#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i6d s LYS 6 N 0.00 3.18 -0.05 1.64 1.02 0.12 -4.75 119.74 120.90 3i6d s LYS 6 Ca 0.00 1.84 0.05 0.00 0.02 0.00 0.00 55.97 57.88 3i6d s LYS 6 Cb 0.00 -2.06 -0.02 0.00 -0.52 0.00 0.00 37.83 35.23 3i6d s LYS 6 CO 0.00 -1.04 -0.19 -1.58 -0.92 0.00 0.00 175.35 171.62 3i6d s HIS 7 N -1.57 2.57 -0.09 3.18 5.65 -1.26 -0.37 115.29 123.40 3i6d s HIS 7 Ca 0.74 -0.39 -0.00 0.00 0.25 0.00 0.00 55.06 55.65 3i6d s HIS 7 Cb -0.30 -1.62 0.02 0.00 -1.18 0.00 0.00 32.58 29.50 3i6d s HIS 7 CO 0.34 0.01 -0.06 0.08 -0.65 0.00 0.00 174.74 174.46 3i6d s VAL 8 N -0.47 0.88 -0.18 0.89 1.01 -0.70 -1.04 120.40 120.79 3i6d s VAL 8 Ca 0.06 -0.22 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 3i6d s VAL 8 Cb -0.12 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 3i6d s VAL 8 CO 0.01 0.33 0.03 0.54 0.00 0.00 0.00 175.10 176.02 3i6d s VAL 9 N 1.56 4.50 -0.26 2.92 0.11 -1.06 -1.27 120.40 126.90 3i6d s VAL 9 Ca 0.01 -0.14 -0.11 0.00 -2.93 0.00 0.00 61.98 58.82 3i6d s VAL 9 Cb -0.13 -3.02 -0.05 0.00 -1.53 0.00 0.00 36.38 31.65 3i6d s VAL 9 CO -0.05 0.46 0.19 -0.63 -3.33 0.00 0.00 175.10 171.73 3i6d s ILE 10 N 0.46 5.33 -0.27 7.04 1.01 0.16 -2.13 121.20 132.80 3i6d s ILE 10 Ca 0.01 0.20 -0.10 0.00 0.00 0.00 0.00 60.65 60.77 3i6d s ILE 10 Cb -0.13 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 3i6d s ILE 10 CO 0.01 0.29 0.15 -0.63 0.00 0.00 0.00 174.94 174.76 3i6d s ILE 11 N 1.43 4.97 0.00 2.92 1.01 -0.41 -0.49 121.20 130.62 3i6d s ILE 11 Ca 0.08 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.78 3i6d s ILE 11 Cb -0.15 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 38.97 3i6d s ILE 11 CO 0.08 0.29 0.00 0.61 0.00 0.00 0.00 174.94 175.91 3i6d n GLY 12 N 4.96 3.11 0.85 6.18 0.00 0.15 -0.44 105.19 120.00 3i6d n GLY 12 Ca -0.15 -1.38 0.08 0.00 0.00 0.00 0.00 46.02 44.58 3i6d n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i6d n GLY 13 N 1.06 3.81 0.00 -0.02 0.00 -1.26 -4.24 105.19 104.54 3i6d n GLY 13 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.10 3i6d n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i6d n GLY 14 N -0.33 -1.87 0.27 -0.02 0.00 -1.26 -0.54 105.19 101.44 3i6d n GLY 14 Ca 0.20 -1.45 -0.05 0.00 0.00 0.00 0.00 46.02 44.72 3i6d n GLY 14 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3i6d h ILE 15 N -0.44 1.25 -0.23 -0.61 6.09 -1.95 -1.26 117.51 120.36 3i6d h ILE 15 Ca 0.00 -1.12 -0.02 0.00 -1.37 0.00 0.00 64.86 62.35 3i6d h ILE 15 Cb 0.00 1.05 -0.01 0.00 0.47 0.00 0.00 36.82 38.33 3i6d h ILE 15 CO 0.00 0.38 0.08 0.74 -3.07 0.00 0.00 178.15 176.28 3i6d h THR 16 N 0.66 1.18 -0.38 2.19 2.02 -1.92 0.56 112.91 117.22 3i6d h THR 16 Ca 0.12 -0.56 -0.15 0.00 0.77 0.00 0.00 66.41 66.58 3i6d h THR 16 Cb 0.55 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.08 3i6d h THR 16 CO 0.03 0.18 -0.36 1.23 0.37 0.00 0.00 175.52 176.97 3i6d h GLY 17 N 0.21 0.98 0.85 2.16 0.00 -1.72 -0.33 103.07 105.22 3i6d h GLY 17 Ca 0.08 -0.98 -0.02 0.00 0.00 0.00 0.00 47.33 46.40 3i6d h GLY 17 CO -0.00 0.88 0.04 1.41 0.00 0.00 0.00 176.54 178.87 3i6d h LEU 18 N 0.74 0.34 -0.45 3.11 3.38 -1.12 0.40 115.31 121.72 3i6d h LEU 18 Ca 0.07 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 57.83 3i6d h LEU 18 Cb 0.94 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.56 3i6d h LEU 18 CO 0.09 0.50 0.20 0.00 0.09 0.00 0.00 178.44 179.32 3i6d h ALA 19 N 0.85 0.55 -0.43 1.53 0.00 0.21 0.41 119.26 122.39 3i6d h ALA 19 Ca 0.07 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3i6d h ALA 19 Cb 0.30 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3i6d h ALA 19 CO 0.00 -0.17 0.23 0.00 0.00 0.00 0.00 179.25 179.31 3i6d h ALA 20 N 1.26 0.54 -0.60 0.00 0.00 -0.71 -2.04 119.26 117.71 3i6d h ALA 20 Ca 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3i6d h ALA 20 Cb 0.15 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3i6d h ALA 20 CO -0.17 0.07 0.35 0.00 0.00 0.00 0.00 179.25 179.50 3i6d h ALA 21 N 1.09 0.77 -0.25 0.00 0.00 0.70 -1.27 119.26 120.30 3i6d h ALA 21 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3i6d h ALA 21 Cb 0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3i6d h ALA 21 CO -0.02 0.27 0.04 0.35 0.00 0.00 0.00 179.25 179.89 3i6d h PHE 22 N 0.82 0.44 -0.00 0.00 3.57 0.01 -2.53 116.94 119.24 3i6d h PHE 22 Ca 0.21 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.65 3i6d h PHE 22 Cb 0.02 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.64 3i6d h PHE 22 CO -0.01 0.53 -0.04 0.66 -2.23 0.00 0.00 178.31 177.21 3i6d n TYR 23 N -4.69 0.00 0.02 0.41 4.01 -0.79 -2.34 117.16 113.78 3i6d n TYR 23 Ca -0.03 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.52 3i6d n TYR 23 Cb 0.20 -0.39 -0.14 0.00 -0.31 0.00 0.00 39.34 38.70 3i6d n TYR 23 CO 0.00 0.00 0.00 1.98 -0.46 0.00 0.00 176.86 178.38 3i6d h MET 24 N 0.04 0.25 -0.43 -0.72 4.05 -1.05 -2.97 114.93 114.10 3i6d h MET 24 Ca 0.00 -0.39 -0.03 0.00 -0.28 0.00 0.00 59.70 59.00 3i6d h MET 24 Cb 0.42 0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.34 3i6d h MET 24 CO 0.00 1.16 0.14 0.93 0.23 0.00 0.00 176.91 179.37 3i6d h GLU 25 N -0.47 0.66 -0.27 0.39 5.08 -1.42 -0.50 114.58 118.05 3i6d h GLU 25 Ca -0.10 -0.14 0.08 0.00 -1.00 0.00 0.00 59.36 58.20 3i6d h GLU 25 Cb 1.45 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 3i6d h GLU 25 CO 0.11 0.64 0.26 -0.22 -1.00 0.00 0.00 179.01 178.81 3i6d h LYS 26 N 0.55 0.00 0.14 2.33 3.64 -1.55 -1.15 116.57 120.54 3i6d h LYS 26 Ca 0.14 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.18 3i6d h LYS 26 Cb 0.25 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3i6d h LYS 26 CO -0.01 0.00 -1.76 0.93 -2.27 0.00 0.00 179.45 176.34 3i6d h GLU 27 N 0.00 0.30 0.00 1.90 4.39 -1.16 -3.33 114.58 116.68 3i6d h GLU 27 Ca 0.13 -0.51 -0.01 0.00 0.34 0.00 0.00 59.36 59.30 3i6d h GLU 27 Cb 0.65 0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.48 3i6d h GLU 27 CO -0.00 1.18 -0.07 0.82 -1.16 0.00 0.00 179.01 179.78 3i6d h ILE 28 N 0.08 0.46 -2.20 3.13 2.04 0.05 -3.03 117.51 118.04 3i6d h ILE 28 Ca -0.34 -0.33 -0.65 0.00 1.00 0.00 0.00 64.86 64.55 3i6d h ILE 28 Cb 2.06 1.22 -0.38 0.00 -0.74 0.00 0.00 36.82 38.98 3i6d h ILE 28 CO 0.14 0.07 -0.22 0.29 0.00 0.00 0.00 178.15 178.43 3i6d n LYS 29 N -3.60 3.75 0.00 2.37 5.02 -0.66 -2.65 118.16 122.40 3i6d n LYS 29 Ca -0.02 -4.75 0.00 0.00 -2.02 0.00 0.00 58.31 51.52 3i6d n LYS 29 Cb 0.18 -2.29 0.00 0.00 -0.02 0.00 0.00 35.03 32.90 3i6d n LYS 29 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3i6d n GLU 30 N -0.24 0.00 0.00 1.97 1.02 -1.15 -4.84 120.64 117.41 3i6d n GLU 30 Ca 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.50 3i6d n GLU 30 Cb 0.38 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.80 3i6d n GLU 30 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3i6d n LYS 31 N 0.00 0.00 -3.85 3.49 4.01 -1.20 -5.04 118.16 115.57 3i6d n LYS 31 Ca 0.00 0.00 -0.37 0.00 -0.51 0.00 0.00 58.31 57.43 3i6d n LYS 31 Cb 0.10 -0.13 0.03 0.00 -0.51 0.00 0.00 35.03 34.52 3i6d n LYS 31 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 3i6d n ASN 32 N 0.00 -4.86 -4.77 4.39 5.15 -1.08 -4.92 115.26 109.16 3i6d n ASN 32 Ca 0.00 -1.11 -0.39 0.00 -0.60 0.00 0.00 54.58 52.48 3i6d n ASN 32 Cb 0.09 -2.51 -0.06 0.00 -0.53 0.00 0.00 39.78 36.77 3i6d n ASN 32 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3i6d s LEU 33 N -6.67 4.58 -1.20 1.20 1.43 -1.13 -4.94 118.68 111.96 3i6d s LEU 33 Ca 0.42 1.71 -0.11 0.00 -1.03 0.00 0.00 54.13 55.12 3i6d s LEU 33 Cb -0.19 -3.41 -0.07 0.00 0.03 0.00 0.00 46.19 42.55 3i6d s LEU 33 CO 0.91 0.18 2.36 -0.81 0.23 0.00 0.00 176.35 179.22 3i6d n PRO 34 N 1.48 2.61 -5.03 1.29 -0.04 -1.26 -4.84 135.00 129.21 3i6d n PRO 34 Ca -0.04 -1.92 -0.30 0.00 -0.04 0.00 0.00 63.50 61.19 3i6d n PRO 34 Cb 0.48 -2.76 -0.15 0.00 -0.04 0.00 0.00 33.50 31.03 3i6d n PRO 34 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3i6d s LEU 35 N 0.60 2.13 -0.12 1.53 0.20 -1.26 0.13 118.68 121.89 3i6d s LEU 35 Ca 0.53 -0.55 -0.01 0.00 0.69 0.00 0.00 54.13 54.78 3i6d s LEU 35 Cb 0.14 -1.30 0.03 0.00 -0.43 0.00 0.00 46.19 44.63 3i6d s LEU 35 CO -0.03 0.28 -0.03 -0.70 -0.29 0.00 0.00 176.35 175.58 3i6d s GLU 36 N -1.05 1.08 0.06 1.98 2.12 0.50 -4.94 118.70 118.45 3i6d s GLU 36 Ca 0.11 -0.21 0.08 0.00 0.36 0.00 0.00 54.97 55.31 3i6d s GLU 36 Cb -0.10 -1.54 -0.03 0.00 0.26 0.00 0.00 34.13 32.72 3i6d s GLU 36 CO 0.01 -0.36 -0.19 -0.48 -0.54 0.00 0.00 175.26 173.70 3i6d s LEU 37 N 1.80 2.61 0.04 2.70 2.34 -1.26 -1.72 118.68 125.18 3i6d s LEU 37 Ca 0.03 -0.48 0.02 0.00 0.06 0.00 0.00 54.13 53.76 3i6d s LEU 37 Cb -0.14 -1.51 -0.02 0.00 -0.56 0.00 0.00 46.19 43.96 3i6d s LEU 37 CO -0.07 0.23 -0.06 0.42 -1.06 0.00 0.00 176.35 175.81 3i6d s THR 38 N -0.98 0.43 -0.11 5.48 -4.23 -0.40 -2.45 115.64 113.38 3i6d s THR 38 Ca 0.15 -1.07 0.02 0.00 -1.18 0.00 0.00 61.69 59.62 3i6d s THR 38 Cb -0.10 -0.56 0.01 0.00 1.34 0.00 0.00 72.50 73.19 3i6d s THR 38 CO 0.06 -0.43 -0.19 -0.22 -0.54 0.00 0.00 174.62 173.30 3i6d s LEU 39 N -1.60 1.92 -0.18 4.79 0.20 -0.79 0.40 118.68 123.42 3i6d s LEU 39 Ca -0.11 -0.50 -0.07 0.00 0.69 0.00 0.00 54.13 54.14 3i6d s LEU 39 Cb -0.09 -1.25 -0.04 0.00 -0.43 0.00 0.00 46.19 44.37 3i6d s LEU 39 CO -0.00 0.07 0.06 -0.69 -0.29 0.00 0.00 176.35 175.49 3i6d s VAL 40 N 0.78 4.79 -0.08 1.68 1.01 0.35 -0.60 120.40 128.34 3i6d s VAL 40 Ca -0.10 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.86 3i6d s VAL 40 Cb -0.16 -3.15 0.02 0.00 0.00 0.00 0.00 36.38 33.09 3i6d s VAL 40 CO 0.01 0.47 -0.11 -0.70 0.00 0.00 0.00 175.10 174.77 3i6d s GLU 41 N 0.27 1.69 0.01 2.72 2.56 0.16 -0.68 118.70 125.43 3i6d s GLU 41 Ca 0.04 -0.38 -0.25 0.00 0.00 0.00 0.00 54.97 54.38 3i6d s GLU 41 Cb -0.12 -1.49 -0.18 0.00 2.00 0.00 0.00 34.13 34.34 3i6d s GLU 41 CO 0.00 -0.06 1.34 0.00 -0.56 0.00 0.00 175.26 175.97 3i6d h ALA 42 N 7.34 -0.13 -2.40 6.30 0.00 -1.68 0.12 119.26 128.80 3i6d h ALA 42 Ca -0.31 -0.18 -0.48 0.00 0.00 0.00 0.00 54.91 53.93 3i6d h ALA 42 Cb 1.17 0.05 0.12 0.00 0.00 0.00 0.00 17.79 19.13 3i6d h ALA 42 CO 0.46 -0.39 0.32 -1.54 0.00 0.00 0.00 179.25 178.10 3i6d s SER 43 N -5.41 4.27 0.04 0.00 1.04 -1.26 -2.86 113.70 109.52 3i6d s SER 43 Ca -0.15 1.31 0.17 0.00 0.48 0.00 0.00 55.95 57.76 3i6d s SER 43 Cb 0.03 -2.03 0.71 0.00 0.10 0.00 0.00 66.02 64.83 3i6d s SER 43 CO 0.63 -2.11 1.53 -0.81 0.98 0.00 0.00 173.24 173.46 3i6d n PRO 44 N -3.52 0.03 -4.60 4.02 -0.04 -1.26 -1.67 135.00 127.96 3i6d n PRO 44 Ca 0.07 0.26 -0.27 0.00 -0.04 0.00 0.00 63.50 63.52 3i6d n PRO 44 Cb 0.56 -1.56 -0.11 0.00 -0.04 0.00 0.00 33.50 32.36 3i6d n PRO 44 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 3i6d s ARG 45 N -3.05 1.92 0.25 0.54 1.70 -1.26 -4.74 118.95 114.31 3i6d s ARG 45 Ca 0.07 -2.10 0.10 0.00 -0.47 0.00 0.00 55.73 53.33 3i6d s ARG 45 Cb 0.10 -1.44 -0.04 0.00 -0.57 0.00 0.00 34.95 33.00 3i6d s ARG 45 CO 0.30 -0.12 -0.06 0.14 -1.08 0.00 0.00 175.30 174.48 3i6d s VAL 46 N -2.86 3.20 0.00 4.99 -7.23 -1.26 -4.73 120.40 112.51 3i6d s VAL 46 Ca 0.32 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.52 3i6d s VAL 46 Cb 0.09 -2.68 0.00 0.00 0.56 0.00 0.00 36.38 34.34 3i6d s VAL 46 CO 0.16 -0.33 0.00 0.61 -0.31 0.00 0.00 175.10 175.23 3i6d n GLY 47 N -0.66 1.96 7.00 2.32 0.00 0.30 -4.92 105.19 111.18 3i6d n GLY 47 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3i6d n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i6d n GLY 48 N -0.24 3.14 0.35 -0.02 0.00 -1.26 -1.19 105.19 105.96 3i6d n GLY 48 Ca 0.00 0.23 0.17 0.00 0.00 0.00 0.00 46.02 46.42 3i6d n GLY 48 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i6d h LYS 49 N 0.00 0.00 -6.49 1.61 1.79 -1.97 -3.38 116.57 108.13 3i6d h LYS 49 Ca 0.00 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.92 3i6d h LYS 49 Cb 0.00 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.58 3i6d h LYS 49 CO 0.00 0.00 1.03 0.42 -1.08 0.00 0.00 179.45 179.82 3i6d s ILE 50 N -4.89 3.90 -0.06 1.86 1.01 -0.33 -4.17 121.20 118.51 3i6d s ILE 50 Ca -0.05 0.75 -0.01 0.00 0.00 0.00 0.00 60.65 61.34 3i6d s ILE 50 Cb 0.18 -4.69 0.03 0.00 0.01 0.00 0.00 42.46 37.98 3i6d s ILE 50 CO 0.66 -1.40 0.02 -1.10 0.00 0.00 0.00 174.94 173.11 3i6d s GLN 51 N 5.26 0.39 -0.21 2.79 -0.21 -1.26 -4.78 119.66 121.64 3i6d s GLN 51 Ca 0.44 0.18 0.00 0.00 0.02 0.00 0.00 55.36 56.00 3i6d s GLN 51 Cb -0.08 -0.79 0.02 0.00 1.00 0.00 0.00 33.01 33.16 3i6d s GLN 51 CO 0.23 -0.29 -0.14 0.99 -2.12 0.00 0.00 175.29 173.96 3i6d s THR 52 N 1.91 2.39 0.10 -0.19 2.01 -1.26 -2.22 115.64 118.37 3i6d s THR 52 Ca 0.03 -1.00 0.08 0.00 0.31 0.00 0.00 61.69 61.11 3i6d s THR 52 Cb -0.12 -2.11 -0.04 0.00 0.01 0.00 0.00 72.50 70.23 3i6d s THR 52 CO -0.04 0.38 -0.15 0.68 -0.69 0.00 0.00 174.62 174.80 3i6d s VAL 53 N 1.29 3.02 -0.07 3.82 -7.23 -0.90 -4.90 120.40 115.42 3i6d s VAL 53 Ca 0.02 -1.36 0.05 0.00 -1.81 0.00 0.00 61.98 58.88 3i6d s VAL 53 Cb -0.15 -2.37 -0.01 0.00 0.56 0.00 0.00 36.38 34.41 3i6d s VAL 53 CO -0.09 0.15 -0.23 -0.54 -0.31 0.00 0.00 175.10 174.08 3i6d s LYS 54 N -2.03 2.73 -0.17 4.82 1.02 -1.26 -1.62 119.74 123.23 3i6d s LYS 54 Ca 0.18 -0.87 -0.07 0.00 0.02 0.00 0.00 55.97 55.23 3i6d s LYS 54 Cb -0.11 -2.24 0.07 0.00 -0.52 0.00 0.00 37.83 35.03 3i6d s LYS 54 CO 0.10 0.33 0.38 0.15 -0.92 0.00 0.00 175.35 175.39 3i6d s LYS 55 N -0.03 0.31 -1.23 1.68 1.02 -1.20 -4.94 119.74 115.35 3i6d s LYS 55 Ca -0.07 0.86 -0.06 0.00 0.02 0.00 0.00 55.97 56.72 3i6d s LYS 55 Cb -0.15 0.11 -0.01 0.00 -0.52 0.00 0.00 37.83 37.26 3i6d s LYS 55 CO 0.05 -0.22 0.74 -0.25 -0.92 0.00 0.00 175.35 174.76 3i6d n ASP 56 N 4.88 -2.87 0.00 2.83 8.00 -1.26 -1.24 116.55 126.88 3i6d n ASP 56 Ca -0.15 -0.86 0.00 0.00 0.71 0.00 0.00 54.79 54.49 3i6d n ASP 56 Cb 0.52 -4.03 0.00 0.00 -0.02 0.00 0.00 41.12 37.59 3i6d n ASP 56 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i6d n GLY 57 N -1.56 0.17 3.95 0.44 0.00 -1.26 -4.82 105.19 102.11 3i6d n GLY 57 Ca -0.22 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 3i6d n GLY 57 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i6d s TYR 58 N -1.37 3.23 -0.32 1.61 2.02 -0.38 -4.00 117.35 118.13 3i6d s TYR 58 Ca 0.00 0.23 -0.02 0.00 -0.37 