.01 -1.12 -4.97 119.74 117.72 3i23 s LYS 90 Ca 0.00 -1.48 -0.25 0.00 -1.01 0.00 0.00 55.97 53.23 3i23 s LYS 90 Cb 0.00 -1.91 -0.08 0.00 -1.01 0.00 0.00 37.83 34.83 3i23 s LYS 90 CO 0.00 0.40 0.80 -1.12 0.51 0.00 0.00 175.35 175.95 3i23 s SER 91 N -2.73 7.38 0.05 2.83 0.01 0.12 -4.22 113.70 117.14 3i23 s SER 91 Ca 0.22 1.67 0.03 0.00 1.31 0.00 0.00 55.95 59.19 3i23 s SER 91 Cb -0.08 -2.51 -0.02 0.00 0.21 0.00 0.00 66.02 63.62 3i23 s SER 91 CO 0.11 0.17 -0.10 0.68 0.41 0.00 0.00 173.24 174.50 3i23 s VAL 92 N -1.22 0.78 -0.17 3.43 -7.23 -0.42 -0.83 120.40 114.74 3i23 s VAL 92 Ca 0.38 -1.05 -0.06 0.00 -1.81 0.00 0.00 61.98 59.44 3i23 s VAL 92 Cb -0.22 -0.78 -0.04 0.00 0.56 0.00 0.00 36.38 35.90 3i23 s VAL 92 CO 0.26 -0.23 0.03 -0.63 -0.31 0.00 0.00 175.10 174.23 3i23 s ILE 93 N -1.14 4.55 -0.17 -0.62 -1.09 0.96 -4.48 121.20 119.21 3i23 s ILE 93 Ca -0.05 -0.12 0.00 0.00 -2.23 0.00 0.00 60.65 58.25 3i23 s ILE 93 Cb -0.09 -3.03 0.03 0.00 -1.58 0.00 0.00 42.46 37.80 3i23 s ILE 93 CO 0.01 0.48 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.40 3i23 s VAL 94 N 0.23 1.49 0.94 2.92 1.01 -1.26 -0.85 120.40 124.89 3i23 s VAL 94 Ca 0.02 -0.74 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 3i23 s VAL 94 Cb -0.13 -1.51 0.15 0.00 0.00 0.00 0.00 36.38 34.90 3i23 s VAL 94 CO 0.01 0.30 1.09 -1.61 0.00 0.00 0.00 175.10 174.89 3i23 s GLU 95 N 1.49 0.89 0.30 2.72 2.02 -1.15 -0.34 118.70 124.63 3i23 s GLU 95 Ca 0.02 0.98 -0.29 0.00 0.02 0.00 0.00 54.97 55.70 3i23 s GLU 95 Cb -0.14 -1.75 -0.10 0.00 0.10 0.00 0.00 34.13 32.23 3i23 s GLU 95 CO -0.09 -2.54 1.25 -1.59 0.02 0.00 0.00 175.26 172.31 3i23 s LYS 96 N -4.80 4.44 0.37 1.61 -2.85 -1.26 -3.82 119.74 113.43 3i23 s LYS 96 Ca 0.65 2.08 -0.21 0.00 -1.00 0.00 0.00 55.97 57.49 3i23 s LYS 96 Cb -0.20 -3.12 -0.10 0.00 -2.06 0.00 0.00 37.83 32.35 3i23 s LYS 96 CO 0.58 -0.08 0.88 -1.25 0.10 0.00 0.00 175.35 175.59 3i23 s PRO 97 N -1.49 4.25 0.07 1.78 0.04 -1.26 -4.79 135.00 133.60 3i23 s PRO 97 Ca 0.49 1.04 -0.35 0.00 0.04 0.00 0.00 61.00 62.22 3i23 s PRO 97 Cb -0.37 -2.40 -0.20 0.00 0.04 0.00 0.00 34.50 31.57 3i23 s PRO 97 CO 0.48 0.10 1.60 0.35 0.04 0.00 0.00 177.00 179.57 3i23 h PHE 98 N 2.34 -1.04 -3.82 0.56 3.57 -1.84 -3.46 116.94 113.25 3i23 h PHE 98 Ca -0.48 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 60.88 3i23 h PHE 98 Cb 1.18 0.34 -0.16 0.00 2.79 0.00 0.00 35.95 40.10 3i23 h PHE 98 CO 0.62 -0.64 -0.48 0.00 -2.23 0.00 0.00 178.31 175.58 3i23 h ASP 100 N 3.31 0.00 -4.87 0.00 2.03 -1.89 -3.44 116.42 111.55 3i23 h ASP 100 Ca -0.33 0.00 -0.20 0.00 -0.73 0.00 0.00 57.03 55.77 3i23 h ASP 100 Cb 1.18 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 39.51 3i23 h ASP 100 CO 0.54 0.16 -0.70 0.42 -1.03 0.00 0.00 179.24 178.62 3i23 s THR 101 N -4.45 0.44 0.20 1.15 -4.23 -1.26 -5.03 115.64 102.46 3i23 s THR 101 Ca -0.04 -1.53 -0.10 0.00 -1.18 0.00 0.00 61.69 58.84 3i23 s THR 101 Cb 0.15 -1.16 0.15 0.00 1.34 0.00 0.00 72.50 72.98 3i23 s THR 101 CO 0.65 -0.73 1.82 0.25 -0.54 0.00 0.00 174.62 176.07 3i23 h LEU 102 N 3.65 0.94 -1.76 4.79 5.85 -1.89 0.56 115.31 127.44 3i23 h LEU 102 Ca -0.35 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.26 3i23 h LEU 102 Cb 1.17 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3i23 h LEU 102 CO 0.56 0.77 -0.01 -0.33 -0.34 0.00 0.00 178.44 179.08 3i23 h GLU 103 N 1.04 0.13 0.16 1.25 5.08 -1.98 0.66 114.58 120.92 3i23 h GLU 103 Ca 0.26 -0.01 -0.29 0.00 -1.00 0.00 0.00 59.36 58.32 3i23 h GLU 103 Cb 0.04 -0.03 0.02 0.00 0.50 0.00 0.00 28.75 29.28 3i23 h GLU 103 CO -0.04 0.16 -1.29 0.45 -1.00 0.00 0.00 179.01 177.28 3i23 h HIS 104 N 0.13 0.67 -0.19 4.33 3.86 -1.72 -2.25 115.15 119.99 3i23 h HIS 104 Ca 0.03 -0.48 -0.02 0.00 -1.16 0.00 0.00 60.37 58.74 3i23 h HIS 104 Cb 0.11 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 3i23 h HIS 104 CO 0.00 1.36 0.02 0.00 0.86 0.00 0.00 177.93 180.18 3i23 h ALA 105 N 0.45 1.69 0.02 2.45 0.00 0.32 -1.66 119.26 122.54 3i23 h ALA 105 Ca -0.17 -0.10 -0.24 0.00 0.00 0.00 0.00 54.91 54.40 3i23 h ALA 105 Cb 2.00 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 19.73 3i23 h ALA 105 CO 0.22 0.24 -0.96 0.93 0.00 0.00 0.00 179.25 179.68 3i23 h GLU 106 N 0.27 0.61 -0.15 0.00 5.08 -0.91 -3.19 114.58 116.29 3i23 h GLU 106 Ca 0.07 -0.69 0.03 0.00 -1.00 0.00 0.00 59.36 57.76 3i23 h GLU 106 Cb 0.15 0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.55 3i23 h GLU 106 CO 0.00 1.28 -0.46 1.49 -1.00 0.00 0.00 179.01 180.32 3i23 h GLU 107 N 0.23 -0.45 -0.90 2.33 4.81 -0.70 -1.29 114.58 118.61 3i23 h GLU 107 Ca -0.13 0.03 0.22 0.00 -0.13 0.00 0.00 59.36 59.35 3i23 h GLU 107 Cb 1.64 0.10 -0.12 0.00 0.63 0.00 0.00 28.75 31.00 3i23 h GLU 107 CO 0.19 -0.30 0.41 -0.07 -0.73 0.00 0.00 179.01 178.50 3i23 h LEU 108 N -0.47 0.36 -1.22 1.64 4.07 -1.43 0.35 115.31 118.60 3i23 h LEU 108 Ca 0.03 0.15 -0.08 0.00 0.08 0.00 0.00 57.88 58.06 3i23 h LEU 108 Cb 0.57 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.41 3i23 h LEU 108 CO -0.39 0.02 -0.31 -0.26 -1.08 0.00 0.00 178.44 176.42 3i23 h PHE 109 N 0.42 0.15 -0.19 1.13 0.04 -1.27 0.12 116.94 117.34 3i23 h PHE 109 Ca 0.56 -0.03 -0.12 0.00 2.80 0.00 0.00 57.97 61.18 3i23 h PHE 109 Cb 1.04 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 39.14 3i23 h PHE 109 CO -0.13 0.43 -0.39 0.00 -0.60 0.00 0.00 178.31 177.63 3i23 h ALA 110 N 1.57 0.98 0.00 2.45 0.00 0.11 -2.47 119.26 121.90 3i23 h ALA 110 Ca 0.02 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.40 3i23 h ALA 110 Cb 0.61 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3i23 h ALA 110 CO 0.04 0.61 -0.54 -0.07 0.00 0.00 0.00 179.25 179.30 3i23 h LEU 111 N 0.36 0.00 -0.81 0.00 3.38 -0.57 0.33 115.31 118.00 3i23 h LEU 111 Ca 0.03 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 3i23 h LEU 111 Cb 0.84 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3i23 h LEU 111 CO 0.07 0.54 -0.29 1.23 0.09 0.00 0.00 178.44 180.08 3i23 h GLY 112 N 2.72 0.61 0.47 0.83 0.00 -0.44 0.55 103.07 107.82 3i23 h GLY 112 Ca -0.01 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 46.78 3i23 h GLY 112 CO 0.07 0.49 -0.03 -1.61 0.00 0.00 0.00 176.54 175.46 3i23 h GLN 113 N 0.49 -0.08 0.00 4.80 5.75 -1.21 0.12 115.11 124.97 3i23 h GLN 113 Ca 0.06 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 3i23 h GLN 113 Cb 0.75 0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.32 3i23 h GLN 113 CO 0.06 0.40 0.00 0.39 -2.65 0.00 0.00 178.83 177.03 3i23 n GLU 114 N -4.88 0.00 0.00 1.69 -0.58 0.08 -2.03 120.64 114.92 3i23 n GLU 114 Ca -0.09 0.51 0.02 0.00 -0.42 0.00 0.00 57.16 57.19 3i23 n GLU 114 Cb 0.27 -1.35 0.15 0.00 -0.57 0.00 0.00 31.44 29.93 3i23 n GLU 114 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3i23 n LYS 115 N -1.83 0.41 -3.97 3.49 4.76 0.16 -4.84 118.16 116.34 3i23 n LYS 115 Ca 0.00 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.16 3i23 n LYS 115 Cb 0.00 -1.19 -0.01 0.00 -1.84 0.00 0.00 35.03 32.00 3i23 n LYS 115 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i23 n GLY 116 N -0.12 -0.34 3.45 0.72 0.00 -0.80 -4.97 105.19 103.13 3i23 n GLY 116 Ca 0.04 0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 3i23 n GLY 116 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i23 s VAL 117 N -3.63 1.42 -0.09 1.61 -7.23 0.34 -5.01 120.40 107.81 3i23 s VAL 117 Ca 0.30 -2.04 -0.21 0.00 -1.81 0.00 0.00 61.98 58.22 3i23 s VAL 117 Cb -0.16 -2.67 -0.04 0.00 0.56 0.00 0.00 36.38 34.07 3i23 s VAL 117 CO 0.88 -0.12 0.61 -0.69 -0.31 0.00 0.00 175.10 175.46 3i23 s VAL 118 N -3.15 5.10 0.00 1.32 1.01 -1.26 -4.45 120.40 118.98 3i23 s VAL 118 Ca 0.33 1.25 0.03 0.00 0.00 0.00 0.00 61.98 63.59 3i23 s VAL 118 Cb 0.07 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 3i23 s VAL 118 CO 0.14 0.28 -0.09 -0.69 0.00 0.00 0.00 175.10 174.75 3i23 s VAL 119 N 0.73 0.68 0.23 2.92 1.01 -1.26 -1.30 120.40 123.40 3i23 s VAL 119 Ca 0.33 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.91 3i23 s VAL 119 Cb -0.17 -0.59 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 3i23 s VAL 119 CO 0.15 0.13 0.26 -2.16 0.00 0.00 0.00 175.10 173.47 3i23 s PRO 121 N -0.37 3.17 -0.58 2.72 0.04 -1.26 -4.90 135.00 133.82 3i23 s PRO 121 Ca 0.02 -0.87 -0.25 0.00 0.04 0.00 0.00 61.00 59.94 3i23 s PRO 121 Cb -0.04 -2.74 0.04 0.00 0.04 0.00 0.00 34.50 31.80 3i23 s PRO 121 CO -0.00 0.44 1.01 -0.47 0.04 0.00 0.00 177.00 178.01 3i23 s TYR 122 N -1.99 2.71 -0.81 0.56 5.04 0.54 -4.68 117.35 118.73 3i23 s TYR 122 Ca 0.33 -0.01 0.02 0.00 -2.44 0.00 0.00 57.07 54.97 3i23 s TYR 122 Cb -0.09 -4.21 0.24 0.00 0.35 0.00 0.00 41.96 38.25 3i23 s TYR 122 CO 0.27 -1.47 0.85 1.04 -1.34 0.00 0.00 