#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jjm s LEU 3 N 0.00 1.03 -0.52 -5.58 2.96 -1.26 -5.04 118.68 110.27 2jjm s LEU 3 Ca 0.00 0.47 -0.15 0.00 -0.22 0.00 0.00 54.13 54.23 2jjm s LEU 3 Cb 0.00 0.77 0.12 0.00 0.50 0.00 0.00 46.19 47.58 2jjm s LEU 3 CO 0.00 -0.09 0.45 -0.54 -1.32 0.00 0.00 176.35 174.85 2jjm s LYS 4 N 0.29 2.89 0.00 1.98 1.02 -1.26 -1.18 119.74 123.48 2jjm s LYS 4 Ca -0.01 -1.67 0.00 0.00 0.02 0.00 0.00 55.97 54.31 2jjm s LYS 4 Cb -0.03 -4.20 -0.04 0.00 -0.52 0.00 0.00 37.83 33.04 2jjm s LYS 4 CO -0.01 -1.26 0.07 0.42 -0.92 0.00 0.00 175.35 173.65 2jjm s ILE 5 N 1.56 4.61 -0.16 2.17 -1.09 -0.67 -0.58 121.20 127.04 2jjm s ILE 5 Ca 0.04 -0.47 0.01 0.00 -2.23 0.00 0.00 60.65 58.00 2jjm s ILE 5 Cb -0.28 -3.10 0.01 0.00 -1.58 0.00 0.00 42.46 37.50 2jjm s ILE 5 CO 0.03 0.34 -0.18 -0.83 -1.23 0.00 0.00 174.94 173.07 2jjm s GLY 6 N -1.74 1.43 -0.02 6.18 0.00 -0.31 -0.76 107.32 112.10 2jjm s GLY 6 Ca 0.23 -1.12 -0.00 0.00 0.00 0.00 0.00 44.72 43.82 2jjm s GLY 6 CO 0.14 0.12 0.05 -0.42 0.00 0.00 0.00 173.10 172.99 2jjm s ILE 7 N 1.01 4.57 -0.05 0.90 1.09 -0.90 0.25 121.20 128.07 2jjm s ILE 7 Ca -0.02 -0.42 0.01 0.00 -1.10 0.00 0.00 60.65 59.12 2jjm s ILE 7 Cb -0.15 -3.06 0.02 0.00 -1.06 0.00 0.00 42.46 38.22 2jjm s ILE 7 CO -0.05 0.39 -0.04 -0.89 -0.10 0.00 0.00 174.94 174.26 2jjm s THR 8 N -1.13 0.52 0.10 2.92 2.01 -0.73 -0.97 115.64 118.36 2jjm s THR 8 Ca 0.21 -0.09 -0.10 0.00 0.31 0.00 0.00 61.69 62.02 2jjm s THR 8 Cb -0.12 -0.57 0.03 0.00 0.01 0.00 0.00 72.50 71.86 2jjm s THR 8 CO 0.11 0.23 0.47 0.00 -0.69 0.00 0.00 174.62 174.75 2jjm s TYR 10 N -4.39 3.89 0.00 0.00 2.02 -1.26 -4.86 117.35 112.75 2jjm s TYR 10 Ca 0.10 -2.97 0.00 0.00 -0.37 0.00 0.00 57.07 53.83 2jjm s TYR 10 Cb -0.01 -3.29 0.00 0.00 -0.40 0.00 0.00 41.96 38.26 2jjm s TYR 10 CO 0.03 -0.76 0.00 -2.30 -1.57 0.00 0.00 175.55 170.95 2jjm n PRO 11 N 2.45 0.00 0.00 -1.71 -0.02 -1.26 -3.93 135.00 130.54 2jjm n PRO 11 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2jjm n PRO 11 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.85 2jjm n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jjm n GLY 14 N 0.00 -0.69 0.12 -1.23 0.00 -1.26 -4.78 105.19 97.35 2jjm n GLY 14 Ca 0.00 -0.10 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 2jjm n GLY 14 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2jjm h GLY 15 N 0.00 0.33 0.15 -0.02 0.00 -2.01 -3.29 103.07 98.22 2jjm h GLY 15 Ca 0.00 -0.61 0.16 0.00 0.00 0.00 0.00 47.33 46.87 2jjm h GLY 15 CO 0.00 0.54 0.41 1.48 0.00 0.00 0.00 176.54 178.98 2jjm h SER 16 N -0.31 0.47 -0.09 0.19 4.64 -1.94 -2.27 113.55 114.24 2jjm h SER 16 Ca -0.06 0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2jjm h SER 16 Cb 1.23 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2jjm h SER 16 CO 0.09 0.17 0.04 1.23 -0.87 0.00 0.00 176.83 177.50 2jjm h GLY 17 N 0.57 0.14 0.21 -0.77 0.00 -1.68 0.36 103.07 101.90 2jjm h GLY 17 Ca 0.47 -0.07 0.03 0.00 0.00 0.00 0.00 47.33 47.77 2jjm h GLY 17 CO -0.39 0.06 -0.36 -2.08 0.00 0.00 0.00 176.54 173.77 2jjm h VAL 18 N 0.03 0.24 0.36 4.60 2.07 -1.49 0.12 116.25 122.18 2jjm h VAL 18 Ca 0.03 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 2jjm h VAL 18 Cb 0.11 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2jjm h VAL 18 CO -0.00 0.00 -0.17 0.58 0.02 0.00 0.00 177.57 177.99 2jjm h VAL 19 N -0.50 0.65 -0.44 2.57 2.07 -1.31 -0.04 116.25 119.25 2jjm h VAL 19 Ca 0.06 -0.09 0.09 0.00 0.82 0.00 0.00 66.70 67.58 2jjm h VAL 19 Cb 0.59 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 30.98 2jjm h VAL 19 CO -0.30 0.02 -0.11 1.23 0.02 0.00 0.00 177.57 178.43 2jjm h GLY 20 N -0.54 0.32 0.94 2.17 0.00 -0.10 0.53 103.07 106.39 2jjm h GLY 20 Ca -0.05 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 2jjm h GLY 20 CO 0.08 -0.17 0.14 -0.84 0.00 0.00 0.00 176.54 175.76 2jjm h THR 21 N 0.00 1.15 -0.57 4.70 2.02 -0.66 -1.60 112.91 117.96 2jjm h THR 21 Ca 0.21 -0.43 -0.07 0.00 0.77 0.00 0.00 66.41 66.89 2jjm h THR 21 Cb 0.32 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 2jjm h THR 21 CO -0.45 0.15 0.06 -0.08 0.37 0.00 0.00 175.52 175.58 2jjm h GLU 22 N 0.34 0.96 -0.91 6.66 4.57 -0.36 -0.93 114.58 124.91 2jjm h GLU 22 Ca 0.10 -0.27 0.06 0.00 -1.18 0.00 0.00 59.36 58.07 2jjm h GLU 22 Cb 0.12 -0.10 -0.06 0.00 -0.16 0.00 0.00 28.75 28.54 2jjm h GLU 22 CO -0.01 0.93 0.59 1.25 -1.18 0.00 0.00 179.01 180.59 2jjm h LEU 23 N 0.85 0.92 -0.38 1.64 5.85 0.25 0.24 115.31 124.69 2jjm h LEU 23 Ca 0.17 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.72 2jjm h LEU 23 Cb 0.46 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 2jjm h LEU 23 CO 0.02 0.60 -0.47 1.23 -0.34 0.00 0.00 178.44 179.47 2jjm h GLY 24 N 1.05 0.95 0.92 3.75 0.00 -0.78 -1.12 103.07 107.84 2jjm h GLY 24 Ca 0.39 -1.04 -0.00 0.00 0.00 0.00 0.00 47.33 46.68 2jjm h GLY 24 CO -0.14 0.93 0.05 1.70 0.00 0.00 0.00 176.54 179.08 2jjm h LYS 25 N 0.69 0.14 0.45 4.80 3.64 -0.39 -1.16 116.57 124.75 2jjm h LYS 25 Ca 0.04 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 2jjm h LYS 25 Cb 1.06 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 2jjm h LYS 25 CO 0.11 0.19 -0.32 1.96 -2.27 0.00 0.00 179.45 179.13 2jjm h GLN 26 N 0.06 -0.72 -0.87 1.90 1.08 -0.90 -1.95 115.11 113.70 2jjm h GLN 26 Ca 0.04 0.05 0.20 0.00 -1.45 0.00 0.00 58.65 57.49 2jjm h GLN 26 Cb 0.09 0.16 -0.06 0.00 -0.05 0.00 0.00 27.48 27.63 2jjm h GLN 26 CO -0.01 -0.48 0.58 -0.07 -0.95 0.00 0.00 178.83 177.91 2jjm h LEU 27 N -0.75 0.34 0.02 1.46 3.38 -1.16 -0.97 115.31 117.63 2jjm h LEU 27 Ca -0.05 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jjm h LEU 27 Cb 0.63 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2jjm h LEU 27 CO 0.02 0.14 -0.01 0.00 0.09 0.00 0.00 178.44 178.68 2jjm h ALA 28 N 1.61 -0.03 -0.05 1.53 0.00 -0.65 -2.57 119.26 119.11 2jjm h ALA 28 Ca 0.45 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2jjm h ALA 28 Cb 1.19 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2jjm h ALA 28 CO -0.14 -0.35 0.14 0.93 0.00 0.00 0.00 179.25 179.82 2jjm h GLU 29 N -0.36 0.00 -0.43 0.00 5.08 -0.45 0.26 114.58 118.67 2jjm h GLU 29 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jjm h GLU 29 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2jjm h GLU 29 CO 0.01 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.56 2jjm n ARG 30 N -3.27 1.95 -0.14 2.33 1.74 -0.90 -4.89 116.66 113.49 2jjm n ARG 30 Ca -0.02 -1.21 0.00 0.00 -0.77 0.00 0.00 57.85 55.85 2jjm n ARG 30 Cb 0.22 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 2jjm n ARG 30 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jjm n GLY 31 N 0.86 0.86 3.81 -0.13 0.00 0.90 -4.65 105.19 106.85 2jjm n GLY 31 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2jjm n GLY 31 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jjm s HIS 32 N -2.47 3.05 -0.43 1.61 3.76 -1.03 -3.79 115.29 115.99 2jjm s HIS 32 Ca 0.00 1.46 -0.12 0.00 -0.15 0.00 0.00 55.06 56.25 2jjm s HIS 32 Cb 0.00 -2.93 0.07 0.00 1.11 0.00 0.00 32.58 30.83 2jjm s HIS 32 CO 0.00 -1.20 0.30 -2.00 -0.85 0.00 0.00 174.74 170.99 2jjm s GLU 33 N -4.67 2.77 -0.01 1.40 2.12 -0.33 -4.42 118.70 115.57 2jjm s GLU 33 Ca 0.60 -1.36 -0.16 0.00 0.36 0.00 0.00 54.97 54.41 2jjm s GLU 33 Cb -0.15 -3.90 -0.06 0.00 0.26 0.00 0.00 34.13 30.29 2jjm s GLU 33 CO 0.48 -0.94 0.45 0.42 -0.54 0.00 0.00 175.26 175.13 2jjm s ILE 34 N 1.52 5.01 -0.35 -3.70 1.09 -0.53 -1.67 121.20 122.58 2jjm s ILE 34 Ca 0.03 0.93 0.01 0.00 -1.10 0.00 0.00 60.65 60.53 2jjm s ILE 34 Cb -0.23 -3.77 0.11 0.00 -1.06 0.00 0.00 42.46 37.51 2jjm s ILE 34 CO 0.05 0.52 0.12 -1.00 -0.10 0.00 0.00 174.94 174.52 2jjm s HIS 35 N -0.68 2.45 -0.10 3.97 3.76 0.06 -1.24 115.29 123.50 2jjm s HIS 35 Ca 0.25 -2.31 -0.30 0.00 -0.15 0.00 0.00 55.06 52.56 2jjm s HIS 35 Cb -0.17 -2.17 -0.03 0.00 1.11 0.00 0.00 32.58 31.33 2jjm s HIS 35 CO 0.14 -0.88 1.29 -0.06 -0.85 0.00 0.00 174.74 174.38 2jjm s PHE 36 N 1.09 2.90 -0.47 1.40 0.08 -0.28 -2.12 117.98 120.59 2jjm s PHE 36 Ca 0.12 0.99 0.00 0.00 0.12 0.00 0.00 56.93 58.16 2jjm s PHE 36 Cb -0.19 -3.53 0.12 0.00 -0.57 0.00 0.00 43.02 38.85 2jjm s PHE 36 CO -0.14 -1.82 0.23 0.42 -0.10 0.00 0.00 175.22 173.81 2jjm s ILE 37 N 2.95 3.00 -0.28 0.64 1.01 -0.14 -0.61 121.20 127.77 2jjm s ILE 37 Ca 0.58 -2.61 -0.23 0.00 0.00 0.00 0.00 60.65 58.38 2jjm s ILE 37 Cb -0.25 -3.06 0.10 0.00 0.01 0.00 0.00 42.46 39.26 2jjm s ILE 37 CO 0.20 -0.74 0.89 0.28 0.00 0.00 0.00 174.94 175.57 2jjm s THR 38 N 0.50 0.00 -0.67 2.92 -1.32 -0.90 -4.45 115.64 111.71 2jjm s THR 38 Ca 0.13 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.37 2jjm s THR 38 Cb -0.22 -1.00 0.06 0.00 -1.51 0.00 0.00 72.50 69.83 2jjm s THR 38 CO -0.04 0.00 1.03 -0.94 -2.21 0.00 0.00 174.62 172.46 2jjm s SER 39 N 0.50 6.18 0.00 8.08 1.04 -1.26 -4.33 113.70 123.92 2jjm s SER 39 Ca -0.00 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.60 2jjm s SER 39 Cb -0.05 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.62 2jjm s SER 39 CO -0.06 -1.51 0.00 0.61 0.98 0.00 0.00 173.24 173.26 2jjm n GLY 40 N 5.32 -0.73 2.55 7.32 0.00 -1.26 -4.94 105.19 113.45 2jjm n GLY 40 Ca -0.02 -0.28 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 2jjm n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jjm s LEU 41 N 0.00 0.44 0.00 0.99 1.43 -1.26 -5.07 118.68 115.20 2jjm s LEU 41 Ca 0.00 -2.46 0.00 0.00 -1.03 0.00 0.00 54.13 50.64 2jjm s LEU 41 Cb 0.00 0.31 0.00 0.00 0.03 0.00 0.00 46.19 46.53 2jjm s LEU 41 CO 0.00 -0.16 0.41 -2.65 0.23 0.00 0.00 176.35 174.18 2jjm n PRO 42 N 3.15 0.00 0.00 1.29 -0.02 -1.26 -4.95 135.00 133.22 2jjm n PRO 42 Ca 0.23 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2jjm n PRO 42 Cb 0.49 -0.94 0.00 0.00 -0.02 0.00 0.00 33.50 33.03 2jjm n PRO 42 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2jjm n LYS 47 N -0.76 0.00 -3.70 -0.52 4.81 -1.26 -5.11 118.16 111.62 2jjm n LYS 47 Ca 0.00 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.28 2jjm n LYS 47 Cb 0.00 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 34.90 2jjm n LYS 47 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2jjm s VAL 48 N -0.09 -0.17 -0.16 3.15 0.11 -1.26 -5.15 120.40 116.84 2jjm s VAL 48 Ca 0.00 0.29 -0.06 0.00 -2.93 0.00 0.00 61.98 59.28 2jjm s VAL 48 Cb 0.00 -0.26 -0.04 0.00 -1.53 0.00 0.00 36.38 34.55 2jjm s VAL 48 CO 0.00 0.12 0.05 -0.31 -3.33 0.00 0.00 175.10 171.63 2jjm s TYR 49 N 1.83 3.24 -0.31 1.54 2.02 -1.26 -4.99 117.35 119.42 2jjm s TYR 49 Ca -0.02 0.10 0.26 0.00 -0.37 0.00 0.00 57.07 57.03 2jjm s TYR 49 Cb -0.12 -2.00 1.11 0.00 -0.40 0.00 0.00 41.96 40.56 2jjm s TYR 49 CO -0.06 0.25 1.77 -1.35 -1.57 0.00 0.00 175.55 174.59 2jjm h PRO 50 N 6.25 0.00 -0.28 -1.71 0.11 -2.01 -3.06 132.00 131.31 2jjm h PRO 50 Ca -0.40 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.66 2jjm h PRO 50 Cb 1.18 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2jjm h PRO 50 CO 0.66 0.00 -0.00 0.27 -0.21 0.00 0.00 178.00 178.71 2jjm n ASN 51 N -2.40 3.51 -3.89 -2.05 6.94 -1.26 -4.90 115.26 111.21 2jjm n ASN 51 Ca 0.01 -3.19 -0.28 