0.00 0.00 57.07 56.91 3i6d s TYR 58 Cb 0.00 -2.30 0.12 0.00 -0.40 0.00 0.00 41.96 39.38 3i6d s TYR 58 CO 0.00 -0.34 0.18 0.42 -1.57 0.00 0.00 175.55 174.24 3i6d s ILE 59 N -2.54 0.03 -0.20 2.71 1.01 -0.42 -3.23 121.20 118.56 3i6d s ILE 59 Ca 0.48 -1.26 -0.06 0.00 0.00 0.00 0.00 60.65 59.81 3i6d s ILE 59 Cb -0.10 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 3i6d s ILE 59 CO 0.38 -0.86 0.03 0.27 0.00 0.00 0.00 174.94 174.75 3i6d s ILE 60 N 1.55 4.29 -0.53 2.92 -4.36 -0.64 -4.78 121.20 119.65 3i6d s ILE 60 Ca 0.14 -0.20 -0.22 0.00 -0.26 0.00 0.00 60.65 60.10 3i6d s ILE 60 Cb -0.20 -2.94 0.05 0.00 1.25 0.00 0.00 42.46 40.62 3i6d s ILE 60 CO -0.16 0.43 0.83 -1.61 0.24 0.00 0.00 174.94 174.67 3i6d s GLU 61 N 0.84 3.27 0.45 0.37 0.41 -1.26 -2.13 118.70 120.65 3i6d s GLU 61 Ca 0.02 -0.46 0.10 0.00 -0.41 0.00 0.00 54.97 54.22 3i6d s GLU 61 Cb -0.14 -4.06 1.00 0.00 -1.78 0.00 0.00 34.13 29.15 3i6d s GLU 61 CO 0.02 -1.38 2.09 0.00 -0.49 0.00 0.00 175.26 175.50 3i6d h ARG 62 N 9.19 0.35 0.00 1.61 3.08 -1.83 -3.44 114.38 123.34 3i6d h ARG 62 Ca -0.26 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.76 3i6d h ARG 62 Cb 1.08 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.05 3i6d h ARG 62 CO 1.04 0.24 0.00 0.41 -1.07 0.00 0.00 179.97 180.59 3i6d n GLY 63 N -1.48 1.76 3.68 0.04 0.00 -1.26 -4.78 105.19 103.16 3i6d n GLY 63 Ca 0.01 -0.17 -0.51 0.00 0.00 0.00 0.00 46.02 45.35 3i6d n GLY 63 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3i6d n PRO 64 N 0.00 1.82 -0.03 1.61 -0.02 -1.26 -4.88 135.00 132.25 3i6d n PRO 64 Ca 0.00 0.66 -0.01 0.00 -2.02 0.00 0.00 63.50 62.14 3i6d n PRO 64 Cb 0.00 -2.48 -0.00 0.00 -0.02 0.00 0.00 33.50 31.00 3i6d n PRO 64 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3i6d h ASP 65 N 8.84 0.00 -0.00 2.55 1.82 -1.96 -3.46 116.42 124.20 3i6d h ASP 65 Ca -0.47 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.17 3i6d h ASP 65 Cb 1.29 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.30 3i6d h ASP 65 CO 0.96 0.26 0.00 -1.54 -1.61 0.00 0.00 179.24 177.31 3i6d n SER 66 N -3.30 0.00 -3.77 2.28 3.41 -1.26 -4.79 113.62 106.18 3i6d n SER 66 Ca -0.01 -0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.47 3i6d n SER 66 Cb 0.03 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.89 3i6d n SER 66 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3i6d s PHE 67 N -1.71 -0.20 0.12 7.33 -0.12 -0.60 -4.93 117.98 117.87 3i6d s PHE 67 Ca 0.00 0.37 -0.31 0.00 -0.05 0.00 0.00 56.93 56.94 3i6d s PHE 67 Cb 0.00 0.09 -0.10 0.00 -0.63 0.00 0.00 43.02 42.37 3i6d s PHE 67 CO 0.00 -0.32 1.82 -1.17 -0.05 0.00 0.00 175.22 175.50 3i6d s LEU 68 N -0.96 4.40 0.22 -1.99 2.96 -1.26 -1.41 118.68 120.63 3i6d s LEU 68 Ca -0.10 2.75 0.01 0.00 -0.22 0.00 0.00 54.13 56.57 3i6d s LEU 68 Cb -0.05 -3.57 0.19 0.00 0.50 0.00 0.00 46.19 43.27 3i6d s LEU 68 CO 0.03 -1.00 1.54 -0.08 -1.32 0.00 0.00 176.35 175.52 3i6d h GLU 69 N 8.53 0.41 0.00 1.98 4.81 -1.81 -3.13 114.58 125.37 3i6d h GLU 69 Ca -0.46 -0.26 0.00 0.00 -0.13 0.00 0.00 59.36 58.51 3i6d h GLU 69 Cb 1.22 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.63 3i6d h GLU 69 CO 0.95 0.86 0.00 2.89 -0.73 0.00 0.00 179.01 182.98 3i6d n ARG 70 N -3.93 0.12 -2.97 1.92 1.85 -1.26 -4.15 116.66 108.24 3i6d n ARG 70 Ca -0.03 0.56 -0.44 0.00 -1.00 0.00 0.00 57.85 56.94 3i6d n ARG 70 Cb 0.60 -1.83 -0.03 0.00 -1.05 0.00 0.00 32.46 30.15 3i6d n ARG 70 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3i6d s LYS 71 N -3.38 3.54 0.17 2.89 1.02 -1.19 -4.93 119.74 117.87 3i6d s LYS 71 Ca -0.00 -1.75 -0.15 0.00 0.02 0.00 0.00 55.97 54.09 3i6d s LYS 71 Cb 0.06 -4.80 0.15 0.00 -0.52 0.00 0.00 37.83 32.72 3i6d s LYS 71 CO 0.20 -1.72 1.21 1.63 -0.92 0.00 0.00 175.35 175.74 3i6d n LYS 72 N 6.38 -0.21 -0.52 1.68 5.02 -1.26 -1.50 118.16 127.75 3i6d n LYS 72 Ca 0.20 1.20 0.43 0.00 -2.02 0.00 0.00 58.31 58.11 3i6d n LYS 72 Cb 0.48 -1.77 0.71 0.00 -0.02 0.00 0.00 35.03 34.43 3i6d n LYS 72 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3i6d h SER 73 N 0.00 0.16 0.00 4.39 4.64 -1.91 0.11 113.55 120.94 3i6d h SER 73 Ca 0.25 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 3i6d h SER 73 Cb 0.44 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3i6d h SER 73 CO -0.77 -0.18 0.00 0.00 -0.87 0.00 0.00 176.83 175.01 3i6d n ALA 74 N -2.62 -0.14 -0.02 5.18 0.00 -0.56 -2.63 120.51 119.72 3i6d n ALA 74 Ca 0.41 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.97 3i6d n ALA 74 Cb 1.65 0.00 0.54 0.00 0.00 0.00 0.00 19.45 21.64 3i6d n ALA 74 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3i6d h PRO 75 N 0.00 0.29 -0.23 0.00 0.13 -1.63 -1.76 132.00 128.81 3i6d h PRO 75 Ca 0.00 -0.02 0.05 0.00 -0.87 0.00 0.00 66.00 65.16 3i6d h PRO 75 Cb 0.00 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 31.01 3i6d h PRO 75 CO 0.00 0.19 -0.09 0.37 -0.23 0.00 0.00 178.00 178.24 3i6d h GLN 76 N 0.30 -0.05 -0.67 0.86 5.75 -0.90 -1.42 115.11 118.99 3i6d h GLN 76 Ca 0.22 0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.81 3i6d h GLN 76 Cb 0.49 0.01 -0.07 0.00 1.07 0.00 0.00 27.48 28.98 3i6d h GLN 76 CO -0.05 -0.03 0.33 1.25 -2.65 0.00 0.00 178.83 177.67 3i6d h LEU 77 N -0.05 0.42 -0.78 -2.39 5.85 -1.08 -0.99 115.31 116.29 3i6d h LEU 77 Ca 0.12 0.06 0.15 0.00 0.84 0.00 0.00 57.88 59.04 3i6d h LEU 77 Cb 0.23 -0.01 -0.10 0.00 0.37 0.00 0.00 40.66 41.15 3i6d h LEU 77 CO -0.26 0.25 0.32 0.58 -0.34 0.00 0.00 178.44 178.99 3i6d h VAL 78 N 0.57 0.64 0.75 1.05 2.07 -1.06 0.19 116.25 120.46 3i6d h VAL 78 Ca 0.32 -0.16 -0.04 0.00 0.82 0.00 0.00 66.70 67.65 3i6d h VAL 78 Cb 0.32 0.15 0.01 0.00 -1.52 0.00 0.00 31.29 30.25 3i6d h VAL 78 CO -0.25 0.08 -0.36 0.11 0.02 0.00 0.00 177.57 177.17 3i6d h LYS 79 N 0.45 -0.97 -1.06 1.57 1.57 -0.55 -1.13 116.57 116.45 3i6d h LYS 79 Ca 0.43 0.07 0.30 0.00 -1.87 0.00 0.00 60.65 59.57 3i6d h LYS 79 Cb 0.67 0.22 -0.12 0.00 0.08 0.00 0.00 32.23 33.08 3i6d h LYS 79 CO -0.41 -0.65 0.66 -0.44 -0.57 0.00 0.00 179.45 178.03 3i6d h ASP 80 N -1.18 0.49 -0.02 0.86 3.32 -0.87 2.85 116.42 121.86 3i6d h ASP 80 Ca -0.10 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3i6d h ASP 80 Cb 0.77 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.38 3i6d h ASP 80 CO 0.17 0.01 0.00 -0.11 -1.72 0.00 0.00 179.24 177.59 3i6d n LEU 81 N -4.79 0.42 -3.13 1.55 7.94 0.62 -4.95 117.00 114.66 3i6d n LEU 81 Ca 0.29 -0.16 -0.13 0.00 -1.11 0.00 0.00 56.01 54.90 3i6d n LEU 81 Cb 0.94 -0.01 0.01 0.00 0.53 0.00 0.00 43.42 44.89 3i6d n LEU 81 CO 0.19 0.08 0.05 0.61 -1.11 0.00 0.00 177.39 177.21 3i6d n GLY 82 N 0.96 -1.04 0.09 -3.96 0.00 0.95 -4.98 105.19 97.22 3i6d n GLY 82 Ca 0.19 0.95 0.00 0.00 0.00 0.00 0.00 46.02 47.16 3i6d n GLY 82 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i6d n LEU 83 N -0.96 0.00 -0.10 0.99 4.77 -0.53 -4.91 117.00 116.27 3i6d n LEU 83 Ca 0.00 -0.44 0.26 0.00 -0.03 0.00 0.00 56.01 55.80 3i6d n LEU 83 Cb 0.54 0.00 0.72 0.00 -2.33 0.00 0.00 43.42 42.35 3i6d n LEU 83 CO 0.53 0.39 1.24 -0.33 -1.33 0.00 0.00 177.39 177.89 3i6d h GLU 84 N 0.00 0.00 -2.00 3.23 5.08 -1.89 -2.33 114.58 116.67 3i6d h GLU 84 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3i6d h GLU 84 Cb 1.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 3i6d h GLU 84 CO 0.00 0.00 -0.00 -2.39 -1.00 0.00 0.00 179.01 175.62 3i6d n HIS 85 N -4.07 0.00 -0.40 4.33 1.44 -1.26 -1.93 115.22 113.32 3i6d n HIS 85 Ca 0.15 -0.60 0.00 0.00 -2.01 0.00 0.00 57.72 55.26 3i6d n HIS 85 Cb 0.87 -0.40 0.00 0.00 0.12 0.00 0.00 29.99 30.58 3i6d n HIS 85 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3i6d n LEU 86 N 1.70 0.00 -4.70 2.39 4.77 -0.88 -5.02 117.00 115.27 3i6d n LEU 86 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 3i6d n LEU 86 Cb 0.30 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 3i6d n LEU 86 CO 0.00 0.00 1.44 0.18 -1.33 0.00 0.00 177.39 177.68 3i6d n LEU 87 N 0.00 3.97 -3.71 2.23 4.77 -0.81 -1.46 117.00 121.98 3i6d n LEU 87 Ca 0.00 1.01 -0.20 0.00 -0.03 0.00 0.00 56.01 56.79 3i6d n LEU 87 Cb 0.00 -1.54 -0.18 0.00 -2.33 0.00 0.00 43.42 39.37 3i6d n LEU 87 CO 0.00 0.15 -0.35 0.68 -1.33 0.00 0.00 177.39 176.54 3i6d s VAL 88 N 2.30 0.03 0.82 4.08 -7.23 -0.97 -4.93 120.40 114.50 3i6d s VAL 88 Ca 0.80 0.31 -0.12 0.00 -1.81 0.00 0.00 61.98 61.17 3i6d s VAL 88 Cb -0.50 -0.25 0.09 0.00 0.56 0.00 0.00 36.38 36.28 3i6d s VAL 88 CO 0.36 0.19 1.15 0.20 -0.31 0.00 0.00 175.10 176.69 3i6d s ASN 89 N 1.95 4.35 0.36 4.85 0.02 -1.26 -2.55 114.94 122.66 3i6d s ASN 89 Ca 0.03 0.94 -0.25 0.00 -1.02 0.00 0.00 52.86 52.56 3i6d s ASN 89 Cb -0.12 -1.52 -0.10 0.00 0.02 0.00 0.00 41.25 39.53 3i6d s ASN 89 CO -0.03 -2.02 0.99 0.54 0.02 0.00 0.00 177.10 176.59 3i6d s ASN 90 N -4.32 7.08 -0.62 -1.22 6.03 -0.57 -4.92 114.94 116.40 3i6d s ASN 90 Ca 0.62 1.91 -0.24 0.00 -1.03 0.00 0.00 52.86 54.12 3i6d s ASN 90 Cb -0.12 -2.58 0.05 0.00 -3.03 0.00 0.00 41.25 35.57 3i6d s ASN 90 CO 0.51 -0.26 1.00 0.00 -2.03 0.00 0.00 177.10 176.32 3i6d s ALA 91 N -1.67 3.09 1.00 3.54 0.00 -0.02 -4.57 121.76 123.12 3i6d s ALA 91 Ca 0.54 -1.51 -0.15 0.00 0.00 0.00 0.00 51.96 50.83 3i6d s ALA 91 Cb -0.19 -3.86 0.02 0.00 0.00 0.00 0.00 23.12 19.09 3i6d s ALA 91 CO 0.25 -2.67 0.11 0.25 0.00 0.00 0.00 175.76 173.70 3i6d n THR 92 N 6.11 0.00 -3.81 0.00 -2.24 -1.26 -4.18 114.28 108.90 3i6d n THR 92 Ca -0.00 -0.24 0.02 0.00 -2.27 0.00 0.00 64.05 61.55 3i6d n THR 92 Cb 0.47 -0.53 0.01 0.00 -2.10 0.00 0.00 70.33 68.17 3i6d n THR 92 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3i6d s GLY 93 N -1.83 -0.25 0.33 3.38 0.00 -1.26 -4.93 107.32 102.76 3i6d s GLY 93 Ca 0.54 0.33 -0.16 0.00 0.00 0.00 0.00 44.72 45.44 3i6d s GLY 93 CO 0.69 2.90 0.76 1.62 0.00 0.00 0.00 173.10 179.06 3i6d s GLN 94 N -2.21 4.02 0.29 2.90 0.74 -1.26 -4.63 119.66 119.52 3i6d s GLN 94 Ca 0.22 0.71 0.09 0.00 0.05 0.00 0.00 55.36 56.43 3i6d s GLN 94 Cb 0.02 -2.41 -0.06 0.00 1.10 0.00 0.00 33.01 31.67 3i6d s GLN 94 CO -0.02 0.14 -0.11 -1.12 -0.55 0.00 0.00 175.29 173.63 3i6d s SER 95 N -2.26 3.21 0.18 6.67 0.01 -1.26 -0.21 113.70 120.03 3i6d s SER 95 Ca 0.55 -1.14 0.00 0.00 1.31 0.00 0.00 55.95 56.67 3i6d s SER 95 Cb -0.10 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.84 3i6d s SER 95 CO 0.17 -0.20 0.07 -0.31 0.41 0.00 0.00 173.24 173.38 3i6d s TYR 96 N -2.78 1.15 -0.19 2.43 2.02 -0.80 -3.27 117.35 115.91 3i6d s TYR 96 Ca 0.30 -1.21 -0.01 0.00 -0.37 0.00 0.00 57.07 55.78 3i6d s TYR 96 Cb 0.01 -0.63 0.05 0.00 -0.40 0.00 0.00 41.96 40.99 3i6d s TYR 96 CO 0.13 -0.44 -0.02 0.08 -1.57 0.00 0.00 175.55 173.73 3i6d s VAL 97 N -3.93 1.01 -0.50 0.71 1.01 -0.38 -2.10 120.40 116.22 3i6d s VAL 97 Ca 0.30 -0.72 -0.28 0.00 0.00 0.00 0.00 61.98 61.28 3i6d s VAL 97 Cb 0.07 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 35.16 3i6d s VAL 97 CO 0.07 -0.02 1.39 -0.22 0.00 0.00 0.00 175.10 176.32 3i6d s LEU 98 N 1.65 3.49 0.00 3.92 2.96 -0.10 -2.87 118.68 127.73 3i6d s LEU 98 Ca -0.01 0.50 0.00 0.00 -0.22 0.00 0.00 54.13 54.40 3i6d s LEU 98 Cb -0.17 -3.27 0.00 0.00 0.50 0.00 0.00 46.19 43.25 3i6d s LEU 98 CO -0.07 -1.57 0.00 0.52 -1.32 0.00 0.00 176.35 173.90 3i6d n VAL 99 N 6.95 0.00 0.00 1.68 0.31 -1.08 -1.23 118.33 124.96 3i6d n VAL 99 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 3i6d n VAL 99 Cb 0.49 -0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.42 3i6d n VAL 99 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3i6d n ASN 100 N -0.08 0.00 -3.23 4.52 3.02 -1.26 -4.39 115.26 113.83 3i6d n ASN 100 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.29 3i6d n ASN 100 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 3i6d n ASN 100 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 3i6d n ARG 101 N -0.59 2.36 -3.65 3.52 0.00 -1.26 -4.97 116.66 112.06 3i6d n ARG 101 Ca 0.00 -4.42 -0.00 0.00 -0.00 0.00 0.00 57.85 53.42 3i6d n ARG 101 Cb 0.00 -2.06 -0.06 0.00 -0.00 0.00 0.00 32.46 30.34 3i6d n ARG 101 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 3i6d s THR 102 N -2.87 0.00 -0.82 8.89 -4.23 -1.26 -5.11 115.64 110.24 3i6d s THR 102 Ca 0.42 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.75 3i6d s THR 102 Cb 0.21 -1.00 0.15 0.00 1.34 0.00 0.00 72.50 73.19 3i6d s THR 102 CO -0.07 0.00 0.94 -0.76 -0.54 0.00 0.00 174.62 174.19 3i6d s LEU 103 N 1.13 5.53 0.51 4.79 1.43 -1.26 -2.62 118.68 128.19 3i6d s LEU 103 Ca -0.08 -2.03 -0.11 0.00 -1.03 0.00 0.00 54.13 50.88 3i6d s LEU 103 Cb -0.03 -2.33 -0.06 0.00 0.03 0.00 0.00 46.19 43.80 3i6d s LEU 103 CO -0.12 -0.97 0.91 -1.00 0.23 0.00 0.00 176.35 175.40 3i6d s HIS 104 N 2.10 3.53 0.42 0.29 3.76 -1.14 -4.87 115.29 119.38 3i6d s HIS 104 Ca 0.24 1.20 0.07 0.00 -0.15 0.00 0.00 55.06 56.42 3i6d s HIS 104 Cb -0.11 -2.60 -0.03 0.00 1.11 0.00 0.00 32.58 30.95 3i6d s HIS 104 CO -0.05 -0.39 0.31 -1.25 -0.85 0.00 0.00 174.74 172.51 3i6d s PRO 105 N -4.47 2.41 0.83 8.40 0.04 -1.26 -1.25 135.00 139.70 3i6d s PRO 105 Ca 0.54 -1.67 -0.11 0.00 0.04 0.00 0.00 61.00 59.80 3i6d s PRO 105 Cb -0.10 -2.23 0.09 0.00 0.04 0.00 0.00 34.50 32.30 3i6d s PRO 105 CO 0.41 -0.19 1.13 -1.64 0.04 0.00 0.00 177.00 176.74 3i6d s MET 106 N -4.06 1.71 1.14 4.56 -1.94 -1.20 -4.85 119.30 114.66 3i6d s MET 106 Ca 0.45 1.40 -0.13 0.00 -1.71 0.00 0.00 55.69 55.70 3i6d s MET 106 Cb -0.01 -1.82 0.27 0.00 2.01 0.00 0.00 34.83 35.28 3i6d s MET 106 CO 0.26 -2.09 1.04 -2.14 -0.01 0.00 0.00 175.02 172.08 3i6d s PRO 107 N -4.66 -0.73 -0.20 2.03 0.02 -1.26 -5.06 135.00 125.14 3i6d s PRO 107 Ca 0.65 0.67 -0.06 0.00 0.02 0.00 0.00 61.00 62.28 3i6d s PRO 107 Cb -0.21 -1.59 -0.03 0.00 0.02 0.00 0.00 34.50 32.69 3i6d s PRO 107 CO 0.55 -3.55 0.02 -1.59 -0.33 0.00 0.00 177.00 172.11 3i6d s LYS 108 N -4.64 3.72 0.08 5.54 0.00 -1.26 -5.18 119.74 118.00 3i6d s LYS 108 Ca 0.68 -0.47 -0.25 0.00 0.00 0.00 0.00 55.97 55.93 3i6d s LYS 108 Cb -0.23 -3.13 -0.06 0.00 0.00 0.00 0.00 37.83 34.41 3i6d s LYS 108 CO 0.62 0.08 0.78 0.45 0.00 0.00 0.00 175.35 177.28 3i6d s SER 130 N 0.86 7.28 0.00 0.03 0.15 -1.26 -5.16 113.70 115.59 3i6d s SER 130 Ca 0.02 1.52 0.00 0.00 0.70 0.00 0.00 55.95 58.19 3i6d s SER 130 Cb -0.14 -2.48 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 3i6d s SER 130 CO 0.02 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.13 3i6d n GLY 131 N 2.17 2.97 0.08 9.45 0.00 -1.26 -4.57 105.19 114.03 3i6d n GLY 131 Ca -0.03 -0.80 -0.10 0.00 0.00 0.00 0.00 46.02 45.09 3i6d n GLY 131 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i6d h LYS 132 N 0.00 0.05 0.01 1.61 1.79 -2.04 -3.14 116.57 114.84 3i6d h LYS 132 Ca 0.00 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 3i6d h LYS 132 Cb 0.00 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.68 3i6d h LYS 132 CO 0.00 0.72 -0.00 0.00 -1.08 0.00 0.00 179.45 179.09 3i6d h ALA 133 N 0.87 -0.01 0.00 3.86 0.00 -1.99 -0.30 119.26 121.70 3i6d h ALA 133 Ca -0.23 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3i6d h ALA 133 Cb 1.