175.55 174.89 3i23 n GLN 123 N 7.78 2.79 0.23 4.97 1.13 -1.26 -4.69 117.38 128.32 3i23 n GLN 123 Ca 0.02 -4.57 0.11 0.00 -1.94 0.00 0.00 57.00 50.62 3i23 n GLN 123 Cb 0.48 -2.36 0.47 0.00 0.11 0.00 0.00 30.24 28.94 3i23 n GLN 123 CO 0.00 0.00 0.00 -2.95 -1.44 0.00 0.00 177.06 172.67 3i23 h ASN 124 N 5.14 0.00 0.05 1.08 -1.07 -1.92 -3.20 115.58 115.66 3i23 h ASN 124 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.55 3i23 h ASN 124 Cb 0.71 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.96 3i23 h ASN 124 CO 0.91 0.20 0.00 0.54 0.07 0.00 0.00 177.43 179.15 3i23 n ARG 125 N -3.35 0.42 0.00 4.14 5.12 -1.26 -1.69 116.66 120.04 3i23 n ARG 125 Ca 0.00 0.03 0.14 0.00 -1.93 0.00 0.00 57.85 56.09 3i23 n ARG 125 Cb 0.43 -1.50 0.64 0.00 -1.16 0.00 0.00 32.46 30.86 3i23 n ARG 125 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3i23 n ARG 126 N -1.05 0.30 -0.62 5.56 1.74 -1.21 -3.15 116.66 118.23 3i23 n ARG 126 Ca 0.10 -0.05 0.02 0.00 -0.77 0.00 0.00 57.85 57.16 3i23 n ARG 126 Cb 0.06 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.21 3i23 n ARG 126 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3i23 n PHE 127 N -1.31 0.63 -2.90 -1.55 3.72 -0.68 -4.68 117.46 110.69 3i23 n PHE 127 Ca 0.11 -1.41 -0.40 0.00 -0.05 0.00 0.00 57.45 55.70 3i23 n PHE 127 Cb 0.29 -0.36 -0.06 0.00 -0.94 0.00 0.00 39.48 38.41 3i23 n PHE 127 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3i23 s ASP 128 N -2.71 7.45 0.10 4.37 1.11 -1.19 -2.57 116.67 123.24 3i23 s ASP 128 Ca 0.41 1.72 -0.29 0.00 0.18 0.00 0.00 52.55 54.57 3i23 s ASP 128 Cb 0.37 -2.53 -0.11 0.00 1.07 0.00 0.00 42.92 41.72 3i23 s ASP 128 CO -0.01 0.15 1.63 1.23 1.18 0.00 0.00 175.17 179.36 3i23 h GLY 129 N 4.52 -0.62 1.65 0.21 0.00 -1.89 -0.41 103.07 106.52 3i23 h GLY 129 Ca -0.46 0.34 0.05 0.00 0.00 0.00 0.00 47.33 47.26 3i23 h GLY 129 CO 0.67 -0.25 0.13 1.29 0.00 0.00 0.00 176.54 178.38 3i23 h ASP 130 N -0.58 0.00 0.15 0.19 2.03 -1.87 0.51 116.42 116.85 3i23 h ASP 130 Ca 0.01 0.00 -0.26 0.00 -0.73 0.00 0.00 57.03 56.04 3i23 h ASP 130 Cb 0.56 0.00 0.03 0.00 -0.83 0.00 0.00 39.33 39.09 3i23 h ASP 130 CO -0.11 0.00 -1.11 0.22 -1.03 0.00 0.00 179.24 177.21 3i23 h TYR 131 N 0.00 0.84 -0.65 4.15 3.20 -1.83 -3.30 116.97 119.37 3i23 h TYR 131 Ca 0.08 -0.56 0.00 0.00 3.14 0.00 0.00 58.73 61.39 3i23 h TYR 131 Cb 0.34 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 3i23 h TYR 131 CO 0.00 1.42 0.41 -0.07 -1.64 0.00 0.00 178.16 178.28 3i23 h LEU 132 N 0.02 0.76 -1.65 2.82 3.38 -0.25 0.15 115.31 120.54 3i23 h LEU 132 Ca -0.18 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3i23 h LEU 132 Cb 1.83 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.39 3i23 h LEU 132 CO 0.21 0.57 0.00 0.00 0.09 0.00 0.00 178.44 179.31 3i23 n ALA 133 N -2.29 1.69 0.00 1.53 0.00 0.09 -1.37 120.51 120.17 3i23 n ALA 133 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3i23 n ALA 133 Cb 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.48 3i23 n ALA 133 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3i23 n LYS 135 N 0.67 0.00 -0.11 0.00 4.81 0.54 -2.66 118.16 121.41 3i23 n LYS 135 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.32 3i23 n LYS 135 Cb 0.13 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.15 3i23 n LYS 135 CO 0.00 0.00 0.00 0.37 1.17 0.00 0.00 177.40 178.94 3i23 h GLN 136 N 0.00 0.74 -0.63 1.64 4.15 -1.48 -2.28 115.11 117.25 3i23 h GLN 136 Ca 0.00 -0.34 -0.02 0.00 0.77 0.00 0.00 58.65 59.05 3i23 h GLN 136 Cb 0.00 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.65 3i23 h GLN 136 CO 0.00 0.95 0.30 0.28 -1.93 0.00 0.00 178.83 178.43 3i23 h VAL 137 N 0.51 1.22 -0.33 2.39 2.07 -1.78 -2.43 116.25 117.90 3i23 h VAL 137 Ca 0.07 -0.63 -0.08 0.00 0.82 0.00 0.00 66.70 66.88 3i23 h VAL 137 Cb 0.76 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3i23 h VAL 137 CO 0.06 0.26 -0.14 0.58 0.02 0.00 0.00 177.57 178.34 3i23 h VAL 138 N 0.87 1.25 -0.00 2.57 2.07 -1.84 -3.01 116.25 118.16 3i23 h VAL 138 Ca 0.22 -1.11 -0.18 0.00 0.82 0.00 0.00 66.70 66.44 3i23 h VAL 138 Cb 0.13 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3i23 h VAL 138 CO -0.03 0.37 -0.83 -0.33 0.02 0.00 0.00 177.57 176.77 3i23 h GLU 139 N 0.53 0.13 0.00 1.57 5.08 -1.20 -3.16 114.58 117.53 3i23 h GLU 139 Ca 0.09 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 3i23 h GLU 139 Cb 0.55 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3i23 h GLU 139 CO 0.04 0.88 -0.37 1.96 -1.00 0.00 0.00 179.01 180.51 3i23 h GLN 140 N 0.07 0.00 -0.08 2.33 4.20 -1.44 -3.48 115.11 116.72 3i23 h GLN 140 Ca -0.03 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 3i23 h GLN 140 Cb 1.44 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.22 3i23 h GLN 140 CO 0.12 0.37 -0.02 0.41 -0.67 0.00 0.00 178.83 179.05 3i23 n GLY 141 N 0.56 0.38 0.22 3.46 0.00 -1.14 -4.98 105.19 103.69 3i23 n GLY 141 Ca 0.01 -0.95 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 3i23 n GLY 141 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3i23 h PHE 142 N 0.00 -0.46 0.00 1.61 0.04 -1.88 -2.97 116.94 113.29 3i23 h PHE 142 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3i23 h PHE 142 Cb 0.58 0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.91 3i23 h PHE 142 CO 0.02 -0.26 0.00 1.28 -0.60 0.00 0.00 178.31 178.75 3i23 n LEU 143 N -5.30 0.00 0.00 1.54 4.77 -1.26 -4.64 117.00 112.10 3i23 n LEU 143 Ca -0.08 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 3i23 n LEU 143 Cb 0.22 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 3i23 n LEU 143 CO 0.30 -0.32 0.00 0.61 -1.33 0.00 0.00 177.39 176.65 3i23 n GLY 144 N -0.64 0.44 3.60 -0.72 0.00 -1.12 0.12 105.19 106.88 3i23 n GLY 144 Ca 0.03 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 3i23 n GLY 144 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i23 s GLU 145 N 0.00 3.82 -0.18 1.61 2.02 -1.26 -4.72 118.70 119.99 3i23 s GLU 145 Ca 0.00 0.59 -0.29 0.00 0.02 0.00 0.00 54.97 55.29 3i23 s GLU 145 Cb 0.00 -3.82 -0.00 0.00 0.10 0.00 0.00 34.13 30.41 3i23 s GLU 145 CO 0.00 -1.02 1.11 0.42 0.02 0.00 0.00 175.26 175.78 3i23 s ILE 146 N 3.64 4.56 -0.03 -1.63 1.01 -1.26 -0.62 121.20 126.86 3i23 s ILE 146 Ca 0.40 1.87 0.22 0.00 0.00 0.00 0.00 60.65 63.14 3i23 s ILE 146 Cb -0.11 -4.21 -0.33 0.00 0.01 0.00 0.00 42.46 37.82 3i23 s ILE 146 CO 0.21 -0.12 0.46 -0.46 0.00 0.00 0.00 174.94 175.03 3i23 n ASN 147 N 6.07 0.05 -3.63 3.58 0.23 0.96 -4.54 115.26 117.97 3i23 n ASN 147 Ca 0.12 0.00 -0.11 0.00 -0.53 0.00 0.00 54.58 54.06 3i23 n ASN 147 Cb 0.46 1.96 -0.07 0.00 -2.08 0.00 0.00 39.78 40.05 3i23 n ASN 147 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 3i23 s GLU 148 N -3.47 0.68 -0.06 -3.83 2.12 -1.07 -2.65 118.70 110.42 3i23 s GLU 148 Ca -0.08 0.86 0.02 0.00 0.36 0.00 0.00 54.97 56.13 3i23 s GLU 148 Cb 0.14 0.31 0.02 0.00 0.26 0.00 0.00 34.13 34.85 3i23 s GLU 148 CO 0.90 -0.09 -0.09 0.08 -0.54 0.00 0.00 175.26 175.52 3i23 s VAL 149 N 0.51 0.94 -0.10 3.70 1.01 -0.97 -0.88 120.40 124.61 3i23 s VAL 149 Ca -0.00 -0.35 0.04 0.00 0.00 0.00 0.00 61.98 61.67 3i23 s VAL 149 Cb -0.05 -0.89 0.00 0.00 0.00 0.00 0.00 36.38 35.44 3i23 s VAL 149 CO -0.05 0.32 -0.22 -0.70 0.00 0.00 0.00 175.10 174.45 3i23 s GLU 150 N 0.85 2.82 -0.04 2.72 2.12 0.11 -0.53 118.70 126.76 3i23 s GLU 150 Ca -0.12 -0.80 0.02 0.00 0.36 0.00 0.00 54.97 54.43 3i23 s GLU 150 Cb -0.15 -2.15 0.02 0.00 0.26 0.00 0.00 34.13 32.10 3i23 s GLU 150 CO 0.01 0.15 -0.07 -0.08 -0.54 0.00 0.00 175.26 174.74 3i23 s THR 151 N 0.42 0.66 0.40 -1.70 -1.32 -0.57 -0.62 115.64 112.91 3i23 s THR 151 Ca -0.18 -0.23 0.07 0.00 -1.21 0.00 0.00 61.69 60.15 3i23 s THR 151 Cb -0.18 -0.64 -0.07 0.00 -1.51 0.00 0.00 72.50 70.11 3i23 s THR 151 CO 0.08 0.24 0.07 -1.00 -2.21 0.00 0.00 174.62 171.79 3i23 s HIS 152 N 0.65 2.55 -0.51 9.09 3.76 -1.06 -1.89 115.29 127.88 3i23 s HIS 152 Ca -0.10 -0.60 0.07 0.00 -0.15 0.00 0.00 55.06 54.27 3i23 s HIS 152 Cb -0.13 -1.80 0.20 0.00 1.11 0.00 0.00 32.58 31.97 3i23 s HIS 152 CO 0.01 0.36 0.78 -0.89 -0.85 0.00 0.00 174.74 174.15 3i23 n ILE 153 N -1.06 0.00 -3.21 0.60 5.41 -1.08 -4.94 119.36 115.08 3i23 n ILE 153 Ca -0.03 -1.13 -0.18 0.00 1.00 0.00 0.00 62.75 62.40 3i23 n ILE 153 Cb 0.65 1.14 0.00 0.00 -0.71 0.00 0.00 39.64 40.73 3i23 n ILE 153 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 3i23 s ASP 154 N 0.14 5.79 0.16 4.38 1.01 -1.26 -4.16 116.67 122.73 3i23 s ASP 154 Ca 0.30 -0.29 -0.08 0.00 0.71 0.00 0.00 52.55 53.19 3i23 s ASP 154 Cb 0.07 -0.94 -0.01 0.00 1.01 0.00 0.00 42.92 43.05 3i23 s ASP 154 CO -0.11 -0.62 0.26 -0.31 0.21 0.00 0.00 175.17 174.61 3i23 s TYR 155 N -2.28 0.42 -0.70 4.23 2.02 -0.45 -4.96 117.35 