0.00 -0.02 0.00 0.00 54.58 51.10 2jjm n ASN 51 Cb 0.21 -0.56 -0.16 0.00 -2.36 0.00 0.00 39.78 36.90 2jjm n ASN 51 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2jjm s ILE 52 N -2.93 1.14 0.06 1.53 1.01 -1.16 -1.45 121.20 119.40 2jjm s ILE 52 Ca 0.42 -0.69 0.04 0.00 0.00 0.00 0.00 60.65 60.43 2jjm s ILE 52 Cb 0.35 -1.33 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 2jjm s ILE 52 CO 0.07 0.10 -0.02 -0.31 0.00 0.00 0.00 174.94 174.78 2jjm s TYR 53 N 1.61 2.97 -0.21 3.97 2.02 -0.37 -4.82 117.35 122.52 2jjm s TYR 53 Ca 0.00 -0.02 -0.00 0.00 -0.37 0.00 0.00 57.07 56.68 2jjm s TYR 53 Cb -0.16 -1.56 0.02 0.00 -0.40 0.00 0.00 41.96 39.86 2jjm s TYR 53 CO -0.08 0.46 -0.13 -0.06 -1.57 0.00 0.00 175.55 174.17 2jjm s PHE 54 N -1.22 2.93 -0.11 2.71 0.08 -1.26 -1.12 117.98 119.98 2jjm s PHE 54 Ca 0.23 -1.56 -0.02 0.00 0.12 0.00 0.00 56.93 55.70 2jjm s PHE 54 Cb -0.12 -1.99 -0.03 0.00 -0.57 0.00 0.00 43.02 40.32 2jjm s PHE 54 CO 0.15 -0.75 -0.04 -1.01 -0.10 0.00 0.00 175.22 173.47 2jjm s HIS 55 N 1.31 3.04 0.04 0.36 3.76 0.22 -4.98 115.29 119.04 2jjm s HIS 55 Ca 0.03 -0.06 0.09 0.00 -0.15 0.00 0.00 55.06 54.96 2jjm s HIS 55 Cb -0.15 -1.84 -0.03 0.00 1.11 0.00 0.00 32.58 31.68 2jjm s HIS 55 CO -0.08 0.22 -0.25 -2.00 -0.85 0.00 0.00 174.74 171.78 2jjm s GLU 56 N -0.34 1.72 -0.30 1.40 -6.30 -1.26 -2.13 118.70 111.49 2jjm s GLU 56 Ca 0.06 -1.04 -0.27 0.00 -2.50 0.00 0.00 54.97 51.22 2jjm s GLU 56 Cb -0.12 -1.85 0.01 0.00 0.00 0.00 0.00 34.13 32.17 2jjm s GLU 56 CO 0.02 0.48 0.99 0.08 0.02 0.00 0.00 175.26 176.85 2jjm s VAL 57 N -0.77 4.61 -0.17 3.70 1.01 -1.26 -4.91 120.40 122.61 2jjm s VAL 57 Ca 0.10 1.62 -0.08 0.00 0.00 0.00 0.00 61.98 63.62 2jjm s VAL 57 Cb -0.10 -4.33 -0.04 0.00 0.00 0.00 0.00 36.38 31.92 2jjm s VAL 57 CO 0.02 -0.37 0.10 0.42 0.00 0.00 0.00 175.10 175.26 2jjm s THR 58 N 3.39 5.12 0.36 3.92 -4.23 -1.26 -4.72 115.64 118.22 2jjm s THR 58 Ca 0.41 0.08 0.08 0.00 -1.18 0.00 0.00 61.69 61.09 2jjm s THR 58 Cb -0.13 -3.30 -0.06 0.00 1.34 0.00 0.00 72.50 70.35 2jjm s THR 58 CO 0.13 0.48 0.05 -0.69 -0.54 0.00 0.00 174.62 174.06 2jjm s VAL 59 N 0.09 2.50 0.00 2.29 1.01 -1.26 -5.01 120.40 120.02 2jjm s VAL 59 Ca 0.07 -1.91 0.00 0.00 0.00 0.00 0.00 61.98 60.14 2jjm s VAL 59 Cb -0.12 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2jjm s VAL 59 CO -0.00 -0.13 0.00 0.59 0.00 0.00 0.00 175.10 175.55 2jjm n ASN 60 N -1.02 0.00 0.00 3.32 4.13 -1.26 -5.14 115.26 115.29 2jjm n ASN 60 Ca -0.04 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.22 2jjm n ASN 60 Cb 0.63 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.87 2jjm n ASN 60 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2jjm n PHE 65 N -0.14 0.00 0.09 3.10 3.72 -1.26 -5.05 117.46 117.92 2jjm n PHE 65 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.29 2jjm n PHE 65 Cb 0.00 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.47 2jjm n PHE 65 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2jjm h GLN 66 N 0.00 -0.28 -4.73 -1.08 1.08 -2.12 -3.46 115.11 104.52 2jjm h GLN 66 Ca 0.00 0.02 -0.37 0.00 -1.45 0.00 0.00 58.65 56.85 2jjm h GLN 66 Cb 0.00 0.06 -0.27 0.00 -0.05 0.00 0.00 27.48 27.23 2jjm h GLN 66 CO 0.00 0.10 -0.77 0.71 -0.95 0.00 0.00 178.83 177.92 2jjm s TYR 67 N -3.70 0.80 -0.08 2.96 2.02 -1.26 -5.11 117.35 112.98 2jjm s TYR 67 Ca -0.13 -0.22 -0.29 0.00 -0.37 0.00 0.00 57.07 56.06 2jjm s TYR 67 Cb 0.01 -0.50 -0.06 0.00 -0.40 0.00 0.00 41.96 41.01 2jjm s TYR 67 CO 0.47 -0.01 1.93 -1.25 -1.57 0.00 0.00 175.55 175.11 2jjm s PRO 68 N -0.55 3.85 -0.26 -1.71 0.04 -1.26 -4.85 135.00 130.25 2jjm s PRO 68 Ca 0.01 2.26 -0.19 0.00 0.04 0.00 0.00 61.00 63.11 2jjm s PRO 68 Cb -0.05 -4.17 -0.21 0.00 0.04 0.00 0.00 34.50 30.11 2jjm s PRO 68 CO 0.00 -1.27 1.59 -2.30 0.04 0.00 0.00 177.00 175.05 2jjm n PRO 69 N 7.80 0.55 -0.29 0.56 -0.02 -1.26 -4.66 135.00 137.67 2jjm n PRO 69 Ca 0.22 -1.12 -0.05 0.00 -2.02 0.00 0.00 63.50 60.52 2jjm n PRO 69 Cb 0.43 -2.48 0.07 0.00 -0.02 0.00 0.00 33.50 31.50 2jjm n PRO 69 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2jjm h TYR 70 N 8.71 1.15 0.79 6.00 3.20 -1.98 0.35 116.97 135.20 2jjm h TYR 70 Ca 0.26 -0.06 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 2jjm h TYR 70 Cb 0.48 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.40 2jjm h TYR 70 CO 1.39 0.85 -0.44 -0.44 -1.64 0.00 0.00 178.16 177.87 2jjm h ASP 71 N 1.13 -1.08 -0.82 -2.11 3.32 -2.00 0.75 116.42 115.60 2jjm h ASP 71 Ca 0.27 0.05 0.12 0.00 0.02 0.00 0.00 57.03 57.49 2jjm h ASP 71 Cb 0.14 0.30 -0.08 0.00 0.22 0.00 0.00 39.33 39.90 2jjm h ASP 71 CO -0.03 -0.70 0.44 -0.07 -1.72 0.00 0.00 179.24 177.15 2jjm h LEU 72 N -1.14 0.57 -0.87 1.55 4.07 -1.94 0.19 115.31 117.75 2jjm h LEU 72 Ca -0.11 0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2jjm h LEU 72 Cb 0.90 -0.03 -0.04 0.00 1.08 0.00 0.00 40.66 42.56 2jjm h LEU 72 CO 0.14 0.29 0.56 0.00 -1.08 0.00 0.00 178.44 178.35 2jjm h ALA 73 N 1.50 1.10 -0.54 1.53 0.00 -0.63 0.42 119.26 122.65 2jjm h ALA 73 Ca 0.42 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 2jjm h ALA 73 Cb 0.51 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2jjm h ALA 73 CO -0.31 0.53 -0.10 1.25 0.00 0.00 0.00 179.25 180.62 2jjm h LEU 74 N 1.18 1.02 -0.29 0.00 5.85 0.68 -1.05 115.31 122.70 2jjm h LEU 74 Ca 0.32 -0.35 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2jjm h LEU 74 Cb -0.10 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.63 2jjm h LEU 74 CO -0.07 1.13 0.18 0.00 -0.34 0.00 0.00 178.44 179.34 2jjm h ALA 75 N 0.92 0.37 -0.62 1.25 0.00 -0.50 -0.21 119.26 120.47 2jjm h ALA 75 Ca 0.14 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2jjm h ALA 75 Cb 0.67 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2jjm h ALA 75 CO 0.05 -0.14 0.37 1.03 0.00 0.00 0.00 179.25 180.56 2jjm h SER 76 N 0.38 0.60 -0.33 0.00 0.87 -0.64 -1.20 113.55 113.23 2jjm h SER 76 Ca 0.10 0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.54 2jjm h SER 76 Cb 0.00 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 2jjm h SER 76 CO -0.02 0.41 -0.28 0.50 -0.53 0.00 0.00 176.83 176.91 2jjm h LYS 77 N 0.73 0.84 0.19 2.24 1.63 -0.91 -0.25 116.57 121.04 2jjm h LYS 77 Ca 0.26 -0.37 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 2jjm h LYS 77 Cb 0.05 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.65 2jjm h LYS 77 CO -0.12 1.01 -0.19 0.52 -3.45 0.00 0.00 179.45 177.22 2jjm h MET 78 N 0.71 -0.40 -0.47 1.90 2.86 -0.64 0.15 114.93 119.04 2jjm h MET 78 Ca 0.08 0.03 0.07 0.00 -2.06 0.00 0.00 59.70 57.82 2jjm h MET 78 Cb 0.82 0.09 -0.06 0.00 0.06 0.00 0.00 31.60 32.52 2jjm h MET 78 CO 0.07 -0.27 0.14 0.00 1.06 0.00 0.00 176.91 177.91 2jjm h ALA 79 N 0.33 0.56 0.36 6.32 0.00 -1.04 0.26 119.26 126.05 2jjm h ALA 79 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2jjm h ALA 79 Cb 0.39 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2jjm h ALA 79 CO -0.05 -0.26 -0.17 1.49 0.00 0.00 0.00 179.25 180.27 2jjm h GLU 80 N 0.30 -0.46 -0.98 0.00 4.81 -0.67 -2.39 114.58 115.19 2jjm h GLU 80 Ca 0.23 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.50 2jjm h GLU 80 Cb 0.26 0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.69 2jjm h GLU 80 CO -0.26 -0.24 0.65 0.28 -0.73 0.00 0.00 179.01 178.72 2jjm h VAL 81 N -0.60 1.24 0.38 0.32 2.07 -0.46 -1.61 116.25 117.58 2jjm h VAL 81 Ca -0.05 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 2jjm h VAL 81 Cb 0.44 -0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 2jjm h VAL 81 CO 0.08 0.24 -0.50 0.00 0.02 0.00 0.00 177.57 177.41 2jjm h ALA 82 N 1.37 -1.07 0.00 1.67 0.00 -0.31 -0.23 119.26 120.69 2jjm h ALA 82 Ca 0.37 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2jjm h ALA 82 Cb -0.13 0.77 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2jjm h ALA 82 CO -0.09 -1.15 0.00 -0.56 0.00 0.00 0.00 179.25 177.45 2jjm h GLN 83 N -0.92 0.00 -0.00 0.00 3.07 -1.37 0.41 115.11 116.30 2jjm h GLN 83 Ca -0.04 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.66 2jjm h GLN 83 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.39 2jjm h GLN 83 CO -0.13 0.00 -0.14 -0.09 0.09 0.00 0.00 178.83 178.56 2jjm h ARG 84 N 0.00 0.10 -0.01 0.06 2.43 -1.09 -3.29 114.38 112.59 2jjm h ARG 84 Ca 0.00 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2jjm h ARG 84 Cb 0.86 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 2jjm h ARG 84 CO 0.00 0.85 -0.18 0.39 -1.51 0.00 0.00 179.97 179.52 2jjm n GLU 85 N -4.60 1.02 -3.47 0.20 -0.58 -0.12 -4.97 120.64 108.14 2jjm n GLU 85 Ca -0.09 -0.58 -0.22 0.00 -0.42 0.00 0.00 57.16 55.84 2jjm n GLU 85 Cb 0.44 -1.49 0.06 0.00 -0.57 0.00 0.00 31.44 29.88 2jjm n GLU 85 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2jjm n ASN 86 N -0.48 -5.57 -4.77 1.62 2.85 0.03 -4.96 115.26 103.99 2jjm n ASN 86 Ca 0.14 -0.84 -0.34 0.00 -0.11 0.00 0.00 54.58 53.43 2jjm n ASN 86 Cb 0.34 -4.37 0.02 0.00 1.24 0.00 0.00 39.78 37.01 2jjm n ASN 86 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2jjm s LEU 87 N -5.96 3.61 -0.23 1.20 1.43 -0.59 -4.87 118.68 113.26 2jjm s LEU 87 Ca 0.42 2.09 -0.16 0.00 -1.03 0.00 0.00 54.13 55.45 2jjm s LEU 87 Cb -0.10 -4.57 -0.11 0.00 0.03 0.00 0.00 46.19 41.44 2jjm s LEU 87 CO 0.80 -1.36 -0.23 0.47 0.23 0.00 0.00 176.35 176.26 2jjm n ASP 88 N -1.74 1.92 -4.43 2.29 8.00 0.26 -4.82 116.55 118.03 2jjm n ASP 88 Ca 0.11 0.38 -0.29 0.00 0.71 0.00 0.00 54.79 55.70 2jjm n ASP 88 Cb 0.51 -0.84 -0.12 0.00 -0.02 0.00 0.00 41.12 40.65 2jjm n ASP 88 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2jjm s ILE 89 N -2.54 2.49 -0.28 0.53 1.09 -1.18 -1.90 121.20 119.42 2jjm s ILE 89 Ca -0.33 -1.64 0.01 0.00 -1.10 0.00 0.00 60.65 57.59 2jjm s ILE 89 Cb 0.10 -2.11 0.08 0.00 -1.06 0.00 0.00 42.46 39.46 2jjm s ILE 89 CO 0.47 0.11 0.01 -0.22 -0.10 0.00 0.00 174.94 175.21 2jjm s LEU 90 N -2.05 2.97 -0.32 2.97 2.96 0.11 -1.16 118.68 124.15 2jjm s LEU 90 Ca 0.15 -1.52 -0.11 0.00 -0.22 0.00 0.00 54.13 52.44 2jjm s LEU 90 Cb -0.10 -1.19 -0.01 0.00 0.50 0.00 0.00 46.19 45.39 2jjm s LEU 90 CO 0.07 -0.32 0.18 -2.28 -1.32 0.00 0.00 176.35 172.69 2jjm s HIS 91 N 1.35 3.20 0.11 5.38 5.65 0.14 -0.93 115.29 130.19 2jjm s HIS 91 Ca 0.02 -0.44 0.06 0.00 0.25 0.00 0.00 55.06 54.96 2jjm s HIS 91 Cb -0.18 -2.40 -0.04 0.00 -1.18 0.00 0.00 32.58 28.78 2jjm s HIS 91 CO -0.11 -0.42 -0.05 0.08 -0.65 0.00 0.00 174.74 173.59 2jjm s VAL 92 N 1.65 3.65 -0.03 0.89 1.01 0.13 -1.78 120.40 125.92 2jjm s VAL 92 Ca 0.05 -1.21 0.06 0.00 0.00 0.00 0.00 61.98 60.87 2jjm s VAL 92 Cb -0.17 -2.75 -0.08 0.00 0.00 0.00 0.00 36.38 33.38 2jjm s VAL 92 CO 0.08 0.07 0.08 1.41 0.00 0.00 0.00 175.10 176.73 2jjm n HIS 93 N 0.48 0.00 -3.59 5.22 8.25 -0.15 -1.62 115.22 123.81 2jjm n HIS 93 Ca -0.12 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.12 2jjm n HIS 93 Cb 0.53 -0.22 -0.01 0.00 1.12 0.00 0.00 29.99 31.41 2jjm n HIS 93 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2jjm s TYR 94 N -2.28 2.13 -0.17 4.41 5.04 -1.26 -4.58 117.35 120.64 2jjm s TYR 94 Ca -0.03 -0.65 -0.22 0.00 -2.44 0.00 0.00 57.07 53.73 2jjm s TYR 94 Cb 0.03 -2.09 -0.20 0.00 0.35 0.00 0.00 41.96 40.05 2jjm s TYR 94 CO 0.25 -0.41 0.41 0.00 -1.34 0.00 0.00 175.55 174.46 2jjm h ALA 95 N 0.80 0.11 -2.67 3.97 0.00 -1.92 -3.37 119.26 116.19 2jjm h ALA 95 Ca -0.38 -0.77 -0.63 0.00 0.00 0.00 0.00 54.91 53.13 2jjm h ALA 95 Cb 1.28 0.35 -0.06 0.00 0.00 0.00 0.00 17.79 19.37 2jjm h ALA 95 CO 0.55 0.34 -0.30 0.42 0.00 0.00 0.00 179.25 180.25 2jjm s ILE 96 N -2.23 5.20 -0.27 0.00 -1.09 -1.26 -0.97 121.20 120.57 2jjm s ILE 96 Ca -0.22 0.61 0.19 0.00 -2.23 0.00 0.00 60.65 59.01 2jjm s ILE 96 Cb 0.01 -3.60 0.13 0.00 -1.58 0.00 0.00 42.46 37.43 2jjm s ILE 96 CO 0.57 0.59 1.37 -0.65 -1.23 0.00 0.00 174.94 175.59 2jjm h PRO 97 N 4.82 0.00 -0.57 2.79 0.11 -2.02 -3.47 132.00 133.65 2jjm h PRO 97 Ca -0.53 0.00 0.20 0.00 0.11 0.00 0.00 66.00 65.79 2jjm h PRO 97 Cb 1.22 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.23 2jjm h PRO 97 CO 0.60 0.21 0.19 0.72 -0.21 0.00 0.00 178.00 179.50 2jjm n HIS 98 N -3.05 0.54 0.13 0.65 8.25 -1.22 -0.37 115.22 120.15 2jjm n HIS 98 Ca 0.01 0.67 -0.14 0.00 -0.26 0.00 0.00 57.72 58.01 2jjm n HIS 98 Cb 0.64 -1.04 -0.08 0.00 1.12 0.00 0.00 29.99 30.63 2jjm n HIS 98 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jjm h ALA 99 N 1.13 -0.27 -0.43 -1.41 0.00 -1.21 -0.24 119.26 116.84 2jjm h ALA 99 Ca 0.43 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 2jjm h ALA 99 Cb 1.04 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2jjm h ALA 99 CO -0.48 -0.60 -0.06 0.82 0.00 0.00 0.00 179.25 178.93 2jjm h ILE 100 N -0.37 1.24 -0.63 0.00 5.03 -0.86 -1.83 117.51 120.10 2jjm h ILE 100 Ca -0.03 -1.05 -0.02 0.00 -0.12 0.00 0.00 64.86 63.64 2jjm h ILE 100 Cb 0.28 0.98 -0.03 0.00 -3.03 0.00 0.00 36.82 35.03 2jjm h ILE 100 CO 0.05 0.36 0.32 0.00 -0.68 0.00 0.00 178.15 178.19 2jjm h ALA 102 N 1.14 1.39 0.21 0.00 0.00 -0.80 -0.98 119.26 120.22 2jjm h ALA 102 Ca 0.22 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2jjm h ALA 102 Cb 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2jjm h ALA 102 CO -0.03 0.43 -0.10 -0.92 0.00 0.00 0.00 179.25 178.62 2jjm h TYR 103 N 0.18 -0.27 -0.34 0.00 3.20 -0.46 -1.17 116.97 118.11 2jjm h TYR 103 Ca 0.03 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.96 2jjm h TYR 103 Cb 0.53 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.83 2jjm h TYR 103 CO 0.01 -0.04 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.41 2jjm h LEU 104 N -0.46 -0.17 -0.43 2.82 3.38 -1.13 -0.55 115.31 118.76 2jjm h LEU 104 Ca -0.03 0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.11 2jjm h LEU 104 Cb 0.35 0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 2jjm h LEU 104 CO 0.05 -0.05 -0.06 0.00 0.09 0.00 0.00 178.44 178.47 2jjm h ALA 105 N 1.31 0.33 0.20 1.53 0.00 -1.08 0.27 119.26 121.82 2jjm h ALA 105 Ca 0.17 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.23 2jjm h ALA 105 Cb 0.23 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2jjm h ALA 105 CO -0.29 -0.43 -0.21 -0.22 0.00 0.00 0.00 179.25 178.10 2jjm h LYS 106 N 0.04 -0.43 -0.81 0.00 3.64 -0.56 -1.06 116.57 117.40 2jjm h LYS 106 Ca 0.21 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.66 2jjm h LYS 106 Cb 0.31 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.18 2jjm h LYS 106 CO -0.40 -0.29 0.53 1.96 -2.27 0.00 0.00 179.45 178.98 2jjm h GLN 107 N -0.45 0.95 -0.07 1.90 1.08 -0.58 0.27 115.11 118.21 2jjm h GLN 107 Ca 0.00 -0.06 -0.10 0.00 -1.45 0.00 0.00 58.65 57.05 2jjm h GLN 107 Cb 0.42 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 2jjm h GLN 107 CO -0.06 0.63 -0.41 0.52 -0.95 0.00 0.00 178.83 178.56 2jjm h MET 108 N 0.97 0.15 -0.91 1.46 2.86 0.08 -3.07 114.93 116.48 2jjm h MET 108 Ca 0.32 -0.07 -0.45 0.00 -2.06 0.00 0.00 59.70 57.45 2jjm h MET 108 Cb 0.07 -0.00 -0.27 0.00 0.06 0.00 0.00 31.60 31.46 2jjm h MET 108 CO -0.10 0.54 0.54 0.44 1.06 0.00 0.00 176.91 179.39 2jjm n ILE 109 N -4.04 3.12 -1.72 -1.22 -5.35 -0.45 -4.90 119.36 104.80 2jjm n ILE 109 Ca -0.02 -1.93 -0.13 0.00 -0.27 0.00 0.00 62.75 60.41 2jjm n ILE 109 Cb 0.46 -0.44 -0.03 0.00 -1.74 0.00 0.00 39.64 37.88 2jjm n ILE 109 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jjm n GLY 110 N -0.99 0.75 2.44 3.28 0.00 -1.12 -3.26 105.19 106.29 2jjm n GLY 110 Ca 0.55 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 2jjm n GLY 110 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jjm n GLU 111 N -2.46 -1.13 -1.23 1.61 1.02 0.89 -4.90 120.64 114.43 2jjm n GLU 111 Ca -0.14 1.02 -0.20 0.00 -0.02 0.00 0.00 57.16 57.82 2jjm n GLU 111 Cb 0.49 -5.23 -0.08 0.00 -0.02 0.00 0.00 31.44 26.60 2jjm n GLU 111 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2jjm n ARG 112 N -2.54 2.16 -3.52 3.49 1.74 -1.20 -4.84 116.66 111.95 2jjm n ARG 112 Ca -0.16 -1.75 -0.13 0.00 -0.77 0.00 0.00 57.85 55.04 2jjm n ARG 112 Cb 0.54 -2.00 -0.04 0.00 -1.02 0.00 0.00 32.46 29.94 2jjm n ARG 112 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 2jjm s ILE 113 N -1.14 0.00 -0.18 0.55 -1.16 -1.26 -4.93 121.20 113.07 2jjm s ILE 113 Ca 0.56 0.00 -0.05 0.00 -0.51 0.00 0.00 60.65 60.65 2jjm s ILE 113 Cb 0.33 -1.00 -0.03 0.00 0.61 0.00 0.00 42.46 42.37 2jjm s ILE 113 CO -0.12 0.00 0.00 -0.54 -2.81 0.00 0.00 174.94 171.47 2jjm s LYS 114 N -1.86 3.70 -0.20 3.50 -0.14 -0.80 -5.01 119.74 118.94 2jjm s LYS 114 Ca -0.03 -0.49 -0.13 0.00 -1.36 0.00 0.00 55.97 53.96 2jjm s LYS 114 Cb -0.00 -3.06 -0.05 0.00 -1.68 0.00 0.00 37.83 33.04 2jjm s LYS 114 CO 0.00 0.12 0.27 0.42 -0.76 0.00 0.00 175.35 175.41 2jjm s ILE 115 N 0.71 5.30 -0.20 2.17 1.01 -1.26 -0.72 121.20 128.21 2jjm s ILE 115 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.12 2jjm s ILE 115 Cb -0.14 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.74 2jjm s ILE 115 CO 0.02 0.34 -0.15 -0.69 0.00 0.00 0.00 174.94 174.46 2jjm s VAL 116 N 0.84 2.33 -0.17 2.92 1.01 -0.10 -0.87 120.40 126.35 2jjm s VAL 116 Ca 0.14 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.08 2jjm s VAL 116 Cb -0.13 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 2jjm s VAL 116 CO 0.04 0.40 -0.03 -0.89 0.00 0.00 0.00 175.10 174.63 2jjm s THR 117 N 1.29 3.89 -0.18 3.92 2.01 -0.36 -0.69 115.64 125.51 2jjm s THR 117 Ca 0.03 -0.35 -0.05 0.00 0.31 0.00 0.00 61.69 61.63 2jjm s THR 117 Cb -0.15 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.62 2jjm s THR 117 CO -0.10 0.47 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.40 2jjm s THR 118 N 0.60 3.95 0.50 -0.82 2.01 -0.64 -0.87 115.64 120.37 2jjm s THR 118 Ca -0.02 -0.32 -0.01 0.00 0.31 0.00 0.00 61.69 61.65 2jjm s THR 118 Cb -0.14 -2.77 0.01 0.00 0.01 0.00 0.00 72.50 69.61 2jjm s THR 118 CO 0.02 0.45 0.74 -0.76 -0.69 0.00 0.00 174.62 174.38 2jjm s LEU 119 N 0.77 3.50 0.00 4.42 1.43 0.13 -4.33 118.68 124.59 2jjm s LEU 119 Ca -0.00 0.32 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 2jjm s LEU 119 Cb -0.14 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 42.89 2jjm s LEU 119 CO 0.02 -0.85 0.00 1.41 0.23 0.00 0.00 176.35 177.16 2jjm n HIS 120 N -2.23 -0.39 0.19 0.29 8.25 -1.26 -3.71 115.22 116.36 2jjm n HIS 120 Ca 0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.39 2jjm n HIS 120 Cb 0.58 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.64 2jjm n HIS 120 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2jjm h GLY 121 N 0.00 -0.90 1.53 -1.41 0.00 -1.98 -3.37 103.07 96.94 2jjm h GLY 121 Ca 0.00 0.39 -0.25 0.00 0.00 0.00 0.00 47.33 47.47 2jjm h GLY 121 CO 0.00 -0.30 -1.08 -0.91 0.00 0.00 0.00 176.54 174.25 2jjm h THR 122 N -0.58 1.42 -0.95 4.70 1.35 -2.00 -0.93 112.91 115.92 2jjm h THR 122 Ca -0.05 -2.64 0.23 0.00 -0.55 0.00 0.00 66.41 63.40 2jjm h THR 122 Cb 0.48 2.62 -0.07 0.00 -1.73 0.00 0.00 68.15 69.45 2jjm h THR 122 CO 0.02 0.78 0.63 -2.24 -0.25 0.00 0.00 175.52 174.46 2jjm h ASP 123 N 0.18 0.40 0.00 5.36 2.03 -1.97 0.78 116.42 123.21 2jjm h ASP 123 Ca -0.11 0.05 -0.29 0.00 -0.73 0.00 0.00 57.03 55.95 2jjm h ASP 123 Cb 1.75 -0.02 -0.04 0.00 -0.83 0.00 0.00 39.33 40.18 2jjm h ASP 123 CO 0.19 0.14 -1.96 -0.38 -1.03 0.00 0.00 179.24 176.19 2jjm n ILE 124 N -4.53 1.51 -0.07 4.15 -0.00 -1.24 -2.55 119.36 116.62 2jjm n ILE 124 Ca 0.21 -0.19 -0.06 0.00 -0.00 0.00 0.00 62.75 62.71 2jjm n ILE 124 Cb 0.77 -2.05 -0.04 0.00 -0.00 0.00 0.00 39.64 38.31 2jjm n ILE 124 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.55 177.29 2jjm h THR 125 N -0.99 0.00 0.05 1.39 2.02 -1.03 -2.17 112.91 112.18 2jjm h THR 125 Ca -0.44 0.00 -0.34 0.00 0.77 0.00 0.00 66.41 66.40 2jjm h THR 125 Cb 1.38 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 2jjm h THR 125 CO -0.27 0.00 -1.89 0.55 0.37 0.00 0.00 175.52 174.29 2jjm n VAL 126 N -3.90 1.63 0.12 3.16 3.14 -0.04 -4.16 118.33 118.29 2jjm n VAL 126 Ca -0.01 -0.40 -0.14 0.00 -2.96 0.00 0.00 64.34 60.83 2jjm n VAL 126 Cb 0.15 -1.82 -0.08 0.00 -1.06 0.00 0.00 33.84 31.03 2jjm n VAL 126 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2jjm h LEU 127 N -0.43 -0.24 -1.65 6.55 3.38 -1.06 -2.83 115.31 119.03 2jjm h LEU 127 Ca -0.46 -0.14 0.05 0.00 0.09 0.00 0.00 57.88 57.43 2jjm h LEU 127 Cb 1.72 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.53 2jjm h LEU 127 CO -0.10 -0.00 0.52 1.23 0.09 0.00 0.00 178.44 180.18 2jjm h GLY 128 N -0.48 0.00 1.33 0.83 0.00 -1.10 0.30 103.07 103.95 2jjm h GLY 128 Ca -0.03 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.13 2jjm h GLY 128 CO 0.05 0.00 -0.51 1.48 0.00 0.00 0.00 176.54 177.56 2jjm h SER 129 N 0.00 0.79 -2.71 0.19 4.64 -1.62 -3.43 113.55 111.40 2jjm h SER 129 Ca 0.09 -0.41 -0.57 0.00 -0.47 0.00 0.00 61.79 60.43 2jjm h SER 129 Cb 1.12 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.96 2jjm h SER 129 CO -0.00 1.15 1.16 -0.62 -0.87 0.00 0.00 176.83 177.66 2jjm s ASP 130 N -6.91 6.28 0.60 4.97 3.68 0.11 -4.90 116.67 120.50 2jjm s ASP 130 Ca -0.09 1.63 0.31 0.00 2.13 0.00 0.00 52.55 56.52 2jjm s ASP 130 Cb 0.11 -2.53 1.83 0.00 -1.45 0.00 0.00 42.92 40.88 2jjm s ASP 130 CO 0.86 -1.34 2.23 1.55 0.13 0.00 0.00 175.17 178.60 2jjm h PRO 131 N 11.16 0.00 0.00 4.34 0.13 -1.85 -0.96 132.00 144.82 2jjm h PRO 131 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2jjm h PRO 131 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2jjm h PRO 131 CO 1.00 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.64 2jjm n SER 132 N -3.77 0.00 0.00 1.44 3.41 -1.26 -3.24 113.62 110.20 2jjm n SER 132 Ca -0.02 0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 2jjm n SER 132 Cb 0.14 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 2jjm n SER 132 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jjm n LEU 133 N -1.36 0.32 0.09 1.04 4.77 -0.42 -4.86 117.00 116.57 2jjm n LEU 133 Ca 0.07 -0.32 -0.04 0.00 -0.03 0.00 0.00 56.01 55.70 2jjm n LEU 133 Cb 0.16 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.23 2jjm n LEU 133 CO 0.14 0.08 0.51 -1.13 -1.33 0.00 0.00 177.39 175.66 2jjm h ASN 134 N 0.00 -0.22 -0.71 -1.43 -1.24 -1.38 -1.12 115.58 109.48 2jjm h ASN 134 Ca 0.00 0.01 0.21 0.00 0.71 0.00 0.00 56.30 57.23 2jjm h ASN 134 Cb 0.61 0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.69 2jjm h ASN 