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.76 3i6d h ALA 133 CO 0.10 -0.02 0.11 0.07 0.00 0.00 0.00 179.25 179.51 3i6d h ARG 134 N -0.99 0.00 0.00 0.00 -0.00 -1.90 -1.52 114.38 109.97 3i6d h ARG 134 Ca -0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 59.98 59.61 3i6d h ARG 134 Cb 0.70 0.00 -0.07 0.00 -0.00 0.00 0.00 29.97 30.60 3i6d h ARG 134 CO 0.00 0.00 -2.36 0.00 -0.00 0.00 0.00 179.97 177.61 3i6d n ALA 135 N -1.93 1.47 -0.10 0.08 0.00 -1.19 -3.84 120.51 115.00 3i6d n ALA 135 Ca -0.02 -1.23 -0.04 0.00 0.00 0.00 0.00 53.44 52.15 3i6d n ALA 135 Cb 0.16 -0.22 0.16 0.00 0.00 0.00 0.00 19.45 19.55 3i6d n ALA 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i6d h ALA 136 N 0.73 1.10 -0.31 0.00 0.00 -0.06 -2.51 119.26 118.22 3i6d h ALA 136 Ca -0.54 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 53.99 3i6d h ALA 136 Cb 2.14 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 3i6d h ALA 136 CO 0.01 0.57 -0.25 1.98 0.00 0.00 0.00 179.25 181.55 3i6d h MET 137 N 0.72 0.72 0.00 0.00 -1.53 -1.57 -0.14 114.93 113.13 3i6d h MET 137 Ca 0.14 -0.36 -0.01 0.00 -3.44 0.00 0.00 59.70 56.02 3i6d h MET 137 Cb 0.46 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.51 3i6d h MET 137 CO 0.02 0.98 -0.07 -0.44 0.14 0.00 0.00 176.91 177.54 3i6d h ASP 138 N 0.48 0.00 0.00 1.39 3.32 -1.63 0.42 116.42 120.40 3i6d h ASP 138 Ca 0.06 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 3i6d h ASP 138 Cb 0.81 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 3i6d h ASP 138 CO 0.07 0.07 -0.45 0.15 -1.72 0.00 0.00 179.24 177.35 3i6d h PHE 139 N 0.00 0.00 -0.52 4.55 3.57 -1.27 -3.35 116.94 119.92 3i6d h PHE 139 Ca -0.00 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 3i6d h PHE 139 Cb 0.36 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 3i6d h PHE 139 CO 0.00 0.80 0.24 0.82 -2.23 0.00 0.00 178.31 177.94 3i6d h ILE 140 N -1.00 1.20 -2.98 1.41 2.04 -0.86 -3.35 117.51 113.97 3i6d h ILE 140 Ca -0.10 -0.57 -0.62 0.00 1.00 0.00 0.00 64.86 64.56 3i6d h ILE 140 Cb 0.82 0.62 -0.41 0.00 -0.74 0.00 0.00 36.82 37.10 3i6d h ILE 140 CO -0.06 0.22 -0.53 0.18 0.00 0.00 0.00 178.15 177.96 3i6d n LEU 141 N -4.58 3.25 -4.40 1.44 4.77 0.14 -4.78 117.00 112.83 3i6d n LEU 141 Ca 0.02 -5.24 -0.31 0.00 -0.03 0.00 0.00 56.01 50.45 3i6d n LEU 141 Cb 0.12 -0.77 0.20 0.00 -2.33 0.00 0.00 43.42 40.64 3i6d n LEU 141 CO 0.37 1.79 0.03 -2.65 -1.33 0.00 0.00 177.39 175.60 3i6d n PRO 142 N 1.82 -1.72 -1.45 3.23 -0.02 -1.26 -4.62 135.00 130.98 3i6d n PRO 142 Ca 0.21 -0.47 -0.31 0.00 -2.02 0.00 0.00 63.50 60.91 3i6d n PRO 142 Cb 0.36 -1.96 0.08 0.00 -0.02 0.00 0.00 33.50 31.95 3i6d n PRO 142 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i6d s ALA 143 N -2.36 2.40 0.27 3.55 0.00 -1.26 -4.96 121.76 119.40 3i6d s ALA 143 Ca 0.62 0.08 -0.30 0.00 0.00 0.00 0.00 51.96 52.37 3i6d s ALA 143 Cb -0.19 -3.19 -0.10 0.00 0.00 0.00 0.00 23.12 19.63 3i6d s ALA 143 CO 0.65 -1.55 1.47 0.45 0.00 0.00 0.00 175.76 176.78 3i6d s SER 144 N -3.66 6.58 0.00 0.00 0.15 0.39 -4.99 113.70 112.16 3i6d s SER 144 Ca 0.60 2.76 0.00 0.00 0.70 0.00 0.00 55.95 60.00 3i6d s SER 144 Cb -0.15 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 3i6d s SER 144 CO 0.55 -0.75 0.39 0.29 1.20 0.00 0.00 173.24 174.93 3i6d n LYS 145 N 2.06 0.00 -1.15 5.44 5.02 -1.26 -4.88 118.16 123.39 3i6d n LYS 145 Ca 0.06 0.25 -0.31 0.00 -2.02 0.00 0.00 58.31 56.30 3i6d n LYS 145 Cb 0.40 -1.01 0.12 0.00 -0.02 0.00 0.00 35.03 34.52 3i6d n LYS 145 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3i6d s THR 146 N -1.28 2.92 -1.35 -0.18 -1.32 -1.26 -4.97 115.64 108.20 3i6d s THR 146 Ca 0.00 0.30 0.18 0.00 -1.21 0.00 0.00 61.69 60.96 3i6d s THR 146 Cb 0.00 -2.71 0.56 0.00 -1.51 0.00 0.00 72.50 68.84 3i6d s THR 146 CO 0.00 -0.39 1.48 2.29 -2.21 0.00 0.00 174.62 175.79 3i6d n LYS 147 N -3.77 3.04 -3.28 7.08 2.85 -1.26 -4.94 118.16 117.88 3i6d n LYS 147 Ca 0.09 -2.56 -0.36 0.00 -1.05 0.00 0.00 58.31 54.43 3i6d n LYS 147 Cb 0.54 -1.58 -0.06 0.00 -0.65 0.00 0.00 35.03 33.27 3i6d n LYS 147 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3i6d s ASP 148 N -1.04 6.90 0.82 -5.58 1.01 -1.26 -5.05 116.67 112.47 3i6d s ASP 148 Ca 0.42 1.18 -0.12 0.00 0.71 0.00 0.00 52.55 54.74 3i6d s ASP 148 Cb 0.24 -2.33 0.09 0.00 1.01 0.00 0.00 42.92 41.93 3i6d s ASP 148 CO 0.25 0.09 1.15 -0.62 0.21 0.00 0.00 175.17 176.25 3i6d s ASP 149 N -1.68 3.70 0.21 0.27 2.15 -1.26 -5.02 116.67 115.04 3i6d s ASP 149 Ca 0.39 2.16 -0.20 0.00 0.43 0.00 0.00 52.55 55.34 3i6d s ASP 149 Cb -0.16 -2.56 0.03 0.00 -0.30 0.00 0.00 42.92 39.93 3i6d s ASP 149 CO 0.20 -2.59 0.59 0.00 -0.17 0.00 0.00 175.17 173.20 3i6d s GLN 150 N -4.45 1.48 0.42 4.34 -2.07 -1.26 -4.89 119.66 113.23 3i6d s GLN 150 Ca 0.68 -0.82 -0.22 0.00 -1.82 0.00 0.00 55.36 53.18 3i6d s GLN 150 Cb -0.24 0.56 -0.11 0.00 -1.09 0.00 0.00 33.01 32.14 3i6d s GLN 150 CO 0.53 -0.65 0.96 -1.54 -1.32 0.00 0.00 175.29 173.27 3i6d s SER 151 N -2.86 6.92 0.26 12.60 1.04 -1.26 -0.24 113.70 130.16 3i6d s SER 151 Ca 0.08 1.74 -0.02 0.00 0.48 0.00 0.00 55.95 58.23 3i6d s SER 151 Cb -0.02 -2.55 0.48 0.00 0.10 0.00 0.00 66.02 64.03 3i6d s SER 151 CO -0.02 -0.37 1.79 -0.07 0.98 0.00 0.00 173.24 175.55 3i6d h LEU 152 N 2.03 0.64 -0.42 2.42 3.38 -1.26 -0.02 115.31 122.08 3i6d h LEU 152 Ca -0.49 0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.56 3i6d h LEU 152 Cb 1.19 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 3i6d h LEU 152 CO 0.61 0.32 0.26 1.23 0.09 0.00 0.00 178.44 180.95 3i6d h GLY 153 N 0.74 0.58 0.95 0.83 0.00 -1.24 -0.49 103.07 104.44 3i6d h GLY 153 Ca 0.44 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.57 3i6d h GLY 153 CO -0.30 0.18 0.14 -2.09 0.00 0.00 0.00 176.54 174.47 3i6d h GLU 154 N 0.52 0.37 -0.17 4.80 4.81 -1.53 -0.61 114.58 122.78 3i6d h GLU 154 Ca 0.16 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.39 3i6d h GLU 154 Cb -0.01 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 3i6d h GLU 154 CO -0.06 0.33 -0.09 0.35 -0.73 0.00 0.00 179.01 178.80 3i6d h PHE 155 N 0.31 -0.22 0.19 0.92 3.57 -0.65 -2.04 116.94 119.02 3i6d h PHE 155 Ca 0.09 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 3i6d h PHE 155 Cb 0.07 0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.93 3i6d h PHE 155 CO -0.03 -0.14 -0.09 0.74 -2.23 0.00 0.00 178.31 176.55 3i6d h PHE 156 N -0.08 -0.24 -0.20 0.41 0.04 -1.02 -3.13 116.94 112.72 3i6d h PHE 156 Ca 0.09 -0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.92 3i6d h PHE 156 Cb 0.22 0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.44 3i6d h PHE 156 CO -0.24 0.17 0.44 -0.09 -0.60 0.00 0.00 178.31 177.99 3i6d h ARG 157 N -0.78 0.00 0.00 1.51 2.43 -1.13 0.35 114.38 116.76 3i6d h ARG 157 Ca -0.03 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 3i6d h ARG 157 Cb 0.51 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 3i6d h ARG 157 CO 0.04 0.00 -0.34 -0.09 -1.51 0.00 0.00 179.97 178.07 3i6d h ARG 158 N 0.00 0.00 0.00 0.20 2.43 -1.30 -3.36 114.38 112.34 3i6d h ARG 158 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3i6d h ARG 158 Cb 0.97 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.52 3i6d h ARG 158 CO -0.00 0.33 0.00 2.89 -1.51 0.00 0.00 179.97 181.68 3i6d n ARG 159 N -3.18 0.70 -3.79 0.20 1.85 0.10 -5.05 116.66 107.50 3i6d n ARG 159 Ca 0.03 -0.83 -0.10 0.00 -1.00 0.00 0.00 57.85 55.95 3i6d n ARG 159 Cb 0.67 -0.91 -0.07 0.00 -1.05 0.00 0.00 32.46 31.10 3i6d n ARG 159 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3i6d s VAL 160 N -0.38 0.11 0.52 8.89 1.01 -0.17 -4.92 120.40 125.46 3i6d s VAL 160 Ca 0.00 -0.92 -0.21 0.00 0.00 0.00 0.00 61.98 60.85 3i6d s VAL 160 Cb 0.00 -1.19 -0.06 0.00 0.00 0.00 0.00 36.38 35.14 3i6d s VAL 160 CO 0.00 -0.51 1.21 -0.83 0.00 0.00 0.00 175.10 174.97 3i6d s GLY 161 N -2.63 2.77 0.19 4.51 0.00 -1.26 -4.36 107.32 106.55 3i6d s GLY 161 Ca 0.02 1.01 -0.13 0.00 0.00 0.00 0.00 44.72 45.62 3i6d s GLY 161 CO -0.09 1.45 1.70 -0.55 0.00 0.00 0.00 173.10 175.61 3i6d h ASP 162 N 1.52 -0.09 -0.66 1.64 3.32 -1.94 -1.53 116.42 118.68 3i6d h ASP 162 Ca -0.50 0.11 0.14 0.00 0.02 0.00 0.00 57.03 56.79 3i6d h ASP 162 Cb 1.27 0.16 -0.11 0.00 0.22 0.00 0.00 39.33 40.88 3i6d h ASP 162 CO 0.58 -0.02 0.07 -0.08 -1.72 0.00 0.00 179.24 178.07 3i6d h GLU 163 N 0.19 0.18 0.22 3.56 4.57 -1.99 -0.44 114.58 120.87 3i6d h GLU 163 Ca 0.26 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.42 3i6d h GLU 163 Cb 0.38 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.93 3i6d h GLU 163 CO -0.38 0.12 -0.13 0.28 -1.18 0.00 0.00 179.01 177.73 3i6d h VAL 164 N 0.18 0.74 -0.04 0.32 2.07 -1.66 -0.52 116.25 117.34 3i6d h VAL 164 Ca 0.36 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.91 3i6d h VAL 164 Cb 0.59 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 3i6d h VAL 164 CO -0.51 0.00 -0.34 0.58 0.02 0.00 0.00 177.57 177.31 3i6d h VAL 165 N -0.33 0.27 -0.34 2.57 2.07 -0.91 0.32 116.25 119.90 3i6d h VAL 165 Ca -0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.54 3i6d h VAL 165 Cb 0.27 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 3i6d h VAL 165 CO 0.03 0.00 0.11 -0.33 0.02 0.00 0.00 177.57 177.40 3i6d h GLU 166 N -0.47 0.24 0.00 1.57 5.08 -0.99 0.55 114.58 120.56 3i6d h GLU 166 Ca 0.07 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3i6d h GLU 166 Cb 0.58 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3i6d h GLU 166 CO -0.30 0.16 -0.61 -0.91 -1.00 0.00 0.00 179.01 176.35 3i6d h ASN 167 N 0.25 0.00 0.00 1.42 2.35 -0.98 -3.33 115.58 115.28 3i6d h ASN 167 Ca 0.15 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 3i6d h ASN 167 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 3i6d h ASN 167 CO -0.17 0.10 0.00 -0.11 -1.65 0.00 0.00 177.43 175.60 3i6d n LEU 168 N -2.15 0.48 0.32 1.61 7.94 0.09 -4.77 117.00 120.52 3i6d n LEU 168 Ca 0.03 0.20 -0.17 0.00 -1.11 0.00 0.00 56.01 54.97 3i6d n LEU 168 Cb 0.44 -0.05 -0.09 0.00 0.53 0.00 0.00 43.42 44.26 3i6d n LEU 168 CO 0.36 -0.70 0.67 0.40 -1.11 0.00 0.00 177.39 177.01 3i6d h ILE 169 N 0.00 0.44 -0.75 1.96 2.04 -1.41 -2.88 117.51 116.90 3i6d h ILE 169 Ca 0.00 -0.04 0.13 0.00 1.00 0.00 0.00 64.86 65.96 3i6d h ILE 169 Cb 0.00 0.45 -0.09 0.00 -0.74 0.00 0.00 36.82 36.44 3i6d h ILE 169 CO 0.00 0.01 0.33 -0.08 0.00 0.00 0.00 178.15 178.40 3i6d h GLU 170 N -0.79 0.48 -0.67 2.37 4.57 -0.14 -1.06 114.58 119.33 3i6d h GLU 170 Ca -0.08 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 57.99 3i6d h GLU 170 Cb 0.60 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.05 3i6d h GLU 170 CO 0.13 0.32 0.11 -1.35 -1.18 0.00 0.00 179.01 177.03 3i6d h PRO 171 N 0.49 1.11 0.49 0.92 0.11 -1.74 -2.02 132.00 131.37 3i6d h PRO 171 Ca 0.41 -0.30 -0.02 0.00 0.11 0.00 0.00 66.00 66.20 3i6d h PRO 171 Cb 0.58 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.56 3i6d h PRO 171 CO -0.37 1.01 -0.24 -0.07 -0.21 0.00 0.00 178.00 178.13 3i6d h LEU 172 N 1.04 -0.56 -0.48 2.35 3.38 -1.18 -2.71 115.31 117.15 3i6d h LEU 172 Ca 0.20 -0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.19 3i6d h LEU 172 Cb 0.44 0.14 -0.07 0.00 0.09 0.00 0.00 40.66 41.26 3i6d h LEU 172 CO 0.01 -0.18 0.06 -0.07 0.09 0.00 0.00 178.44 178.35 3i6d h LEU 173 N -1.00 -0.07 -2.14 1.67 3.38 -1.24 0.25 115.31 116.16 3i6d h LEU 173 Ca -0.07 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.03 3i6d h LEU 173 Cb 0.60 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 3i6d h LEU 173 CO 0.11 -0.01 0.09 -1.28 0.09 0.00 0.00 178.44 177.44 3i6d h SER 174 N 0.18 0.00 1.06 -0.43 0.87 -1.44 -1.09 113.55 112.70 3i6d h SER 174 Ca 0.24 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.80 3i6d h SER 174 Cb 0.34 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 3i6d h SER 174 CO -0.35 0.00 -0.02 1.23 -0.53 0.00 0.00 176.83 177.17 3i6d h GLY 175 N 0.00 0.00 -0.52 5.77 0.00 -0.16 0.12 103.07 108.29 3i6d h GLY 175 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 3i6d h GLY 175 CO -0.00 0.00 -0.23 0.29 0.00 0.00 0.00 176.54 176.59 3i6d n ILE 176 N -3.12 1.63 -0.46 2.60 -5.35 -0.44 -4.65 119.36 109.57 3i6d n ILE 176 Ca 0.01 -2.15 0.00 0.00 -0.27 0.00 0.00 62.75 60.33 3i6d n ILE 176 Cb 0.33 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.14 3i6d n ILE 176 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3i6d n TYR 177 N -1.08 0.00 -4.10 4.28 4.01 -1.07 -5.02 117.16 114.18 3i6d n TYR 177 Ca 0.14 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.55 3i6d n TYR 177 Cb 0.69 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.71 3i6d n TYR 177 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3i6d n ALA 178 N 0.00 -1.31 -4.06 -0.72 0.00 0.03 -4.85 120.51 109.60 3i6d n ALA 178 Ca 0.00 0.05 -0.15 0.00 0.00 0.00 0.00 53.44 53.35 3i6d n ALA 178 Cb 0.00 -3.76 -0.04 0.00 0.00 0.00 0.00 19.45 15.66 3i6d n ALA 178 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i6d n GLY 179 N -1.53 3.69 3.51 0.00 0.00 -1.26 -4.12 105.19 105.48 3i6d n GLY 179 Ca 0.04 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 3i6d n GLY 179 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i6d s ASP 180 N -2.33 6.18 0.47 1.61 -1.08 -1.26 -4.61 116.67 115.65 3i6d s ASP 180 Ca 0.09 -0.48 0.32 0.00 -0.52 0.00 0.00 52.55 51.96 3i6d s ASP 180 Cb 0.00 -2.20 1.65 0.00 -1.46 0.00 0.00 42.92 40.91 3i6d s ASP 180 CO 0.06 -0.45 1.97 0.16 0.52 0.00 0.00 175.17 177.44 3i6d h ILE 181 N 5.63 0.00 -0.00 4.11 3.07 -1.94 0.17 117.51 128.55 