115.62 3i23 s TYR 155 Ca 0.50 -0.79 0.05 0.00 -0.37 0.00 0.00 57.07 56.46 3i23 s TYR 155 Cb -0.10 -0.09 0.17 0.00 -0.40 0.00 0.00 41.96 41.54 3i23 s TYR 155 CO 0.32 -0.70 0.49 -0.47 -1.57 0.00 0.00 175.55 173.63 3i23 s TYR 156 N -3.97 3.56 -0.41 2.71 5.04 -1.25 -1.53 117.35 121.52 3i23 s TYR 156 Ca 0.17 -3.32 0.11 0.00 -2.44 0.00 0.00 57.07 51.60 3i23 s TYR 156 Cb 0.04 -2.75 0.38 0.00 0.35 0.00 0.00 41.96 39.98 3i23 s TYR 156 CO -0.00 -0.57 0.86 0.54 -1.34 0.00 0.00 175.55 175.04 3i23 n ARG 157 N 2.08 1.70 -1.76 4.97 1.74 0.18 -4.97 116.66 120.59 3i23 n ARG 157 Ca 0.19 -3.75 -0.41 0.00 -0.77 0.00 0.00 57.85 53.11 3i23 n ARG 157 Cb 0.35 -1.75 0.01 0.00 -1.02 0.00 0.00 32.46 30.04 3i23 n ARG 157 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3i23 n PRO 158 N 0.02 2.42 -1.18 5.56 -0.04 -1.15 -2.58 135.00 138.04 3i23 n PRO 158 Ca 0.24 0.85 -0.06 0.00 -0.04 0.00 0.00 63.50 64.49 3i23 n PRO 158 Cb 0.65 -2.62 -0.03 0.00 -0.04 0.00 0.00 33.50 31.46 3i23 n PRO 158 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i23 n GLY 159 N 0.55 0.84 0.14 0.55 0.00 -1.26 -4.91 105.19 101.10 3i23 n GLY 159 Ca 0.03 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 3i23 n GLY 159 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i23 h SER 160 N 0.00 0.51 -3.57 1.61 4.64 -1.90 -3.43 113.55 111.41 3i23 h SER 160 Ca -0.13 -0.92 -0.71 0.00 -0.47 0.00 0.00 61.79 59.57 3i23 h SER 160 Cb 0.46 -0.16 -0.21 0.00 -0.31 0.00 0.00 62.40 62.18 3i23 h SER 160 CO 0.18 1.80 -0.46 -0.63 -0.87 0.00 0.00 176.83 176.85 3i23 s ILE 161 N -2.57 5.10 0.00 0.95 1.09 -1.26 -4.85 121.20 119.66 3i23 s ILE 161 Ca -0.19 -0.59 0.00 0.00 -1.10 0.00 0.00 60.65 58.77 3i23 s ILE 161 Cb 0.06 -3.79 0.00 0.00 -1.06 0.00 0.00 42.46 37.67 3i23 s ILE 161 CO 0.81 -0.22 0.00 0.35 -0.10 0.00 0.00 174.94 175.79 3i23 n THR 162 N 5.11 0.00 -3.74 2.92 -2.24 -1.26 -4.62 114.28 110.45 3i23 n THR 162 Ca -0.12 -0.11 -0.20 0.00 -2.27 0.00 0.00 64.05 61.36 3i23 n THR 162 Cb 0.47 0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 69.50 3i23 n THR 162 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3i23 s GLU 163 N -0.32 3.05 1.00 -0.78 8.01 -1.26 -4.61 118.70 123.79 3i23 s GLU 163 Ca 0.00 -1.05 -0.15 0.00 0.01 0.00 0.00 54.97 53.79 3i23 s GLU 163 Cb 0.00 -2.71 0.19 0.00 -4.31 0.00 0.00 34.13 27.30 3i23 s GLU 163 CO 0.00 0.18 1.16 -0.65 0.01 0.00 0.00 175.26 175.96 3i23 s GLN 164 N -4.05 0.37 0.00 1.61 -0.21 -1.26 -1.16 119.66 114.95 3i23 s GLN 164 Ca 0.40 0.09 0.00 0.00 0.02 0.00 0.00 55.36 55.88 3i23 s GLN 164 Cb -0.08 -1.77 0.00 0.00 1.00 0.00 0.00 33.01 32.16 3i23 s GLN 164 CO 0.29 -2.68 0.00 0.41 -2.12 0.00 0.00 175.29 171.18 3i23 n GLY 165 N -2.06 2.96 3.77 3.09 0.00 -1.26 -4.58 105.19 107.11 3i23 n GLY 165 Ca 0.10 -1.02 -0.34 0.00 0.00 0.00 0.00 46.02 44.76 3i23 n GLY 165 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3i23 s PRO 166 N -2.08 3.13 0.64 1.61 0.04 -1.26 -4.59 135.00 132.50 3i23 s PRO 166 Ca 0.00 1.54 0.23 0.00 0.04 0.00 0.00 61.00 62.81 3i23 s PRO 166 Cb 0.00 -1.98 1.18 0.00 0.04 0.00 0.00 34.50 33.74 3i23 s PRO 166 CO 0.00 -1.01 1.66 1.57 0.04 0.00 0.00 177.00 179.26 3i23 h LYS 167 N 0.75 0.00 0.00 4.56 2.10 -2.00 0.40 116.57 122.38 3i23 h LYS 167 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 3i23 h LYS 167 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 3i23 h LYS 167 CO 0.56 0.00 0.00 0.93 -2.00 0.00 0.00 179.45 178.94 3i23 h GLU 168 N 0.00 0.00 -0.07 0.07 3.07 -1.99 -2.62 114.58 113.04 3i23 h GLU 168 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 3i23 h GLU 168 Cb 1.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.22 3i23 h GLU 168 CO -0.00 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.70 3i23 n ASN 169 N -2.49 2.05 -4.49 1.42 4.13 0.14 -4.67 115.26 111.35 3i23 n ASN 169 Ca 0.03 -1.70 -0.26 0.00 1.68 0.00 0.00 54.58 54.34 3i23 n ASN 169 Cb 0.34 -0.03 0.13 0.00 -1.54 0.00 0.00 39.78 38.68 3i23 n ASN 169 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 3i23 s GLY 170 N -1.90 1.77 0.10 7.41 0.00 -0.99 -4.92 107.32 108.79 3i23 s GLY 170 Ca 0.35 -1.55 -0.04 0.00 0.00 0.00 0.00 44.72 43.47 3i23 s GLY 170 CO 0.31 -0.92 1.20 1.76 0.00 0.00 0.00 173.10 175.46 3i23 h SER 171 N -0.91 0.47 -0.41 1.64 0.02 -1.75 0.11 113.55 112.72 3i23 h SER 171 Ca -0.39 -0.45 0.00 0.00 -0.84 0.00 0.00 61.79 60.11 3i23 h SER 171 Cb 1.26 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.63 3i23 h SER 171 CO 0.39 1.30 0.26 0.15 -1.14 0.00 0.00 176.83 177.80 3i23 h PHE 172 N 0.13 0.52 -0.40 3.45 3.57 -1.89 1.14 116.94 123.47 3i23 h PHE 172 Ca -0.11 0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.24 3i23 h PHE 172 Cb 1.82 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 40.38 3i23 h PHE 172 CO 0.06 0.35 -0.36 1.88 -2.23 0.00 0.00 178.31 178.01 3i23 h TYR 173 N 0.54 1.11 -0.02 0.41 -1.99 -1.77 -0.24 116.97 115.02 3i23 h TYR 173 Ca 0.15 -0.32 -0.13 0.00 2.00 0.00 0.00 58.73 60.43 3i23 h TYR 173 Cb -0.03 -0.24 0.01 0.00 2.00 0.00 0.00 36.73 38.47 3i23 h TYR 173 CO -0.04 1.15 -0.48 0.78 -0.00 0.00 0.00 178.16 179.57 3i23 h GLY 174 N 0.81 0.40 0.00 3.88 0.00 -0.55 -3.38 103.07 104.22 3i23 h GLY 174 Ca 0.07 -0.66 -0.33 0.00 0.00 0.00 0.00 47.33 46.41 3i23 h GLY 174 CO 0.09 0.58 -2.12 1.04 0.00 0.00 0.00 176.54 176.13 3i23 n LEU 175 N -4.31 1.78 -0.33 3.11 4.77 0.39 -4.65 117.00 117.76 3i23 n LEU 175 Ca -0.10 0.17 0.14 0.00 -0.03 0.00 0.00 56.01 56.19 3i23 n LEU 175 Cb 0.61 -0.61 0.32 0.00 -2.33 0.00 0.00 43.42 41.41 3i23 n LEU 175 CO 0.44 0.51 1.14 1.23 -1.33 0.00 0.00 177.39 179.39 3i23 h GLY 176 N -0.23 1.73 -0.34 -0.72 0.00 -0.59 -1.53 103.07 101.39 3i23 h GLY 176 Ca -0.49 -0.30 0.11 0.00 0.00 0.00 0.00 47.33 46.65 3i23 h GLY 176 CO -0.26 -0.15 -0.28 1.19 0.00 0.00 0.00 176.54 177.04 3i23 h ILE 177 N 0.62 0.24 -0.37 2.60 2.10 -1.58 -1.95 117.51 119.16 3i23 h ILE 177 Ca 0.58 0.00 -0.03 0.00 1.08 0.00 0.00 64.86 66.49 3i23 h ILE 177 Cb 1.00 0.24 -0.02 0.00 -1.09 0.00 0.00 36.82 36.95 3i23 h ILE 177 CO -0.44 0.00 0.11 0.45 -1.08 0.00 0.00 178.15 177.20 3i23 h HIS 178 N -0.13 0.59 0.00 2.19 3.86 -1.55 -1.57 115.15 118.54 3i23 h HIS 178 Ca 0.25 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 3i23 h HIS 178 Cb 0.53 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.83 3i23 h HIS 178 CO -0.59 0.57 0.00 1.28 0.86 0.00 0.00 177.93 180.05 3i23 n LEU 179 N -4.63 0.04 0.00 2.43 4.77 -0.73 -3.08 117.00 115.79 3i23 n LEU 179 Ca -0.01 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3i23 n LEU 179 Cb 0.17 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 3i23 n LEU 179 CO 0.37 0.01 0.00 -0.67 -1.33 0.00 0.00 177.39 175.77 3i23 n ASP 181 N 0.08 0.00 -1.13 -1.43 2.03 -0.59 -4.76 116.55 110.74 3i23 n ASP 181 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 3i23 n ASP 181 Cb 0.01 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.41 3i23 n ASP 181 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 3i23 n ARG 182 N 0.00 0.56 0.00 -0.67 1.85 -1.18 -0.58 116.66 116.64 3i23 n ARG 182 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 3i23 n ARG 182 Cb 0.00 -1.22 0.00 0.00 -1.05 0.00 0.00 32.46 30.19 3i23 n ARG 182 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 3i23 n ILE 184 N 0.90 0.00 0.36 8.89 2.08 -1.26 -2.75 119.36 127.58 3i23 n ILE 184 Ca 0.00 0.00 0.14 0.00 0.56 0.00 0.00 62.75 63.45 3i23 n ILE 184 Cb 0.28 0.00 0.53 0.00 -0.75 0.00 0.00 39.64 39.69 3i23 n ILE 184 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3i23 h ALA 185 N 0.00 1.00 0.00 -1.39 0.00 -1.16 -1.28 119.26 116.44 3i23 h ALA 185 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.55 3i23 h ALA 185 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 3i23 h ALA 185 CO 0.00 0.00 -2.31 -0.11 0.00 0.00 0.00 179.25 176.83 3i23 n LEU 186 N -2.66 2.72 -0.36 0.00 7.94 -1.11 -4.70 117.00 118.82 3i23 n LEU 186 Ca 0.02 -0.03 0.08 0.00 -1.11 0.00 0.00 56.01 54.96 3i23 n LEU 186 Cb 0.31 -0.78 -0.00 0.00 0.53 0.00 0.00 43.42 43.48 3i23 n LEU 186 CO 0.25 0.81 0.26 0.49 -1.11 0.00 0.00 177.39 178.09 3i23 n PHE 187 N -3.36 0.00 -2.78 1.96 3.72 -1.25 -5.11 117.46 110.64 3i23 n PHE 187 Ca -0.42 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 56.98 3i23 n PHE 187 Cb 0.91 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.45 3i23 n PHE 187 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3i23 n GLY 188 N 1.14 -2.02 3.68 1.37 0.00 -0.48 -4.87 105.19 104.01 3i23 n GLY 188 Ca 0.07 -1.