134 CO 0.00 -0.14 0.58 -0.55 -1.29 0.00 0.00 177.43 176.02 2jjm h ASN 135 N -0.23 0.00 -0.17 1.15 -1.07 -1.90 0.65 115.58 114.01 2jjm h ASN 135 Ca -0.02 0.00 -0.12 0.00 0.07 0.00 0.00 56.30 56.23 2jjm h ASN 135 Cb 0.18 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.44 2jjm h ASN 135 CO 0.03 0.00 -0.37 0.25 0.07 0.00 0.00 177.43 177.41 2jjm h LEU 136 N 0.00 0.61 -0.49 6.14 5.85 -1.83 -1.04 115.31 124.55 2jjm h LEU 136 Ca 0.34 -0.56 -0.08 0.00 0.84 0.00 0.00 57.88 58.41 2jjm h LEU 136 Cb 1.48 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.32 2jjm h LEU 136 CO -0.00 1.06 -0.02 0.40 -0.34 0.00 0.00 178.44 179.53 2jjm h ILE 137 N 0.18 1.27 0.57 4.05 2.04 0.37 -1.80 117.51 124.18 2jjm h ILE 137 Ca 0.00 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 64.72 2jjm h ILE 137 Cb 0.97 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2jjm h ILE 137 CO 0.08 0.39 -0.30 -0.09 0.00 0.00 0.00 178.15 178.22 2jjm h ARG 138 N 0.74 -0.78 -0.71 2.37 2.43 -1.10 -1.44 114.38 115.89 2jjm h ARG 138 Ca 0.14 0.05 0.13 0.00 -0.81 0.00 0.00 59.98 59.49 2jjm h ARG 138 Cb 0.55 0.18 -0.09 0.00 -0.42 0.00 0.00 29.97 30.18 2jjm h ARG 138 CO 0.03 -0.52 0.25 0.35 -1.51 0.00 0.00 179.97 178.57 2jjm h PHE 139 N -0.81 0.42 -0.72 2.20 3.04 -1.15 0.11 116.94 120.02 2jjm h PHE 139 Ca -0.07 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 61.91 2jjm h PHE 139 Cb 0.64 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 39.04 2jjm h PHE 139 CO -0.06 0.03 0.45 0.78 -2.02 0.00 0.00 178.31 177.49 2jjm h GLY 140 N 0.39 1.03 0.68 2.40 0.00 -1.07 -0.51 103.07 105.98 2jjm h GLY 140 Ca 0.38 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 2jjm h GLY 140 CO -0.40 0.40 -0.11 -2.22 0.00 0.00 0.00 176.54 174.21 2jjm h ILE 141 N 0.98 0.84 -0.38 2.60 2.04 -0.12 -2.81 117.51 120.65 2jjm h ILE 141 Ca 0.26 -0.62 0.07 0.00 1.00 0.00 0.00 64.86 65.57 2jjm h ILE 141 Cb -0.06 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2jjm h ILE 141 CO -0.05 0.13 0.26 -0.33 0.00 0.00 0.00 178.15 178.16 2jjm h GLU 142 N -0.64 0.20 0.00 2.37 5.08 -0.71 -2.12 114.58 118.76 2jjm h GLU 142 Ca -0.03 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2jjm h GLU 142 Cb 0.46 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2jjm h GLU 142 CO 0.05 0.13 -0.19 1.96 -1.00 0.00 0.00 179.01 179.96 2jjm h GLN 143 N 0.20 0.00 -7.17 2.33 1.08 -1.04 -3.46 115.11 107.05 2jjm h GLN 143 Ca 0.17 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.88 2jjm h GLN 143 Cb 0.42 0.00 0.07 0.00 -0.05 0.00 0.00 27.48 27.92 2jjm h GLN 143 CO -0.03 0.00 0.38 -1.12 -0.95 0.00 0.00 178.83 177.11 2jjm s SER 144 N -4.78 5.66 0.08 1.46 0.01 -0.80 -4.97 113.70 110.36 2jjm s SER 144 Ca 0.08 1.91 -0.11 0.00 1.31 0.00 0.00 55.95 59.15 2jjm s SER 144 Cb 0.11 -2.55 -0.24 0.00 0.21 0.00 0.00 66.02 63.56 2jjm s SER 144 CO 0.65 -1.25 1.16 0.44 0.41 0.00 0.00 173.24 174.64 2jjm h ASP 145 N 0.52 0.73 -4.25 2.44 3.32 -1.31 -3.45 116.42 114.41 2jjm h ASP 145 Ca -0.47 -0.66 -0.31 0.00 0.02 0.00 0.00 57.03 55.60 2jjm h ASP 145 Cb 1.23 -0.23 -0.26 0.00 0.22 0.00 0.00 39.33 40.30 2jjm h ASP 145 CO 0.57 1.48 -0.75 -0.69 -1.72 0.00 0.00 179.24 178.13 2jjm s VAL 146 N -3.00 0.51 -0.01 -1.35 1.01 -0.88 -5.03 120.40 111.64 2jjm s VAL 146 Ca -0.08 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.34 2jjm s VAL 146 Cb 0.07 -0.49 -0.00 0.00 0.00 0.00 0.00 36.38 35.96 2jjm s VAL 146 CO 0.91 -0.07 -0.07 -0.69 0.00 0.00 0.00 175.10 175.18 2jjm s VAL 147 N -0.63 0.62 0.14 2.92 1.01 -1.26 -1.22 120.40 121.98 2jjm s VAL 147 Ca -0.02 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.67 2jjm s VAL 147 Cb -0.05 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 2jjm s VAL 147 CO 0.00 0.19 -0.03 0.42 0.00 0.00 0.00 175.10 175.68 2jjm s THR 148 N 0.01 0.70 0.23 3.92 -4.23 -0.05 -1.60 115.64 114.63 2jjm s THR 148 Ca 0.00 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 2jjm s THR 148 Cb -0.05 -1.95 -0.05 0.00 1.34 0.00 0.00 72.50 71.79 2jjm s THR 148 CO -0.00 -0.63 0.02 0.00 -0.54 0.00 0.00 174.62 173.46 2jjm s ALA 149 N -3.63 1.76 -0.77 3.99 0.00 -0.30 0.19 121.76 123.00 2jjm s ALA 149 Ca 0.19 -1.78 0.25 0.00 0.00 0.00 0.00 51.96 50.62 2jjm s ALA 149 Cb 0.06 0.60 0.43 0.00 0.00 0.00 0.00 23.12 24.20 2jjm s ALA 149 CO 0.01 -0.30 1.37 1.33 0.00 0.00 0.00 175.76 178.17 2jjm n VAL 150 N -0.42 0.22 -3.50 0.00 0.24 -1.24 -0.97 118.33 112.65 2jjm n VAL 150 Ca -0.04 -0.17 -0.15 0.00 -2.04 0.00 0.00 64.34 61.94 2jjm n VAL 150 Cb 0.64 -0.01 -0.04 0.00 -1.47 0.00 0.00 33.84 32.96 2jjm n VAL 150 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2jjm s SER 151 N -3.76 -0.57 0.43 -1.34 1.04 -1.26 -4.17 113.70 104.06 2jjm s SER 151 Ca 0.08 0.31 0.13 0.00 0.48 0.00 0.00 55.95 56.95 2jjm s SER 151 Cb 0.15 0.55 0.93 0.00 0.10 0.00 0.00 66.02 67.75 2jjm s SER 151 CO 0.71 -0.77 1.96 0.45 0.98 0.00 0.00 173.24 176.57 2jjm h HIS 152 N 2.59 0.06 -0.84 5.02 -0.00 -1.93 -1.65 115.15 118.41 2jjm h HIS 152 Ca -0.31 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.07 2jjm h HIS 152 Cb 1.22 -0.02 -0.04 0.00 -0.00 0.00 0.00 27.41 28.57 2jjm h HIS 152 CO 0.32 0.24 0.55 1.03 -0.00 0.00 0.00 177.93 180.08 2jjm h SER 153 N 0.06 0.96 -0.16 2.45 0.87 -1.92 -2.01 113.55 113.80 2jjm h SER 153 Ca 0.01 -0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.52 2jjm h SER 153 Cb 0.35 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 2jjm h SER 153 CO 0.02 0.69 -0.02 0.25 -0.53 0.00 0.00 176.83 177.25 2jjm h LEU 154 N 1.13 0.30 -2.70 2.23 5.85 -1.62 -0.74 115.31 119.76 2jjm h LEU 154 Ca 0.31 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2jjm h LEU 154 Cb -0.13 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 2jjm h LEU 154 CO -0.07 0.56 0.08 0.40 -0.34 0.00 0.00 178.44 179.08 2jjm h ILE 155 N 0.02 0.08 0.07 4.05 2.04 -1.07 0.29 117.51 123.00 2jjm h ILE 155 Ca 0.04 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.73 2jjm h ILE 155 Cb 0.42 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2jjm h ILE 155 CO 0.01 0.00 -0.85 0.78 0.00 0.00 0.00 178.15 178.09 2jjm h ASN 156 N 0.00 0.24 -0.63 1.72 2.35 -0.70 -2.99 115.58 115.57 2jjm h ASN 156 Ca 0.01 -0.87 0.01 0.00 -0.55 0.00 0.00 56.30 54.90 2jjm h ASN 156 Cb 0.17 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 2jjm h ASN 156 CO -0.00 1.37 0.42 -0.33 -1.65 0.00 0.00 177.43 177.24 2jjm h GLU 157 N -0.62 0.81 0.00 0.81 4.39 -0.00 -1.45 114.58 118.53 2jjm h GLU 157 Ca -0.19 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.46 2jjm h GLU 157 Cb 1.46 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 2jjm h GLU 157 CO 0.03 0.54 -0.00 1.15 -1.16 0.00 0.00 179.01 179.56 2jjm h THR 158 N 0.84 1.17 0.00 1.13 2.02 -0.56 -0.60 112.91 116.92 2jjm h THR 158 Ca 0.24 -0.52 0.00 0.00 0.77 0.00 0.00 66.41 66.90 2jjm h THR 158 Cb -0.06 1.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2jjm h THR 158 CO -0.05 0.14 0.00 0.45 0.37 0.00 0.00 175.52 176.42 2jjm h HIS 159 N -0.23 0.00 0.04 3.16 3.86 -1.32 -0.94 115.15 119.72 2jjm h HIS 159 Ca -0.00 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.03 2jjm h HIS 159 Cb 0.22 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 2jjm h HIS 159 CO 0.00 0.00 -0.95 1.49 0.86 0.00 0.00 177.93 179.33 2jjm h GLU 160 N 0.00 0.08 0.00 2.45 4.81 -0.88 -3.29 114.58 117.74 2jjm h GLU 160 Ca 0.00 -0.13 -0.19 0.00 -0.13 0.00 0.00 59.36 58.91 2jjm h GLU 160 Cb 0.42 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 2jjm h GLU 160 CO 0.00 1.06 -1.03 -0.07 -0.73 0.00 0.00 179.01 178.24 2jjm h LEU 161 N -0.78 0.01 0.17 1.64 3.38 -1.11 -3.41 115.31 115.21 2jjm h LEU 161 Ca -0.23 -0.61 -0.33 0.00 0.09 0.00 0.00 57.88 56.80 2jjm h LEU 161 Cb 1.36 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.12 2jjm h LEU 161 CO -0.07 1.40 -1.59 0.58 0.09 0.00 0.00 178.44 178.86 2jjm h VAL 162 N -0.98 1.12 -5.71 1.22 2.07 -1.39 -3.49 116.25 109.09 2jjm h VAL 162 Ca -0.28 -2.69 -0.33 0.00 0.82 0.00 0.00 66.70 64.21 2jjm h VAL 162 Cb 1.26 2.82 0.15 0.00 -1.52 0.00 0.00 31.29 34.01 2jjm h VAL 162 CO -0.16 0.84 -0.81 0.29 0.02 0.00 0.00 177.57 177.74 2jjm n LYS 163 N -3.55 -5.19 -2.64 1.57 5.02 -0.69 -4.85 118.16 107.83 2jjm n LYS 163 Ca -0.19 0.80 -0.33 0.00 -2.02 0.00 0.00 58.31 56.57 2jjm n LYS 163 Cb 1.07 -5.67 -0.05 0.00 -0.02 0.00 0.00 35.03 30.35 2jjm n LYS 163 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2jjm s PRO 164 N -5.29 4.05 -1.14 1.97 0.04 -1.26 -4.97 135.00 128.40 2jjm s PRO 164 Ca 0.11 1.13 -0.05 0.00 0.04 0.00 0.00 61.00 62.23 2jjm s PRO 164 Cb -0.02 -2.15 0.26 0.00 0.04 0.00 0.00 34.50 32.64 2jjm s PRO 164 CO 0.75 -0.19 1.71 0.09 0.04 0.00 0.00 177.00 179.40 2jjm n ASN 165 N -0.98 6.43 -3.70 6.66 5.03 -1.26 -4.91 115.26 122.53 2jjm n ASN 165 Ca 0.07 -3.37 -0.11 0.00 0.87 0.00 0.00 54.58 52.04 2jjm n ASN 165 Cb 0.54 -1.31 -0.06 0.00 -1.02 0.00 0.00 39.78 37.93 2jjm n ASN 165 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 2jjm s LYS 166 N -2.21 0.95 -0.07 3.52 2.47 -1.26 -4.91 119.74 118.23 2jjm s LYS 166 Ca 0.36 -0.63 -0.15 0.00 -1.56 0.00 0.00 55.97 53.99 2jjm s LYS 166 Cb 0.10 0.41 -0.05 0.00 -1.46 0.00 0.00 37.83 36.83 2jjm s LYS 166 CO 0.03 -0.34 0.40 -0.51 0.16 0.00 0.00 175.35 175.09 2jjm s ASP 167 N -2.50 6.69 -0.14 1.43 1.01 -1.26 -5.08 116.67 116.82 2jjm s ASP 167 Ca -0.00 0.82 0.01 0.00 0.71 0.00 0.00 52.55 54.09 2jjm s ASP 167 Cb 0.01 -2.24 0.00 0.00 1.01 0.00 0.00 42.92 41.70 2jjm s ASP 167 CO -0.08 0.19 -0.18 -0.63 0.21 0.00 0.00 175.17 174.67 2jjm s ILE 168 N -0.27 2.41 0.64 0.77 1.01 -1.26 -4.26 121.20 120.24 2jjm s ILE 168 Ca 0.23 -0.86 -0.04 0.00 0.00 0.00 0.00 60.65 59.97 2jjm s ILE 168 Cb -0.15 -1.99 0.05 0.00 0.01 0.00 0.00 42.46 40.37 2jjm s ILE 168 CO 0.10 0.53 0.93 -1.10 0.00 0.00 0.00 174.94 175.40 2jjm s GLN 169 N 0.76 2.38 -0.11 2.79 -0.21 -0.63 -4.89 119.66 119.74 2jjm s GLN 169 Ca -0.07 -0.39 0.02 0.00 0.02 0.00 0.00 55.36 54.94 2jjm s GLN 169 Cb -0.16 -2.28 -0.01 0.00 1.00 0.00 0.00 33.01 31.57 2jjm s GLN 169 CO 0.00 -1.02 -0.19 0.99 -2.12 0.00 0.00 175.29 172.95 2jjm s THR 170 N -3.07 2.55 -0.17 -0.19 2.01 -1.26 -1.14 115.64 114.37 2jjm s THR 170 Ca 0.58 -0.85 -0.04 0.00 0.31 0.00 0.00 61.69 61.69 2jjm s THR 170 Cb -0.11 -2.02 0.07 0.00 0.01 0.00 0.00 72.50 70.46 2jjm s THR 170 CO 0.43 0.55 0.17 -0.69 -0.69 0.00 0.00 174.62 174.38 2jjm s VAL 171 N 0.24 -0.24 0.80 3.82 1.01 -0.15 -4.91 120.40 120.98 2jjm s VAL 171 Ca -0.13 -0.02 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 2jjm s VAL 171 Cb -0.16 -0.56 0.07 0.00 0.00 0.00 0.00 36.38 35.73 2jjm s VAL 171 CO 0.07 -0.15 1.09 -0.31 0.00 0.00 0.00 175.10 175.79 2jjm s TYR 172 N 2.26 2.67 0.69 5.22 1.51 -1.26 -4.00 117.35 124.45 2jjm s TYR 172 Ca 0.05 1.35 -0.11 0.00 -1.01 0.00 0.00 57.07 57.34 2jjm s TYR 172 Cb -0.15 -3.06 0.01 0.00 -0.11 0.00 0.00 41.96 38.65 2jjm s TYR 172 CO -0.10 -1.85 1.08 -0.80 -1.11 0.00 0.00 175.55 172.77 2jjm s ASN 173 N -3.61 5.47 0.42 2.29 -0.87 -1.26 -4.97 114.94 112.40 2jjm s ASN 173 Ca 0.61 1.10 0.04 0.00 -1.57 0.00 0.00 52.86 53.04 2jjm s ASN 173 Cb -0.16 -1.91 -0.02 0.00 -0.02 0.00 