3i6d h ILE 181 Ca -0.28 -0.08 0.00 0.00 1.55 0.00 0.00 64.86 66.04 3i6d h ILE 181 Cb 1.13 0.85 0.00 0.00 -0.27 0.00 0.00 36.82 38.53 3i6d h ILE 181 CO 0.74 0.00 -0.03 0.47 -1.05 0.00 0.00 178.15 178.28 3i6d n ASP 182 N -2.66 0.07 -0.05 2.16 8.00 -1.26 -0.78 116.55 122.03 3i6d n ASP 182 Ca -0.01 -0.04 -0.07 0.00 0.71 0.00 0.00 54.79 55.38 3i6d n ASP 182 Cb 0.10 -0.30 -0.05 0.00 -0.02 0.00 0.00 41.12 40.86 3i6d n ASP 182 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3i6d n LYS 183 N -1.31 0.49 -1.69 -1.24 4.76 0.47 -4.78 118.16 114.87 3i6d n LYS 183 Ca 0.12 0.05 -0.42 0.00 -2.87 0.00 0.00 58.31 55.19 3i6d n LYS 183 Cb 0.27 -1.20 -0.00 0.00 -1.84 0.00 0.00 35.03 32.26 3i6d n LYS 183 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3i6d n LEU 184 N -2.74 3.49 -4.72 -0.35 4.77 -0.37 -2.27 117.00 114.81 3i6d n LEU 184 Ca -0.17 1.18 -0.41 0.00 -0.03 0.00 0.00 56.01 56.58 3i6d n LEU 184 Cb 0.69 -1.47 -0.04 0.00 -2.33 0.00 0.00 43.42 40.27 3i6d n LEU 184 CO 0.11 -0.62 0.60 -0.55 -1.33 0.00 0.00 177.39 175.60 3i6d s SER 185 N -0.39 7.34 0.04 -1.43 0.15 0.64 -1.68 113.70 118.37 3i6d s SER 185 Ca 0.57 1.62 -0.22 0.00 0.70 0.00 0.00 55.95 58.61 3i6d s SER 185 Cb -0.56 -2.54 -0.15 0.00 -1.71 0.00 0.00 66.02 61.06 3i6d s SER 185 CO 0.61 -0.12 1.42 0.25 1.20 0.00 0.00 173.24 176.60 3i6d h LEU 186 N 6.11 0.21 -1.25 3.45 5.85 -0.89 -2.49 115.31 126.31 3i6d h LEU 186 Ca -0.42 -0.37 0.06 0.00 0.84 0.00 0.00 57.88 57.98 3i6d h LEU 186 Cb 1.21 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.13 3i6d h LEU 186 CO 0.73 0.53 0.54 -0.03 -0.34 0.00 0.00 178.44 179.87 3i6d h MET 187 N -0.12 0.90 0.00 1.25 4.05 -1.84 -0.38 114.93 118.78 3i6d h MET 187 Ca 0.03 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 3i6d h MET 187 Cb 0.44 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 31.04 3i6d h MET 187 CO 0.01 0.59 -0.73 0.77 0.23 0.00 0.00 176.91 177.79 3i6d h SER 188 N 0.93 0.00 0.00 1.39 0.02 -1.92 -3.21 113.55 110.76 3i6d h SER 188 Ca 0.35 -0.01 -0.36 0.00 -0.84 0.00 0.00 61.79 60.93 3i6d h SER 188 Cb 0.18 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.66 3i6d h SER 188 CO -0.12 0.00 -2.38 0.35 -1.14 0.00 0.00 176.83 173.55 3i6d n THR 189 N -2.77 1.39 -3.18 -2.27 -2.24 -0.94 -4.75 114.28 99.51 3i6d n THR 189 Ca 0.01 -0.53 -0.23 0.00 -2.27 0.00 0.00 64.05 61.03 3i6d n THR 189 Cb 0.54 -1.35 -0.05 0.00 -2.10 0.00 0.00 70.33 67.37 3i6d n THR 189 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3i6d n PHE 190 N -3.20 1.37 0.28 4.78 3.72 -0.17 -4.93 117.46 119.30 3i6d n PHE 190 Ca -0.43 -3.84 0.16 0.00 -0.05 0.00 0.00 57.45 53.30 3i6d n PHE 190 Cb 0.96 -0.44 0.77 0.00 -0.94 0.00 0.00 39.48 39.83 3i6d n PHE 190 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3i6d h PRO 191 N 3.50 0.00 0.00 -1.08 0.13 -1.63 -1.98 132.00 130.94 3i6d h PRO 191 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3i6d h PRO 191 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 3i6d h PRO 191 CO 0.61 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.38 3i6d n GLN 192 N -3.07 0.02 -0.56 0.86 0.00 -1.26 -1.77 117.38 111.59 3i6d n GLN 192 Ca 0.00 0.35 0.06 0.00 0.00 0.00 0.00 57.00 57.41 3i6d n GLN 192 Cb 0.46 -1.50 0.29 0.00 0.00 0.00 0.00 30.24 29.49 3i6d n GLN 192 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3i6d n PHE 193 N -1.47 1.33 0.00 2.61 3.72 -0.74 -5.00 117.46 117.91 3i6d n PHE 193 Ca 0.02 -0.49 0.01 0.00 -0.05 0.00 0.00 57.45 56.93 3i6d n PHE 193 Cb 0.08 -0.30 -0.01 0.00 -0.94 0.00 0.00 39.48 38.32 3i6d n PHE 193 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3i6d n TYR 194 N 0.66 0.00 0.00 1.38 4.02 -0.73 -0.46 117.16 122.02 3i6d n TYR 194 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.09 3i6d n TYR 194 Cb 0.82 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 40.12 3i6d n TYR 194 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 3i6d n GLN 226 N -1.51 0.00 -4.60 -0.72 0.00 -1.26 -4.77 117.38 104.52 3i6d n GLN 226 Ca -0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 57.00 56.73 3i6d n GLN 226 Cb 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 30.24 30.14 3i6d n GLN 226 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 3i6d s PHE 227 N -1.47 2.02 0.23 3.69 0.08 -1.26 -2.32 117.98 118.95 3i6d s PHE 227 Ca 0.00 -0.39 0.10 0.00 0.12 0.00 0.00 56.93 56.76 3i6d s PHE 227 Cb 0.00 -1.17 -0.05 0.00 -0.57 0.00 0.00 43.02 41.24 3i6d s PHE 227 CO 0.00 0.16 -0.18 -0.65 -0.10 0.00 0.00 175.22 174.45 3i6d s GLN 228 N -1.48 1.50 0.19 0.44 -0.21 -0.50 -1.51 119.66 118.07 3i6d s GLN 228 Ca 0.09 -1.64 -0.04 0.00 0.02 0.00 0.00 55.36 53.80 3i6d s GLN 228 Cb -0.10 -1.50 0.02 0.00 1.00 0.00 0.00 33.01 32.43 3i6d s GLN 228 CO 0.03 0.28 0.31 2.41 -2.12 0.00 0.00 175.29 176.20 3i6d n THR 229 N -0.34 0.00 -3.98 -0.19 -1.04 -1.06 -1.55 114.28 106.12 3i6d n THR 229 Ca -0.08 -0.72 -0.34 0.00 -2.04 0.00 0.00 64.05 60.87 3i6d n THR 229 Cb 0.59 0.53 -0.15 0.00 -1.82 0.00 0.00 70.33 69.48 3i6d n THR 229 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3i6d s LEU 230 N 0.00 2.82 0.66 -4.42 1.43 -1.26 -2.30 118.68 115.61 3i6d s LEU 230 Ca 0.12 -0.65 0.14 0.00 -1.03 0.00 0.00 54.13 52.71 3i6d s LEU 230 Cb -0.01 -1.64 0.75 0.00 0.03 0.00 0.00 46.19 45.32 3i6d s LEU 230 CO 0.08 -0.06 1.42 0.77 0.23 0.00 0.00 176.35 178.79 3i6d h SER 231 N 8.03 0.00 1.03 2.29 4.64 -1.61 1.29 113.55 129.22 3i6d h SER 231 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3i6d h SER 231 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3i6d h SER 231 CO 0.60 0.00 -0.75 0.74 -0.87 0.00 0.00 176.83 176.55 3i6d h THR 232 N 0.00 0.00 0.00 2.95 2.02 -1.94 -3.48 112.91 112.46 3i6d h THR 232 Ca 0.03 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.43 3i6d h THR 232 Cb 1.48 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 69.25 3i6d h THR 232 CO -0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 3i6d n GLY 233 N 1.24 3.63 0.39 2.16 0.00 0.44 -4.81 105.19 108.25 3i6d n GLY 233 Ca 0.02 -1.49 0.18 0.00 0.00 0.00 0.00 46.02 44.73 3i6d n GLY 233 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3i6d h LEU 234 N 0.00 0.44 -2.24 0.99 3.38 -1.87 -1.06 115.31 114.95 3i6d h LEU 234 Ca 0.00 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.03 3i6d h LEU 234 Cb 0.00 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3i6d h LEU 234 CO 0.00 0.19 0.26 -0.61 0.09 0.00 0.00 178.44 178.36 3i6d h GLN 235 N 0.45 0.00 -0.40 1.13 4.15 -1.90 0.39 115.11 118.93 3i6d h GLN 235 Ca 0.45 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.77 3i6d h GLN 235 Cb 1.06 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.74 3i6d h GLN 235 CO -0.18 0.00 -0.19 1.79 -1.93 0.00 0.00 178.83 178.32 3i6d h THR 236 N 0.00 1.27 -0.81 2.39 1.35 -1.50 -2.19 112.91 113.42 3i6d h THR 236 Ca 0.03 -1.29 0.13 0.00 -0.55 0.00 0.00 66.41 64.74 3i6d h THR 236 Cb 0.54 1.17 -0.06 0.00 -1.73 0.00 0.00 68.15 68.07 3i6d h THR 236 CO -0.00 0.43 0.53 0.25 -0.25 0.00 0.00 175.52 176.48 3i6d h LEU 237 N 0.68 0.55 -0.02 3.87 5.85 -1.08 0.15 115.31 125.30 3i6d h LEU 237 Ca 0.10 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 3i6d h LEU 237 Cb 0.69 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3i6d h LEU 237 CO 0.05 0.29 -0.06 0.58 -0.34 0.00 0.00 178.44 178.96 3i6d h VAL 238 N 0.59 1.46 -0.60 1.05 2.07 -1.49 -3.15 116.25 116.17 3i6d h VAL 238 Ca 0.40 -1.46 -0.03 0.00 0.82 0.00 0.00 66.70 66.43 3i6d h VAL 238 Cb 0.71 2.39 -0.03 0.00 -1.52 0.00 0.00 31.29 32.84 3i6d h VAL 238 CO -0.16 0.39 0.26 -0.33 0.02 0.00 0.00 177.57 177.75 3i6d h GLU 239 N -0.49 0.86 -0.47 1.57 5.08 -0.80 -2.40 114.58 117.93 3i6d h GLU 239 Ca -0.00 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 3i6d h GLU 239 Cb 0.66 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 3i6d h GLU 239 CO 0.01 0.70 0.25 1.49 -1.00 0.00 0.00 179.01 180.46 3i6d h GLU 240 N 0.86 0.64 -0.03 2.33 4.22 -0.79 -2.30 114.58 119.51 3i6d h GLU 240 Ca 0.21 -0.06 -0.03 0.00 0.08 0.00 0.00 59.36 59.56 3i6d h GLU 240 Cb 0.14 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.26 3i6d h GLU 240 CO -0.02 0.48 -0.09 0.82 -2.18 0.00 0.00 179.01 178.02 3i6d h ILE 241 N 0.64 1.45 -0.97 2.32 2.04 -1.40 -2.63 117.51 118.98 3i6d h ILE 241 Ca 0.17 -1.47 0.19 0.00 1.00 0.00 0.00 64.86 64.75 3i6d h ILE 241 Cb 0.03 2.35 -0.09 0.00 -0.74 0.00 0.00 36.82 38.37 3i6d h ILE 241 CO -0.03 0.40 0.61 -0.08 0.00 0.00 0.00 178.15 179.05 3i6d h GLU 242 N -0.43 0.62 -0.05 2.37 4.81 -1.12 -0.75 114.58 120.03 3i6d h GLU 242 Ca -0.00 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 58.99 3i6d h GLU 242 Cb 0.69 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 3i6d h GLU 242 CO 0.02 0.41 -0.82 0.87 -0.73 0.00 0.00 179.01 178.76 3i6d h LYS 243 N 0.64 0.45 -0.14 1.92 1.57 -1.43 -3.20 116.57 116.38 3i6d h LYS 243 Ca 0.53 -0.41 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3i6d h LYS 243 Cb 0.97 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3i6d h LYS 243 CO -0.29 1.05 0.00 1.04 -0.57 0.00 0.00 179.45 180.69 3i6d n GLN 244 N -3.81 1.33 -3.39 3.15 6.02 -0.33 -4.75 117.38 115.60 3i6d n GLN 244 Ca -0.06 -0.50 -0.41 0.00 -0.01 0.00 0.00 57.00 56.02 3i6d n GLN 244 Cb 0.76 -1.12 -0.09 0.00 1.02 0.00 0.00 30.24 30.81 3i6d n GLN 244 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3i6d s LEU 245 N -1.03 4.37 -0.19 1.08 1.43 -0.95 -4.95 118.68 118.45 3i6d s LEU 245 Ca 0.10 -0.15 -0.11 0.00 -1.03 0.00 0.00 54.13 52.95 3i6d s LEU 245 Cb 0.05 -2.37 -0.08 0.00 0.03 0.00 0.00 46.19 43.82 3i6d s LEU 245 CO 0.07 -0.33 -0.27 0.29 0.23 0.00 0.00 176.35 176.34 3i6d n LYS 246 N 5.41 0.44 -0.00 1.70 4.76 -1.26 -4.63 118.16 124.58 3i6d n LYS 246 Ca -0.09 0.19 0.15 0.00 -2.87 0.00 0.00 58.31 55.69 3i6d n LYS 246 Cb 0.49 -1.24 0.83 0.00 -1.84 0.00 0.00 35.03 33.28 3i6d n LYS 246 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3i6d n LEU 247 N -4.00 0.26 -4.62 -0.35 4.32 -1.26 -4.81 117.00 106.53 3i6d n LEU 247 Ca -0.35 -0.09 -0.38 0.00 -0.02 0.00 0.00 56.01 55.18 3i6d n LEU 247 Cb 0.71 -0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.41 3i6d n LEU 247 CO 0.05 0.04 -0.12 -0.89 -1.22 0.00 0.00 177.39 175.25 3i6d s THR 248 N -1.99 5.30 -0.74 -5.08 2.01 -1.26 -4.16 115.64 109.73 3i6d s THR 248 Ca 0.44 0.26 -0.26 0.00 0.31 0.00 0.00 61.69 62.44 3i6d s THR 248 Cb 0.21 -3.55 0.04 0.00 0.01 0.00 0.00 72.50 69.20 3i6d s THR 248 CO 0.34 0.28 1.22 -0.54 -0.69 0.00 0.00 174.62 175.23 3i6d s LYS 249 N 1.49 3.19 -0.60 4.92 1.02 -1.03 -4.90 119.74 123.84 3i6d s LYS 249 Ca 0.09 -0.43 -0.23 0.00 0.02 0.00 0.00 55.97 55.42 3i6d s LYS 249 Cb -0.15 -4.25 0.05 0.00 -0.52 0.00 0.00 37.83 32.96 3i6d s LYS 249 CO 0.08 -2.08 0.96 0.08 -0.92 0.00 0.00 175.35 173.47 3i6d s VAL 250 N 5.31 4.34 -0.27 3.17 1.01 -1.26 -1.89 120.40 130.82 3i6d s VAL 250 Ca 0.33 0.00 -0.11 0.00 0.00 0.00 0.00 61.98 62.20 3i6d s VAL 250 Cb -0.10 -4.61 -0.05 0.00 0.00 0.00 0.00 36.38 31.62 3i6d s VAL 250 CO 0.13 -1.28 0.19 -0.31 0.00 0.00 0.00 175.10 173.82 3i6d s TYR 251 N 4.05 3.25 0.44 5.22 4.12 0.24 -4.99 117.35 129.67 3i6d s TYR 251 Ca 0.27 0.16 0.06 0.00 0.02 0.00 0.00 57.07 57.58 3i6d s TYR 251 Cb -0.14 -2.35 0.06 0.00 -1.52 0.00 0.00 41.96 38.01 3i6d s TYR 251 CO 0.15 -0.10 0.51 1.63 0.02 0.00 0.00 175.55 177.76 3i6d n LYS 252 N 4.84 0.76 -0.97 -0.62 5.02 -1.26 0.39 118.16 126.32 3i6d n LYS 252 Ca -0.14 -2.53 -0.06 0.00 -2.02 0.00 0.00 58.31 53.55 3i6d n LYS 252 Cb 0.52 -0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.50 3i6d n LYS 252 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i6d n GLY 253 N -0.39 0.58 3.04 0.72 0.00 0.25 -4.77 105.19 104.62 3i6d n GLY 253 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 3i6d n GLY 253 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i6d s THR 254 N -1.31 1.08 -0.06 2.61 -4.23 -0.22 -4.90 115.64 108.61 3i6d s THR 254 Ca 0.00 -0.49 0.04 0.00 -1.18 0.00 0.00 61.69 60.06 3i6d s THR 254 Cb 0.00 -0.96 -0.02 0.00 1.34 0.00 0.00 72.50 72.86 3i6d s THR 254 CO 0.00 0.33 -0.17 -1.59 -0.54 0.00 0.00 174.62 172.65 3i6d s LYS 255 N 0.37 2.63 0.13 3.99 -2.85 -1.26 -1.96 119.74 120.78 3i6d s LYS 255 Ca -0.08 -0.76 -0.30 0.00 -1.00 0.00 0.00 55.97 53.83 3i6d s LYS 255 Cb -0.12 -2.35 -0.06 0.00 -2.06 0.00 0.00 37.83 33.23 3i6d s LYS 255 CO 0.02 0.49 1.08 0.08 0.10 0.00 0.00 175.35 177.12 3i6d s VAL 256 N -0.41 4.12 -0.05 1.79 1.01 -1.26 -0.96 120.40 124.65 3i6d s VAL 256 Ca 0.04 1.73 0.06 0.00 0.00 0.00 0.00 61.98 63.81 3i6d s VAL 256 Cb -0.12 -4.10 -0.09 0.00 0.00 0.00 0.00 36.38 32.07 3i6d s VAL 256 CO 0.02 0.25 0.15 0.35 0.00 0.00 0.00 175.10 175.86 3i6d n THR 257 N 2.87 0.00 -3.72 3.92 -2.24 0.65 -4.92 114.28 110.84 3i6d n THR 257 Ca 0.04 -0.17 -0.12 0.00 -2.27 0.00 0.00 64.05 61.53 3i6d n THR 257 Cb 0.47 0.46 -0.10 0.00 -2.10 0.00 0.00 70.33 69.06 3i6d n THR 257 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3i6d s LYS 258 N -2.29 0.45 -0.19 -0.78 2.20 -1.12 -4.32 119.74 113.70 3i6d s LYS 258 Ca -0.02 0.63 -0.03 0.00 -0.36 0.00 0.00 55.97 56.19 3i6d s LYS 258 Cb 0.04 0.16 -0.01 0.00 -1.51 0.00 0.00 37.83 36.51 3i6d s LYS 258 CO 0.25 -0.09 -0.06 -1.17 -0.36 0.00 0.00 175.35 173.93 3i6d s LEU 259 N 0.55 2.95 0.00 5.43 2.96 -0.42 -0.98 118.68 129.17 3i6d s LEU 259 Ca -0.03 -0.32 0.02 0.00 -0.22 0.00 0.00 54.13 53.59 3i6d s LEU 259 Cb -0.04 -1.