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 3i23 n GLY 188 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3i23 s ARG 189 N -0.04 4.36 0.91 1.61 3.52 -1.26 -4.62 118.95 123.43 3i23 s ARG 189 Ca 0.00 1.56 -0.13 0.00 -0.13 0.00 0.00 55.73 57.03 3i23 s ARG 189 Cb 0.00 -3.57 0.14 0.00 -1.56 0.00 0.00 34.95 29.96 3i23 s ARG 189 CO 0.00 -0.43 1.17 -1.25 -0.81 0.00 0.00 175.30 173.98 3i23 s PRO 190 N 2.30 1.15 -0.06 5.12 0.04 -1.26 -5.01 135.00 137.28 3i23 s PRO 190 Ca 0.52 0.14 -0.03 0.00 0.04 0.00 0.00 61.00 61.67 3i23 s PRO 190 Cb -0.22 -1.85 -0.27 0.00 0.04 0.00 0.00 34.50 32.20 3i23 s PRO 190 CO 0.19 -2.16 0.62 -0.44 0.04 0.00 0.00 177.00 175.25 3i23 h ASP 191 N -1.47 0.39 -5.03 6.66 3.32 -1.61 -3.42 116.42 115.25 3i23 h ASP 191 Ca -0.48 -0.68 -0.06 0.00 0.02 0.00 0.00 57.03 55.83 3i23 h ASP 191 Cb 1.32 -0.13 -0.15 0.00 0.22 0.00 0.00 39.33 40.59 3i23 h ASP 191 CO 0.58 1.59 -0.01 0.00 -1.72 0.00 0.00 179.24 179.69 3i23 s GLN 192 N -2.59 1.03 0.00 3.56 -2.07 -1.25 -1.50 119.66 116.85 3i23 s GLN 192 Ca -0.14 -0.39 0.04 0.00 -1.82 0.00 0.00 55.36 53.04 3i23 s GLN 192 Cb 0.07 0.46 -0.01 0.00 -1.09 0.00 0.00 33.01 32.44 3i23 s GLN 192 CO 0.82 -0.38 -0.12 0.08 -1.32 0.00 0.00 175.29 174.37 3i23 s VAL 193 N -2.86 0.91 -0.02 3.63 1.01 0.17 -0.69 120.40 122.55 3i23 s VAL 193 Ca -0.03 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.43 3i23 s VAL 193 Cb -0.00 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.58 3i23 s VAL 193 CO -0.05 0.19 -0.16 0.42 0.00 0.00 0.00 175.10 175.50 3i23 s THR 194 N -0.38 2.89 -0.04 3.92 -4.23 -0.64 -0.14 115.64 117.01 3i23 s THR 194 Ca 0.04 -0.90 0.04 0.00 -1.18 0.00 0.00 61.69 59.68 3i23 s THR 194 Cb -0.05 -2.15 -0.00 0.00 1.34 0.00 0.00 72.50 71.64 3i23 s THR 194 CO -0.00 0.51 -0.17 -0.31 -0.54 0.00 0.00 174.62 174.11 3i23 s TYR 195 N -0.78 1.68 -0.28 3.99 2.02 -0.23 -1.68 117.35 122.07 3i23 s TYR 195 Ca 0.12 -0.48 -0.01 0.00 -0.37 0.00 0.00 57.07 56.34 3i23 s TYR 195 Cb -0.11 -1.13 0.09 0.00 -0.40 0.00 0.00 41.96 40.41 3i23 s TYR 195 CO 0.02 -0.16 0.07 0.34 -1.57 0.00 0.00 175.55 174.25 3i23 s ASP 196 N 0.04 3.87 -0.05 2.29 2.15 -1.00 -1.99 116.67 121.97 3i23 s ASP 196 Ca -0.04 -1.48 0.03 0.00 0.43 0.00 0.00 52.55 51.48 3i23 s ASP 196 Cb -0.11 -0.90 0.01 0.00 -0.30 0.00 0.00 42.92 41.62 3i23 s ASP 196 CO 0.02 -0.38 -0.12 -0.63 -0.17 0.00 0.00 175.17 173.90 3i23 s ILE 197 N 1.59 1.07 -0.04 4.11 1.01 -1.26 0.61 121.20 128.30 3i23 s ILE 197 Ca 0.06 -0.47 -0.15 0.00 0.00 0.00 0.00 60.65 60.10 3i23 s ILE 197 Cb -0.17 -0.97 0.05 0.00 0.01 0.00 0.00 42.46 41.37 3i23 s ILE 197 CO -0.19 0.33 0.67 -2.11 0.00 0.00 0.00 174.94 173.64 3i23 n ARG 198 N 3.64 0.03 -3.98 2.79 1.85 -0.49 -4.75 116.66 115.74 3i23 n ARG 198 Ca -0.22 -0.29 -0.34 0.00 -1.00 0.00 0.00 57.85 56.01 3i23 n ARG 198 Cb 0.52 0.54 -0.14 0.00 -1.05 0.00 0.00 32.46 32.33 3i23 n ARG 198 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 3i23 s ASN 199 N -2.47 4.57 0.00 2.89 3.84 -1.26 -0.51 114.94 122.00 3i23 s ASN 199 Ca 0.16 -1.21 0.11 0.00 0.21 0.00 0.00 52.86 52.13 3i23 s ASN 199 Cb -0.00 -1.64 0.60 0.00 -0.55 0.00 0.00 41.25 39.66 3i23 s ASN 199 CO -0.01 -0.20 1.39 -0.46 -2.79 0.00 0.00 177.10 175.03 3i23 n ASN 200 N 4.57 0.12 0.01 -4.21 6.94 -1.26 -4.10 115.26 117.32 3i23 n ASN 200 Ca -0.14 -1.69 -0.03 0.00 -0.02 0.00 0.00 54.58 52.70 3i23 n ASN 200 Cb 0.44 -0.01 -0.01 0.00 -2.36 0.00 0.00 39.78 37.84 3i23 n ASN 200 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3i23 n GLU 201 N -0.58 0.16 -3.83 -3.83 1.02 -1.26 -4.95 120.64 107.36 3i23 n GLU 201 Ca 0.08 0.07 -0.35 0.00 -0.02 0.00 0.00 57.16 56.93 3i23 n GLU 201 Cb 0.05 -0.78 -0.12 0.00 -0.02 0.00 0.00 31.44 30.57 3i23 n GLU 201 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3i23 s VAL 202 N -2.25 3.08 0.13 2.62 1.01 -1.26 -5.02 120.40 118.71 3i23 s VAL 202 Ca -0.09 -2.01 -0.15 0.00 0.00 0.00 0.00 61.98 59.73 3i23 s VAL 202 Cb 0.01 -3.09 0.07 0.00 0.00 0.00 0.00 36.38 33.38 3i23 s VAL 202 CO 0.13 -0.60 1.01 -0.24 0.00 0.00 0.00 175.10 175.41 3i23 n SER 203 N 4.54 -0.53 0.00 3.32 2.88 -1.26 -1.38 113.62 121.19 3i23 n SER 203 Ca -0.03 1.15 0.12 0.00 -1.33 0.00 0.00 58.87 58.78 3i23 n SER 203 Cb 0.42 -0.21 0.57 0.00 -0.75 0.00 0.00 64.21 64.23 3i23 n SER 203 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 3i23 n GLU 204 N -4.90 0.15 -1.81 -1.46 0.00 -1.26 -4.59 120.64 106.77 3i23 n GLU 204 Ca 0.04 0.07 -0.30 0.00 0.00 0.00 0.00 57.16 56.97 3i23 n GLU 204 Cb 0.22 -1.50 0.06 0.00 0.00 0.00 0.00 31.44 30.22 3i23 n GLU 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3i23 s ALA 205 N -2.83 2.72 0.65 -1.84 0.00 -0.48 -4.45 121.76 115.54 3i23 s ALA 205 Ca 0.17 -0.33 -0.18 0.00 0.00 0.00 0.00 51.96 51.62 3i23 s ALA 205 Cb 0.16 -3.04 -0.02 0.00 0.00 0.00 0.00 23.12 20.22 3i23 s ALA 205 CO 0.42 -1.31 1.07 1.33 0.00 0.00 0.00 175.76 177.27 3i23 n VAL 206 N -3.13 3.98 -1.71 0.00 0.24 -0.31 -4.61 118.33 112.79 3i23 n VAL 206 Ca 0.07 -0.47 -0.42 0.00 -2.04 0.00 0.00 64.34 61.47 3i23 n VAL 206 Cb 0.57 -1.25 -0.01 0.00 -1.47 0.00 0.00 33.84 31.69 3i23 n VAL 206 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3i23 n ASP 207 N -1.36 2.98 0.00 -1.34 5.68 -1.26 -4.61 116.55 116.63 3i23 n ASP 207 Ca 0.14 1.20 0.00 0.00 -0.50 0.00 0.00 54.79 55.64 3i23 n ASP 207 Cb 0.48 -1.50 0.00 0.00 -1.14 0.00 0.00 41.12 38.96 3i23 n ASP 207 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 3i23 n ASN 208 N 0.94 0.85 -3.93 -1.12 6.94 -0.51 -2.21 115.26 116.21 3i23 n ASN 208 Ca 0.05 -1.27 -0.10 0.00 -0.02 0.00 0.00 54.58 53.24 3i23 n ASN 208 Cb 0.36 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.67 3i23 n ASN 208 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 3i23 s TYR 209 N -0.27 0.15 -0.28 -2.53 5.04 0.34 -3.72 117.35 116.09 3i23 s TYR 209 Ca 0.00 -0.32 -0.21 0.00 -2.44 0.00 0.00 57.07 54.09 3i23 s TYR 209 Cb 0.00 -0.12 0.12 0.00 0.35 0.00 0.00 41.96 42.31 3i23 s TYR 209 CO 0.00 -0.20 0.96 -0.59 -1.34 0.00 0.00 175.55 174.38 3i23 s PHE 210 N -1.25 -0.59 -0.40 4.97 -0.71 -0.87 -1.40 117.98 117.73 3i23 s PHE 210 Ca -0.14 1.31 0.02 0.00 -1.04 0.00 0.00 56.93 57.08 3i23 s PHE 210 Cb -0.08 0.38 0.12 0.00 -1.21 0.00 0.00 43.02 42.23 3i23 s PHE 210 CO -0.00 -0.29 0.18 0.34 -1.34 0.00 0.00 175.22 174.11 3i23 s ASP 211 N 0.75 3.95 -0.10 1.98 -1.08 0.20 -1.75 116.67 120.63 3i23 s ASP 211 Ca -0.02 -2.33 0.00 0.00 -0.52 0.00 0.00 52.55 49.68 3i23 s ASP 211 Cb -0.05 -1.11 -0.02 0.00 -1.46 0.00 0.00 42.92 40.28 3i23 s ASP 211 CO -0.10 -0.32 -0.10 -0.69 0.52 0.00 0.00 175.17 174.48 3i23 s VAL 212 N 0.72 3.35 -0.17 1.11 1.01 -0.77 -2.39 120.40 123.25 3i23 s VAL 212 Ca 0.15 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 3i23 s VAL 212 Cb -0.22 -2.39 0.00 0.00 0.00 0.00 0.00 36.38 33.78 3i23 s VAL 212 CO -0.08 0.55 -0.14 -1.81 0.00 0.00 0.00 175.10 173.63 3i23 s ASP 213 N -0.19 3.70 -0.33 3.32 1.01 -0.68 -0.81 116.67 122.71 3i23 s ASP 213 Ca 0.01 -0.48 -0.14 0.00 0.71 0.00 0.00 52.55 52.65 3i23 s ASP 213 Cb -0.13 -1.59 -0.02 0.00 1.01 0.00 0.00 42.92 42.19 3i23 s ASP 213 CO 0.03 0.05 0.28 -0.76 0.21 0.00 0.00 175.17 174.98 3i23 s LEU 214 N 1.04 4.42 0.08 1.23 1.43 0.58 -1.62 118.68 125.84 3i23 s LEU 214 Ca -0.01 -0.28 -0.08 0.00 -1.03 0.00 0.00 54.13 52.73 3i23 s LEU 214 Cb -0.15 -2.22 -0.06 0.00 0.03 0.00 0.00 46.19 43.80 3i23 s LEU 214 CO -0.03 -0.25 0.37 -1.00 0.23 0.00 0.00 176.35 175.67 3i23 s HIS 215 N 1.84 3.56 -0.35 0.29 3.76 0.14 -0.77 115.29 123.76 3i23 s HIS 215 Ca 0.08 0.69 -0.00 0.00 -0.15 0.00 0.00 55.06 55.68 3i23 s HIS 215 Cb -0.17 -2.09 0.12 0.00 1.11 0.00 0.00 32.58 31.55 3i23 s HIS 215 CO 0.11 0.52 0.16 0.71 -0.85 0.00 0.00 174.74 175.38 3i23 s TYR 216 N -1.44 1.51 0.00 1.40 2.02 -0.38 -1.36 117.35 119.10 3i23 s TYR 216 Ca 0.34 -1.84 0.00 0.00 -0.37 0.00 0.00 57.07 55.20 3i23 s TYR 216 Cb -0.13 -1.57 0.00 0.00 -0.40 0.00 0.00 41.96 39.86 3i23 s TYR 216 CO 0.19 -0.84 0.00 0.41 -1.57 0.00 0.00 175.55 173.74 3i23 n GLY 217 N 4.40 0.43 0.36 0.71 0.00 -1.26 -2.53 105.19 107.30 3i23 n GLY 217 Ca 0.03 -0.85 0.09 0.00 0.00 0.00 0.00 46.02 45.29 3i23 n GLY 217 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i23 n SER 218 N -1.92 1.67 -0.00 1.61 3.41 -1.26 -4.53 113.62 112.60 3i23 n SER 218 Ca 0.00 -1.33 -0.15 0.00 -0.26 0.00 0.00 58.87 57.13 3i23 n SER 218 Cb 0.00 0.54 -0.14 0.00 -0.26 0.00 0.00 64.21 64.35 3i23 n SER 218 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3i23 h LYS 219 N 1.78 0.14 -5.57 4.33 1.57 -1.94 -3.49 116.57 113.41 3i23 h LYS 219 Ca 0.00 -0.24 -0.44 0.00 -1.87 0.00 0.00 60.65 58.09 3i23 h LYS 219 Cb 0.61 0.09 -0.18 0.00 0.08 0.00 0.00 32.23 32.83 3i23 h LYS 219 CO 0.00 0.88 -0.76 -1.17 -0.57 0.00 0.00 179.45 177.83 3i23 s LEU 220 N -6.60 2.44 -0.23 2.94 2.96 -1.05 -4.29 118.68 114.85 3i23 s LEU 220 Ca -0.13 -0.86 -0.22 0.00 -0.22 0.00 0.00 54.13 