0.00 41.25 39.14 2jjm s ASN 173 CO 0.56 -1.31 0.15 0.72 -2.57 0.00 0.00 177.10 174.65 2jjm s PHE 174 N -3.32 1.78 0.02 2.20 -0.12 -1.26 -4.90 117.98 112.37 2jjm s PHE 174 Ca 0.58 -1.36 0.01 0.00 -0.05 0.00 0.00 56.93 56.10 2jjm s PHE 174 Cb -0.11 -1.11 -0.02 0.00 -0.63 0.00 0.00 43.02 41.15 2jjm s PHE 174 CO 0.51 -0.39 -0.05 0.42 -0.05 0.00 0.00 175.22 175.66 2jjm s ILE 175 N -3.20 0.30 -0.68 -4.49 -1.09 -1.26 -4.94 121.20 105.84 2jjm s ILE 175 Ca 0.24 -0.74 -0.26 0.00 -2.23 0.00 0.00 60.65 57.66 2jjm s ILE 175 Cb 0.02 -0.37 0.04 0.00 -1.58 0.00 0.00 42.46 40.57 2jjm s ILE 175 CO 0.16 -0.30 1.15 -0.62 -1.23 0.00 0.00 174.94 174.10 2jjm s ASP 176 N -1.10 6.22 0.62 3.58 2.15 -1.26 -4.24 116.67 122.64 2jjm s ASP 176 Ca -0.09 -0.50 0.32 0.00 0.43 0.00 0.00 52.55 52.72 2jjm s ASP 176 Cb -0.07 -2.51 1.84 0.00 -0.30 0.00 0.00 42.92 41.87 2jjm s ASP 176 CO -0.00 -1.62 2.16 -0.33 -0.17 0.00 0.00 175.17 175.20 2jjm h GLU 177 N 9.76 0.00 0.00 4.34 5.08 -1.99 0.12 114.58 131.89 2jjm h GLU 177 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2jjm h GLU 177 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2jjm h GLU 177 CO 1.22 0.00 0.00 -2.13 -1.00 0.00 0.00 179.01 177.10 2jjm n ARG 178 N -3.55 0.49 0.00 2.33 3.00 -1.26 -2.73 116.66 114.94 2jjm n ARG 178 Ca -0.00 0.01 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2jjm n ARG 178 Cb 0.25 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.21 2jjm n ARG 178 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2jjm n VAL 179 N -1.01 0.00 -4.02 5.15 0.31 0.37 -4.99 118.33 114.13 2jjm n VAL 179 Ca 0.12 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.13 2jjm n VAL 179 Cb 0.06 -0.30 -0.15 0.00 -0.91 0.00 0.00 33.84 32.54 2jjm n VAL 179 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2jjm s TYR 180 N -1.58 3.54 0.23 3.52 1.51 -1.01 -4.88 117.35 118.68 2jjm s TYR 180 Ca 0.00 -2.66 0.01 0.00 -1.01 0.00 0.00 57.07 53.42 2jjm s TYR 180 Cb 0.00 -2.50 -0.05 0.00 -0.11 0.00 0.00 41.96 39.30 2jjm s TYR 180 CO 0.00 -0.92 0.06 -0.59 -1.11 0.00 0.00 175.55 173.00 2jjm s PHE 181 N 1.01 1.43 -0.87 2.71 -0.71 -1.26 -4.66 117.98 115.62 2jjm s PHE 181 Ca 0.02 -1.13 0.00 0.00 -1.04 0.00 0.00 56.93 54.78 2jjm s PHE 181 Cb -0.20 -0.83 0.00 0.00 -1.21 0.00 0.00 43.02 40.79 2jjm s PHE 181 CO -0.06 -0.30 0.38 1.17 -1.34 0.00 0.00 175.22 175.08 2jjm n LYS 182 N -0.39 0.68 -0.89 1.99 4.81 -1.26 -4.74 118.16 118.36 2jjm n LYS 182 Ca -0.02 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 57.08 2jjm n LYS 182 Cb 0.65 -1.32 0.11 0.00 0.02 0.00 0.00 35.03 34.50 2jjm n LYS 182 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2jjm n ARG 183 N 0.22 -0.17 -4.14 1.64 0.00 -1.26 -5.00 116.66 107.96 2jjm n ARG 183 Ca 0.00 -0.01 -0.28 0.00 -0.00 0.00 0.00 57.85 57.56 2jjm n ARG 183 Cb 0.19 -1.85 -0.17 0.00 -0.00 0.00 0.00 32.46 30.63 2jjm n ARG 183 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 2jjm s ASP 184 N -1.91 2.38 -1.34 2.89 3.84 -1.26 -4.62 116.67 116.66 2jjm s ASP 184 Ca 0.58 -0.40 -0.06 0.00 -0.00 0.00 0.00 52.55 52.68 2jjm s ASP 184 Cb -0.24 -1.02 0.11 0.00 -1.38 0.00 0.00 42.92 40.39 2jjm s ASP 184 CO 0.66 -0.05 2.40 0.23 -0.00 0.00 0.00 175.17 178.41 2jjm n MET 185 N 4.60 4.49 0.05 2.11 2.81 -1.26 -4.69 117.12 125.23 2jjm n MET 185 Ca -0.17 -3.38 0.02 0.00 -1.81 0.00 0.00 57.70 52.37 2jjm n MET 185 Cb 0.50 -2.66 0.38 0.00 -0.71 0.00 0.00 33.22 30.73 2jjm n MET 185 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2jjm h THR 186 N 2.68 1.16 0.00 2.03 1.03 -1.97 -1.88 112.91 115.95 2jjm h THR 186 Ca 0.70 -0.57 -0.09 0.00 -0.01 0.00 0.00 66.41 66.44 2jjm h THR 186 Cb 0.32 0.90 -0.01 0.00 -1.07 0.00 0.00 68.15 68.28 2jjm h THR 186 CO 1.51 0.20 -0.44 1.56 -0.01 0.00 0.00 175.52 178.34 2jjm h GLN 187 N 0.42 0.00 0.02 0.00 4.20 -2.02 -3.15 115.11 114.58 2jjm h GLN 187 Ca 0.10 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.58 2jjm h GLN 187 Cb 0.21 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 2jjm h GLN 187 CO 0.00 0.44 -0.97 1.25 -0.67 0.00 0.00 178.83 178.88 2jjm h LEU 188 N 0.00 0.44 -1.32 1.46 5.85 -1.74 -3.07 115.31 116.93 2jjm h LEU 188 Ca -0.00 -0.37 0.09 0.00 0.84 0.00 0.00 57.88 58.44 2jjm h LEU 188 Cb 0.92 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.76 2jjm h LEU 188 CO 0.06 1.18 0.53 0.11 -0.34 0.00 0.00 178.44 179.98 2jjm h LYS 189 N 0.17 0.75 -0.13 1.25 1.57 -1.39 0.15 116.57 118.94 2jjm h LYS 189 Ca -0.08 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 2jjm h LYS 189 Cb 1.62 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.75 2jjm h LYS 189 CO 0.16 0.50 0.03 -0.22 -0.57 0.00 0.00 179.45 179.35 2jjm h LYS 190 N 0.77 0.22 0.00 3.15 3.11 -1.62 -0.25 116.57 121.95 2jjm h LYS 190 Ca 0.37 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 58.16 2jjm h LYS 190 Cb 0.41 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.61 2jjm h LYS 190 CO -0.14 0.38 0.00 1.49 -2.81 0.00 0.00 179.45 178.37 2jjm h GLU 191 N 0.02 0.00 -0.02 1.90 4.81 -0.93 -0.35 114.58 120.01 2jjm h GLU 191 Ca 0.04 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2jjm h GLU 191 Cb 0.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2jjm h GLU 191 CO 0.00 0.00 -0.38 0.66 -0.73 0.00 0.00 179.01 178.56 2jjm n TYR 192 N -3.07 0.00 -1.29 0.92 4.01 -0.46 -5.01 117.16 112.26 2jjm n TYR 192 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2jjm n TYR 192 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 2jjm n TYR 192 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jjm n GLY 193 N 1.33 0.39 3.51 2.72 0.00 -0.14 -5.07 105.19 107.92 2jjm n GLY 193 Ca 0.09 -1.03 -0.31 0.00 0.00 0.00 0.00 46.02 44.78 2jjm n GLY 193 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jjm s ILE 194 N -2.00 3.06 0.00 -0.61 2.07 -0.25 -5.01 121.20 118.46 2jjm s ILE 194 Ca 0.00 -1.15 0.00 0.00 -1.41 0.00 0.00 60.65 58.09 2jjm s ILE 194 Cb 0.00 -2.33 0.00 0.00 0.13 0.00 0.00 42.46 40.26 2jjm s ILE 194 CO 0.00 0.29 0.00 -1.20 -1.91 0.00 0.00 174.94 172.12 2jjm n SER 195 N 1.34 0.00 -4.74 4.50 7.64 -1.26 -4.41 113.62 116.69 2jjm n SER 195 Ca -0.15 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.31 2jjm n SER 195 Cb 0.52 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.70 2jjm n SER 195 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2jjm s LYS 199 N 0.00 4.14 -0.17 1.43 -0.14 -1.17 -5.06 119.74 118.78 2jjm s LYS 199 Ca 0.00 2.54 0.00 0.00 -1.36 0.00 0.00 55.97 57.16 2jjm s LYS 199 Cb 0.00 -3.05 0.01 0.00 -1.68 0.00 0.00 37.83 33.10 2jjm s LYS 199 CO 0.00 -0.64 -0.17 0.42 -0.76 0.00 0.00 175.35 174.20 2jjm s ILE 200 N 0.38 2.39 -0.23 2.17 1.01 -1.26 -1.79 121.20 123.86 2jjm s ILE 200 Ca 0.66 -0.84 -0.05 0.00 0.00 0.00 0.00 60.65 60.42 2jjm s ILE 200 Cb -0.47 -2.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.98 2jjm s ILE 200 CO 0.42 0.52 -0.01 -0.76 0.00 0.00 0.00 174.94 175.11 2jjm s LEU 201 N 1.12 3.04 -0.05 2.97 1.02 -0.64 -0.77 118.68 125.37 2jjm s LEU 201 Ca 0.00 -0.37 0.03 0.00 0.02 0.00 0.00 54.13 53.82 2jjm s LEU 201 Cb -0.14 -1.78 -0.03 0.00 0.02 0.00 0.00 46.19 44.26 2jjm s LEU 201 CO -0.07 -0.03 -0.13 -0.51 0.02 0.00 0.00 176.35 175.64 2jjm s ILE 202 N 1.51 3.19 -0.03 -0.59 -1.16 -0.45 0.59 121.20 124.25 2jjm s ILE 202 Ca 0.06 -0.68 -0.00 0.00 -0.51 0.00 0.00 60.65 59.52 2jjm s ILE 202 Cb -0.15 -2.26 0.03 0.00 0.61 0.00 0.00 42.46 40.69 2jjm s ILE 202 CO -0.02 0.59 0.01 -2.28 -2.81 0.00 0.00 174.94 170.44 2jjm s HIS 203 N -0.72 0.25 -0.14 3.50 5.65 -0.22 -2.30 115.29 121.31 2jjm s HIS 203 Ca 0.11 0.05 0.03 0.00 0.25 0.00 0.00 55.06 55.49 2jjm s HIS 203 Cb -0.11 -0.41 0.01 0.00 -1.18 0.00 0.00 32.58 30.89 2jjm s HIS 203 CO 0.01 -0.14 -0.22 0.42 -0.65 0.00 0.00 174.74 174.16 2jjm s ILE 204 N 1.23 2.04 0.34 0.89 1.01 -1.26 -1.47 121.20 123.98 2jjm s ILE 204 Ca -0.07 -0.97 -0.17 0.00 0.00 0.00 0.00 60.65 59.44 2jjm s ILE 204 Cb -0.13 -1.80 0.06 0.00 0.01 0.00 0.00 42.46 40.60 2jjm s ILE 204 CO -0.02 0.55 0.87 -0.94 0.00 0.00 0.00 174.94 175.39 2jjm s SER 205 N 0.78 0.03 -0.39 3.58 1.04 -1.09 -5.02 113.70 112.63 2jjm s SER 205 Ca -0.08 -1.06 0.07 0.00 0.48 0.00 0.00 55.95 55.36 2jjm s SER 205 Cb -0.16 0.76 0.70 0.00 0.10 0.00 0.00 66.02 67.42 2jjm s SER 205 CO -0.01 -1.52 1.86 -0.46 0.98 0.00 0.00 173.24 174.09 2jjm n ASN 206 N -1.44 4.21 -4.14 7.02 0.23 -1.26 -3.98 115.26 115.88 2jjm n ASN 206 Ca -0.07 -3.44 -0.29 0.00 -0.53 0.00 0.00 54.58 50.24 2jjm n ASN 206 Cb 0.60 -0.79 -0.09 0.00 -2.08 0.00 0.00 39.78 37.42 2jjm n ASN 206 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 2jjm n PHE 207 N -0.70 -1.12 -3.66 -2.53 3.01 -1.26 -3.97 117.46 107.22 2jjm n PHE 207 Ca 0.51 0.56 -0.20 0.00 1.01 0.00 0.00 57.45 59.32 2jjm n PHE 207 Cb 1.53 -2.39 -0.02 0.00 -0.01 0.00 0.00 39.48 38.58 2jjm n PHE 207 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2jjm s ARG 208 N -6.89 2.94 0.44 -1.08 0.52 -1.26 -1.57 118.95 112.05 2jjm s ARG 208 Ca 0.10 -1.14 0.12 0.00 -0.52 0.00 0.00 55.73 54.29 2jjm s ARG 208 Cb -0.06 -2.65 0.96 0.00 0.52 0.00 0.00 34.95 33.72 2jjm s ARG 208 CO 0.90 0.10 2.00 0.87 0.02 0.00 0.00 175.30 179.19 2jjm h LYS 209 N 1.09 0.15 0.00 3.54 1.57 -1.99 -1.92 116.57 119.01 2jjm h LYS 209 Ca -0.46 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.25 2jjm h LYS 209 Cb 1.25 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 2jjm h LYS 209 CO 0.56 0.24 -0.25 0.28 -0.57 0.00 0.00 179.45 179.71 2jjm h VAL 210 N 0.15 1.01 0.00 0.50 2.07 -2.00 -1.89 116.25 116.09 2jjm h VAL 210 Ca 0.03 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.66 2jjm h VAL 210 Cb 0.23 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2jjm h VAL 210 CO 0.01 0.24 0.00 0.11 0.02 0.00 0.00 177.57 177.95 2jjm h LYS 211 N 0.00 0.00 -6.19 1.57 1.79 -1.70 -0.95 116.57 111.08 2jjm h LYS 211 Ca -0.00 0.00 -0.44 0.00 -2.18 0.00 0.00 60.65 58.03 2jjm h LYS 211 Cb 0.48 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.17 2jjm h LYS 211 CO 0.03 0.00 -0.86 0.54 -1.08 0.00 0.00 179.45 178.08 2jjm n ARG 212 N -2.67 -3.80 0.29 3.15 5.12 -0.71 -3.51 116.66 114.54 2jjm n ARG 212 Ca 0.03 0.55 0.15 0.00 -1.93 0.00 0.00 57.85 56.64 2jjm n ARG 212 Cb 0.35 -4.87 0.90 0.00 -1.16 0.00 0.00 32.46 27.69 2jjm n ARG 212 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2jjm h VAL 213 N -1.83 0.50 -0.62 1.55 2.07 -1.84 -1.60 116.25 114.48 2jjm h VAL 213 Ca -0.62 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 66.85 2jjm h VAL 213 Cb 1.36 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 32.14 2jjm h VAL 213 CO 0.56 0.02 0.36 1.56 0.02 0.00 0.00 177.57 180.09 2jjm h GLN 214 N 0.00 0.66 -0.08 1.57 7.50 -1.95 -1.02 115.11 121.79 2jjm h GLN 214 Ca -0.00 -0.04 -0.05 0.00 0.50 0.00 0.00 58.65 59.06 2jjm h GLN 214 Cb 0.06 -0.15 -0.01 0.00 0.05 0.00 0.00 27.48 27.43 2jjm h GLN 214 CO 0.00 0.44 -0.19 -0.44 -1.50 0.00 0.00 178.83 177.15 2jjm h ASP 215 N 0.68 0.12 0.09 1.46 3.32 -1.65 0.12 116.42 120.57 2jjm h ASP 215 Ca 0.26 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.20 2jjm h ASP 215 Cb 0.10 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2jjm