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.91 3i6d s LEU 259 CO -0.03 0.06 0.21 -0.24 -1.32 0.00 0.00 176.35 175.02 3i6d n SER 260 N 4.27 -0.55 -4.12 3.68 2.88 0.44 -4.77 113.62 115.44 3i6d n SER 260 Ca -0.18 -2.16 -0.30 0.00 -1.33 0.00 0.00 58.87 54.90 3i6d n SER 260 Cb 0.52 1.14 -0.17 0.00 -0.75 0.00 0.00 64.21 64.95 3i6d n SER 260 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 3i6d s HIS 261 N -3.19 2.24 0.00 0.66 2.46 -1.26 0.18 115.29 116.38 3i6d s HIS 261 Ca 0.20 -1.02 0.00 0.00 0.47 0.00 0.00 55.06 54.70 3i6d s HIS 261 Cb 0.00 -1.56 0.00 0.00 -0.13 0.00 0.00 32.58 30.90 3i6d s HIS 261 CO 0.14 -0.48 0.00 0.43 -2.47 0.00 0.00 174.74 172.36 3i6d n SER 262 N 3.95 0.00 0.00 9.88 7.64 0.14 -4.82 113.62 130.41 3i6d n SER 262 Ca -0.20 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.68 3i6d n SER 262 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 3i6d n SER 262 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i6d n GLY 263 N 4.74 -0.22 0.27 0.23 0.00 -1.26 -4.83 105.19 104.12 3i6d n GLY 263 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 3i6d n GLY 263 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3i6d n SER 264 N -2.15 1.52 -4.60 1.61 2.88 -1.26 -5.02 113.62 106.59 3i6d n SER 264 Ca 0.00 -1.26 -0.25 0.00 -1.33 0.00 0.00 58.87 56.03 3i6d n SER 264 Cb 0.00 0.06 -0.09 0.00 -0.75 0.00 0.00 64.21 63.43 3i6d n SER 264 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3i6d s TYR 266 N -2.57 3.53 -0.17 0.00 2.02 0.71 0.26 117.35 121.12 3i6d s TYR 266 Ca 0.34 0.77 -0.01 0.00 -0.37 0.00 0.00 57.07 57.80 3i6d s TYR 266 Cb 0.02 -2.16 -0.01 0.00 -0.40 0.00 0.00 41.96 39.41 3i6d s TYR 266 CO 0.18 0.44 -0.11 0.45 -1.57 0.00 0.00 175.55 174.94 3i6d s SER 267 N -2.04 3.94 -0.38 2.29 0.15 0.13 -2.08 113.70 115.71 3i6d s SER 267 Ca 0.38 -0.42 -0.06 0.00 0.70 0.00 0.00 55.95 56.55 3i6d s SER 267 Cb -0.13 -1.63 0.07 0.00 -1.71 0.00 0.00 66.02 62.62 3i6d s SER 267 CO 0.20 0.07 0.17 -0.76 1.20 0.00 0.00 173.24 174.12 3i6d s LEU 268 N 0.94 4.79 -0.06 3.45 1.02 -0.23 -0.42 118.68 128.16 3i6d s LEU 268 Ca -0.02 -1.47 -0.30 0.00 0.02 0.00 0.00 54.13 52.36 3i6d s LEU 268 Cb -0.15 -1.89 -0.03 0.00 0.02 0.00 0.00 46.19 44.14 3i6d s LEU 268 CO -0.01 -0.45 1.21 -1.61 0.02 0.00 0.00 176.35 175.51 3i6d s GLU 269 N 1.34 4.34 0.65 1.70 2.02 -0.15 -1.76 118.70 126.84 3i6d s GLU 269 Ca 0.02 1.67 0.02 0.00 0.02 0.00 0.00 54.97 56.70 3i6d s GLU 269 Cb -0.22 -3.57 0.10 0.00 0.10 0.00 0.00 34.13 30.54 3i6d s GLU 269 CO 0.01 -0.47 0.90 -0.51 0.02 0.00 0.00 175.26 175.21 3i6d s LEU 270 N 2.31 3.08 0.04 1.80 1.43 -0.38 -0.25 118.68 126.71 3i6d s LEU 270 Ca 0.56 -0.40 -0.23 0.00 -1.03 0.00 0.00 54.13 53.02 3i6d s LEU 270 Cb -0.24 -2.08 -0.13 0.00 0.03 0.00 0.00 46.19 43.77 3i6d s LEU 270 CO 0.21 -1.60 1.35 -0.78 0.23 0.00 0.00 176.35 175.76 3i6d h ASP 271 N -0.25 -0.75 -0.02 2.29 -0.00 -1.35 -3.13 116.42 113.21 3i6d h ASP 271 Ca -0.36 0.03 0.00 0.00 -0.00 0.00 0.00 57.03 56.71 3i6d h ASP 271 Cb 1.28 0.21 -0.00 0.00 -0.00 0.00 0.00 39.33 40.81 3i6d h ASP 271 CO 0.42 -0.50 0.02 -0.55 -0.00 0.00 0.00 179.24 178.64 3i6d h ASN 272 N -0.80 0.00 0.00 2.28 7.08 -1.95 -3.46 115.58 118.72 3i6d h ASN 272 Ca -0.08 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.14 3i6d h ASN 272 Cb 0.63 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.87 3i6d h ASN 272 CO 0.10 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 176.06 3i6d n GLY 273 N -1.27 1.92 3.74 9.14 0.00 -1.19 -5.11 105.19 112.42 3i6d n GLY 273 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 3i6d n GLY 273 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i6d s VAL 274 N -1.62 2.30 -0.12 1.61 1.01 -1.26 -4.69 120.40 117.63 3i6d s VAL 274 Ca 0.00 0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.16 3i6d s VAL 274 Cb 0.00 -2.99 0.02 0.00 0.00 0.00 0.00 36.38 33.41 3i6d s VAL 274 CO 0.00 -0.05 -0.12 -0.89 0.00 0.00 0.00 175.10 174.04 3i6d s THR 275 N -1.60 1.31 0.31 3.92 2.01 -1.26 -1.25 115.64 119.08 3i6d s THR 275 Ca 0.79 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 62.30 3i6d s THR 275 Cb -0.33 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.90 3i6d s THR 275 CO 0.39 0.41 0.50 -0.76 -0.69 0.00 0.00 174.62 174.47 3i6d s LEU 276 N 1.32 4.09 0.08 4.42 1.43 -0.73 -4.88 118.68 124.41 3i6d s LEU 276 Ca -0.01 0.39 0.10 0.00 -1.03 0.00 0.00 54.13 53.58 3i6d s LEU 276 Cb -0.14 -3.23 -0.03 0.00 0.03 0.00 0.00 46.19 42.82 3i6d s LEU 276 CO -0.06 -0.23 -0.25 -1.81 0.23 0.00 0.00 176.35 174.24 3i6d s ASP 277 N -3.92 3.36 0.06 2.29 1.01 -1.26 -1.07 116.67 117.14 3i6d s ASP 277 Ca 0.39 -0.62 -0.23 0.00 0.71 0.00 0.00 52.55 52.80 3i6d s ASP 277 Cb -0.10 -0.33 0.06 0.00 1.01 0.00 0.00 42.92 43.56 3i6d s ASP 277 CO 0.34 0.23 0.55 0.00 0.21 0.00 0.00 175.17 176.50 3i6d s ALA 278 N -0.93 -1.41 -0.14 5.23 0.00 -0.88 -4.85 121.76 118.77 3i6d s ALA 278 Ca 0.13 0.63 0.18 0.00 0.00 0.00 0.00 51.96 52.90 3i6d s ALA 278 Cb -0.10 0.46 -0.25 0.00 0.00 0.00 0.00 23.12 23.22 3i6d s ALA 278 CO 0.04 -0.55 0.29 -0.25 0.00 0.00 0.00 175.76 175.30 3i6d n ASP 279 N 0.27 0.17 -3.84 0.00 8.00 -0.21 -0.21 116.55 120.74 3i6d n ASP 279 Ca -0.18 0.08 -0.12 0.00 0.71 0.00 0.00 54.79 55.28 3i6d n ASP 279 Cb 0.61 1.02 -0.13 0.00 -0.02 0.00 0.00 41.12 42.60 3i6d n ASP 279 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3i6d s SER 280 N -5.37 -0.07 -0.06 -2.24 0.15 -1.20 -4.81 113.70 100.11 3i6d s SER 280 Ca -0.08 0.13 0.02 0.00 0.70 0.00 0.00 55.95 56.72 3i6d s SER 280 Cb 0.08 0.13 0.02 0.00 -1.71 0.00 0.00 66.02 64.54 3i6d s SER 280 CO 0.84 -0.03 -0.09 -0.69 1.20 0.00 0.00 173.24 174.47 3i6d s VAL 281 N 0.08 0.94 -0.36 4.45 1.01 -0.51 -2.57 120.40 123.45 3i6d s VAL 281 Ca -0.00 -0.35 -0.07 0.00 0.00 0.00 0.00 61.98 61.55 3i6d s VAL 281 Cb -0.01 -0.89 0.05 0.00 0.00 0.00 0.00 36.38 35.53 3i6d s VAL 281 CO -0.00 0.32 0.15 -0.63 0.00 0.00 0.00 175.10 174.93 3i6d s ILE 282 N 0.83 3.92 -0.29 2.22 1.01 -0.91 -0.21 121.20 127.77 3i6d s ILE 282 Ca -0.12 -1.20 -0.16 0.00 0.00 0.00 0.00 60.65 59.17 3i6d s ILE 282 Cb -0.15 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.02 3i6d s ILE 282 CO 0.02 -0.27 0.42 -0.69 0.00 0.00 0.00 174.94 174.41 3i6d s VAL 283 N 1.41 5.13 -0.32 2.92 1.01 0.23 -1.29 120.40 129.49 3i6d s VAL 283 Ca 0.00 0.50 0.03 0.00 0.00 0.00 0.00 61.98 62.51 3i6d s VAL 283 Cb -0.20 -3.78 0.06 0.00 0.00 0.00 0.00 36.38 32.45 3i6d s VAL 283 CO 0.03 0.04 0.87 0.35 0.00 0.00 0.00 175.10 176.39 3i6d n THR 284 N 5.20 0.57 -1.59 3.92 -2.24 0.41 -2.08 114.28 118.47 3i6d n THR 284 Ca -0.07 -0.79 -0.33 0.00 -2.27 0.00 0.00 64.05 60.59 3i6d n THR 284 Cb 0.50 0.74 0.06 0.00 -2.10 0.00 0.00 70.33 69.54 3i6d n THR 284 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i6d s ALA 285 N -0.69 2.35 0.79 6.98 0.00 -1.21 -4.79 121.76 125.20 3i6d s ALA 285 Ca 0.05 0.53 -0.14 0.00 0.00 0.00 0.00 51.96 52.40 3i6d s ALA 285 Cb 0.03 -3.33 0.03 0.00 0.00 0.00 0.00 23.12 19.85 3i6d s ALA 285 CO 0.04 -1.49 0.89 -2.30 0.00 0.00 0.00 175.76 172.90 3i6d n PRO 286 N -2.72 0.19 -0.37 0.00 -0.02 -1.26 -4.45 135.00 126.37 3i6d n PRO 286 Ca 0.11 0.13 0.29 0.00 -2.02 0.00 0.00 63.50 62.00 3i6d n PRO 286 Cb 0.52 -2.18 0.55 0.00 -0.02 0.00 0.00 33.50 32.38 3i6d n PRO 286 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 3i6d h HIS 287 N -0.77 0.73 -0.03 6.00 2.07 -1.93 -1.57 115.15 119.65 3i6d h HIS 287 Ca -0.46 0.03 -0.01 0.00 -2.85 0.00 0.00 60.37 57.08 3i6d h HIS 287 Cb 1.31 -0.19 -0.00 0.00 2.57 0.00 0.00 27.41 31.10 3i6d h HIS 287 CO 0.41 -0.18 -0.01 -0.22 -3.07 0.00 0.00 177.93 174.86 3i6d h LYS 288 N 0.22 0.06 0.02 5.12 3.11 -1.90 -1.53 116.57 121.66 3i6d h LYS 288 Ca 0.76 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 58.57 3i6d h LYS 288 Cb 2.03 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 33.26 3i6d h LYS 288 CO -0.51 0.45 -0.01 0.00 -2.81 0.00 0.00 179.45 176.57 3i6d h ALA 289 N 0.61 -0.02 0.10 5.00 0.00 -1.66 -2.91 119.26 120.38 3i6d h ALA 289 Ca 0.01 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.84 3i6d h ALA 289 Cb 0.43 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 3i6d h ALA 289 CO 0.00 -0.42 -0.20 0.00 0.00 0.00 0.00 179.25 178.62 3i6d h ALA 290 N 0.78 -0.34 0.00 0.00 0.00 -1.38 -0.98 119.26 117.34 3i6d h ALA 290 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3i6d h ALA 290 Cb 0.19 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3i6d h ALA 290 CO 0.00 -0.73 0.24 0.00 0.00 0.00 0.00 179.25 178.76 3i6d h ALA 291 N 0.43 1.23 0.03 0.00 0.00 -1.26 0.13 119.26 119.80 3i6d h ALA 291 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 3i6d h ALA 291 Cb 0.41 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3i6d h ALA 291 CO -0.12 -0.23 -1.15 0.78 0.00 0.00 0.00 179.25 178.54 3i6d h GLY 292 N 0.00 0.06 1.61 0.00 0.00 -0.97 -2.91 103.07 100.86 3i6d h GLY 292 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.17 3i6d h GLY 292 CO 0.00 0.14 0.00 1.03 0.00 0.00 0.00 176.54 177.71 3i6d n MET 293 N -3.35 0.35 -2.75 4.80 0.00 0.03 -3.75 117.12 112.45 3i6d n MET 293 Ca -0.04 0.03 -0.03 0.00 0.00 0.00 0.00 57.70 57.66 3i6d n MET 293 Cb 0.97 -1.50 0.07 0.00 0.00 0.00 0.00 33.22 32.76 3i6d n MET 293 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 3i6d n LEU 294 N -1.30 0.42 0.14 4.03 7.94 -1.22 -1.30 117.00 125.70 3i6d n LEU 294 Ca 0.12 -3.24 0.19 0.00 -1.11 0.00 0.00 56.01 51.98 3i6d n LEU 294 Cb 0.22 0.32 0.74 0.00 0.53 0.00 0.00 43.42 45.24 3i6d n LEU 294 CO 0.21 1.39 1.17 0.77 -1.11 0.00 0.00 177.39 179.82 3i6d h SER 295 N 2.20 0.00 0.11 1.96 4.64 -1.60 -2.70 113.55 118.16 3i6d h SER 295 Ca -0.23 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.87 3i6d h SER 295 Cb 1.26 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.36 3i6d h SER 295 CO 0.12 0.00 -0.84 -0.33 -0.87 0.00 0.00 176.83 174.90 3i6d h GLU 296 N 0.00 0.58 -6.38 4.77 4.39 -1.93 -3.45 114.58 112.56 3i6d h GLU 296 Ca 0.16 -0.52 -0.57 0.00 0.34 0.00 0.00 59.36 58.77 3i6d h GLU 296 Cb 1.06 0.13 0.03 0.00 -0.10 0.00 0.00 28.75 29.87 3i6d h GLU 296 CO -0.00 1.15 1.11 -0.11 -1.16 0.00 0.00 179.01 179.99 3i6d n LEU 297 N -3.85 3.76 -0.16 1.33 7.94 -1.02 -4.89 117.00 120.11 3i6d n LEU 297 Ca -0.07 0.97 -0.02 0.00 -1.11 0.00 0.00 56.01 55.78 3i6d n LEU 297 Cb 0.78 -1.46 0.06 0.00 0.53 0.00 0.00 43.42 43.32 3i6d n LEU 297 CO 0.52 0.05 0.83 -0.65 -1.11 0.00 0.00 177.39 177.02 3i6d h PRO 298 N 9.10 0.09 0.00 1.96 0.11 -1.90 -1.69 132.00 139.67 3i6d h PRO 298 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3i6d h PRO 298 Cb 1.25 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3i6d h PRO 298 CO 0.94 0.06 0.00 0.00 -0.21 0.00 0.00 178.00 178.79 3i6d h ALA 299 N 1.45 1.00 0.00 -0.75 0.00 -1.94 -2.32 119.26 116.71 3i6d h ALA 299 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3i6d h ALA 299 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3i6d h ALA 299 CO -0.43 0.00 0.00 1.51 0.00 0.00 0.00 179.25 180.33 3i6d n ILE 300 N -2.90 1.36 0.14 0.00 0.13 -0.64 -1.83 119.36 115.62 3i6d n ILE 300 Ca -0.01 0.45 0.03 0.00 -1.10 0.00 0.00 62.75 62.12 3i6d n ILE 300 Cb 0.15 -1.38 0.42 0.00 -0.84 0.00 0.00 39.64 38.00 3i6d n ILE 300 CO 0.00 0.00 0.00 0.77 2.80 0.00 0.00 176.55 180.12 3i6d h SER 301 N 0.00 0.19 -0.87 9.51 4.64 -1.57 -1.46 113.55 123.99 3i6d h SER 301 Ca 0.00 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.29 3i6d h SER 301 Cb 0.12 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.12 3i6d h SER 301 CO 0.00 0.33 0.57 0.45 -0.87 0.00 0.00 176.83 177.30 3i6d h HIS 302 N 0.20 1.10 -0.30 4.77 3.86 -1.61 -1.73 115.15 121.43 3i6d h HIS 302 Ca 0.04 0.02 -0.18 0.00 -1.16 0.00 0.00 60.37 59.10 3i6d h HIS 302 Cb 0.32 -0.37 -0.00 0.00 1.06 0.00 0.00 27.41 28.42 3i6d h HIS 302 CO 0.00 0.70 -0.50 1.25 0.86 0.00 0.00 177.93 180.24 3i6d h LEU 303 N 1.18 0.93 -0.06 2.43 5.85 -1.45 -3.18 115.31 121.02 3i6d h LEU 303 Ca 0.32 -0.48 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3i6d h LEU 303 Cb -0.12 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.64 3i6d h LEU 303 CO -0.07 1.27 -0.11 2.29 -0.34 0.00 0.00 178.44 181.48 3i6d n LYS 304 N -4.01 0.24 0.00 1.25 2.85 -0.91 -3.11 118.16 114.46 3i6d n LYS 304 Ca -0.04 -0.06 0.12 0.00 -1.05 0.00 0.00 58.31 57.29 3i6d n LYS 304 Cb 0.60 -1.50 0.15 0.00 -0.65 0.00 0.00 35.03 33.64 3i6d n LYS 304 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3i6d n ASN 305 N -1.33 2.60 -4.73 -5.58 5.03 -0.69 -4.96 115.26 105.60 3i6d n ASN 305 Ca 0.10 -1.83 -0.31 0.00 0.87 0.00 0.00 54.58 53.41 3i6d n ASN 305 Cb 0.31 0.07 0.12 0.00 -1.02 0.00 0.00 39.78 39.26 3i6d n ASN 305 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 3i6d s MET 306 N -2.08 1.74 0.03 3.52 -1.94 -1.18 -5.06 119.30 114.34 3i6d s MET 306 Ca 0.28 1.13 0.08 0.00 -1.71 0.00 0.00 55.69 55.47 3i6d s MET 306 Cb 0.20 -1.84 -0.03 0.00 2.01 0.00 0.00 34.83 35.17 3i6d s MET 306 CO 0.35 -1.99 -0.24 -1.01 -0.01 0.00 0.00 175.02 172.12 3i6d s HIS 307 N -2.86 2.08 -0.26 -0.03 3.76 -1.26 -5.02 115.29 111.69 3i6d s HIS 307 Ca 0.63 -0.39 -0.00 0.00 -0.15 0.00 0.00 55.06 55.14 3i6d s HIS 307 Cb -0.18 -1.26 0.08 0.00 1.11 0.00 0.00 32.58 32.32 3i6d s HIS 307 CO 0.57 0.08 0.03 -1.12 -0.85 0.00 0.00 174.74 173.45 3i6d s SER 308 N -1.09 3.81 0.65 1.40 0.01 -1.26 -0.12 113.70 117.10 3i6d s SER 308 Ca 0.10 -1.37 -0.18 0.00 1.31 0.00 0.00 55.95 55.81 3i6d s SER 308 Cb -0.09 -0.98 -0.01 0.00 0.21 0.00 0.00 66.02 65.15 3i6d s SER 308 CO 0.01 -0.33 1.24 0.42 0.41 0.00 0.00 173.24 174.99 3i6d s THR 309 N 1.53 2.32 0.05 1.44 -4.23 -0.57 -4.22 115.64 111.96 3i6d s THR 309 Ca 0.03 0.19 -0.13 0.00 -1.18 0.00 0.00 61.69 60.60 3i6d s THR 309 Cb -0.18 -3.00 -0.06 0.00 1.34 0.00 0.00 72.50 70.61 3i6d s THR 309 CO -0.14 -0.05 0.42 -0.44 -0.54 0.00 0.00 174.62 173.87 3i6d s SER 310 N -1.62 6.75 0.07 3.99 0.01 -1.05 -2.63 113.70 119.21 3i6d s SER 310 Ca 0.79 0.92 -0.10 0.00 1.31 0.00 0.00 55.95 58.87 3i6d s SER 310 Cb -0.33 -2.23 0.00 0.00 0.21 0.00 0.00 66.02 63.68 3i6d s SER 310 CO 0.39 0.24 0.21 0.54 0.41 0.00 0.00 173.24 175.02 3i6d s VAL 311 N -1.25 0.12 0.02 3.43 0.11 -0.35 -4.38 120.40 118.10 3i6d s VAL 311 Ca 0.29 -1.01 0.07 0.00 -2.93 0.00 0.00 61.98 58.40 3i6d s VAL 311 Cb -0.15 -1.15 -0.02 0.00 -1.53 0.00 0.00 36.38 33.53 3i6d s VAL 311 CO 0.16 -0.56 -0.20 0.00 -3.33 0.00 0.00 175.10 171.17 3i6d s ALA 312 N -3.29 1.70 -0.12 1.54 0.00 -0.06 -1.28 121.76 120.25 3i6d s ALA 312 Ca 0.00 -0.96 0.03 0.00 0.00 0.00 0.00 51.96 51.04 3i6d s ALA 312 Cb 0.02 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.77 3i6d s ALA 312 CO -0.08 0.40 -0.22 1.21 0.00 0.00 0.00 175.76 177.07 3i6d s ASN 313 N -0.84 3.17 -0.22 0.00 3.84 -0.67 -1.28 114.94 118.95 3i6d s ASN 313 Ca 0.07 -0.56 -0.00 0.00 0.21 0.00 0.00 52.86 52.58 3i6d s ASN 313 Cb -0.08 -1.44 0.06 0.00 -0.55 0.00 0.00 41.25 39.23 3i6d s ASN 313 CO 0.01 0.12 -0.03 -0.69 -2.79 0.00 0.00 177.10 173.71 3i6d s VAL 314 N 0.58 1.27 0.24 -5.21 1.01 -0.52 -1.57 120.40 116.20 3i6d s VAL 314 Ca -0.13 -1.01 -0.13 0.00 0.00 