52.70 3i23 s LEU 220 Cb 0.07 -0.63 0.06 0.00 0.50 0.00 0.00 46.19 46.19 3i23 s LEU 220 CO 0.80 -0.13 0.63 -0.75 -1.32 0.00 0.00 176.35 175.59 3i23 s LYS 221 N -2.87 0.75 -0.14 1.98 2.20 -1.08 -1.24 119.74 119.33 3i23 s LYS 221 Ca 0.13 0.85 0.02 0.00 -0.36 0.00 0.00 55.97 56.61 3i23 s LYS 221 Cb -0.04 0.36 0.01 0.00 -1.51 0.00 0.00 37.83 36.65 3i23 s LYS 221 CO 0.04 -0.09 -0.19 0.08 -0.36 0.00 0.00 175.35 174.83 3i23 s VAL 222 N 0.28 1.82 -0.22 4.02 1.01 0.05 -2.29 120.40 125.08 3i23 s VAL 222 Ca -0.00 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 61.10 3i23 s VAL 222 Cb -0.04 -1.64 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 3i23 s VAL 222 CO 0.01 0.50 0.00 -0.75 0.00 0.00 0.00 175.10 174.87 3i23 s LYS 223 N 1.01 3.53 -0.11 2.72 2.20 0.31 -0.31 119.74 129.10 3i23 s LYS 223 Ca -0.04 -0.55 -0.05 0.00 -0.36 0.00 0.00 55.97 54.97 3i23 s LYS 223 Cb -0.15 -3.12 -0.04 0.00 -1.51 0.00 0.00 37.83 33.02 3i23 s LYS 223 CO -0.04 -0.13 0.08 0.14 -0.36 0.00 0.00 175.35 175.03 3i23 s VAL 224 N 1.38 4.97 -0.09 4.02 -7.23 0.01 -1.51 120.40 121.96 3i23 s VAL 224 Ca 0.05 0.01 -0.11 0.00 -1.81 0.00 0.00 61.98 60.11 3i23 s VAL 224 Cb -0.15 -3.14 0.03 0.00 0.56 0.00 0.00 36.38 33.68 3i23 s VAL 224 CO 0.00 0.60 0.30 -0.75 -0.31 0.00 0.00 175.10 174.95 3i23 s LYS 225 N -0.88 0.42 -0.00 4.82 2.20 -0.79 -1.85 119.74 123.65 3i23 s LYS 225 Ca 0.14 0.29 0.00 0.00 -0.36 0.00 0.00 55.97 56.04 3i23 s LYS 225 Cb -0.12 0.20 0.00 0.00 -1.51 0.00 0.00 37.83 36.40 3i23 s LYS 225 CO 0.03 -0.07 -0.01 0.99 -0.36 0.00 0.00 175.35 175.93 3i23 s THR 226 N -0.16 0.12 -0.16 3.43 2.01 -0.71 -2.64 115.64 117.52 3i23 s THR 226 Ca -0.03 -0.04 -0.10 0.00 0.31 0.00 0.00 61.69 61.83 3i23 s THR 226 Cb -0.03 -0.12 0.05 0.00 0.01 0.00 0.00 72.50 72.41 3i23 s THR 226 CO 0.01 0.05 0.40 0.21 -0.69 0.00 0.00 174.62 174.59 3i23 s ASN 227 N 0.11 -0.47 0.00 3.53 3.84 -1.26 -2.04 114.94 118.64 3i23 s ASN 227 Ca -0.01 0.84 0.27 0.00 0.21 0.00 0.00 52.86 54.17 3i23 s ASN 227 Cb -0.02 0.76 0.81 0.00 -0.55 0.00 0.00 41.25 42.24 3i23 s ASN 227 CO -0.00 -0.18 1.60 1.41 -2.79 0.00 0.00 177.10 177.14 3i23 n HIS 228 N 3.91 0.00 -2.87 0.43 8.25 -1.24 -1.34 115.22 122.36 3i23 n HIS 228 Ca -0.21 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 56.99 3i23 n HIS 228 Cb 0.56 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.59 3i23 n HIS 228 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3i23 n SER 229 N -0.01 4.36 -4.03 0.41 7.64 -1.18 0.49 113.62 121.30 3i23 n SER 229 Ca 0.16 -3.66 -0.31 0.00 1.01 0.00 0.00 58.87 56.07 3i23 n SER 229 Cb 0.38 -0.54 -0.15 0.00 -1.01 0.00 0.00 64.21 62.89 3i23 n SER 229 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3i23 s VAL 230 N -4.57 2.23 -0.00 0.44 1.01 -0.58 -4.96 120.40 113.96 3i23 s VAL 230 Ca 0.48 -2.13 -0.13 0.00 0.00 0.00 0.00 61.98 60.21 3i23 s VAL 230 Cb 0.31 -2.55 -0.33 0.00 0.00 0.00 0.00 36.38 33.80 3i23 s VAL 230 CO -0.14 -0.43 0.87 0.00 0.00 0.00 0.00 175.10 175.39 3i23 h ALA 231 N 7.66 -0.01 -2.63 5.51 0.00 -1.95 -3.35 119.26 124.50 3i23 h ALA 231 Ca -0.09 -0.98 -0.72 0.00 0.00 0.00 0.00 54.91 53.12 3i23 h ALA 231 Cb 1.03 0.29 -0.24 0.00 0.00 0.00 0.00 17.79 18.86 3i23 h ALA 231 CO 0.50 0.85 -0.45 -1.12 0.00 0.00 0.00 179.25 179.04 3i23 s SER 232 N -7.44 5.89 0.54 0.00 0.01 -1.26 -5.05 113.70 106.39 3i23 s SER 232 Ca -0.12 -1.16 -0.22 0.00 1.31 0.00 0.00 55.95 55.77 3i23 s SER 232 Cb 0.05 -2.08 -0.05 0.00 0.21 0.00 0.00 66.02 64.15 3i23 s SER 232 CO 0.91 -0.49 1.33 -2.84 0.41 0.00 0.00 173.24 172.56 3i23 s PRO 233 N 1.57 3.16 0.63 12.44 0.02 -1.26 -5.04 135.00 146.52 3i23 s PRO 233 Ca 0.03 2.18 -0.01 0.00 0.02 0.00 0.00 61.00 63.22 3i23 s PRO 233 Cb -0.21 -2.24 0.07 0.00 0.02 0.00 0.00 34.50 32.14 3i23 s PRO 233 CO 0.06 -1.16 0.88 0.71 -0.33 0.00 0.00 177.00 177.17 3i23 s TYR 234 N -1.34 2.47 0.59 6.54 1.51 -1.26 -5.01 117.35 120.85 3i23 s TYR 234 Ca 0.72 -0.03 -0.20 0.00 -1.01 0.00 0.00 57.07 56.55 3i23 s TYR 234 Cb -0.39 -2.90 -0.03 0.00 -0.11 0.00 0.00 41.96 38.53 3i23 s TYR 234 CO 0.46 -1.22 1.27 -2.14 -1.11 0.00 0.00 175.55 172.81 3i23 s PRO 235 N -4.95 2.94 0.50 -1.71 0.02 -1.26 -4.85 135.00 125.68 3i23 s PRO 235 Ca 0.61 2.00 0.20 0.00 0.02 0.00 0.00 61.00 63.82 3i23 s PRO 235 Cb -0.09 -2.02 1.28 0.00 0.02 0.00 0.00 34.50 33.69 3i23 s PRO 235 CO 0.41 -1.28 2.08 -0.09 -0.33 0.00 0.00 177.00 177.79 3i23 h ARG 236 N 1.00 0.00 -2.93 5.54 9.65 0.58 -3.40 114.38 124.82 3i23 h ARG 236 Ca -0.51 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.23 3i23 h ARG 236 Cb 1.31 0.00 -0.26 0.00 -1.39 0.00 0.00 29.97 29.63 3i23 h ARG 236 CO 0.55 0.11 -0.35 -0.06 2.80 0.00 0.00 179.97 183.01 3i23 s PHE 237 N -4.63 -0.38 -0.06 2.20 0.08 -0.78 -2.56 117.98 111.85 3i23 s PHE 237 Ca -0.04 0.90 0.01 0.00 0.12 0.00 0.00 56.93 57.92 3i23 s PHE 237 Cb 0.15 0.13 0.02 0.00 -0.57 0.00 0.00 43.02 42.75 3i23 s PHE 237 CO 0.65 -0.20 -0.08 0.42 -0.10 0.00 0.00 175.22 175.90 3i23 s ILE 238 N 0.44 0.87 -0.02 0.64 1.01 0.21 -1.02 121.20 123.33 3i23 s ILE 238 Ca -0.02 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.34 3i23 s ILE 238 Cb -0.04 -0.84 0.01 0.00 0.01 0.00 0.00 42.46 41.60 3i23 s ILE 238 CO -0.02 0.30 -0.05 -0.69 0.00 0.00 0.00 174.94 174.48 3i23 s VAL 239 N 0.91 0.48 -0.04 2.92 1.01 -0.49 0.10 120.40 125.30 3i23 s VAL 239 Ca -0.11 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.72 3i23 s VAL 239 Cb -0.15 -0.47 0.02 0.00 0.00 0.00 0.00 36.38 35.78 3i23 s VAL 239 CO 0.01 0.18 -0.06 -1.00 0.00 0.00 0.00 175.10 174.23 3i23 s HIS 240 N 0.43 0.80 0.21 5.22 3.76 -0.06 -1.66 115.29 123.99 3i23 s HIS 240 Ca -0.05 -0.22 0.04 0.00 -0.15 0.00 0.00 55.06 54.67 3i23 s HIS 240 Cb -0.09 -0.66 -0.01 0.00 1.11 0.00 0.00 32.58 32.92 3i23 s HIS 240 CO -0.00 -0.17 0.14 0.41 -0.85 0.00 0.00 174.74 174.27 3i23 n GLY 241 N 3.83 3.46 0.29 -2.22 0.00 -0.19 -0.03 105.19 110.33 3i23 n GLY 241 Ca -0.24 -1.87 -0.05 0.00 0.00 0.00 0.00 46.02 43.86 3i23 n GLY 241 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i23 h SER 242 N 1.10 0.81 0.83 1.61 4.64 -0.05 -3.21 113.55 119.29 3i23 h SER 242 Ca -0.15 -0.19 -0.07 0.00 -0.47 0.00 0.00 61.79 60.91 3i23 h SER 242 Cb 0.70 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 3i23 h SER 242 CO 0.23 0.85 -1.22 0.59 -0.87 0.00 0.00 176.83 176.41 3i23 n ASN 243 N -4.22 0.82 0.00 4.97 3.02 0.33 -4.96 115.26 115.22 3i23 n ASN 243 Ca 0.03 0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.91 3i23 n ASN 243 Cb 0.29 0.39 0.00 0.00 -0.61 0.00 0.00 39.78 39.84 3i23 n ASN 243 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i23 n GLY 244 N 1.28 -1.05 3.45 7.41 0.00 -1.16 -1.20 105.19 113.93 3i23 n GLY 244 Ca -0.04 -0.81 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 3i23 n GLY 244 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i23 s SER 245 N -4.00 2.80 -0.09 1.61 0.01 0.27 -1.02 113.70 113.27 3i23 s SER 245 Ca 0.00 -1.24 -0.03 0.00 1.31 0.00 0.00 55.95 55.98 3i23 s SER 245 Cb 0.00 -0.17 0.05 0.00 0.21 0.00 0.00 66.02 66.10 3i23 s SER 245 CO 0.00 -0.40 0.17 0.12 0.41 0.00 0.00 173.24 173.54 3i23 s PHE 246 N -3.04 -0.21 -0.08 2.43 5.36 -0.67 -1.60 117.98 120.17 3i23 s PHE 246 Ca 0.31 0.65 0.04 0.00 -0.96 0.00 0.00 56.93 56.97 3i23 s PHE 246 Cb 0.05 -0.23 0.00 0.00 -0.34 0.00 0.00 43.02 42.50 3i23 s PHE 246 CO 0.13 -0.28 -0.22 0.42 -1.46 0.00 0.00 175.22 173.82 3i23 s ILE 247 N 2.25 1.88 -0.23 3.12 -1.09 -0.52 -1.39 121.20 125.22 3i23 s ILE 247 Ca 0.02 -0.93 -0.03 0.00 -2.23 0.00 0.00 60.65 57.49 3i23 s ILE 247 Cb -0.12 -1.63 0.07 0.00 -1.58 0.00 0.00 42.46 39.21 3i23 s ILE 247 CO -0.06 0.52 0.06 -0.75 -1.23 0.00 0.00 174.94 173.48 3i23 s LYS 248 N 0.29 0.59 0.33 2.79 2.36 -0.19 -0.80 119.74 125.12 3i23 s LYS 248 Ca -0.15 -0.57 0.01 0.00 -2.55 0.00 0.00 55.97 52.71 3i23 s LYS 248 Cb -0.17 -1.97 -0.03 0.00 -1.05 0.00 0.00 37.83 34.61 3i23 s LYS 248 CO 0.07 -0.76 0.53 0.71 1.55 0.00 0.00 175.35 177.44 3i23 s TYR 249 N 1.84 3.50 0.00 4.03 2.02 -1.26 0.12 117.35 127.59 3i23 s TYR 249 Ca 0.03 0.32 0.00 0.00 -0.37 0.00 0.00 57.07 57.05 3i23 s TYR 249 Cb -0.17 -1.87 0.00 0.00 -0.40 0.00 0.00 41.96 39.52 3i23 s TYR 249 CO -0.15 0.16 0.00 0.41 -1.57 0.00 0.00 175.55 174.39 3i23 n GLY 250 N -1.72 -0.95 3.95 0.71 0.00 -1.26 -4.73 105.19 101.19 3i23 n GLY 250 Ca -0.05 -1.15 -0.20 0.00 0.00 0.00 0.00 46.02 44.62 3i23 n GLY 250 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3i23 s GLU 251 N -4.32 3.05 0.20 1.61 -1.05 -1.26 -4.75 118.70 112.18 3i23 s GLU 251 Ca 0.00 -1.06 -0.32 0.00 -0.15 0.00 0.00 54.97 53.44 3i23 s GLU 251 Cb 0.00 -2.74 -0.12 0.00 -0.44 0.00 0.00 34.13 30.84 3i23 s GLU 251 CO 0.00 0.11 1.69 0.34 0.95 0.00 0.00 