h ASP 215 CO -0.14 0.32 -0.27 0.58 -1.72 0.00 0.00 179.24 178.01 2jjm h VAL 216 N 0.12 1.25 0.02 -1.35 2.07 -1.22 -1.38 116.25 115.78 2jjm h VAL 216 Ca 0.02 -1.19 -0.00 0.00 0.82 0.00 0.00 66.70 66.35 2jjm h VAL 216 Cb 0.41 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 2jjm h VAL 216 CO 0.03 0.37 -0.01 0.58 0.02 0.00 0.00 177.57 178.55 2jjm h VAL 217 N 0.26 1.45 -0.48 2.57 2.07 -0.68 -2.71 116.25 118.73 2jjm h VAL 217 Ca 0.04 -1.71 0.10 0.00 0.82 0.00 0.00 66.70 65.95 2jjm h VAL 217 Cb 0.62 2.55 -0.10 0.00 -1.52 0.00 0.00 31.29 32.84 2jjm h VAL 217 CO 0.04 0.42 -0.17 1.56 0.02 0.00 0.00 177.57 179.44 2jjm h GLN 218 N -0.81 -0.06 -0.82 1.57 1.08 -0.92 0.43 115.11 115.59 2jjm h GLN 218 Ca -0.00 0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.22 2jjm h GLN 218 Cb 0.72 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.12 2jjm h GLN 218 CO 0.01 -0.04 0.54 0.00 -0.95 0.00 0.00 178.83 178.38 2jjm h ALA 219 N 1.34 1.45 -0.15 3.87 0.00 -1.36 -2.21 119.26 122.20 2jjm h ALA 219 Ca 0.23 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 2jjm h ALA 219 Cb 0.42 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2jjm h ALA 219 CO -0.53 0.49 -0.59 0.35 0.00 0.00 0.00 179.25 178.97 2jjm h PHE 220 N 1.07 0.62 -0.94 0.00 3.04 -0.42 0.25 116.94 120.56 2jjm h PHE 220 Ca 0.31 -0.23 0.06 0.00 3.98 0.00 0.00 57.97 62.08 2jjm h PHE 220 Cb -0.06 -0.11 -0.06 0.00 2.56 0.00 0.00 35.95 38.27 2jjm h PHE 220 CO -0.00 0.96 0.60 0.00 -2.02 0.00 0.00 178.31 177.85 2jjm h ALA 221 N 0.99 1.29 0.09 2.41 0.00 0.31 -0.27 119.26 124.07 2jjm h ALA 221 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2jjm h ALA 221 Cb 1.14 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2jjm h ALA 221 CO 0.11 0.40 -0.04 0.87 0.00 0.00 0.00 179.25 180.59 2jjm h LYS 222 N 1.12 -0.11 -0.21 0.00 1.57 -1.28 -3.30 116.57 114.36 2jjm h LYS 222 Ca 0.40 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.25 2jjm h LYS 222 Cb 0.13 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2jjm h LYS 222 CO -0.16 0.12 0.53 0.97 -0.57 0.00 0.00 179.45 180.34 2jjm h ILE 223 N -1.01 0.11 0.07 1.86 -0.00 -0.41 -0.95 117.51 117.20 2jjm h ILE 223 Ca -0.01 0.00 -0.26 0.00 -0.00 0.00 0.00 64.86 64.59 2jjm h ILE 223 Cb 0.29 0.52 -0.01 0.00 -0.00 0.00 0.00 36.82 37.61 2jjm h ILE 223 CO 0.02 0.00 -1.22 1.62 -0.00 0.00 0.00 178.15 178.57 2jjm h VAL 224 N 0.00 1.49 -0.04 2.19 3.04 -1.13 -2.98 116.25 118.82 2jjm h VAL 224 Ca 0.10 -3.14 -0.01 0.00 -1.01 0.00 0.00 66.70 62.65 2jjm h VAL 224 Cb 1.15 2.86 -0.00 0.00 -2.01 0.00 0.00 31.29 33.28 2jjm h VAL 224 CO -0.00 0.89 -0.01 0.71 -1.01 0.00 0.00 177.57 178.15 2jjm h THR 225 N 0.04 1.04 -0.01 3.17 1.35 -1.24 -2.83 112.91 114.43 2jjm h THR 225 Ca -0.11 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 2jjm h THR 225 Cb 1.91 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 2jjm h THR 225 CO 0.16 0.04 -0.22 -0.62 -0.25 0.00 0.00 175.52 174.64 2jjm n GLU 226 N -4.49 1.57 -3.73 4.72 1.02 -1.25 -4.96 120.64 113.52 2jjm n GLU 226 Ca -0.02 -1.04 -0.13 0.00 -0.02 0.00 0.00 57.16 55.95 2jjm n GLU 226 Cb 0.12 -1.29 -0.11 0.00 -0.02 0.00 0.00 31.44 30.15 2jjm n GLU 226 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2jjm s VAL 227 N -1.72 -0.01 -0.36 2.62 1.01 -1.07 -5.10 120.40 115.78 2jjm s VAL 227 Ca 0.15 0.02 -0.23 0.00 0.00 0.00 0.00 61.98 61.93 2jjm s VAL 227 Cb 0.13 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.98 2jjm s VAL 227 CO 0.34 0.01 0.76 1.51 0.00 0.00 0.00 175.10 177.72 2jjm s ASP 228 N 0.48 6.54 0.05 3.32 -4.77 -1.26 -4.20 116.67 116.84 2jjm s ASP 228 Ca -0.02 0.35 -0.26 0.00 -3.30 0.00 0.00 52.55 49.32 2jjm s ASP 228 Cb -0.04 -2.39 0.06 0.00 -1.09 0.00 0.00 42.92 39.46 2jjm s ASP 228 CO -0.02 -0.71 0.60 0.00 0.70 0.00 0.00 175.17 175.74 2jjm s ALA 229 N 3.04 -1.58 0.16 2.11 0.00 -1.26 -3.01 121.76 121.22 2jjm s ALA 229 Ca 0.30 0.83 0.06 0.00 0.00 0.00 0.00 51.96 53.16 2jjm s ALA 229 Cb -0.13 0.40 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 2jjm s ALA 229 CO 0.16 -0.54 0.08 0.15 0.00 0.00 0.00 175.76 175.61 2jjm s LYS 230 N -2.38 2.70 -0.22 0.00 3.01 -0.74 -4.96 119.74 117.14 2jjm s LYS 230 Ca -0.05 -0.95 -0.05 0.00 -1.01 0.00 0.00 55.97 53.90 2jjm s LYS 230 Cb -0.01 -2.53 -0.02 0.00 -1.01 0.00 0.00 37.83 34.26 2jjm s LYS 230 CO -0.01 0.48 0.01 -1.17 0.51 0.00 0.00 175.35 175.17 2jjm s LEU 231 N -2.99 3.20 -0.42 3.17 2.96 -0.45 -1.62 118.68 122.53 2jjm s LEU 231 Ca 0.29 -0.26 -0.20 0.00 -0.22 0.00 0.00 54.13 53.74 2jjm s LEU 231 Cb -0.10 -1.83 0.02 0.00 0.50 0.00 0.00 46.19 44.78 2jjm s LEU 231 CO 0.21 0.01 0.62 -0.76 -1.32 0.00 0.00 176.35 175.11 2jjm s LEU 232 N 1.33 4.48 -0.73 -0.68 1.43 0.20 -0.86 118.68 123.86 2jjm s LEU 232 Ca 0.04 -0.28 -0.13 0.00 -1.03 0.00 0.00 54.13 52.73 2jjm s LEU 232 Cb -0.15 -2.70 0.19 0.00 0.03 0.00 0.00 46.19 43.56 2jjm s LEU 232 CO 0.01 -0.72 0.66 -0.76 0.23 0.00 0.00 176.35 175.76 2jjm s LEU 233 N 2.73 6.45 0.10 1.79 1.43 -1.25 -1.05 118.68 128.89 2jjm s LEU 233 Ca 0.22 -2.46 -0.25 0.00 -1.03 0.00 0.00 54.13 50.60 2jjm s LEU 233 Cb -0.14 -2.17 -0.07 0.00 0.03 0.00 0.00 46.19 43.84 2jjm s LEU 233 CO 0.18 -0.63 0.77 -0.69 0.23 0.00 0.00 176.35 176.21 2jjm s VAL 234 N 0.53 4.56 0.00 -1.59 1.01 -0.54 -1.98 120.40 122.38 2jjm s VAL 234 Ca 0.14 1.67 0.00 0.00 0.00 0.00 0.00 61.98 63.79 2jjm s VAL 234 Cb -0.16 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.09 2jjm s VAL 234 CO -0.05 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2jjm n GLY 235 N 2.01 2.40 3.40 4.51 0.00 0.18 -2.68 105.19 115.00 2jjm n GLY 235 Ca -0.04 -2.07 -0.14 0.00 0.00 0.00 0.00 46.02 43.77 2jjm n GLY 235 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jjm s ASP 236 N 0.00 -0.49 0.03 1.61 2.15 -1.26 -3.52 116.67 115.20 2jjm s ASP 236 Ca 0.00 0.84 -0.05 0.00 0.43 0.00 0.00 52.55 53.76 2jjm s ASP 236 Cb 0.00 0.86 0.02 0.00 -0.30 0.00 0.00 42.92 43.50 2jjm s ASP 236 CO 0.00 -0.28 0.26 0.61 -0.17 0.00 0.00 175.17 175.59 2jjm n GLY 237 N 2.31 0.99 0.26 2.66 0.00 -1.25 -4.42 105.19 105.73 2jjm n GLY 237 Ca -0.15 -0.95 -0.08 0.00 0.00 0.00 0.00 46.02 44.83 2jjm n GLY 237 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2jjm h PRO 238 N 0.00 -0.22 -0.31 1.61 0.11 -1.76 -2.21 132.00 129.22 2jjm h PRO 238 Ca -0.06 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.06 2jjm h PRO 238 Cb 0.28 0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.44 2jjm h PRO 238 CO 0.08 -0.14 0.00 0.39 -0.21 0.00 0.00 178.00 178.12 2jjm n GLU 239 N -5.36 0.53 0.11 1.05 -0.58 -0.61 -4.06 120.64 111.72 2jjm n GLU 239 Ca -0.01 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.60 2jjm n GLU 239 Cb 0.28 -1.15 -0.08 0.00 -0.57 0.00 0.00 31.44 29.91 2jjm n GLU 239 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 2jjm h PHE 240 N 0.27 -0.22 -0.62 -0.32 3.57 -1.59 -2.14 116.94 115.89 2jjm h PHE 240 Ca 0.00 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.51 2jjm h PHE 240 Cb 0.15 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.93 2jjm h PHE 240 CO 0.00 0.00 0.40 0.00 -2.23 0.00 0.00 178.31 176.48 2jjm h THR 242 N 0.80 1.03 -0.44 0.00 2.02 -1.83 0.59 112.91 115.08 2jjm h THR 242 Ca 0.24 -0.20 -0.08 0.00 0.77 0.00 0.00 66.41 67.14 2jjm h THR 242 Cb -0.04 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.76 2jjm h THR 242 CO -0.07 0.10 -0.07 0.40 0.37 0.00 0.00 175.52 176.25 2jjm h ILE 243 N 0.57 1.25 -0.56 3.11 1.08 -0.78 0.22 117.51 122.40 2jjm h ILE 243 Ca 0.20 -1.09 -0.10 0.00 -0.39 0.00 0.00 64.86 63.48 2jjm h ILE 243 Cb 0.04 0.99 -0.02 0.00 -3.07 0.00 0.00 36.82 34.76 2jjm h ILE 243 CO -0.10 0.37 -0.06 0.25 -0.69 0.00 0.00 178.15 177.92 2jjm h LEU 244 N 0.69 1.02 -1.01 1.44 5.85 0.37 -1.25 115.31 122.42 2jjm h LEU 244 Ca 0.13 -0.33 -0.08 0.00 0.84 0.00 0.00 57.88 58.44 2jjm h LEU 244 Cb 0.52 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2jjm h LEU 244 CO 0.03 1.11 -0.12 -0.61 -0.34 0.00 0.00 178.44 178.50 2jjm h GLN 245 N 0.91 0.57 0.55 1.25 5.75 0.56 -2.54 115.11 122.17 2jjm h GLN 245 Ca 0.15 -0.17 -0.03 0.00 -0.15 0.00 0.00 58.65 58.45 2jjm h GLN 245 Cb 0.62 -0.06 0.01 0.00 1.07 0.00 0.00 27.48 29.12 2jjm h GLN 245 CO 0.04 0.68 -0.26 1.25 -2.65 0.00 0.00 178.83 177.89 2jjm h LEU 246 N 0.52 -0.62 -2.13 -2.39 5.85 -0.50 -1.79 115.31 114.25 2jjm h LEU 246 Ca 0.09 -0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.84 2jjm h LEU 246 Cb 0.52 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2jjm h LEU 246 CO 0.03 -0.25 0.30 -0.37 -0.34 0.00 0.00 178.44 177.82 2jjm h VAL 247 N -1.07 0.33 0.29 1.05 -1.51 -1.25 -2.47 116.25 111.63 2jjm h VAL 247 Ca -0.08 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.38 2jjm h VAL 247 Cb 0.63 0.75 0.00 0.00 -2.13 0.00 0.00 31.29 30.54 2jjm h VAL 247 CO 0.12 0.00 -0.14 0.50 -1.23 0.00 0.00 177.57 176.82 2jjm h LYS 248 N 0.00 -0.38 -0.96 5.19 3.64 -1.20 -2.07 116.57 120.79 2jjm h LYS 248 Ca 0.11 0.03 -0.31 0.00 -1.27 0.00 0.00 60.65 59.20 2jjm h LYS 248 Cb 0.71 0.09 -0.19 0.00 -0.41 0.00 0.00 32.23 32.43 2jjm h LYS 248 CO -0.00 -0.04 0.40 0.27 -2.27 0.00 0.00 179.45 177.81 2jjm n ASN 249 N -5.08 3.64 0.00 4.20 0.23 -0.69 -3.32 115.26 114.24 2jjm n ASN 249 Ca -0.09 -3.06 0.00 0.00 -0.53 0.00 0.00 54.58 50.90 2jjm n ASN 249 Cb 0.27 -0.72 0.00 0.00 -2.08 0.00 0.00 39.78 37.24 2jjm n ASN 249 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2jjm n LEU 250 N -0.50 0.89 -2.90 -4.53 7.94 -0.96 -5.01 117.00 111.94 2jjm n LEU 250 Ca 0.39 -0.89 -0.19 0.00 -1.11 0.00 0.00 56.01 54.20 2jjm n LEU 250 Cb 1.27 0.00 0.01 0.00 0.53 0.00 0.00 43.42 45.22 2jjm n LEU 250 CO 0.40 0.22 -0.09 1.41 -1.11 0.00 0.00 177.39 178.23 2jjm n HIS 251 N -0.03 -1.64 0.09 1.96 8.25 -1.21 -4.79 115.22 117.85 2jjm n HIS 251 Ca 0.00 0.29 0.03 0.00 -0.26 0.00 0.00 57.72 57.78 2jjm n HIS 251 Cb 0.06 -3.40 0.05 0.00 1.12 0.00 0.00 29.99 27.82 2jjm n HIS 251 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2jjm n ILE 252 N -3.93 0.44 -0.33 1.59 5.41 -1.04 -4.77 119.36 116.74 2jjm n ILE 252 Ca -0.10 -0.72 0.26 0.00 1.00 0.00 0.00 62.75 63.19 2jjm n ILE 252 Cb 0.60 0.85 0.49 0.00 -0.71 0.00 0.00 39.64 40.86 2jjm n ILE 252 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 2jjm h GLU 253 N 1.10 0.00 -0.84 0.38 4.22 -1.68 0.93 114.58 118.69 2jjm h GLU 253 Ca 0.00 -0.00 -0.12 0.00 0.08 0.00 0.00 59.36 59.32 2jjm h GLU 253 Cb 0.41 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.59 2jjm h GLU 253 CO 0.00 0.00 0.15 -0.40 -2.18 0.00 0.00 179.01 176.58 2jjm n ASP 254 N -5.34 3.77 -0.10 1.04 5.68 -1.26 -3.79 116.55 116.55 2jjm n ASP 254 Ca 0.33 -2.73 0.02 0.00 -0.50 0.00 0.00 54.79 51.91 2jjm n ASP 254 Cb 1.11 -0.65 0.02 0.00 -1.14 0.00 0.00 41.12 40.46 2jjm n ASP 254 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2jjm n ARG 255 N 0.06 1.15 -4.19 0.11 1.74 0.32 -5.02 116.66 110.83 2jjm n ARG 255 Ca 0.24 -1.22 -0.19 0.00 -0.77 0.00 0.00 57.85 55.92 2jjm n ARG 255 Cb 0.98 -0.81 -0.16 0.00 -1.02 0.00 0.00 32.46 31.46 2jjm n ARG 255 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2jjm s VAL 256 N -0.75 0.51 -0.88 1.55 1.01 -1.22 -1.34 120.40 119.28 2jjm s VAL 256 Ca 0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 61.98 61.85 2jjm s VAL 256 Cb 0.04 -0.50 0.26 0.00 0.00 0.00 0.00 36.38 36.18 2jjm s VAL 256 CO 0.00 0.19 1.00 0.18 0.00 0.00 0.00 175.10 176.48 2jjm n LEU 257 N 3.62 4.80 -4.67 3.92 4.32 -0.04 -4.96 117.00 123.99 2jjm n LEU 257 Ca -0.21 -5.26 -0.52 0.00 -0.02 0.00 0.00 56.01 50.00 2jjm n LEU 257 Cb 0.53 -1.03 -0.06 0.00 -1.62 0.00 0.00 43.42 41.25 2jjm n LEU 257 CO 0.24 1.76 1.22 0.49 -1.22 0.00 0.00 177.39 179.88 2jjm n PHE 258 N 1.53 1.99 0.50 -1.77 3.72 -1.26 -3.74 117.46 118.43 2jjm n PHE 258 Ca 0.26 0.42 0.07 0.00 -0.05 0.00 0.00 57.45 58.15 2jjm n PHE 258 Cb 0.37 -2.48 0.08 0.00 -0.94 0.00 0.00 39.48 36.51 2jjm n PHE 258 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2jjm n LEU 259 N 4.55 2.38 0.00 4.37 4.32 -0.84 -4.94 117.00 126.84 2jjm n LEU 259 Ca 0.22 -1.14 0.10 0.00 -0.02 0.00 0.00 56.01 55.17 2jjm n LEU 259 Cb 0.20 -0.04 -0.02 0.00 -1.62 0.00 0.00 43.42 41.94 2jjm n LEU 259 CO 0.72 0.46 -0.13 0.61 -1.22 0.00 0.00 177.39 177.83 2jjm n GLY 260 N 0.84 -1.77 3.65 -0.72 0.00 -1.25 -4.55 105.19 101.40 2jjm n GLY 260 Ca 0.10 -1.22 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 2jjm n GLY 260 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jjm s LYS 261 N -1.26 4.16 0.38 1.61 -2.85 -1.23 -0.65 119.74 119.91 2jjm s LYS 261 Ca 0.00 1.31 0.07 0.00 -1.00 0.00 0.00 55.97 56.36 2jjm s LYS 261 Cb 0.00 -3.71 -0.01 0.00 -2.06 0.00 0.00 37.83 32.05 2jjm s LYS 261 CO 0.00 -0.77 0.46 -0.65 0.10 0.00 0.00 175.35 174.49 2jjm s GLN 262 N 3.48 2.83 -0.02 1.78 -1.52 -1.26 -4.85 119.66 120.10 2jjm s GLN 262 Ca 0.47 -1.25 -0.01 0.00 -1.95 0.00 0.00 55.36 52.62 2jjm s GLN 262 Cb -0.15 -2.65 -0.01 0.00 -0.22 0.00 0.00 33.01 29.98 2jjm s GLN 262 CO 0.12 -0.10 -0.02 -3.47 -0.25 0.00 0.00 175.29 171.56 2jjm n ASP 263 N -1.65 0.61 -3.78 5.90 2.03 -1.26 -4.77 116.55 113.62 2jjm n ASP 263 Ca 0.03 0.02 -0.42 0.00 0.52 0.00 0.00 54.79 54.94 2jjm n ASP 263 Cb 0.59 -0.05 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 2jjm n ASP 263 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2jjm n ASN 264 N -3.01 4.96 0.00 1.67 4.13 -1.26 -4.70 115.26 117.05 2jjm n ASN 264 Ca -0.03 -3.01 0.14 0.00 1.68 0.00 0.00 54.58 53.35 2jjm n ASN 264 Cb 0.53 -1.53 0.75 0.00 -1.54 0.00 0.00 39.78 37.98 2jjm n ASN 264 CO 0.00 0.00 0.00 0.55 0.28 0.00 0.00 177.26 178.09 2jjm n VAL 265 N 3.81 0.07 -0.33 2.41 3.14 -1.26 -3.88 118.33 122.29 2jjm n VAL 265 Ca 0.46 0.02 0.04 0.00 -2.96 0.00 0.00 64.34 61.90 2jjm n VAL 265 Cb 0.36 -0.57 0.19 0.00 -1.06 0.00 0.00 33.84 32.77 2jjm n VAL 265 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2jjm h ALA 266 N 3.49 1.32 -0.23 1.55 0.00 -1.90 -1.43 119.26 122.06 2jjm h ALA 266 Ca 0.00 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 2jjm h ALA 266 Cb 0.16 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2jjm h ALA 266 CO 0.00 0.18 -0.47 0.93 0.00 0.00 0.00 179.25 179.89 2jjm h GLU 267 N 0.90 0.60 -0.20 0.00 5.08 -1.91 -2.31 114.58 116.75 2jjm h GLU 267 Ca 0.44 -0.34 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2jjm h GLU 267 Cb 0.39 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2jjm h GLU 267 CO -0.25 0.94 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.62 2jjm h LEU 268 N 0.48 0.35 -0.93 1.33 3.38 -1.58 -2.81 115.31 115.52 2jjm h LEU 268 Ca 0.03 -0.32 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 2jjm h LEU 268 Cb 1.00 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 2jjm h LEU 268 CO 0.09 0.58 0.56 -0.07 0.09 0.00 0.00 178.44 179.70 2jjm h LEU 269 N 0.10 1.12 -0.57 1.67 3.38 -1.30 -2.66 115.31 117.06 2jjm h LEU 269 Ca 0.05 -0.07 0.12 0.00 0.09 0.00 0.00 57.88 58.07 2jjm h LEU 269 Cb 0.41 -0.28 -0.10 0.00 0.09 0.00 0.00 40.66 40.78 2jjm h LEU 269 CO 0.01 0.86 -0.00 0.00 0.09 0.00 0.00 178.44 179.40 2jjm h ALA 270 N 1.31 0.55 -0.40 1.53 0.00 -1.21 -0.32 119.26 120.72 2jjm h ALA 270 Ca 0.33 0.17 -0.20 0.00 0.00 0.00 0.00 54.91 55.22 2jjm h ALA 270 Cb -0.06 0.30 -0.12 0.00 0.00 0.00 0.00 17.79 17.91 2jjm h ALA 270 CO -0.06 -0.39 0.25 0.00 0.00 0.00 0.00 179.25 179.05 2jjm n MET 271 N -5.26 1.64 -4.16 0.00 0.00 -1.01 -4.66 117.12 103.67 2jjm n MET 271 Ca 0.08 -1.27 -0.24 0.00 0.00 0.00 0.00 57.70 56.27 2jjm n MET 271 Cb 0.32 -1.53 -0.07 0.00 0.00 0.00 0.00 33.22 31.94 2jjm n MET 271 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2jjm s SER 272 N -0.00 4.54 -0.01 3.17 0.01 -0.13 -4.83 113.70 116.44 2jjm s SER 272 Ca 0.24 -0.85 0.00 0.00 1.31 0.00 0.00 55.95 56.65 2jjm s SER 272 Cb 0.20 -0.66 -0.01 0.00 0.21 0.00 0.00 66.02 65.76 2jjm s SER 272 CO 0.05 -0.30 -0.01 0.47 0.41 0.00 0.00 173.24 173.86 2jjm n ASP 273 N -1.11 4.13 -3.82 2.44 8.00 0.05 -4.88 116.55 121.36 2jjm n ASP 273 Ca -0.03 -0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.33 2jjm n ASP 273 Cb 0.62 0.12 -0.15 0.00 -0.02 0.00 0.00 41.12 41.69 2jjm n ASP 273 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2jjm s LEU 274 N -4.81 1.49 -0.09 0.64 2.96 -0.95 -4.02 118.68 113.90 2jjm s LEU 274 Ca -0.01 0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 53.94 2jjm s LEU 274 Cb 0.00 0.04 -0.03 0.00 0.50 0.00 0.00 46.19 46.70 2jjm s LEU 274 CO 0.03 -0.07 0.00 -0.32 -1.32 0.00 0.00 176.35 174.68 2jjm s MET 275 N 0.52 3.08 -0.03 1.98 1.75 -0.65 -1.34 119.30 124.61 2jjm s MET 275 Ca -0.04 -0.41 0.07 0.00 -1.25 0.00 0.00 55.69 54.06 2jjm s MET 275 Cb -0.06 -2.83 -0.02 0.00 2.84 0.00 0.00 34.83 34.76 2jjm s MET 275 CO -0.02 0.66 -0.23 -0.51 -0.65 0.00 0.00 175.02 174.27 2jjm s LEU 276 N -0.75 2.21 -0.29 4.11 1.43 -0.97 -1.10 118.68 123.31 2jjm s LEU 276 Ca 0.12 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2jjm s LEU 276 Cb -0.12 -1.39 0.15 0.00 0.03 0.00 0.00 46.19 44.87 2jjm s LEU 276 CO 0.02 0.32 0.37 -0.22 0.23 0.00 0.00 176.35 177.07 2jjm s LEU 277 N -0.61 -0.58 -0.37 1.79 2.96 -1.15 -4.51 118.68 116.22 2jjm s LEU 277 Ca 0.09 -0.56 0.07 0.00 -0.22 0.00 0.00 54.13 53.51 2jjm s LEU 277 Cb -0.10 0.88 0.44 0.00 0.50 0.00 0.00 46.19 47.91 2jjm s LEU 277 CO -0.00 -0.36 1.13 0.18 -1.32 0.00 0.00 176.35 175.98 2jjm n LEU 278 N 5.29 4.51 -4.87 -0.68 4.77 -1.26 -1.03 117.00 123.74 2jjm n LEU 278 Ca 0.00 -4.89 -0.31 0.00 -0.03 0.00 0.00 56.01 50.79 2jjm n LEU 278 Cb 0.48 -0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2jjm n LEU 278 CO -0.01 2.11 0.65 -0.94 -1.33 0.00 0.00 177.39 177.87 2jjm s SER 279 N -3.55 6.38 0.55 -1.43 1.04 -1.23 -4.56 113.70 110.90 2jjm s SER 279 Ca 0.47 1.38 0.33 0.00 0.48 0.00 0.00 55.95 58.61 2jjm s SER 279 Cb 0.40 -2.44 1.47 0.00 0.10 0.00 0.00 66.02 65.55 2jjm s SER 279 CO -0.09 -0.70 2.03 -0.33 0.98 0.00 0.00 173.24 175.13 2jjm h GLU 280 N 0.28 0.00 -2.49 4.02 5.08 -1.45 -3.45 114.58 116.56 2jjm h GLU 280 Ca -0.45 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.86 2jjm h GLU 280 Cb 1.19 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.28 2jjm h GLU 280 CO 0.62 0.05 0.18 0.15 -1.00 0.00 0.00 179.01 179.01 2jjm s LYS 281 N -3.80 1.14 -0.25 2.33 1.02 -1.26 -4.92 119.74 114.00 2jjm s LYS 281 Ca -0.00 -0.09 -0.28 0.00 0.02 0.00 0.00 55.97 55.61 2jjm s LYS 281 Cb 0.10 0.53 0.17 0.00 -0.52 0.00 0.00 37.83 38.11 2jjm s LYS 281 CO 0.54 -0.43 1.23 -2.00 -0.92 0.00 0.00 175.35 173.78 2jjm s GLU 282 N -2.36 0.27 -0.02 1.68 2.56 -1.26 -4.98 118.70 114.59 2jjm s GLU 282 Ca -0.06 0.12 0.18 0.00 0.00 0.00 0.00 54.97 55.21 2jjm s GLU 282 Cb -0.00 0.13 -0.26 0.00 2.00 0.00 0.00 34.13 35.99 2jjm s GLU 282 CO -0.01 -0.07 0.50 0.43 -0.56 0.00 0.00 175.26 175.55 2jjm n SER 283 N 0.89 0.78 0.12 -1.70 7.64 -1.26 -4.12 113.62 115.97 2jjm n SER 283 Ca -0.06 -0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.57 2jjm n SER 283 Cb 0.58 1.62 0.00 0.00 -1.01 0.00 0.00 64.21 65.40 2jjm n SER 283 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 2jjm n PHE 284 N -1.95 -2.09 -4.34 1.43 -0.00 -1.26 -4.58 117.46 104.66 2jjm n PHE 284 Ca -0.02 0.37 -0.19 0.00 -0.00 0.00 0.00 57.45 57.62 2jjm n PHE 284 Cb 0.43 0.55 -0.10 0.00 -0.00 0.00 0.00 39.48 40.36 2jjm n PHE 284 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 2jjm s GLY 285 N -4.96 1.41 0.42 7.13 0.00 -1.26 -4.37 107.32 105.69 2jjm s GLY 285 Ca 0.00 -1.64 0.11 0.00 0.00 0.00 0.00 44.72 43.19 2jjm s GLY 285 CO 0.00 -1.73 1.99 1.41 0.00 0.00 0.00 173.10 174.77 2jjm h LEU 286 N 2.63 0.20 -1.72 0.66 4.07 -1.98 -1.55 115.31 117.62 2jjm h LEU 286 Ca -0.38 -0.03 0.08 0.00 0.08 0.00 0.00 57.88 57.63 2jjm h LEU 286 Cb 1.22 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.90 2jjm h LEU 286 CO 0.61 0.28 0.53 -0.37 -1.08 0.00 0.00 178.44 178.42 2jjm h VAL 287 N 0.21 0.16 -0.58 1.22 -1.51 -1.95 7.09 116.25 120.89 2jjm h VAL 287 Ca 0.05 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.51 2jjm h VAL 287 Cb 0.23 0.53 -0.03 0.00 -2.13 0.00 0.00 31.29 29.89 2jjm h VAL 287 CO 0.01 0.00 0.32 -0.07 -1.23 0.00 0.00 177.57 176.60 2jjm h LEU 288 N 0.00 0.73 0.37 4.19 3.38 -1.64 0.26 115.31 122.60 2jjm h LEU 288 Ca 0.14 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2jjm h LEU 288 Cb 1.20 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2jjm h LEU 288 CO -0.00 0.61 -0.18 -0.07 0.09 0.00 0.00 178.44 178.89 2jjm h LEU 289 N 0.79 -0.42 -0.54 1.67 4.07 1.47 0.19 115.31 122.53 2jjm h LEU 289 Ca 0.21 -0.04 0.09 0.00 0.08 0.00 0.00 57.88 58.21 2jjm h LEU 289 Cb 0.04 0.11 -0.11 0.00 1.08 0.00 0.00 40.66 41.78 2jjm h LEU 289 CO -0.03 -0.22 -0.37 -0.33 -1.08 0.00 0.00 178.44 176.40 2jjm h GLU 290 N -0.59 -0.20 -0.04 1.13 5.08 -0.64 0.69 114.58 120.00 2jjm h GLU 290 Ca -0.05 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2jjm h GLU 290 Cb 0.43 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.67 2jjm h GLU 290 CO 0.08 -0.14 -0.52 0.00 -1.00 0.00 0.00 179.01 177.44 2jjm h ALA 291 N 0.79 -0.88 0.32 3.43 0.00 -0.50 -0.81 119.26 121.61 2jjm h ALA 291 Ca 0.20 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2jjm h ALA 291 Cb 0.56 0.93 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 2jjm h ALA 291 CO -0.65 -1.08 -0.31 0.52 0.00 0.00 0.00 179.25 177.73 2jjm h MET 292 N -0.63 -0.63 -1.14 0.00 2.86 0.17 0.47 114.93 116.02 2jjm h MET 292 Ca 0.03 0.04 0.33 0.00 -2.06 0.00 0.00 59.70 58.04 2jjm h MET 292 Cb 0.70 0.14 -0.05 0.00 0.06 0.00 0.00 31.60 32.46 2jjm h MET 292 CO -0.38 -0.42 1.18 0.00 1.06 0.00 0.00 176.91 178.34 2jjm n ALA 293 N -2.60 1.10 -0.74 6.32 0.00 0.23 0.32 120.51 125.14 2jjm n ALA 293 Ca -0.09 0.38 0.07 0.00 0.00 0.00 0.00 53.44 53.79 2jjm n ALA 293 Cb 0.33 -0.66 0.38 0.00 0.00 0.00 0.00 19.45 19.50 2jjm n ALA 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jjm n GLY 295 N 0.61 0.71 3.47 0.00 0.00 0.94 -4.46 105.19 106.45 2jjm n GLY 295 Ca 0.26 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 2jjm n GLY 295 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jjm s VAL 296 N -2.12 4.99 0.51 1.61 1.01 -0.91 -4.54 120.40 120.94 2jjm s VAL 296 Ca 0.00 -0.48 -0.22 0.00 0.00 0.00 0.00 61.98 61.28 2jjm s VAL 296 Cb 0.00 -3.65 -0.06 0.00 0.00 0.00 0.00 36.38 32.67 2jjm s VAL 296 CO 0.00 -0.10 1.27 -2.16 0.00 0.00 0.00 175.10 174.12 2jjm s PRO 297 N 1.66 3.43 0.19 2.72 0.04 -1.26 -3.59 135.00 138.18 2jjm s PRO 297 Ca 0.05 2.04 0.11 0.00 0.04 0.00 0.00 61.00 63.23 2jjm s PRO 297 Cb -0.18 -2.