0.00 0.00 61.98 60.71 3i6d s VAL 314 Cb -0.17 -1.58 -0.08 0.00 0.00 0.00 0.00 36.38 34.56 3i6d s VAL 314 CO 0.04 -0.10 0.62 0.00 0.00 0.00 0.00 175.10 175.66 3i6d s ALA 315 N 1.52 3.48 -0.01 5.51 0.00 -0.18 -1.76 121.76 130.32 3i6d s ALA 315 Ca -0.04 -0.10 -0.00 0.00 0.00 0.00 0.00 51.96 51.82 3i6d s ALA 315 Cb -0.18 -2.59 0.02 0.00 0.00 0.00 0.00 23.12 20.36 3i6d s ALA 315 CO -0.07 0.43 0.02 -0.51 0.00 0.00 0.00 175.76 175.63 3i6d s LEU 316 N -2.58 1.50 -0.17 0.00 1.43 -0.43 -2.49 118.68 115.94 3i6d s LEU 316 Ca 0.47 0.04 -0.02 0.00 -1.03 0.00 0.00 54.13 53.58 3i6d s LEU 316 Cb -0.12 -0.01 -0.01 0.00 0.03 0.00 0.00 46.19 46.08 3i6d s LEU 316 CO 0.20 -0.07 -0.09 -0.83 0.23 0.00 0.00 176.35 175.79 3i6d s GLY 317 N 0.55 1.58 -0.03 -3.19 0.00 0.51 -0.81 107.32 105.92 3i6d s GLY 317 Ca -0.05 -1.01 0.05 0.00 0.00 0.00 0.00 44.72 43.71 3i6d s GLY 317 CO -0.02 0.09 -0.18 -1.36 0.00 0.00 0.00 173.10 171.64 3i6d s PHE 318 N 0.84 1.69 0.11 1.90 0.08 0.12 0.86 117.98 123.58 3i6d s PHE 318 Ca -0.03 -0.43 -0.14 0.00 0.12 0.00 0.00 56.93 56.45 3i6d s PHE 318 Cb -0.15 -1.12 -0.07 0.00 -0.57 0.00 0.00 43.02 41.11 3i6d s PHE 318 CO 0.01 -0.12 1.45 -1.35 -0.10 0.00 0.00 175.22 175.11 3i6d h PRO 319 N 6.04 0.72 0.00 0.24 0.11 -1.87 0.29 132.00 137.54 3i6d h PRO 319 Ca -0.34 -0.35 0.00 0.00 0.11 0.00 0.00 66.00 65.41 3i6d h PRO 319 Cb 1.16 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3i6d h PRO 319 CO 0.48 0.97 0.00 -1.91 -0.21 0.00 0.00 178.00 177.33 3i6d n GLU 320 N -4.28 0.00 0.00 1.05 4.07 -1.26 -4.36 120.64 115.86 3i6d n GLU 320 Ca -0.03 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.08 3i6d n GLU 320 Cb 0.44 0.00 0.07 0.00 -0.06 0.00 0.00 31.44 31.89 3i6d n GLU 320 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3i6d n GLY 321 N 0.00 -0.09 0.31 8.31 0.00 -1.25 -2.95 105.19 109.51 3i6d n GLY 321 Ca 0.00 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 3i6d n GLY 321 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i6d h SER 322 N 0.00 -0.69 -6.24 1.61 4.64 -1.79 0.30 113.55 111.38 3i6d h SER 322 Ca 0.00 0.05 -0.10 0.00 -0.47 0.00 0.00 61.79 61.27 3i6d h SER 322 Cb 0.00 0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.31 3i6d h SER 322 CO 0.00 -0.42 -1.04 0.52 -0.87 0.00 0.00 176.83 175.02 3i6d n VAL 323 N -5.40 -3.95 -0.64 0.95 0.31 -1.15 -4.24 118.33 104.20 3i6d n VAL 323 Ca -0.10 0.56 -0.21 0.00 -0.01 0.00 0.00 64.34 64.57 3i6d n VAL 323 Cb 0.30 -3.74 0.01 0.00 -0.91 0.00 0.00 33.84 29.50 3i6d n VAL 323 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i6d n GLN 324 N 0.79 0.00 -0.24 5.55 3.00 -1.26 -3.71 117.38 121.51 3i6d n GLN 324 Ca -0.02 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.93 3i6d n GLN 324 Cb 0.49 -0.55 0.03 0.00 0.00 0.00 0.00 30.24 30.21 3i6d n GLN 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3i6d n MET 325 N 0.99 -0.24 0.00 -1.09 0.00 -1.26 -4.58 117.12 110.93 3i6d n MET 325 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 57.70 57.46 3i6d n MET 325 Cb 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 33.22 33.31 3i6d n MET 325 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 3i6d n GLU 326 N -1.40 0.00 -1.41 3.17 0.28 -1.26 -4.71 120.64 115.30 3i6d n GLU 326 Ca 0.02 0.73 -0.23 0.00 -0.16 0.00 0.00 57.16 57.51 3i6d n GLU 326 Cb 0.07 -1.49 0.17 0.00 1.43 0.00 0.00 31.44 31.62 3i6d n GLU 326 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 3i6d n HIS 327 N -2.44 -3.96 -3.27 -1.84 8.25 -1.26 -5.09 115.22 105.60 3i6d n HIS 327 Ca 0.00 -0.91 -0.06 0.00 -0.26 0.00 0.00 57.72 56.49 3i6d n HIS 327 Cb 0.00 -0.83 -0.05 0.00 1.12 0.00 0.00 29.99 30.23 3i6d n HIS 327 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 3i6d s GLU 328 N -5.26 0.44 0.05 -0.41 2.12 -1.26 -5.00 118.70 109.37 3i6d s GLU 328 Ca 0.59 0.38 -0.00 0.00 0.36 0.00 0.00 54.97 56.31 3i6d s GLU 328 Cb -0.02 -0.17 0.00 0.00 0.26 0.00 0.00 34.13 34.20 3i6d s GLU 328 CO 0.42 -0.90 0.07 0.41 -0.54 0.00 0.00 175.26 174.72 3i6d n GLY 329 N 5.37 3.12 0.19 -1.50 0.00 -1.26 -4.75 105.19 106.37 3i6d n GLY 329 Ca 0.00 -1.45 -0.10 0.00 0.00 0.00 0.00 46.02 44.47 3i6d n GLY 329 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3i6d h THR 330 N 1.15 0.61 -0.11 2.61 2.02 -0.85 -3.44 112.91 114.89 3i6d h THR 330 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3i6d h THR 330 Cb 0.17 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 3i6d h THR 330 CO 0.05 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.55 3i6d n GLY 331 N -1.29 0.99 3.53 2.16 0.00 -1.25 0.49 105.19 109.82 3i6d n GLY 331 Ca -0.03 -0.59 -0.09 0.00 0.00 0.00 0.00 46.02 45.31 3i6d n GLY 331 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3i6d s PHE 332 N -2.06 -0.36 0.17 1.61 -0.12 -0.02 -1.90 117.98 115.31 3i6d s PHE 332 Ca 0.00 0.18 0.10 0.00 -0.05 0.00 0.00 56.93 57.16 3i6d s PHE 332 Cb 0.00 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.91 3i6d s PHE 332 CO 0.00 -0.68 -0.22 0.14 -0.05 0.00 0.00 175.22 174.40 3i6d s VAL 333 N -3.33 2.15 -0.19 -2.49 -7.23 -0.89 -1.05 120.40 107.37 3i6d s VAL 333 Ca 0.05 -1.94 -0.09 0.00 -1.81 0.00 0.00 61.98 58.19 3i6d s VAL 333 Cb -0.01 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 34.89 3i6d s VAL 333 CO -0.08 -0.15 0.09 -0.63 -0.31 0.00 0.00 175.10 174.02 3i6d s ILE 334 N -1.69 5.06 0.72 -0.62 1.09 -0.40 -0.92 121.20 124.44 3i6d s ILE 334 Ca 0.18 0.06 -0.14 0.00 -1.10 0.00 0.00 60.65 59.65 3i6d s ILE 334 Cb -0.08 -3.29 0.03 0.00 -1.06 0.00 0.00 42.46 38.07 3i6d s ILE 334 CO 0.08 0.45 1.15 -0.55 -0.10 0.00 0.00 174.94 175.98 3i6d s SER 335 N 0.35 4.49 0.00 3.58 0.15 -0.36 -4.81 113.70 117.10 3i6d s SER 335 Ca 0.05 2.14 0.00 0.00 0.70 0.00 0.00 55.95 58.84 3i6d s SER 335 Cb -0.12 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 3i6d s SER 335 CO -0.01 -2.05 0.73 0.54 1.20 0.00 0.00 173.24 173.65 3i6d n ARG 336 N -2.80 0.00 -1.68 5.44 5.12 -1.25 -3.64 116.66 117.86 3i6d n ARG 336 Ca 0.12 0.54 -0.16 0.00 -1.93 0.00 0.00 57.85 56.41 3i6d n ARG 336 Cb 0.51 -1.23 -0.07 0.00 -1.16 0.00 0.00 32.46 30.51 3i6d n ARG 336 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3i6d s ASN 337 N -2.61 4.14 0.00 0.55 4.22 -1.26 -3.83 114.94 116.15 3i6d s ASN 337 Ca 0.00 -0.15 0.00 0.00 -2.14 0.00 0.00 52.86 50.57 3i6d s ASN 337 Cb 0.00 -2.55 0.00 0.00 1.28 0.00 0.00 41.25 39.98 3i6d s ASN 337 CO 0.00 -3.67 0.00 -0.24 -2.04 0.00 0.00 177.10 171.15 3i6d n SER 338 N 17.70 0.00 -4.24 3.54 2.88 -1.24 -4.46 113.62 127.80 3i6d n SER 338 Ca 0.45 -0.22 -0.36 0.00 -1.33 0.00 0.00 58.87 57.40 3i6d n SER 338 Cb 0.44 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.84 3i6d n SER 338 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3i6d n ASP 339 N 0.00 -0.73 -4.62 -3.46 8.00 -1.25 -4.96 116.55 109.53 3i6d n ASP 339 Ca 0.00 -1.29 -0.26 0.00 0.71 0.00 0.00 54.79 53.95 3i6d n ASP 339 Cb 0.06 -1.61 -0.08 0.00 -0.02 0.00 0.00 41.12 39.46 3i6d n ASP 339 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3i6d s PHE 340 N -4.10 2.73 -0.19 1.24 0.40 -1.26 -5.06 117.98 111.74 3i6d s PHE 340 Ca 0.17 -0.19 -0.18 0.00 -0.60 0.00 0.00 56.93 56.13 3i6d s PHE 340 Cb -0.09 -1.30 -0.21 0.00 0.51 0.00 0.00 43.02 41.93 3i6d s PHE 340 CO 0.99 0.54 0.26 0.00 0.70 0.00 0.00 175.22 177.71 3i6d h ALA 341 N 2.58 0.30 -2.53 5.36 0.00 -1.92 -3.47 119.26 119.59 3i6d h ALA 341 Ca -0.46 -1.25 -0.51 0.00 0.00 0.00 0.00 54.91 52.68 3i6d h ALA 341 Cb 1.21 0.73 0.10 0.00 0.00 0.00 0.00 17.79 19.83 3i6d h ALA 341 CO 0.57 0.85 0.39 0.96 0.00 0.00 0.00 179.25 182.03 3i6d s ILE 342 N -2.41 3.12 -0.25 0.00 -4.36 -1.26 -4.31 121.20 111.72 3i6d s ILE 342 Ca -0.27 0.57 0.03 0.00 -0.26 0.00 0.00 60.65 60.73 3i6d s ILE 342 Cb 0.06 -3.12 -0.17 0.00 1.25 0.00 0.00 42.46 40.47 3i6d s ILE 342 CO 0.64 -0.27 -0.20 0.41 0.24 0.00 0.00 174.94 175.76 3i6d n THR 343 N -2.11 1.46 -3.95 8.37 -1.04 0.20 -4.80 114.28 112.42 3i6d n THR 343 Ca 0.11 -0.59 -0.09 0.00 -2.04 0.00 0.00 64.05 61.44 3i6d n THR 343 Cb 0.51 -1.33 -0.03 0.00 -1.82 0.00 0.00 70.33 67.67 3i6d n THR 343 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i6d s ALA 344 N -2.51 -0.41 -0.25 2.41 0.00 -1.23 -1.28 121.76 118.48 3i6d s ALA 344 Ca -0.32 -0.82 -0.11 0.00 0.00 0.00 0.00 51.96 50.71 3i6d s ALA 344 Cb 0.09 0.96 0.09 0.00 0.00 0.00 0.00 23.12 24.26 3i6d s ALA 344 CO 0.61 -0.91 0.58 0.00 0.00 0.00 0.00 175.76 176.04 3i6d s THR 346 N 2.14 1.85 -0.85 0.00 -1.32 0.69 -0.84 115.64 117.31 3i6d s THR 346 Ca -0.07 -1.28 -0.19 0.00 -1.21 0.00 0.00 61.69 58.94 3i6d s THR 346 Cb -0.09 -1.59 0.12 0.00 -1.51 0.00 0.00 72.50 69.43 3i6d s THR 346 CO -0.17 0.26 1.05 0.86 -2.21 0.00 0.00 174.62 174.42 3i6d s TRP 347 N -0.80 3.04 0.23 9.09 -0.11 0.18 -1.35 118.94 129.22 3i6d s TRP 347 Ca 0.09 -1.21 -0.06 0.00 1.22 0.00 0.00 56.10 56.13 3i6d s TRP 347 Cb -0.09 -4.25 0.41 0.00 -1.50 0.00 0.00 33.47 28.04 3i6d s TRP 347 CO 0.02 -1.49 1.69 1.15 -4.62 0.00 0.00 176.95 173.70 3i6d h THR 348 N 5.84 0.55 -0.18 5.86 2.02 -1.45 -2.54 112.91 123.00 3i6d h THR 348 Ca 0.04 -0.09 0.05 0.00 0.77 0.00 0.00 66.41 67.17 3i6d h THR 348 Cb 1.04 0.26 -0.07 0.00 -1.74 0.00 0.00 68.15 67.63 3i6d h THR 348 CO 1.11 0.05 -0.38 0.78 0.37 0.00 0.00 175.52 177.45 3i6d h ASN 349 N 0.27 -1.21 -0.61 4.18 -0.26 -1.71 0.96 115.58 117.20 3i6d h ASN 349 Ca 0.39 0.17 0.10 0.00 -0.56 0.00 0.00 56.30 56.40 3i6d h ASN 349 Cb 0.64 0.51 -0.08 0.00 -1.06 0.00 0.00 38.32 38.33 3i6d h ASN 349 CO -0.48 -0.39 0.19 0.11 -1.06 0.00 0.00 177.43 175.80 3i6d h LYS 350 N -0.43 0.34 0.02 0.81 1.79 -1.81 -0.19 116.57 117.10 3i6d h LYS 350 Ca 0.10 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.54 3i6d h LYS 350 Cb 0.59 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 3i6d h LYS 350 CO -0.41 0.22 -0.01 0.87 -1.08 0.00 0.00 179.45 179.04 3i6d h LYS 351 N 0.35 -0.03 -3.10 3.15 1.57 -1.28 -3.38 116.57 113.85 3i6d h LYS 351 Ca 0.32 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.48 3i6d h LYS 351 Cb 0.43 0.01 -0.41 0.00 0.08 0.00 0.00 32.23 32.34 3i6d h LYS 351 CO -0.35 0.70 -0.67 -1.58 -0.57 0.00 0.00 179.45 176.98 3i6d s TRP 352 N -2.59 2.77 0.36 -1.35 0.52 0.33 -0.84 118.94 118.15 3i6d s TRP 352 Ca -0.15 -2.94 0.04 0.00 0.02 0.00 0.00 56.10 53.07 3i6d s TRP 352 Cb -0.02 -2.37 0.71 0.00 -1.15 0.00 0.00 33.47 30.65 3i6d s TRP 352 CO 0.57 -0.71 2.00 -1.00 0.02 0.00 0.00 176.95 177.84 3i6d h PRO 353 N 6.19 0.75 0.00 4.98 0.13 -1.18 -1.50 132.00 141.37 3i6d h PRO 353 Ca 0.03 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 3i6d h PRO 353 Cb 0.86 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.82 3i6d h PRO 353 CO 0.61 0.50 0.00 -2.39 -0.23 0.00 0.00 178.00 176.49 3i6d n HIS 354 N -4.46 0.00 -0.06 1.56 1.44 -1.26 -2.40 115.22 110.04 3i6d n HIS 354 Ca 0.07 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.67 3i6d n HIS 354 Cb 0.11 -0.22 -0.11 0.00 0.12 0.00 0.00 29.99 29.89 3i6d n HIS 354 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3i6d h ALA 355 N 2.07 -0.01 -3.19 1.59 0.00 -1.57 -3.45 119.26 114.70 3i6d h ALA 355 Ca 0.00 -0.40 -0.65 0.00 0.00 0.00 0.00 54.91 53.86 3i6d h ALA 355 Cb 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.70 3i6d h ALA 355 CO 0.00 -0.03 -0.60 0.00 0.00 0.00 0.00 179.25 178.62 3i6d s ALA 356 N -2.45 3.49 0.18 0.00 0.00 -1.01 -1.30 121.76 120.67 3i6d s ALA 356 Ca -0.16 -0.93 -0.30 0.00 0.00 0.00 0.00 51.96 50.57 3i6d s ALA 356 Cb -0.02 -1.47 -0.09 0.00 0.00 0.00 0.00 23.12 21.54 3i6d s ALA 356 CO 0.57 0.69 1.31 -2.14 0.00 0.00 0.00 175.76 176.20 3i6d s PRO 357 N -1.85 4.38 0.17 0.00 0.02 -1.26 -4.91 135.00 131.55 3i6d s PRO 357 Ca 0.23 2.04 -0.31 0.00 0.02 0.00 0.00 61.00 62.99 3i6d s PRO 357 Cb -0.12 -3.21 -0.17 0.00 0.02 0.00 0.00 34.50 31.03 3i6d s PRO 357 CO 0.15 -0.27 0.81 0.39 -0.33 0.00 0.00 177.00 177.75 3i6d n GLU 358 N 2.82 0.38 0.00 5.54 4.71 -1.26 -0.95 120.64 131.88 3i6d n GLU 358 Ca 0.07 0.14 0.00 0.00 -0.01 0.00 0.00 57.16 57.35 3i6d n GLU 358 Cb 0.43 -1.37 0.00 0.00 -1.01 0.00 0.00 31.44 29.49 3i6d n GLU 358 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3i6d n GLY 359 N 1.80 1.24 3.58 0.62 0.00 -1.26 -5.03 105.19 106.14 3i6d n GLY 359 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 3i6d n GLY 359 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i6d s LYS 360 N -0.64 2.53 -0.23 1.61 -0.14 -0.13 -4.48 119.74 118.27 3i6d s LYS 360 Ca 0.00 -0.72 -0.03 0.00 -1.36 0.00 0.00 55.97 53.85 3i6d s LYS 360 Cb 0.00 -2.48 -0.00 0.00 -1.68 0.00 0.00 37.83 33.67 3i6d s LYS 360 CO 0.00 0.60 -0.05 0.99 -0.76 0.00 0.00 175.35 176.14 3i6d s THR 361 N -0.96 3.24 -0.34 2.17 2.01 0.10 -4.72 115.64 117.14 3i6d s THR 361 Ca 0.16 -0.62 -0.09 0.00 0.31 0.00 0.00 61.69 61.46 3i6d s THR 361 Cb -0.11 -2.51 0.02 0.00 0.01 0.00 0.00 72.50 69.91 3i6d s THR 361 CO 0.06 0.38 0.15 -0.22 -0.69 0.00 0.00 174.62 174.31 3i6d s LEU 362 N 1.44 4.38 0.30 4.42 2.96 -1.26 -0.70 118.68 130.22 3i6d s LEU 362 Ca 0.05 -0.89 0.06 0.00 -0.22 0.00 0.00 54.13 53.13 3i6d s LEU 362 Cb -0.15 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 3i6d s LEU 362 CO -0.04 -0.31 0.38 -0.76 -1.32 0.00 0.00 176.35 174.31 3i6d s LEU 363 N 1.52 4.01 -0.05 -0.68 1.43 0.01 -1.23 118.68 123.69 3i6d s LEU 363 Ca 0.02 -0.16 -0.02 0.00 -1.03 0.00 0.00 54.13 52.94 3i6d s LEU 363 Cb -0.19 -2.67 0.04 0.00 0.03 0.00 0.00 46.19 43.40 3i6d s LEU 363 CO 0.05 -0.27 0.10 -0.60 0.23 0.00 0.00 176.35 175.86 3i6d s ARG 364 N -4.05 -0.01 -0.02 1.70 3.52 -0.46 -1.31 118.95 118.31 3i6d s ARG 364 Ca 0.40 0.40 0.06 0.00 -0.13 0.00 0.00 55.73 56.45 3i6d s ARG 364 Cb -0.09 -0.34 -0.01 0.00 -1.56 0.00 0.00 34.95 32.95 3i6d s ARG 364 CO 0.29 -0.27 -0.20 0.00 -0.81 0.00 0.00 175.30 174.31 3i6d s ALA 365 N 1.84 1.69 -0.01 6.12 0.00 -0.72 -0.22 121.76 130.46 3i6d s ALA 365 Ca -0.00 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.10 3i6d s ALA 365 Cb -0.12 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 3i6d s ALA 365 CO -0.04 0.39 0.04 0.71 0.00 0.00 0.00 175.76 176.86 3i6d s TYR 366 N -0.37 3.18 0.05 0.00 2.02 -0.83 -1.43 117.35 119.96 3i6d s TYR 366 Ca 0.05 0.15 -0.00 0.00 -0.37 0.00 0.00 57.07 56.90 3i6d s TYR 366 Cb -0.09 -1.71 -0.03 0.00 -0.40 0.00 0.00 41.96 39.73 