175.26 178.35 3i23 s ASP 252 N -4.10 6.42 0.00 0.83 -1.08 -1.26 -4.91 116.67 112.56 3i23 s ASP 252 Ca 0.43 2.82 0.20 0.00 -0.52 0.00 0.00 52.55 55.48 3i23 s ASP 252 Cb -0.08 -2.60 0.56 0.00 -1.46 0.00 0.00 42.92 39.34 3i23 s ASP 252 CO 0.30 -0.94 1.45 0.00 0.52 0.00 0.00 175.17 176.49 3i23 n GLN 253 N 3.93 2.07 -0.32 4.34 1.13 -1.26 -4.31 117.38 122.96 3i23 n GLN 253 Ca 0.15 -1.62 0.04 0.00 -1.94 0.00 0.00 57.00 53.63 3i23 n GLN 253 Cb 0.36 -1.42 0.19 0.00 0.11 0.00 0.00 30.24 29.47 3i23 n GLN 253 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 3i23 h GLN 254 N 3.05 0.85 -0.38 -1.09 4.20 -1.91 -0.73 115.11 119.09 3i23 h GLN 254 Ca 0.00 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.52 3i23 h GLN 254 Cb 0.68 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3i23 h GLN 254 CO 0.00 0.56 -0.31 1.49 -0.67 0.00 0.00 178.83 179.90 3i23 h GLU 255 N 0.87 0.88 0.00 1.46 4.81 -2.00 -1.46 114.58 119.15 3i23 h GLU 255 Ca 0.43 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3i23 h GLU 255 Cb 0.39 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.78 3i23 h GLU 255 CO -0.25 1.09 0.00 -0.91 -0.73 0.00 0.00 179.01 178.21 3i23 h ASN 256 N 0.69 0.00 0.13 1.04 2.35 -1.69 -2.86 115.58 115.24 3i23 h ASN 256 Ca 0.07 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.46 3i23 h ASN 256 Cb 0.89 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.25 3i23 h ASN 256 CO 0.08 0.00 -1.96 0.44 -1.65 0.00 0.00 177.43 174.34 3i23 h ASP 257 N 0.00 0.43 0.14 5.81 3.32 -1.05 -3.33 116.42 121.73 3i23 h ASP 257 Ca 0.00 -0.95 -0.02 0.00 0.02 0.00 0.00 57.03 56.08 3i23 h ASP 257 Cb 0.65 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 3i23 h ASP 257 CO 0.00 1.85 -0.10 -0.07 -1.72 0.00 0.00 179.24 179.20 3i23 h LEU 258 N 0.05 0.00 0.00 1.55 3.38 -1.30 0.21 115.31 119.21 3i23 h LEU 258 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 3i23 h LEU 258 Cb 2.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.78 3i23 h LEU 258 CO 0.09 0.10 0.00 0.29 0.09 0.00 0.00 178.44 179.01 3i23 n LYS 259 N -4.19 0.48 -0.22 1.13 5.02 -1.08 -2.98 118.16 116.32 3i23 n LYS 259 Ca -0.03 0.03 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 3i23 n LYS 259 Cb 0.18 -1.50 0.17 0.00 -0.02 0.00 0.00 35.03 33.86 3i23 n LYS 259 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i23 n ALA 260 N -1.22 2.63 -0.99 7.82 0.00 0.67 -4.96 120.51 124.46 3i23 n ALA 260 Ca 0.14 -2.72 0.00 0.00 0.00 0.00 0.00 53.44 50.86 3i23 n ALA 260 Cb 0.18 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.21 3i23 n ALA 260 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i23 n GLY 261 N -1.28 0.44 3.94 0.00 0.00 -1.16 -5.06 105.19 102.06 3i23 n GLY 261 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 3i23 n GLY 261 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i23 s ILE 262 N -1.97 3.82 -0.07 -0.61 1.01 -0.80 -5.02 121.20 117.56 3i23 s ILE 262 Ca 0.00 -0.30 0.14 0.00 0.00 0.00 0.00 60.65 60.49 3i23 s ILE 262 Cb 0.00 -3.45 -0.22 0.00 0.01 0.00 0.00 42.46 38.79 3i23 s ILE 262 CO 0.00 -0.38 0.61 -2.65 0.00 0.00 0.00 174.94 172.52 3i23 n PRO 264 N -2.29 0.64 0.00 2.79 -0.02 -1.26 -3.55 135.00 131.31 3i23 n PRO 264 Ca 0.03 0.25 0.13 0.00 -2.02 0.00 0.00 63.50 61.89 3i23 n PRO 264 Cb 0.58 -1.76 0.52 0.00 -0.02 0.00 0.00 33.50 32.82 3i23 n PRO 264 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3i23 n ASP 265 N -2.99 0.14 -4.76 2.55 3.85 -1.26 -4.81 116.55 109.27 3i23 n ASP 265 Ca -0.18 0.28 -0.38 0.00 -0.71 0.00 0.00 54.79 53.80 3i23 n ASP 265 Cb 1.04 -0.29 0.02 0.00 -1.35 0.00 0.00 41.12 40.54 3i23 n ASP 265 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3i23 s ALA 266 N -2.99 2.87 0.18 2.12 0.00 -1.26 -4.95 121.76 117.73 3i23 s ALA 266 Ca 0.14 1.19 -0.30 0.00 0.00 0.00 0.00 51.96 52.98 3i23 s ALA 266 Cb 0.19 -3.50 -0.08 0.00 0.00 0.00 0.00 23.12 19.72 3i23 s ALA 266 CO 0.57 -1.12 1.32 -1.25 0.00 0.00 0.00 175.76 175.28 3i23 s PRO 267 N -2.84 4.38 0.00 0.00 0.04 -1.26 -2.81 135.00 132.51 3i23 s PRO 267 Ca 0.69 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.77 3i23 s PRO 267 Cb -0.36 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 30.97 3i23 s PRO 267 CO 0.43 -0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.59 3i23 n GLY 268 N 2.61 1.74 3.62 0.56 0.00 -1.26 -5.00 105.19 107.46 3i23 n GLY 268 Ca 0.07 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.64 3i23 n GLY 268 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3i23 n PHE 269 N -2.00 2.15 -0.10 1.61 7.35 -1.12 -1.98 117.46 123.36 3i23 n PHE 269 Ca 0.00 -0.10 0.00 0.00 -0.76 0.00 0.00 57.45 56.59 3i23 n PHE 269 Cb 0.00 -2.70 0.00 0.00 0.35 0.00 0.00 39.48 37.13 3i23 n PHE 269 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3i23 n GLY 270 N 5.21 0.81 3.67 7.13 0.00 -1.26 -4.83 105.19 115.92 3i23 n GLY 270 Ca 0.27 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.92 3i23 n GLY 270 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i23 s GLU 271 N -0.90 4.12 0.78 1.61 2.02 -0.84 -1.04 118.70 124.46 3i23 s GLU 271 Ca 0.00 -0.10 -0.11 0.00 0.02 0.00 0.00 54.97 54.78 3i23 s GLU 271 Cb 0.00 -3.53 0.06 0.00 0.10 0.00 0.00 34.13 30.76 3i23 s GLU 271 CO 0.00 0.04 1.09 0.34 0.02 0.00 0.00 175.26 176.75 3i23 s ASP 272 N 1.01 4.60 0.12 -0.19 2.15 -1.26 -4.97 116.67 118.13 3i23 s ASP 272 Ca 0.12 1.45 -0.29 0.00 0.43 0.00 0.00 52.55 54.26 3i23 s ASP 272 Cb -0.14 -2.22 -0.06 0.00 -0.30 0.00 0.00 42.92 40.20 3i23 s ASP 272 CO 0.05 -1.92 0.90 -0.44 -0.17 0.00 0.00 175.17 173.60 3i23 s SER 273 N -3.77 7.46 0.00 -0.34 0.01 -1.26 -4.98 113.70 110.82 3i23 s SER 273 Ca 0.60 1.74 0.00 0.00 1.31 0.00 0.00 55.95 59.60 3i23 s SER 273 Cb -0.15 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.52 3i23 s SER 273 CO 0.55 0.01 0.44 -0.81 0.41 0.00 0.00 173.24 173.84 3i23 n PRO 274 N 2.49 0.00 0.00 12.44 -0.04 -1.26 -2.65 135.00 145.97 3i23 n PRO 274 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3i23 n PRO 274 Cb 0.49 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 3i23 n PRO 274 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3i23 n TYR 276 N 2.85 0.00 -1.70 0.54 4.01 -1.26 -4.91 117.16 116.69 3i23 n TYR 276 Ca 0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.31 3i23 n TYR 276 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.02 3i23 n TYR 276 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3i23 n TYR 277 N 0.00 2.28 -0.67 -0.72 4.01 -1.09 -4.41 117.16 116.56 3i23 n TYR 277 Ca 0.00 0.55 -0.29 0.00 -0.16 0.00 0.00 57.90 58.00 3i23 n TYR 277 Cb 0.00 -2.42 0.23 0.00 -0.31 0.00 0.00 39.34 36.84 3i23 n TYR 277 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3i23 s GLY 278 N -0.29 1.57 -0.03 2.72 0.00 -1.17 -4.74 107.32 105.39 3i23 s GLY 278 Ca 0.56 -0.05 -0.01 0.00 0.00 0.00 0.00 44.72 45.22 3i23 s GLY 278 CO 0.62 0.61 0.04 1.85 0.00 0.00 0.00 173.10 176.22 3i23 s GLU 279 N -4.57 -0.04 -0.08 2.90 2.12 0.02 -1.05 118.70 118.00 3i23 s GLU 279 Ca 0.68 0.24 -0.02 0.00 0.36 0.00 0.00 54.97 56.23 3i23 s GLU 279 Cb -0.24 -0.31 -0.03 0.00 0.26 0.00 0.00 34.13 33.81 3i23 s GLU 279 CO 0.62 -0.21 -0.00 0.14 -0.54 0.00 0.00 175.26 175.27 3i23 s VAL 280 N 1.34 4.26 -0.26 3.70 -7.23 -0.74 -1.44 120.40 120.02 3i23 s VAL 280 Ca -0.06 -0.27 -0.03 0.00 -1.81 0.00 0.00 61.98 59.82 3i23 s VAL 280 Cb -0.13 -2.78 0.09 0.00 0.56 0.00 0.00 36.38 34.12 3i23 s VAL 280 CO -0.03 0.60 0.09 -0.89 -0.31 0.00 0.00 175.10 174.57 3i23 s THR 281 N -0.87 0.36 0.15 5.32 2.01 -0.63 -2.60 115.64 119.37 3i23 s THR 281 Ca 0.13 -0.86 -0.05 0.00 0.31 0.00 0.00 61.69 61.23 3i23 s THR 281 Cb -0.11 -1.17 -0.02 0.00 0.01 0.00 0.00 72.50 71.21 3i23 s THR 281 CO 0.02 -0.55 0.17 -0.72 -0.69 0.00 0.00 174.62 172.85 3i23 s TYR 282 N 1.90 0.64 -0.25 4.92 -0.85 -0.58 -0.57 117.35 122.55 3i23 s TYR 282 Ca 0.06 -1.00 -0.04 0.00 -0.52 0.00 0.00 57.07 55.57 3i23 s TYR 282 Cb -0.17 -0.27 0.01 0.00 0.38 0.00 0.00 41.96 41.91 3i23 s TYR 282 CO -0.24 -0.63 -0.02 -0.98 -1.52 0.00 0.00 175.55 172.17 3i23 s ARG 283 N -4.01 3.13 0.86 -3.49 1.70 -0.34 0.90 118.95 117.70 3i23 s ARG 283 Ca 0.21 -0.80 -0.14 0.00 -0.47 0.00 0.00 55.73 54.53 3i23 s ARG 283 Cb 0.05 -3.10 0.22 0.00 -0.57 0.00 0.00 34.95 31.56 3i23 s ARG 283 CO 0.01 -0.33 0.60 0.27 -1.08 0.00 0.00 175.30 174.77 3i23 n ASN 284 N 4.77 -2.71 -0.05 -2.89 0.23 0.86 -4.68 115.26 110.80 3i23 n ASN 284 Ca -0.17 -0.69 0.09 0.00 -0.53 0.00 0.00 54.58 53.28 3i23 n ASN 284 Cb 0.49 -0.62 0.47 0.00 -2.08 0.00 0.00 39.78 38.03 3i23 n ASN 284 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 3i23 h GLY 285 N -2.35 0.58 0.40 4.83 0.00 -1.99 0.38 103.07 104.92 3i23 h GLY 285 Ca -0.25 