3i6d s TYR 366 CO -0.00 0.50 -0.04 0.08 -1.57 0.00 0.00 175.55 174.53 3i6d s VAL 367 N -1.12 0.26 0.00 0.71 1.01 -0.40 0.63 120.40 121.49 3i6d s VAL 367 Ca 0.20 -1.52 0.00 0.00 0.00 0.00 0.00 61.98 60.67 3i6d s VAL 367 Cb -0.12 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.14 3i6d s VAL 367 CO 0.11 -0.80 0.00 0.61 0.00 0.00 0.00 175.10 175.02 3i6d n GLY 368 N 0.61 -0.57 3.16 4.51 0.00 -1.26 -0.88 105.19 110.75 3i6d n GLY 368 Ca -0.17 -1.24 -0.08 0.00 0.00 0.00 0.00 46.02 44.53 3i6d n GLY 368 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i6d s LYS 369 N -4.78 0.75 0.12 1.61 -2.85 -1.17 -4.80 119.74 108.62 3i6d s LYS 369 Ca 0.00 -1.05 -0.35 0.00 -1.00 0.00 0.00 55.97 53.57 3i6d s LYS 369 Cb 0.00 0.29 -0.16 0.00 -2.06 0.00 0.00 37.83 35.90 3i6d s LYS 369 CO 0.00 -0.20 1.32 0.00 0.10 0.00 0.00 175.35 176.56 3i6d n ALA 370 N 0.03 -0.68 0.00 0.59 0.00 -1.26 -2.94 120.51 116.25 3i6d n ALA 370 Ca -0.15 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.79 3i6d n ALA 370 Cb 0.62 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.98 3i6d n ALA 370 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i6d n GLY 371 N 2.46 0.92 3.44 0.00 0.00 -1.26 -4.85 105.19 105.89 3i6d n GLY 371 Ca 0.17 -0.68 -0.44 0.00 0.00 0.00 0.00 46.02 45.07 3i6d n GLY 371 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i6d s ASP 372 N -4.00 6.57 -0.10 1.61 -1.08 -1.15 -4.76 116.67 113.76 3i6d s ASP 372 Ca 0.00 -1.97 0.15 0.00 -0.52 0.00 0.00 52.55 50.21 3i6d s ASP 372 Cb 0.00 -2.38 0.23 0.00 -1.46 0.00 0.00 42.92 39.31 3i6d s ASP 372 CO 0.00 -1.06 1.11 -1.84 0.52 0.00 0.00 175.17 173.90 3i6d n GLU 373 N 6.42 1.31 0.28 4.34 0.28 -1.23 -3.02 120.64 129.02 3i6d n GLU 373 Ca 0.19 -2.29 0.18 0.00 -0.16 0.00 0.00 57.16 55.08 3i6d n GLU 373 Cb 0.48 -1.34 0.74 0.00 1.43 0.00 0.00 31.44 32.76 3i6d n GLU 373 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3i6d h SER 374 N 0.00 0.00 -0.23 -1.84 4.64 -1.92 -3.04 113.55 111.17 3i6d h SER 374 Ca 0.00 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.39 3i6d h SER 374 Cb 0.99 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.07 3i6d h SER 374 CO 0.00 0.01 0.26 0.40 -0.87 0.00 0.00 176.83 176.64 3i6d h ILE 375 N 0.00 0.41 0.00 0.95 2.04 -1.99 -1.79 117.51 117.13 3i6d h ILE 375 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3i6d h ILE 375 Cb 0.46 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 3i6d h ILE 375 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 178.15 178.67 3i6d n VAL 376 N -3.72 0.95 0.04 1.67 0.31 -1.15 -3.28 118.33 113.15 3i6d n VAL 376 Ca 0.03 0.28 -0.21 0.00 -0.01 0.00 0.00 64.34 64.43 3i6d n VAL 376 Cb 0.40 -1.16 -0.14 0.00 -0.91 0.00 0.00 33.84 32.02 3i6d n VAL 376 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3i6d h ASP 377 N 0.00 0.48 -2.52 4.52 3.32 -1.58 -3.48 116.42 117.16 3i6d h ASP 377 Ca 0.00 -0.88 -0.57 0.00 0.02 0.00 0.00 57.03 55.60 3i6d h ASP 377 Cb 0.29 -0.16 0.20 0.00 0.22 0.00 0.00 39.33 39.88 3i6d h ASP 377 CO 0.00 1.77 -1.05 0.18 -1.72 0.00 0.00 179.24 178.42 3i6d n LEU 378 N -3.51 -2.51 -4.79 1.55 4.77 -1.20 -4.92 117.00 106.38 3i6d n LEU 378 Ca -0.27 0.48 -0.31 0.00 -0.03 0.00 0.00 56.01 55.87 3i6d n LEU 378 Cb 1.06 -0.98 0.07 0.00 -2.33 0.00 0.00 43.42 41.24 3i6d n LEU 378 CO 0.47 -4.47 0.71 -0.94 -1.33 0.00 0.00 177.39 171.82 3i6d s SER 379 N -1.24 5.00 0.33 -1.43 1.04 -1.26 -4.69 113.70 111.45 3i6d s SER 379 Ca 0.55 1.73 0.11 0.00 0.48 0.00 0.00 55.95 58.82 3i6d s SER 379 Cb -0.34 -2.51 1.03 0.00 0.10 0.00 0.00 66.02 64.30 3i6d s SER 379 CO 0.68 -1.70 1.61 0.44 0.98 0.00 0.00 173.24 175.24 3i6d h ASP 380 N -0.85 0.10 0.23 7.02 5.19 -1.98 0.23 116.42 126.36 3i6d h ASP 380 Ca -0.44 0.24 -0.01 0.00 -0.62 0.00 0.00 57.03 56.21 3i6d h ASP 380 Cb 1.22 0.30 -0.01 0.00 0.18 0.00 0.00 39.33 41.01 3i6d h ASP 380 CO 0.54 -0.30 -0.26 0.78 -3.12 0.00 0.00 179.24 176.88 3i6d h ASN 381 N 0.11 -0.72 -0.83 6.45 2.35 -1.98 0.53 115.58 121.49 3i6d h ASN 381 Ca 0.71 0.06 0.19 0.00 -0.55 0.00 0.00 56.30 56.70 3i6d h ASN 381 Cb 1.66 0.24 -0.11 0.00 0.05 0.00 0.00 38.32 40.16 3i6d h ASN 381 CO -0.75 -0.33 0.32 0.44 -1.65 0.00 0.00 177.43 175.45 3i6d h ASP 382 N -0.49 0.24 0.55 5.81 3.45 -0.98 0.17 116.42 125.16 3i6d h ASP 382 Ca -0.03 0.14 -0.03 0.00 0.43 0.00 0.00 57.03 57.55 3i6d h ASP 382 Cb 0.44 0.14 0.01 0.00 -0.56 0.00 0.00 39.33 39.35 3i6d h ASP 382 CO -0.05 0.02 -0.26 0.40 -1.57 0.00 0.00 179.24 177.78 3i6d h ILE 383 N 0.39 0.00 -0.12 0.35 2.04 -0.61 0.47 117.51 120.02 3i6d h ILE 383 Ca 0.49 -0.25 0.04 0.00 1.00 0.00 0.00 64.86 66.14 3i6d h ILE 383 Cb 0.86 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 3i6d h ILE 383 CO -0.49 0.00 0.30 0.40 0.00 0.00 0.00 178.15 178.35 3i6d h ILE 384 N -0.99 0.17 0.00 -0.67 2.04 0.35 0.14 117.51 118.55 3i6d h ILE 384 Ca -0.08 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 3i6d h ILE 384 Cb 0.57 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 3i6d h ILE 384 CO 0.12 0.00 -0.00 0.78 0.00 0.00 0.00 178.15 179.05 3i6d h ASN 385 N 0.00 -0.00 -0.84 1.72 2.35 -0.54 -3.13 115.58 115.14 3i6d h ASN 385 Ca 0.06 -0.92 0.03 0.00 -0.55 0.00 0.00 56.30 54.92 3i6d h ASN 385 Cb 0.65 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.97 3i6d h ASN 385 CO -0.00 0.96 0.55 0.40 -1.65 0.00 0.00 177.43 177.69 3i6d h ILE 386 N -1.00 1.15 0.30 2.81 2.04 0.93 0.10 117.51 123.84 3i6d h ILE 386 Ca -0.00 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 3i6d h ILE 386 Cb 0.92 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3i6d h ILE 386 CO 0.00 0.19 -0.15 0.58 0.00 0.00 0.00 178.15 178.78 3i6d h VAL 387 N 1.05 0.72 -0.47 1.67 2.07 -0.93 -2.26 116.25 118.11 3i6d h VAL 387 Ca 0.33 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.64 3i6d h VAL 387 Cb 0.02 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3i6d h VAL 387 CO -0.10 0.03 -0.01 -0.07 0.02 0.00 0.00 177.57 177.44 3i6d h LEU 388 N -0.48 0.74 -0.73 2.57 3.38 -1.43 0.93 115.31 120.29 3i6d h LEU 388 Ca -0.04 -0.18 0.10 0.00 0.09 0.00 0.00 57.88 57.85 3i6d h LEU 388 Cb 0.36 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 3i6d h LEU 388 CO 0.07 0.82 0.36 -0.08 0.09 0.00 0.00 178.44 179.70 3i6d h GLU 389 N 0.72 0.59 0.15 1.13 4.22 -0.67 0.18 114.58 120.91 3i6d h GLU 389 Ca 0.14 -0.04 -0.29 0.00 0.08 0.00 0.00 59.36 59.25 3i6d h GLU 389 Cb 0.46 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.58 3i6d h GLU 389 CO 0.02 0.39 -1.44 -0.44 -2.18 0.00 0.00 179.01 175.36 3i6d h ASP 390 N 0.61 0.51 -0.93 1.04 5.19 -1.03 -3.35 116.42 118.46 3i6d h ASP 390 Ca 0.36 -0.90 0.09 0.00 -0.62 0.00 0.00 57.03 55.96 3i6d h ASP 390 Cb 0.40 -0.17 -0.07 0.00 0.18 0.00 0.00 39.33 39.67 3i6d h ASP 390 CO -0.28 1.65 0.57 0.25 -3.12 0.00 0.00 179.24 178.32 3i6d h LEU 391 N -0.15 0.87 -2.20 1.55 5.85 0.12 -1.01 115.31 120.34 3i6d h LEU 391 Ca -0.29 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 3i6d h LEU 391 Cb 1.89 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.77 3i6d h LEU 391 CO 0.13 0.51 -0.04 0.11 -0.34 0.00 0.00 178.44 178.81 3i6d h LYS 392 N 0.98 0.00 0.00 1.25 1.57 -0.78 -2.80 116.57 116.78 3i6d h LYS 392 Ca 0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 3i6d h LYS 392 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3i6d h LYS 392 CO -0.22 0.04 0.00 1.63 -0.57 0.00 0.00 179.45 180.33 3i6d n LYS 393 N -3.32 0.22 -1.07 3.15 5.02 -0.38 -3.05 118.16 118.74 3i6d n LYS 393 Ca -0.02 0.14 0.02 0.00 -2.02 0.00 0.00 58.31 56.43 3i6d n LYS 393 Cb 0.19 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.71 3i6d n LYS 393 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 3i6d n VAL 394 N -1.25 0.00 0.00 -0.18 0.24 -1.06 -5.09 118.33 110.99 3i6d n VAL 394 Ca 0.07 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 3i6d n VAL 394 Cb 0.10 0.75 0.00 0.00 -1.47 0.00 0.00 33.84 33.22 3i6d n VAL 394 CO 0.00 0.00 0.00 1.15 -2.14 0.00 0.00 176.83 175.84 3i6d n MET 395 N 0.27 0.00 -3.60 7.34 0.00 -1.17 -4.56 117.12 115.40 3i6d n MET 395 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 57.70 57.35 3i6d n MET 395 Cb 0.94 0.00 -0.09 0.00 0.00 0.00 0.00 33.22 34.07 3i6d n MET 395 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 3i6d s ASN 396 N 0.00 6.23 -0.87 3.17 -0.87 -1.24 -4.36 114.94 117.00 3i6d s ASN 396 Ca 0.00 0.25 -0.01 0.00 -1.57 0.00 0.00 52.86 51.53 3i6d s ASN 396 Cb 0.00 -2.14 0.21 0.00 -0.02 0.00 0.00 41.25 39.31 3i6d s ASN 396 CO 0.00 0.05 0.75 -0.63 -2.57 0.00 0.00 177.10 174.71 3i6d s ILE 397 N 0.96 4.21 -0.28 0.60 1.01 -1.26 -3.99 121.20 122.45 3i6d s ILE 397 Ca 0.11 -3.91 -0.29 0.00 0.00 0.00 0.00 60.65 56.56 3i6d s ILE 397 Cb -0.13 -3.62 -0.01 0.00 0.01 0.00 0.00 42.46 38.70 3i6d s ILE 397 CO 0.04 -1.08 1.53 0.20 0.00 0.00 0.00 174.94 175.63 3i6d s ASN 398 N -0.27 6.38 0.00 3.58 -0.87 0.11 -4.75 114.94 119.11 3i6d s ASN 398 Ca 0.27 1.36 0.00 0.00 -1.57 0.00 0.00 52.86 52.93 3i6d s ASN 398 Cb -0.07 -2.53 0.00 0.00 -0.02 0.00 0.00 41.25 38.63 3i6d s ASN 398 CO -0.13 -1.30 0.00 0.61 -2.57 0.00 0.00 177.10 173.72 3i6d n GLY 399 N 4.73 -1.52 3.30 0.66 0.00 -1.26 -3.86 105.19 107.24 3i6d n GLY 399 Ca 0.18 -2.06 -0.18 0.00 0.00 0.00 0.00 46.02 43.96 3i6d n GLY 399 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i6d s GLU 400 N 0.00 1.20 0.11 1.61 0.41 -1.26 -5.08 118.70 115.69 3i6d s GLU 400 Ca 0.00 -1.45 -0.31 0.00 -0.41 0.00 0.00 54.97 52.80 3i6d s GLU 400 Cb 0.00 -1.02 -0.09 0.00 -1.78 0.00 0.00 34.13 31.24 3i6d s GLU 400 CO 0.00 0.18 1.70 -2.14 -0.49 0.00 0.00 175.26 174.51 3i6d s PRO 401 N -3.30 4.18 0.03 0.39 0.02 -1.26 -4.84 135.00 130.21 3i6d s PRO 401 Ca 0.17 2.44 -0.21 0.00 0.02 0.00 0.00 61.00 63.42 3i6d s PRO 401 Cb -0.02 -3.49 -0.15 0.00 0.02 0.00 0.00 34.50 30.85 3i6d s PRO 401 CO 0.05 -0.75 1.31 1.05 -0.33 0.00 0.00 177.00 178.33 3i6d h GLU 402 N 8.07 0.34 -6.06 5.54 4.11 0.08 -3.44 114.58 123.23 3i6d h GLU 402 Ca -0.44 -0.19 -0.68 0.00 0.07 0.00 0.00 59.36 58.11 3i6d h GLU 402 Cb 1.21 0.01 -0.27 0.00 0.50 0.00 0.00 28.75 30.20 3i6d h GLU 402 CO 0.93 0.76 -0.81 1.41 0.07 0.00 0.00 179.01 181.37 3i6d s MET 403 N -4.19 2.66 -0.04 1.06 0.00 -1.16 -4.97 119.30 112.66 3i6d s MET 403 Ca -0.14 -0.77 -0.01 0.00 0.00 0.00 0.00 55.69 54.76 3i6d s MET 403 Cb 0.05 -2.34 0.03 0.00 0.00 0.00 0.00 34.83 32.57 3i6d s MET 403 CO 0.75 0.46 0.03 0.99 0.00 0.00 0.00 175.02 177.26 3i6d s THR 404 N -0.34 0.07 -0.24 10.11 2.01 -1.26 -0.36 115.64 125.63 3i6d s THR 404 Ca 0.02 0.27 -0.02 0.00 0.31 0.00 0.00 61.69 62.28 3i6d s THR 404 Cb -0.13 -0.26 0.07 0.00 0.01 0.00 0.00 72.50 72.20 3i6d s THR 404 CO 0.02 0.18 0.05 0.00 -0.69 0.00 0.00 174.62 174.19 3i6d s VAL 406 N 1.77 4.55 -0.30 0.00 1.01 -1.26 -1.01 120.40 125.16 3i6d s VAL 406 Ca 0.03 -0.36 -0.14 0.00 0.00 0.00 0.00 61.98 61.51 3i6d s VAL 406 Cb -0.17 -3.68 0.15 0.00 0.00 0.00 0.00 36.38 32.68 3i6d s VAL 406 CO -0.15 -0.51 0.89 0.28 0.00 0.00 0.00 175.10 175.62 3i6d s THR 407 N -2.51 -0.56 0.16 3.92 -1.32 -0.61 -4.97 115.64 109.75 3i6d s THR 407 Ca 0.45 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 60.92 3i6d s THR 407 Cb -0.10 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.85 3i6d s THR 407 CO 0.39 0.00 0.35 -0.13 -2.21 0.00 0.00 174.62 173.02 3i6d s ARG 408 N 2.43 3.53 -0.38 7.08 3.00 -1.26 -1.67 118.95 131.68 3i6d s ARG 408 Ca -0.04 -0.30 0.01 0.00 0.00 0.00 0.00 55.73 55.40 3i6d s ARG 408 Cb -0.07 -2.88 0.14 0.00 0.00 0.00 0.00 34.95 32.14 3i6d s ARG 408 CO -0.18 0.46 0.23 -1.58 0.00 0.00 0.00 175.30 174.23 3i6d s TRP 409 N -1.74 1.12 0.08 -0.53 0.52 -0.40 -5.00 118.94 112.98 3i6d s TRP 409 Ca 0.38 -1.91 -0.32 0.00 0.02 0.00 0.00 56.10 54.27 3i6d s TRP 409 Cb -0.12 -1.19 -0.17 0.00 -1.15 0.00 0.00 33.47 30.85 3i6d s TRP 409 CO 0.28 -0.81 1.62 0.45 0.02 0.00 0.00 176.95 178.50 3i6d h HIS 410 N 6.81 -0.91 -2.02 -1.98 3.86 -1.89 -0.92 115.15 118.09 3i6d h HIS 410 Ca 0.06 -0.01 -0.56 0.00 -1.16 0.00 0.00 60.37 58.70 3i6d h HIS 410 Cb 0.95 0.33 -0.39 0.00 1.06 0.00 0.00 27.41 29.36 3i6d h HIS 410 CO 0.44 -0.52 -1.07 0.39 0.86 0.00 0.00 177.93 178.02 3i6d n GLU 411 N -5.48 0.83 0.00 2.45 1.02 -1.26 -2.54 120.64 115.66 3i6d n GLU 411 Ca -0.12 -3.32 0.04 0.00 -0.02 0.00 0.00 57.16 53.74 3i6d n GLU 411 Cb 0.37 -1.29 0.02 0.00 -0.02 0.00 0.00 31.44 30.52 3i6d n GLU 411 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3i6d n SER 412 N 1.39 1.33 -4.16 1.62 7.64 -1.20 -4.77 113.62 115.47 3i6d n SER 412 Ca 0.22 -1.17 -0.39 0.00 1.01 0.00 0.00 58.87 58.54 3i6d n SER 412 Cb 0.52 0.22 -0.08 0.00 -1.01 0.00 0.00 64.21 63.86 3i6d n SER 412 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3i6d s MET 413 N -0.83 2.73 0.26 1.43 -1.94 -1.08 -4.96 119.30 114.90 3i6d s MET 413 Ca 0.07 -2.39 -0.31 0.00 -1.71 0.00 0.00 55.69 51.35 3i6d s MET 413 Cb 0.06 -3.88 -0.12 0.00 2.01 0.00 0.00 34.83 32.89 3i6d s MET 413 CO 0.13 -1.19 1.53 -2.30 -0.01 0.00 0.00 175.02 173.18 3i6d n PRO 414 N 3.80 2.41 -3.81 2.03 -0.02 -1.26 -1.52 135.00 136.63 3i6d n PRO 414 Ca 0.07 0.86 -0.36 0.00 -2.02 0.00 0.00 63.50 62.04 3i6d n PRO 414 Cb 0.40 -2.60 -0.13 0.00 -0.02 0.00 0.00 33.50 31.15 3i6d n PRO 414 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3i6d s GLN 415 N -0.25 3.23 -0.50 -0.52 -1.52 0.83 -4.92 119.66 116.01 3i6d s GLN 415 Ca 0.67 -0.75 -0.20 0.00 -1.95 0.00 0.00 55.36 53.14 3i6d s GLN 415 Cb -0.57 -3.24 0.05 0.00 -0.22 0.00 0.00 33.01 29.04 3i6d s GLN 415 CO 0.47 -0.34 0.65 0.71 -0.25 0.00 0.00 175.29 176.53 3i6d s TYR 416 N 1.50 3.03 0.59 0.91 2.02 -1.26 -4.49 117.35 119.65 3i6d s TYR 416 Ca 0.04 -0.47 0.01 0.00 -0.37 0.00 0.00 57.07 56.28 3i6d s TYR 416 Cb -0.16 -3.56 0.05 0.00 -0.40 0.00 0.00 41.96 37.89 3i6d s TYR 416 CO 0.01 -1.04 0.82 -1.01 -1.57 0.00 0.00 175.55 172.75 3i6d s HIS 417 N 2.73 2.54 0.11 2.71 3.76 -1.26 -0.26 115.29 125.62 3i6d s HIS 417 Ca 0.17 -0.09 -0.36 0.00 -0.15 0.00 0.00 55.06 54.63 3i6d s HIS 417 Cb -0.18 -2.78 -0.16 0.00 1.11 0.00 0.00 32.58 30.56 3i6d s HIS 417 CO 0.13 -1.06 1.40 0.28 -0.85 0.00 0.00 174.74 174.63 3i6d n VAL 418 N -2.44 0.06 -0.18 -0.90 0.31 -0.96 -0.56 118.33 113.66 3i6d n VAL 418 Ca 0.10 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 3i6d n VAL 418 Cb 0.60 