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3i23 h GLY 285 CO 0.16 0.14 0.00 0.70 0.00 0.00 0.00 176.54 177.54 3i23 n ASN 286 N -4.47 0.00 0.00 0.19 3.02 -1.26 -4.83 115.26 107.91 3i23 n ASN 286 Ca 0.07 -1.34 0.00 0.00 -0.03 0.00 0.00 54.58 53.28 3i23 n ASN 286 Cb 0.25 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.42 3i23 n ASN 286 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3i23 n GLY 287 N 0.48 0.80 3.77 7.41 0.00 0.13 -4.98 105.19 112.80 3i23 n GLY 287 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 3i23 n GLY 287 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3i23 s ASP 288 N -2.75 5.98 -0.10 1.61 1.01 -1.26 -4.67 116.67 116.49 3i23 s ASP 288 Ca 0.00 2.21 -0.13 0.00 0.71 0.00 0.00 52.55 55.35 3i23 s ASP 288 Cb 0.00 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.29 3i23 s ASP 288 CO 0.00 -1.04 0.29 0.26 0.21 0.00 0.00 175.17 174.89 3i23 s TRP 289 N -1.68 3.57 -0.07 4.23 0.52 -1.26 -0.09 118.94 124.15 3i23 s TRP 289 Ca 0.68 0.70 0.03 0.00 0.02 0.00 0.00 56.10 57.53 3i23 s TRP 289 Cb -0.25 -2.24 0.01 0.00 -1.15 0.00 0.00 33.47 29.83 3i23 s TRP 289 CO 0.30 0.46 -0.15 0.42 0.02 0.00 0.00 176.95 178.00 3i23 s ILE 290 N -0.30 1.34 -0.20 2.03 1.01 0.26 -4.97 121.20 120.38 3i23 s ILE 290 Ca 0.18 -0.60 -0.02 0.00 0.00 0.00 0.00 60.65 60.21 3i23 s ILE 290 Cb -0.14 -1.21 0.06 0.00 0.01 0.00 0.00 42.46 41.18 3i23 s ILE 290 CO 0.07 0.40 0.02 -0.54 0.00 0.00 0.00 174.94 174.89 3i23 s LYS 291 N 0.61 0.81 0.17 2.79 1.02 -1.26 -1.53 119.74 122.35 3i23 s LYS 291 Ca -0.15 -0.49 -0.02 0.00 0.02 0.00 0.00 55.97 55.32 3i23 s LYS 291 Cb -0.16 -2.15 -0.04 0.00 -0.52 0.00 0.00 37.83 34.96 3i23 s LYS 291 CO 0.05 -0.62 0.13 -1.59 -0.92 0.00 0.00 175.35 172.39 3i23 s LYS 292 N 1.79 1.10 0.35 1.68 -2.85 -1.07 -5.02 119.74 115.73 3i23 s LYS 292 Ca -0.01 -1.49 -0.01 0.00 -1.00 0.00 0.00 55.97 53.45 3i23 s LYS 292 Cb -0.17 0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 35.84 3i23 s LYS 292 CO -0.08 -0.35 0.58 -0.65 0.10 0.00 0.00 175.35 174.95 3i23 s GLN 293 N -4.09 3.52 -0.26 1.78 -0.21 -1.26 -1.79 119.66 117.35 3i23 s GLN 293 Ca 0.30 -0.20 -0.02 0.00 0.02 0.00 0.00 55.36 55.47 3i23 s GLN 293 Cb 0.06 -2.62 0.03 0.00 1.00 0.00 0.00 33.01 31.48 3i23 s GLN 293 CO 0.07 0.11 -0.04 0.42 -2.12 0.00 0.00 175.29 173.72 3i23 s ILE 294 N -2.33 2.98 -0.23 1.08 -1.09 -0.21 -4.89 121.20 116.51 3i23 s ILE 294 Ca 0.42 -1.02 -0.28 0.00 -2.23 0.00 0.00 60.65 57.53 3i23 s ILE 294 Cb -0.10 -2.54 -0.05 0.00 -1.58 0.00 0.00 42.46 38.20 3i23 s ILE 294 CO 0.36 0.16 2.16 -0.75 -1.23 0.00 0.00 174.94 175.65 3i23 s LYS 295 N 1.33 3.17 0.08 2.79 2.20 -1.26 -3.02 119.74 125.03 3i23 s LYS 295 Ca -0.00 1.96 -0.34 0.00 -0.36 0.00 0.00 55.97 57.23 3i23 s LYS 295 Cb -0.17 -4.35 -0.13 0.00 -1.51 0.00 0.00 37.83 31.67 3i23 s LYS 295 CO -0.04 -2.06 1.67 2.41 -0.36 0.00 0.00 175.35 176.98 3i23 n THR 296 N 7.67 0.19 -1.95 3.43 -1.04 -1.26 -4.94 114.28 116.39 3i23 n THR 296 Ca 0.29 -0.03 -0.36 0.00 -2.04 0.00 0.00 64.05 61.90 3i23 n THR 296 Cb 0.45 -1.63 0.04 0.00 -1.82 0.00 0.00 70.33 67.37 3i23 n THR 296 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3i23 s PRO 297 N 1.96 2.87 -0.04 -2.82 0.02 -1.26 -4.72 135.00 131.01 3i23 s PRO 297 Ca 0.84 1.87 -0.30 0.00 0.02 0.00 0.00 61.00 63.43 3i23 s PRO 297 Cb -0.69 -1.91 -0.06 0.00 0.02 0.00 0.00 34.50 31.86 3i23 s PRO 297 CO 0.43 -1.29 1.62 0.08 -0.33 0.00 0.00 177.00 177.50 3i23 s VAL 298 N -1.57 3.56 -0.14 3.83 1.01 -1.26 -4.53 120.40 121.30 3i23 s VAL 298 Ca 0.78 0.74 -0.29 0.00 0.00 0.00 0.00 61.98 63.21 3i23 s VAL 298 Cb -0.32 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 3i23 s VAL 298 CO 0.35 -0.05 1.03 -0.83 0.00 0.00 0.00 175.10 175.59 3i23 s GLY 299 N 3.06 2.13 -0.21 4.51 0.00 -0.20 -4.87 107.32 111.73 3i23 s GLY 299 Ca 0.72 0.32 -0.04 0.00 0.00 0.00 0.00 44.72 45.72 3i23 s GLY 299 CO 0.29 2.02 0.21 -0.35 0.00 0.00 0.00 173.10 175.28 3i23 s ASP 300 N 1.16 1.62 0.44 1.64 2.15 -1.06 -4.40 116.67 118.22 3i23 s ASP 300 Ca 0.47 -0.37 0.19 0.00 0.43 0.00 0.00 52.55 53.27 3i23 s ASP 300 Cb -0.17 0.30 1.03 0.00 -0.30 0.00 0.00 42.92 43.77 3i23 s ASP 300 CO 0.14 -0.34 1.93 1.88 -0.17 0.00 0.00 175.17 178.61 3i23 h TYR 301 N 8.32 0.00 -0.28 -5.34 0.05 -1.84 -2.79 116.97 115.09 3i23 h TYR 301 Ca -0.17 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.66 3i23 h TYR 301 Cb 1.14 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.86 3i23 h TYR 301 CO 0.16 0.24 0.19 0.78 -1.05 0.00 0.00 178.16 178.49 3i23 h GLY 302 N 1.06 0.22 1.22 3.88 0.00 -1.93 -0.83 103.07 106.69 3i23 h GLY 302 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.25 3i23 h GLY 302 CO 0.03 0.06 0.25 0.54 0.00 0.00 0.00 176.54 177.43 3i23 n ARG 303 N -4.49 0.06 0.13 4.80 1.74 -1.05 0.19 116.66 118.03 3i23 n ARG 303 Ca 0.03 0.47 -0.01 0.00 -0.77 0.00 0.00 57.85 57.56 3i23 n ARG 303 Cb 0.22 -1.93 0.11 0.00 -1.02 0.00 0.00 32.46 29.84 3i23 n ARG 303 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 3i23 h TYR 304 N 0.00 0.00 0.00 -1.55 3.20 -1.37 -0.98 116.97 116.27 3i23 h TYR 304 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3i23 h TYR 304 Cb 0.50 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.77 3i23 h TYR 304 CO 0.00 0.66 -0.81 0.66 -1.64 0.00 0.00 178.16 177.03 3i23 n TYR 305 N -3.58 0.28 0.06 -3.82 4.01 0.50 -2.81 117.16 111.79 3i23 n TYR 305 Ca -0.00 0.08 -0.21 0.00 -0.16 0.00 0.00 57.90 57.61 3i23 n TYR 305 Cb 0.69 -0.44 -0.12 0.00 -0.31 0.00 0.00 39.34 39.16 3i23 n TYR 305 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3i23 h ASP 306 N 0.00 0.84 -0.72 7.72 3.32 -1.06 -2.39 116.42 124.13 3i23 h ASP 306 Ca 0.00 -0.79 -0.06 0.00 0.02 0.00 0.00 57.03 56.20 3i23 h ASP 306 Cb 0.68 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 3i23 h ASP 306 CO 0.00 1.53 0.20 0.00 -1.72 0.00 0.00 179.24 179.24 3i23 h ALA 307 N 0.33 0.94 -0.12 3.45 0.00 -1.25 -2.19 119.26 120.42 3i23 h ALA 307 Ca -0.15 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 3i23 h ALA 307 Cb 1.74 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 3i23 h ALA 307 CO 0.21 0.65 -0.24 0.28 0.00 0.00 0.00 179.25 180.14 3i23 h VAL 308 N 1.07 1.23 -0.34 0.00 2.07 -1.53 -1.97 116.25 116.78 3i23 h VAL 308 Ca 0.23 -1.06 -0.16 0.00 0.82 0.00 0.00 66.70 66.53 3i23 h VAL 308 Cb 0.35 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 3i23 h VAL 308 CO -0.00 0.32 -0.43 0.22 0.02 0.00 0.00 177.57 177.70 3i23 h TYR 309 N 0.19 1.06 -0.11 1.57 3.20 -0.87 0.27 116.97 122.28 3i23 h TYR 309 Ca 0.03 -0.33 -0.15 0.00 3.14 0.00 0.00 58.73 61.41 3i23 h TYR 309 Cb 0.54 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 3i23 h TYR 309 CO 0.01 1.15 -0.59 0.93 -1.64 0.00 0.00 178.16 178.02 3i23 h GLU 310 N 0.71 0.37 -0.13 1.82 4.39 -1.22 0.26 114.58 120.77 3i23 h GLU 310 Ca 0.05 -0.25 -0.06 0.00 0.34 0.00 0.00 59.36 59.44 3i23 h GLU 310 Cb 1.02 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.70 3i23 h GLU 310 CO 0.10 0.85 -0.17 1.15 -1.16 0.00 0.00 179.01 179.78 3i23 h THR 311 N 0.28 1.36 0.00 1.13 2.02 -1.27 0.70 112.91 117.13 3i23 h THR 311 Ca -0.00 -1.36 -0.13 0.00 0.77 0.00 0.00 66.41 65.68 3i23 h THR 311 Cb 1.11 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 69.44 3i23 h THR 311 CO 0.10 0.40 -0.63 -0.07 0.37 0.00 0.00 175.52 175.68 3i23 h LEU 312 N -0.04 0.00 0.00 2.58 3.38 -0.91 -2.52 115.31 117.80 3i23 h LEU 312 Ca 0.02 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.71 3i23 h LEU 312 Cb 0.71 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.41 3i23 h LEU 312 CO 0.04 0.63 -2.04 0.29 0.09 0.00 0.00 178.44 177.45 3i23 n LYS 313 N -3.33 1.29 -0.07 1.13 4.01 0.91 -4.65 118.16 117.44 3i23 n LYS 313 Ca 0.01 0.02 0.08 0.00 -0.51 0.00 0.00 58.31 57.91 3i23 n LYS 313 Cb 0.76 -1.38 0.11 0.00 -0.51 0.00 0.00 35.03 34.00 3i23 n LYS 313 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 3i23 n ASN 314 N -2.68 2.21 0.00 4.39 5.03 0.23 -4.98 115.26 119.45 3i23 n ASN 314 Ca -0.27 -2.86 0.00 0.00 0.87 0.00 0.00 54.58 52.32 3i23 n ASN 314 Cb 0.95 -0.35 0.00 0.00 -1.02 0.00 0.00 39.78 39.37 3i23 n ASN 314 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3i23 n GLY 315 N -1.23 0.00 3.60 7.41 0.00 -0.21 -4.83 105.19 109.93 3i23 n GLY 315 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 3i23 n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i23 n ALA 316 N 0.71 0.06 -1.54 4.61 0.00 -0.72 -4.80 120.51 118.83 3i23 n ALA 316 Ca 0.00 0.17 -0.52 0.00 0.00 0.00 0.00 53.44 53.10 3i23 n ALA 316 Cb 0.24 -2.06 -0.05 0.00 0.00 0.00 0.00 19.45 17.58 3i23 n ALA 316 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3i23 n PRO 317 N -0.06 0.76 -2.11 0.00 -0.02 -1.26 -4.02 135.00 128.29 3i23 n PRO 317 Ca 0.10 0.27 -0.41 0.00 -2.02 0.00 0.00 63.50 61.44 3i23 n PRO 317 Cb 0.41 -1.73 -0.02 0.00 -0.02 0.00 0.00 33.50 32.13 3i23 n PRO 317 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 3i23 s GLN 318 N -0.23 4.34 0.09 -0.52 -2.07 -1.26 -4.82 119.66 115.19 3i23 s GLN 318 Ca 0.78 2.20 -0.25 0.00 -1.82 0.00 0.00 55.36 56.27 3i23 s GLN 318 Cb -0.97 -3.12 -0.09 0.00 -1.09 0.00 0.00 33.01 27.74 3i23 s GLN 318 CO 0.53 -0.28 1.41 1.25 -1.32 0.00 0.00 175.29 176.88 3i23 h LEU 319 N 4.47 -1.35 -8.91 2.60 5.85 -1.89 -3.37 115.31 112.71 3i23 h LEU 319 Ca -0.47 0.17 -0.60 0.00 0.84 0.00 0.00 57.88 57.82 3i23 h LEU 319 Cb 1.22 0.54 -0.10 0.00 0.37 0.00 0.00 40.66 42.69 3i23 h LEU 319 CO 0.73 -0.33 0.43 -0.69 -0.34 0.00 0.00 178.44 178.24 3i23 s VAL 320 N -4.99 4.77 0.10 1.05 1.01 -1.26 -5.04 120.40 116.04 3i23 s VAL 320 Ca -0.11 1.21 -0.16 0.00 0.00 0.00 0.00 61.98 62.92 3i23 s VAL 320 Cb 0.06 -4.17 -0.07 0.00 0.00 0.00 0.00 36.38 32.20 3i23 s VAL 320 CO 0.46 -0.27 0.53 0.42 0.00 0.00 0.00 175.10 176.24 3i23 s THR 321 N 3.01 4.84 0.37 3.92 -4.23 -1.26 -4.94 115.64 117.35 3i23 s THR 321 Ca 0.33 0.97 0.18 0.00 -1.18 0.00 0.00 61.69 61.99 3i23 s THR 321 Cb -0.14 -3.79 0.37 0.00 1.34 0.00 0.00 72.50 70.28 3i23 s THR 321 CO 0.13 0.41 1.67 0.50 -0.54 0.00 0.00 174.62 176.79 3i23 h LYS 322 N 4.09 0.29 -0.54 3.99 3.64 -1.95 0.28 116.57 126.37 3i23 h LYS 322 Ca -0.49 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 58.80 3i23 h LYS 322 Cb 1.20 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 3i23 h LYS 322 CO 0.64 0.19 0.05 0.93 -2.27 0.00 0.00 179.45 178.99 3i23 h GLU 323 N 0.30 0.88 0.00 1.90 3.07 -1.98 0.71 114.58 119.46 3i23 h GLU 323 Ca 0.73 -0.23 -0.26 0.00 -0.50 0.00 0.00 59.36 59.10 3i23 h GLU 323 Cb 1.81 -0.11 0.02 0.00 -0.84 0.00 0.00 28.75 29.63 3i23 h GLU 323 CO -0.52 0.85 -1.03 1.96 -1.40 0.00 0.00 179.01 178.87 3i23 h GLN 324 N 0.83 0.69 0.27 2.33 4.20 -0.91 -1.48 115.11 121.03 3i23 h GLN 324 Ca 0.17 -0.75 -0.01 0.00 0.06 0.00 0.00 58.65 58.12 3i23 h GLN 324 Cb 0.42 0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.42 3i23 h GLN 324 CO 0.01 1.32 -0.13 0.00 -0.67 0.00 0.00 178.83 179.37 3i23 h ALA 325 N 0.39 -0.36 -0.32 3.87 0.00 -1.01 -1.52 119.26 120.31 3i23 h ALA 325 Ca -0.13 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3i23 h ALA 325 Cb 1.68 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 3i23 h ALA 325 CO 0.20 -0.68 -0.14 -0.07 0.00 0.00 0.00 179.25 178.56 3i23 h LEU 326 N -0.40 0.55 -0.27 0.00 3.38 -0.94 -1.93 115.31 115.71 3i23 h LEU 326 Ca -0.04 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.66 3i23 h LEU 326 Cb 0.30 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3i23 h LEU 326 CO 0.06 0.72 -0.31 0.74 0.09 0.00 0.00 178.44 179.73 3i23 h THR 327 N 0.51 1.31 0.21 0.22 2.02 -1.22 -2.25 112.91 113.71 3i23 h THR 327 Ca 0.09 -1.49 -0.01 0.00 0.77 0.00 0.00 66.41 65.77 3i23 h THR 327 Cb 0.54 1.64 -0.00 0.00 -1.74 0.00 0.00 68.15 68.59 3i23 h THR 327 CO 0.03 0.47 -0.12 -1.13 0.37 0.00 0.00 175.52 175.15 3i23 h ASN 328 N 0.41 -0.28 0.14 4.18 -0.00 -1.17 -2.41 115.58 116.45 3i23 h ASN 328 Ca 0.04 0.02 -0.01 0.00 -0.00 0.00 0.00 56.30 56.34 3i23 h ASN 328 Cb 0.89 0.08 -0.00 0.00 -0.00 0.00 0.00 38.32 39.29 3i23 h ASN 328 CO 0.08 -0.19 -0.06 0.40 -0.00 0.00 0.00 177.43 177.65 3i23 h ILE 329 N -0.31 0.63 -0.05 2.57 2.04 -1.35 -1.47 117.51 119.57 3i23 h ILE 329 Ca -0.02 -0.24 -0.20 0.00 1.00 0.00 0.00 64.86 65.40 3i23 h ILE 329 Cb 0.25 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 37.47 3i23 h ILE 329 CO 0.03 0.06 -0.80 -0.08 0.00 0.00 0.00 178.15 177.36 3i23 h GLU 330 N 0.00 0.41 0.02 2.37 4.81 -0.96 -2.33 114.58 118.90 3i23 h GLU 330 Ca -0.00 -0.37 -0.25 0.00 -0.13 0.00 0.00 59.36 58.61 3i23 h GLU 330 Cb 0.14 0.09 0.02 0.00 0.63 0.00 0.00 28.75 29.63 3i23 h GLU 330 CO 0.01 1.02 -0.98 0.82 -0.73 0.00 0.00 179.01 179.15 3i23 h ILE 331 N 0.26 1.31 0.07 2.32 2.04 -0.95 -0.15 117.51 122.42 3i23 h ILE 331 Ca -0.05 -2.24 0.01 0.00 1.00 0.00 0.00 64.86 63.58 3i23 h ILE 331 Cb 1.40 2.47 -0.01 0.00 -0.74 0.00 0.00 36.82 39.94 3i23 h ILE 331 CO 0.14 0.68 -0.09 0.25 0.00 0.00 0.00 178.15 179.13 3i23 h LEU 332 N 0.27 -0.25 -0.50 1.44 5.85 -1.31 -1.90 115.31 118.91 3i23 h LEU 332 Ca -0.13 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.52 3i23 h LEU 332 Cb 1.65 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.75 3i23 h LEU 332 CO 0.19 -0.14 -0.06 -0.33 -0.34 0.00 0.00 178.44 177.76 3i23 h GLU 333 N -0.20 0.93 0.00 1.25 5.08 -1.47 -2.86 114.58 117.31 3i23 h GLU 333 Ca 0.01 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 3i23 h GLU 333 Cb 0.20 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 3i23 h GLU 333 CO -0.04 0.98 -0.01 0.00 -1.00 0.00 0.00 179.01 178.95 3i23 h ALA 334 N 0.92 1.52 0.00 3.43 0.00 -0.79 -1.82 119.26 122.51 3i23 h ALA 334 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3i23 h ALA 334 Cb 0.60 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3i23 h ALA 334 CO 0.04 0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.71 3i23 n GLY 335 N -1.29 -1.02 0.28 0.00 0.00 -0.73 -2.75 105.19 99.67 3i23 n GLY 335 Ca -0.03 0.03 0.03 0.00 0.00 0.00 0.00 46.02 46.06 3i23 n GLY 335 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i23 n PHE 336 N -1.84 0.22 0.03 1.61 3.72 -0.68 -4.55 117.46 115.96 3i23 n PHE 336 Ca 0.02 -0.58 -0.06 0.00 -0.05 0.00 0.00 57.45 56.78 3i23 n PHE 336 Cb 0.15 -0.07 -0.11 0.00 -0.94 0.00 0.00 39.48 38.51 3i23 n PHE 336 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3i23 h LEU 337 N 0.78 0.00 -8.94 4.37 4.07 -1.60 -3.46 115.31 110.53 3i23 h LEU 337 Ca 0.00 0.00 -0.61 0.00 0.08 0.00 0.00 57.88 57.35 3i23 h LEU 337 Cb 0.69 0.00 -0.19 0.00 1.08 0.00 0.00 40.66 42.24 3i23 h LEU 337 CO 0.02 0.91 -0.81 0.20 -1.08 0.00 0.00 178.44 177.68 3i23 s ASN 338 N -6.32 3.13 -0.04 -0.43 0.01 -1.26 -5.10 114.94 104.92 3i23 s ASN 338 Ca -0.02 -0.85 -0.30 0.00 -0.71 0.00 0.00 52.86 50.98 3i23 s ASN 338 Cb 0.09 -0.21 -0.04 0.00 0.41 0.00 0.00 41.25 41.50 3i23 s ASN 338 CO 0.82 0.07 1.21 -2.84 -1.51 0.00 0.00 177.10 174.84 3i23 s PRO 339 N -2.65 4.36 0.33 -0.60 0.02 -1.26 -4.89 135.00 130.31 3i23 s PRO 339 Ca 0.18 1.70 -0.29 0.00 0.02 0.00 0.00 61.00 62.61 3i23 s PRO 339 Cb -0.07 -3.53 -0.11 0.00 0.02 0.00 0.00 34.50 30.81 3i23 s PRO 339 CO 0.08 -0.42 1.46 0.45 -0.33 0.00 0.00 177.00 178.25 3i23 s SER 340 N 1.44 6.48 0.51 2.53 0.15 -1.26 -4.12 113.70 119.42 3i23 s SER 340 Ca 0.57 2.90 -0.19 0.00 0.70 0.00 0.00 55.95 59.93 3i23 s SER 340 Cb -0.26 -2.65 -0.07 0.00 -1.71 0.00 0.00 66.02 61.33 3i23 s SER 340 CO 0.23 -0.79 1.04 -2.84 1.20 0.00 0.00 173.24 172.09 3i23 s PRO 341 N -1.47 3.70 0.18 5.44 0.02 -1.26 -4.92 135.00 136.69 3i23 s PRO 341 Ca 0.55 1.32 -0.10 0.00 0.02 0.00 0.00 61.00 62.79 3i23 s PRO 341 Cb -0.45 -2.08 -0.00 0.00 0.02 0.00 0.00 34.50 31.99 3i23 s PRO 341 CO 0.55 -0.51 0.33 -1.54 -0.33 0.00 0.00 177.00 175.50 3i23 s SER 342 N -2.17 -0.00 0.16 2.53 1.04 -0.84 -4.98 113.70 109.43 3i23 s SER 342 Ca 0.66 -0.85 0.10 0.00 0.48 0.00 0.00 55.95 56.34 3i23 s SER 342 Cb -0.16 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 3i23 s SER 342 CO 0.24 -0.94 -0.22 -0.69 0.98 0.00 0.00 173.24 172.61 3i23 s VAL 343 N -3.97 2.04 -0.20 5.02 1.01 -1.26 -1.06 120.40 121.98 3i23 s VAL 343 Ca 0.17 -1.88 -0.11 0.00 0.00 0.00 0.00 61.98 60.16 3i23 s VAL 343 Cb 0.02 -1.92 0.06 0.00 0.00 0.00 0.00 36.38 34.55 3i23 s VAL 343 CO 0.01 -0.16 0.48 -0.47 0.00 0.00 0.00 175.10 174.97 3i23 s TYR 344 N -1.66 -0.72 -0.18 5.22 5.04 0.80 -4.98 117.35 120.86 3i23 s TYR 344 Ca 0.16 1.50 -0.12 0.00 -2.44 0.00 0.00 57.07 56.17 3i23 s TYR 344 Cb -0.08 0.36 -0.05 0.00 0.35 0.00 0.00 41.96 42.54 3i23 s TYR 344 CO 0.07 -0.39 0.23 -1.01 -1.34 0.00 0.00 175.55 173.12 3i23 s HIS 345 N 1.41 3.42 0.33 4.97 3.76 -1.26 0.45 115.29 128.38 3i23 s HIS 345 Ca -0.09 0.47 -0.29 0.00 -0.15 0.00 0.00 55.06 55.00 3i23 s HIS 345 Cb -0.07 -2.29 -0.11 0.00 1.11 0.00 0.00 32.58 31.22 3i23 s HIS 345 CO -0.14 0.22 1.49 -0.51 -0.85 0.00 0.00 174.74 174.94 3i23 s LEU 346 N 0.55 4.35 0.02 0.89 2.01 -0.56 -4.79 118.68 121.15 3i23 s LEU 346 Ca 0.13 2.93 0.00 0.00 0.01 0.00 0.00 54.13 57.20 3i23 s LEU 346 Cb -0.12 -3.65 0.00 0.00 0.01 0.00 0.00 46.19 42.42 3i23 s LEU 346 CO 0.02 -0.82 0.31 0.29 1.01 0.00 0.00 176.35 177.17 3i23 n LYS 347 N 1.18 0.00 -0.58 1.70 4.76 -1.26 -4.98 118.16 118.97 3i23 n LYS 347 Ca 0.03 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 3i23 n LYS 347 Cb 0.39 -1.22 0.00 0.00 -1.84 0.00 0.00 35.03 32.36 3i23 n LYS 347 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12