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 3i6d n VAL 418 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i6d n GLY 419 N 2.73 0.72 0.27 2.92 0.00 -1.26 -4.97 105.19 105.60 3i6d n GLY 419 Ca 0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 3i6d n GLY 419 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3i6d h HIS 420 N 0.00 0.38 -0.72 1.61 6.17 -1.19 -2.10 115.15 119.30 3i6d h HIS 420 Ca 0.00 0.04 -0.05 0.00 0.71 0.00 0.00 60.37 61.07 3i6d h HIS 420 Cb 0.00 -0.06 -0.03 0.00 2.52 0.00 0.00 27.41 29.84 3i6d h HIS 420 CO 0.00 -0.00 0.26 -0.22 0.71 0.00 0.00 177.93 178.68 3i6d h LYS 421 N 0.35 1.10 -0.02 5.26 3.64 -1.93 -1.41 116.57 123.56 3i6d h LYS 421 Ca 0.40 -0.22 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3i6d h LYS 421 Cb 0.64 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3i6d h LYS 421 CO -0.44 0.92 0.01 1.96 -2.27 0.00 0.00 179.45 179.63 3i6d h GLN 422 N 1.05 0.04 -0.98 1.90 1.08 -1.84 -0.97 115.11 115.38 3i6d h GLN 422 Ca 0.24 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.45 3i6d h GLN 422 Cb 0.26 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.63 3i6d h GLN 422 CO -0.01 0.18 0.65 0.00 -0.95 0.00 0.00 178.83 178.70 3i6d h ARG 423 N -0.12 1.27 -0.30 1.46 3.08 -1.31 -0.82 114.38 117.65 3i6d h ARG 423 Ca 0.01 -0.08 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 3i6d h ARG 423 Cb 0.16 -0.29 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 3i6d h ARG 423 CO -0.00 0.84 -0.16 0.82 -1.07 0.00 0.00 179.97 180.40 3i6d h ILE 424 N 1.31 1.24 -0.03 2.04 1.08 -1.05 -1.79 117.51 120.32 3i6d h ILE 424 Ca 0.37 -1.12 -0.00 0.00 -0.39 0.00 0.00 64.86 63.72 3i6d h ILE 424 Cb -0.11 1.20 -0.00 0.00 -3.07 0.00 0.00 36.82 34.83 3i6d h ILE 424 CO -0.09 0.36 0.01 0.50 -0.69 0.00 0.00 178.15 178.24 3i6d h LYS 425 N 0.48 0.05 -0.57 2.37 3.64 -0.26 -0.58 116.57 121.70 3i6d h LYS 425 Ca 0.08 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.53 3i6d h LYS 425 Cb 0.56 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.31 3i6d h LYS 425 CO 0.04 0.27 0.22 0.93 -2.27 0.00 0.00 179.45 178.64 3i6d h GLU 426 N -0.19 0.41 -0.46 1.90 5.08 -1.02 0.15 114.58 120.45 3i6d h GLU 426 Ca 0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3i6d h GLU 426 Cb 0.25 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3i6d h GLU 426 CO 0.00 0.27 0.29 1.25 -1.00 0.00 0.00 179.01 179.82 3i6d h LEU 427 N 0.42 0.53 -0.20 1.33 5.85 -1.06 0.56 115.31 122.75 3i6d h LEU 427 Ca 0.28 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.97 3i6d h LEU 427 Cb 0.30 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3i6d h LEU 427 CO -0.26 0.41 0.13 0.03 -0.34 0.00 0.00 178.44 178.40 3i6d h ARG 428 N 0.61 0.26 -0.05 1.25 -0.00 -0.20 -0.06 114.38 116.19 3i6d h ARG 428 Ca 0.17 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.98 59.63 3i6d h ARG 428 Cb -0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 29.97 29.87 3i6d h ARG 428 CO -0.03 0.17 0.03 0.93 0.00 0.00 0.00 179.97 181.06 3i6d h GLU 429 N 0.26 0.07 -0.62 0.04 5.08 -0.30 0.81 114.58 119.92 3i6d h GLU 429 Ca 0.08 -0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.52 3i6d h GLU 429 Cb -0.02 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.15 3i6d h GLU 429 CO -0.03 0.09 0.26 0.00 -1.00 0.00 0.00 179.01 178.33 3i6d h ALA 430 N 0.97 0.81 -0.08 3.43 0.00 0.37 -0.14 119.26 124.62 3i6d h ALA 430 Ca 0.02 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 3i6d h ALA 430 Cb 0.04 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3i6d h ALA 430 CO -0.00 -0.15 -0.27 -0.07 0.00 0.00 0.00 179.25 178.76 3i6d h LEU 431 N 0.46 0.14 -0.53 0.00 3.38 -0.65 -1.07 115.31 117.04 3i6d h LEU 431 Ca 0.31 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 58.12 3i6d h LEU 431 Cb 0.35 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3i6d h LEU 431 CO -0.28 0.41 -0.15 0.00 0.09 0.00 0.00 178.44 178.51 3i6d h ALA 432 N 1.60 0.73 0.00 1.53 0.00 0.95 0.13 119.26 124.21 3i6d h ALA 432 Ca 0.02 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 3i6d h ALA 432 Cb 0.55 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3i6d h ALA 432 CO 0.04 0.68 -1.14 0.66 0.00 0.00 0.00 179.25 179.48 3i6d h SER 433 N 0.91 0.00 0.00 0.00 4.64 -1.15 -3.32 113.55 114.64 3i6d h SER 433 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3i6d h SER 433 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3i6d h SER 433 CO 0.06 0.32 -0.86 0.00 -0.87 0.00 0.00 176.83 175.48 3i6d n ALA 434 N -2.29 2.79 -2.88 5.18 0.00 -0.42 -4.76 120.51 118.13 3i6d n ALA 434 Ca -0.05 -0.23 -0.12 0.00 0.00 0.00 0.00 53.44 53.04 3i6d n ALA 434 Cb 0.70 -0.32 0.02 0.00 0.00 0.00 0.00 19.45 19.86 3i6d n ALA 434 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3i6d n TYR 435 N -1.48 0.11 -1.65 0.00 4.01 0.44 -5.03 117.16 113.57 3i6d n TYR 435 Ca 0.00 -3.07 -0.46 0.00 -0.16 0.00 0.00 57.90 54.22 3i6d n TYR 435 Cb 0.18 -0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 39.13 3i6d n TYR 435 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3i6d n PRO 436 N 0.06 1.85 0.00 -0.72 -0.04 -1.12 -1.51 135.00 133.52 3i6d n PRO 436 Ca 0.14 0.66 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 3i6d n PRO 436 Cb 0.75 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.90 3i6d n PRO 436 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i6d n GLY 437 N 2.38 1.27 3.80 0.55 0.00 -1.26 -4.97 105.19 106.96 3i6d n GLY 437 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 3i6d n GLY 437 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i6d s VAL 438 N -2.31 5.35 -0.01 1.61 1.01 -0.57 -1.42 120.40 124.07 3i6d s VAL 438 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.40 3i6d s VAL 438 Cb 0.00 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.85 3i6d s VAL 438 CO 0.00 0.51 -0.00 -0.31 0.00 0.00 0.00 175.10 175.30 3i6d s TYR 439 N -0.31 0.12 -0.19 5.22 2.02 0.71 -4.83 117.35 120.09 3i6d s TYR 439 Ca 0.15 0.02 0.01 0.00 -0.37 0.00 0.00 57.07 56.88 3i6d s TYR 439 Cb -0.13 -0.15 0.02 0.00 -0.40 0.00 0.00 41.96 41.30 3i6d s TYR 439 CO 0.04 -0.04 -0.19 -1.64 -1.57 0.00 0.00 175.55 172.15 3i6d s MET 440 N 0.36 2.90 0.33 -0.62 -1.94 -1.26 0.78 119.30 119.85 3i6d s MET 440 Ca -0.03 -0.86 0.02 0.00 -1.71 0.00 0.00 55.69 53.11 3i6d s MET 440 Cb -0.05 -2.58 -0.01 0.00 2.01 0.00 0.00 34.83 34.20 3i6d s MET 440 CO -0.01 -0.24 0.37 0.95 -0.01 0.00 0.00 175.02 176.08 3i6d s THR 441 N 1.28 0.00 -2.54 2.05 -4.23 -0.89 -4.97 115.64 106.34 3i6d s THR 441 Ca 0.04 -1.80 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 3i6d s THR 441 Cb -0.14 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.13 3i6d s THR 441 CO -0.12 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 3i6d n GLY 442 N -0.58 0.73 0.16 3.99 0.00 -1.26 -4.24 105.19 103.99 3i6d n GLY 442 Ca 0.04 -2.12 0.09 0.00 0.00 0.00 0.00 46.02 44.03 3i6d n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i6d n ALA 443 N -1.00 0.89 1.08 4.61 0.00 -1.26 -0.96 120.51 123.87 3i6d n ALA 443 Ca 0.00 0.17 0.13 0.00 0.00 0.00 0.00 53.44 53.73 3i6d n ALA 443 Cb 0.00 -1.11 0.39 0.00 0.00 0.00 0.00 19.45 18.73 3i6d n ALA 443 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3i6d n SER 444 N -2.15 0.45 0.00 0.00 7.64 -1.26 -4.36 113.62 113.93 3i6d n SER 444 Ca -0.01 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.66 3i6d n SER 444 Cb 0.13 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 3i6d n SER 444 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3i6d n PHE 445 N -1.33 0.00 -3.48 1.43 3.72 -0.13 -4.97 117.46 112.70 3i6d n PHE 445 Ca 0.08 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.21 3i6d n PHE 445 Cb 0.33 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.78 3i6d n PHE 445 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3i6d n GLU 446 N -0.71 2.02 0.00 -1.08 1.02 -1.24 -5.00 120.64 115.65 3i6d n GLU 446 Ca 0.00 -4.35 0.00 0.00 -0.02 0.00 0.00 57.16 52.79 3i6d n GLU 446 Cb 0.00 -2.08 0.00 0.00 -0.02 0.00 0.00 31.44 29.34 3i6d n GLU 446 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i6d n GLY 447 N 1.23 3.54 0.07 0.62 0.00 -1.26 -4.86 105.19 104.53 3i6d n GLY 447 Ca 0.27 -1.14 0.11 0.00 0.00 0.00 0.00 46.02 45.26 3i6d n GLY 447 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3i6d n VAL 448 N 0.03 0.38 -1.97 1.61 0.24 -1.26 -4.02 118.33 113.34 3i6d n VAL 448 Ca 0.00 -0.52 -0.39 0.00 -2.04 0.00 0.00 64.34 61.39 3i6d n VAL 448 Cb 0.00 -0.20 0.01 0.00 -1.47 0.00 0.00 33.84 32.18 3i6d n VAL 448 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3i6d s GLY 449 N -4.40 2.88 0.22 7.63 0.00 -1.26 -4.80 107.32 107.59 3i6d s GLY 449 Ca -0.03 1.23 -0.11 0.00 0.00 0.00 0.00 44.72 45.81 3i6d s GLY 449 CO 0.83 1.77 1.65 -2.22 0.00 0.00 0.00 173.10 175.13 3i6d h ILE 450 N 1.96 0.45 0.20 0.90 2.04 -1.92 -0.29 117.51 120.85 3i6d h ILE 450 Ca -0.50 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.34 3i6d h ILE 450 Cb 1.27 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3i6d h ILE 450 CO 0.60 0.02 -0.33 -0.65 0.00 0.00 0.00 178.15 177.79 3i6d h PRO 451 N 0.09 -0.58 -1.01 2.37 0.11 -1.91 -1.25 132.00 129.82 3i6d h PRO 451 Ca 0.33 0.04 0.24 0.00 0.11 0.00 0.00 66.00 66.72 3i6d h PRO 451 Cb 0.54 0.13 -0.11 0.00 0.11 0.00 0.00 31.00 31.67 3i6d h PRO 451 CO -0.56 -0.39 0.62 -0.44 -0.21 0.00 0.00 178.00 177.02 3i6d h ASP 452 N -0.60 0.61 -0.10 -2.05 3.32 -1.58 0.12 116.42 116.14 3i6d h ASP 452 Ca 0.01 0.11 -0.13 0.00 0.02 0.00 0.00 57.03 57.03 3i6d h ASP 452 Cb 0.60 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 3i6d h ASP 452 CO -0.14 0.13 -0.39 0.00 -1.72 0.00 0.00 179.24 177.12 3i6d h ILE 454 N 0.51 0.88 -0.13 0.00 2.04 0.38 -1.69 117.51 119.50 3i6d h ILE 454 Ca 0.05 -0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.75 3i6d h ILE 454 Cb 0.90 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 3i6d h ILE 454 CO 0.08 0.00 -0.56 -2.24 0.00 0.00 0.00 178.15 175.43 3i6d h ASP 455 N -0.17 0.44 -0.86 1.72 -0.00 -1.49 -0.23 116.42 115.83 3i6d h ASP 455 Ca -0.02 -0.24 0.16 0.00 -0.00 0.00 0.00 57.03 56.93 3i6d h ASP 455 Cb 0.13 -0.13 -0.06 0.00 -0.00 0.00 0.00 39.33 39.27 3i6d h ASP 455 CO 0.03 0.91 0.56 1.56 -0.00 0.00 0.00 179.24 182.30 3i6d h GLN 456 N 0.30 0.53 0.01 4.15 4.20 -1.10 1.80 115.11 125.00 3i6d h GLN 456 Ca 0.00 -0.03 -0.20 0.00 0.06 0.00 0.00 58.65 58.48 3i6d h GLN 456 Cb 1.08 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.72 3i6d h GLN 456 CO 0.10 0.35 -0.91 0.78 -0.67 0.00 0.00 178.83 178.47 3i6d h GLY 457 N 0.54 0.10 0.86 3.46 0.00 -0.73 -1.74 103.07 105.55 3i6d h GLY 457 Ca 0.43 -0.19 -0.08 0.00 0.00 0.00 0.00 47.33 47.49 3i6d h GLY 457 CO -0.18 0.17 -0.19 0.50 0.00 0.00 0.00 176.54 176.84 3i6d h LYS 458 N 0.04 0.53 -0.54 4.80 1.57 0.23 -2.10 116.57 121.10 3i6d h LYS 458 Ca -0.03 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.45 3i6d h LYS 458 Cb 1.58 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.87 3i6d h LYS 458 CO 0.13 0.84 0.20 0.00 -0.57 0.00 0.00 179.45 180.05 3i6d h ALA 459 N 0.68 1.34 -0.32 3.86 0.00 0.24 -1.32 119.26 123.74 3i6d h ALA 459 Ca 0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3i6d h ALA 459 Cb 0.72 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3i6d h ALA 459 CO 0.05 0.49 0.20 0.00 0.00 0.00 0.00 179.25 179.98 3i6d h ALA 460 N 1.45 0.41 -0.58 0.00 0.00 -1.09 -0.08 119.26 119.38 3i6d h ALA 460 Ca 0.18 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.10 3i6d h ALA 460 Cb 0.18 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3i6d h ALA 460 CO -0.01 -0.09 0.31 0.28 0.00 0.00 0.00 179.25 179.73 3i6d h VAL 461 N 0.42 0.97 0.38 0.00 2.07 -0.65 -0.34 116.25 119.10 3i6d h VAL 461 Ca 0.12 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 3i6d h VAL 461 Cb -0.00 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.07 3i6d h VAL 461 CO -0.02 0.11 -0.37 -1.28 0.02 0.00 0.00 177.57 176.02 3i6d h SER 462 N 0.59 -1.01 -0.32 0.57 0.87 -0.65 -1.96 113.55 111.64 3i6d h SER 462 Ca 0.26 0.09 0.05 0.00 -1.23 0.00 0.00 61.79 60.95 3i6d h SER 462 Cb 0.15 0.34 -0.04 0.00 -0.44 0.00 0.00 62.40 62.40 3i6d h SER 462 CO -0.16 -0.52 0.05 0.44 -0.53 0.00 0.00 176.83 176.10 3i6d h ASP 463 N -0.77 -0.02 -0.76 6.23 3.32 -0.64 -1.31 116.42 122.46 3i6d h ASP 463 Ca -0.03 0.06 0.09 0.00 0.02 0.00 0.00 57.03 57.17 3i6d h ASP 463 Cb 0.69 0.08 -0.07 0.00 0.22 0.00 0.00 39.33 40.26 3i6d h ASP 463 CO -0.06 0.02 0.41 0.00 -1.72 0.00 0.00 179.24 177.90 3i6d h ALA 464 N 1.25 1.06 0.33 3.45 0.00 -0.95 -0.94 119.26 123.46 3i6d h ALA 464 Ca 0.15 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3i6d h ALA 464 Cb 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3i6d h ALA 464 CO -0.21 0.04 -0.16 -0.07 0.00 0.00 0.00 179.25 178.85 3i6d h LEU 465 N 0.71 -0.37 -0.80 0.00 3.38 -0.95 -0.63 115.31 116.65 3i6d h LEU 465 Ca 0.37 -0.16 0.17 0.00 0.09 0.00 0.00 57.88 58.34 3i6d h LEU 465 Cb 0.34 0.10 -0.15 0.00 0.09 0.00 0.00 40.66 41.04 3i6d h LEU 465 CO -0.25 -0.00 -0.13 0.74 0.09 0.00 0.00 178.44 178.89 3i6d h THR 466 N -0.78 0.23 -0.70 0.22 2.02 -0.95 0.52 112.91 113.47 3i6d h THR 466 Ca -0.04 -0.01 -0.03 0.00 0.77 0.00 0.00 66.41 67.10 3i6d h THR 466 Cb 0.51 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 3i6d h THR 466 CO 0.07 0.00 0.33 0.22 0.37 0.00 0.00 175.52 176.52 3i6d h TYR 467 N 0.03 1.02 -0.06 3.16 3.20 -1.07 -3.20 116.97 120.03 3i6d h TYR 467 Ca 0.40 -0.05 -0.17 0.00 3.14 0.00 0.00 58.73 62.05 3i6d h TYR 467 Cb 0.66 -0.31 0.01 0.00 1.54 0.00 0.00 36.73 38.63 3i6d h TYR 467 CO -0.56 0.76 -0.63 -0.07 -1.64 0.00 0.00 178.16 176.01 3i6d h LEU 468 N 0.98 0.66 0.00 2.82 3.38 0.11 -3.46 115.31 119.81 3i6d h LEU 468 Ca 0.24 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3i6d h LEU 468 Cb 0.13 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3i6d h LEU 468 CO -0.03 1.26 0.00 0.49 0.09 0.00 0.00 178.44 180.25 3i6d n PHE 469 N -4.15 0.00 0.00 1.13 3.72 0.15 -5.08 117.46 113.23 3i6d n PHE 469 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 3i6d n PHE 469 Cb 0.67 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.21 3i6d n PHE 469 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14