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.98 2jjm s PRO 297 CO 0.09 -0.90 -0.24 0.00 0.04 0.00 0.00 177.00 175.99 2jjm s ILE 299 N -1.69 1.71 0.10 0.00 1.01 -0.26 -1.26 121.20 120.82 2jjm s ILE 299 Ca 0.20 -2.53 0.06 0.00 0.00 0.00 0.00 60.65 58.38 2jjm s ILE 299 Cb -0.08 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 2jjm s ILE 299 CO 0.09 -0.80 -0.06 -0.83 0.00 0.00 0.00 174.94 173.35 2jjm s GLY 300 N 0.46 1.84 0.62 6.18 0.00 -0.74 -2.91 107.32 112.77 2jjm s GLY 300 Ca 0.15 -1.21 -0.19 0.00 0.00 0.00 0.00 44.72 43.48 2jjm s GLY 300 CO -0.04 -1.19 1.29 -0.51 0.00 0.00 0.00 173.10 172.65 2jjm s THR 301 N -1.29 2.13 -1.34 0.90 -4.23 -0.19 -3.26 115.64 108.36 2jjm s THR 301 Ca 0.24 0.08 -0.17 0.00 -1.18 0.00 0.00 61.69 60.66 2jjm s THR 301 Cb -0.11 -3.04 0.06 0.00 1.34 0.00 0.00 72.50 70.76 2jjm s THR 301 CO 0.16 -0.01 1.86 -1.14 -0.54 0.00 0.00 174.62 174.95 2jjm n ARG 302 N -1.68 3.11 -4.88 3.99 0.63 -0.60 -4.71 116.66 112.51 2jjm n ARG 302 Ca 0.14 -3.11 -0.27 0.00 -0.92 0.00 0.00 57.85 53.69 2jjm n ARG 302 Cb 0.48 -3.44 -0.16 0.00 0.45 0.00 0.00 32.46 29.78 2jjm n ARG 302 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2jjm s VAL 303 N 3.93 1.52 -0.28 5.15 1.01 -1.26 -4.93 120.40 125.54 2jjm s VAL 303 Ca 0.52 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.68 2jjm s VAL 303 Cb 0.06 -1.32 -0.07 0.00 0.00 0.00 0.00 36.38 35.05 2jjm s VAL 303 CO 0.04 0.44 0.72 0.61 0.00 0.00 0.00 175.10 176.90 2jjm n GLY 304 N 3.31 -0.14 0.00 4.51 0.00 -1.26 -1.00 105.19 110.61 2jjm n GLY 304 Ca -0.19 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2jjm n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jjm n GLY 305 N 1.74 2.37 0.11 -0.02 0.00 -1.26 -4.12 105.19 104.02 2jjm n GLY 305 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 2jjm n GLY 305 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jjm h ILE 306 N 0.00 0.98 0.00 -0.61 1.08 -1.27 -3.34 117.51 114.35 2jjm h ILE 306 Ca 0.00 -2.29 0.00 0.00 -0.39 0.00 0.00 64.86 62.18 2jjm h ILE 306 Cb 0.00 2.52 0.00 0.00 -3.07 0.00 0.00 36.82 36.27 2jjm h ILE 306 CO 0.00 0.56 0.28 -0.65 -0.69 0.00 0.00 178.15 177.65 2jjm h PRO 307 N -0.60 0.00 -0.00 2.37 0.11 -1.80 0.22 132.00 132.29 2jjm h PRO 307 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2jjm h PRO 307 Cb 1.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.65 2jjm h PRO 307 CO -0.06 0.00 -0.24 0.39 -0.21 0.00 0.00 178.00 177.88 2jjm n GLU 308 N -2.72 0.52 -0.02 1.05 1.02 -1.25 -4.18 120.64 115.06 2jjm n GLU 308 Ca -0.02 -0.25 -0.02 0.00 -0.02 0.00 0.00 57.16 56.85 2jjm n GLU 308 Cb 0.32 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.22 2jjm n GLU 308 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 2jjm n VAL 309 N -1.02 0.25 -3.62 2.62 0.24 0.65 -4.97 118.33 112.47 2jjm n VAL 309 Ca 0.11 -0.13 -0.39 0.00 -2.04 0.00 0.00 64.34 61.89 2jjm n VAL 309 Cb 0.32 -0.80 -0.11 0.00 -1.47 0.00 0.00 33.84 31.78 2jjm n VAL 309 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2jjm s ILE 310 N -2.09 4.80 -0.37 1.34 1.01 -0.46 -5.01 121.20 120.42 2jjm s ILE 310 Ca -0.04 -0.33 -0.09 0.00 0.00 0.00 0.00 60.65 60.20 2jjm s ILE 310 Cb 0.01 -3.44 0.05 0.00 0.01 0.00 0.00 42.46 39.09 2jjm s ILE 310 CO 0.13 0.07 0.18 0.00 0.00 0.00 0.00 174.94 175.32 2jjm s GLN 311 N 1.65 2.66 -0.33 2.79 -2.07 -1.26 -4.56 119.66 118.54 2jjm s GLN 311 Ca 0.05 -1.24 -0.42 0.00 -1.82 0.00 0.00 55.36 51.93 2jjm s GLN 311 Cb -0.17 -3.64 -0.17 0.00 -1.09 0.00 0.00 33.01 27.94 2jjm s GLN 311 CO 0.07 -0.77 1.69 1.58 -1.32 0.00 0.00 175.29 176.55 2jjm n HIS 312 N 4.89 1.95 0.00 9.60 -0.00 -1.25 -0.13 115.22 130.28 2jjm n HIS 312 Ca -0.11 0.72 0.00 0.00 -0.00 0.00 0.00 57.72 58.32 2jjm n HIS 312 Cb 0.44 -2.39 0.00 0.00 -0.00 0.00 0.00 29.99 28.05 2jjm n HIS 312 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2jjm n GLY 313 N 4.09 3.21 0.17 1.57 0.00 0.90 -4.71 105.19 110.40 2jjm n GLY 313 Ca 0.28 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.07 2jjm n GLY 313 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jjm n ASP 314 N 0.00 1.96 0.00 1.61 2.03 0.82 -4.72 116.55 118.25 2jjm n ASP 314 Ca 0.00 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.41 2jjm n ASP 314 Cb 0.00 -0.57 0.00 0.00 -0.72 0.00 0.00 41.12 39.83 2jjm n ASP 314 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2jjm n THR 315 N -3.69 0.42 -3.78 5.18 -2.24 -0.48 -4.43 114.28 105.26 2jjm n THR 315 Ca -0.46 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 60.75 2jjm n THR 315 Cb 0.90 0.90 0.00 0.00 -2.10 0.00 0.00 70.33 70.03 2jjm n THR 315 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jjm n GLY 316 N -0.21 -1.13 3.11 3.38 0.00 -1.25 -4.11 105.19 104.98 2jjm n GLY 316 Ca 0.00 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.79 2jjm n GLY 316 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jjm s TYR 317 N -3.00 0.81 0.48 1.61 1.51 -0.39 0.31 117.35 118.67 2jjm s TYR 317 Ca 0.00 -0.62 0.04 0.00 -1.01 0.00 0.00 57.07 55.48 2jjm s TYR 317 Cb 0.00 -0.47 -0.03 0.00 -0.11 0.00 0.00 41.96 41.35 2jjm s TYR 317 CO 0.00 -0.08 0.06 -0.51 -1.11 0.00 0.00 175.55 173.91 2jjm s LEU 318 N -2.04 2.56 0.00 -1.29 1.43 -1.26 -1.79 118.68 116.29 2jjm s LEU 318 Ca -0.02 -1.49 0.00 0.00 -1.03 0.00 0.00 54.13 51.59 2jjm s LEU 318 Cb -0.05 -0.88 0.00 0.00 0.03 0.00 0.00 46.19 45.28 2jjm s LEU 318 CO -0.01 -0.74 0.00 0.00 0.23 0.00 0.00 176.35 175.83 2jjm s GLU 320 N -2.00 2.08 0.30 0.00 8.01 -1.26 -1.56 118.70 124.26 2jjm s GLU 320 Ca 0.00 1.77 -0.29 0.00 0.01 0.00 0.00 54.97 56.45 2jjm s GLU 320 Cb 0.00 -1.82 -0.10 0.00 -4.31 0.00 0.00 34.13 27.90 2jjm s GLU 320 CO 0.00 -1.89 1.16 0.14 0.01 0.00 0.00 175.26 174.68 2jjm s VAL 321 N -1.99 3.26 0.00 2.63 -7.23 -1.26 -3.05 120.40 112.76 2jjm s VAL 321 Ca 0.74 1.27 0.00 0.00 -1.81 0.00 0.00 61.98 62.19 2jjm s VAL 321 Cb -0.29 -3.81 0.00 0.00 0.56 0.00 0.00 36.38 32.84 2jjm s VAL 321 CO 0.46 0.30 0.00 0.61 -0.31 0.00 0.00 175.10 176.16 2jjm n GLY 322 N 1.07 1.55 2.32 2.32 0.00 -1.26 -4.95 105.19 106.24 2jjm n GLY 322 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2jjm n GLY 322 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jjm n ASP 323 N 0.00 7.70 -0.19 1.61 -0.08 -1.17 -4.68 116.55 119.74 2jjm n ASP 323 Ca 0.00 -2.51 0.00 0.00 -1.51 0.00 0.00 54.79 50.77 2jjm n ASP 323 Cb 0.00 -1.46 0.09 0.00 2.34 0.00 0.00 41.12 42.09 2jjm n ASP 323 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 2jjm h THR 324 N 2.95 0.51 0.33 5.18 1.35 -1.89 -1.04 112.91 120.30 2jjm h THR 324 Ca 0.73 -0.04 -0.01 0.00 -0.55 0.00 0.00 66.41 66.54 2jjm h THR 324 Cb 0.41 0.39 -0.00 0.00 -1.73 0.00 0.00 68.15 67.22 2jjm h THR 324 CO 1.54 0.02 -0.19 0.71 -0.25 0.00 0.00 175.52 177.34 2jjm h THR 325 N 0.11 0.60 -0.82 6.82 1.35 -1.92 -1.93 112.91 117.11 2jjm h THR 325 Ca 0.30 0.00 0.09 0.00 -0.55 0.00 0.00 66.41 66.25 2jjm h THR 325 Cb 0.48 0.60 -0.06 0.00 -1.73 0.00 0.00 68.15 67.44 2jjm h THR 325 CO -0.51 0.00 0.54 1.23 -0.25 0.00 0.00 175.52 176.53 2jjm h GLY 326 N -0.50 1.13 0.79 5.82 0.00 -1.81 -1.16 103.07 107.34 2jjm h GLY 326 Ca -0.04 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 2jjm h GLY 326 CO 0.04 0.21 0.02 -2.08 0.00 0.00 0.00 176.54 174.73 2jjm h VAL 327 N 0.82 1.22 -0.34 4.60 2.07 -0.98 -1.53 116.25 122.10 2jjm h VAL 327 Ca 0.37 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 67.25 2jjm h VAL 327 Cb 0.37 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 2jjm h VAL 327 CO -0.14 0.20 0.08 0.00 0.02 0.00 0.00 177.57 177.72 2jjm h ALA 328 N 0.79 0.37 -0.24 1.67 0.00 -0.71 -0.00 119.26 121.14 2jjm h ALA 328 Ca 0.03 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.04 2jjm h ALA 328 Cb 0.29 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2jjm h ALA 328 CO 0.00 -0.32 0.02 -0.44 0.00 0.00 0.00 179.25 178.51 2jjm h ASP 329 N 0.20 -0.06 -0.41 0.00 3.45 -1.17 0.23 116.42 118.67 2jjm h ASP 329 Ca 0.16 0.05 -0.02 0.00 0.43 0.00 0.00 57.03 57.65 2jjm h ASP 329 Cb 0.17 0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 38.99 2jjm h ASP 329 CO -0.20 0.00 0.20 -0.61 -1.57 0.00 0.00 179.24 177.06 2jjm h GLN 330 N 0.10 0.63 0.38 3.56 5.75 -0.80 -2.42 115.11 122.31 2jjm h GLN 330 Ca 0.11 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.51 2jjm h GLN 330 Cb 0.13 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.56 2jjm h GLN 330 CO -0.17 0.51 -0.18 0.00 -2.65 0.00 0.00 178.83 176.34 2jjm h ALA 331 N 1.59 -0.51 -0.94 3.38 0.00 0.05 -2.86 119.26 119.97 2jjm h ALA 331 Ca 0.16 -0.15 0.22 0.00 0.00 0.00 0.00 54.91 55.14 2jjm h ALA 331 Cb 0.10 0.20 -0.12 0.00 0.00 0.00 0.00 17.79 17.97 2jjm h ALA 331 CO -0.02 -0.50 0.49 -0.84 0.00 0.00 0.00 179.25 178.38 2jjm h ILE 332 N -1.08 0.55 0.16 0.00 -0.00 -0.59 0.12 117.51 116.66 2jjm h ILE 332 Ca -0.05 -0.18 -0.01 0.00 -0.00 0.00 0.00 64.86 64.62 2jjm h ILE 332 Cb 0.46 -0.02 0.00 0.00 -0.00 0.00 0.00 36.82 37.26 2jjm h ILE 332 CO 0.09 0.10 -0.08 -0.61 -0.00 0.00 0.00 178.15 177.64 2jjm h GLN 333 N 0.52 -0.21 0.00 0.16 -0.00 -1.50 -3.06 115.11 111.02 2jjm h GLN 333 Ca 0.58 0.01 -0.05 0.00 -0.00 0.00 0.00 58.65 59.20 2jjm h GLN 333 Cb 1.06 0.05 -0.01 0.00 0.00 0.00 0.00 27.48 28.58 2jjm h GLN 333 CO -0.48 -0.04 -0.23 1.25 0.00 0.00 0.00 178.83 179.33 2jjm h LEU 334 N -0.33 0.00 -0.64 -2.39 5.85 -0.97 -3.02 115.31 113.81 2jjm h LEU 334 Ca -0.02 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.55 2jjm h LEU 334 Cb 0.26 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2jjm h LEU 334 CO 0.04 0.23 -0.51 -0.07 -0.34 0.00 0.00 178.44 177.79 2jjm h LEU 335 N 0.00 0.49 0.00 2.25 3.38 -0.73 -3.35 115.31 117.35 2jjm h LEU 335 Ca -0.00 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 2jjm h LEU 335 Cb 0.64 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2jjm h LEU 335 CO 0.03 0.91 -0.67 0.07 0.09 0.00 0.00 178.44 178.88 2jjm h LYS 336 N 0.35 0.00 -6.20 1.13 2.10 -1.56 -3.43 116.57 108.96 2jjm h LYS 336 Ca 0.01 0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 58.07 2jjm h LYS 336 Cb 1.02 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.36 2jjm h LYS 336 CO 0.09 0.81 1.25 -3.47 -2.00 0.00 0.00 179.45 176.13 2jjm n ASP 337 N -4.54 3.41 0.00 7.07 -0.08 -1.14 -4.72 116.55 116.56 2jjm n ASP 337 Ca -0.20 0.72 0.11 0.00 -1.51 0.00 0.00 54.79 53.92 2jjm n ASP 337 Cb 0.51 -1.43 -0.06 0.00 2.34 0.00 0.00 41.12 42.48 2jjm n ASP 337 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2jjm n GLU 338 N 7.50 0.19 0.19 -0.67 2.13 -1.26 -3.53 120.64 125.19 2jjm n GLU 338 Ca 0.26 -0.04 -0.09 0.00 0.66 0.00 0.00 57.16 57.95 2jjm n GLU 338 Cb 0.34 -1.53 -0.04 0.00 0.27 0.00 0.00 31.44 30.49 2jjm n GLU 338 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2jjm h GLU 339 N 0.00 -0.54 -0.88 5.31 4.39 -1.94 -2.43 114.58 118.50 2jjm h GLU 339 Ca 0.00 0.04 0.12 0.00 0.34 0.00 0.00 59.36 59.86 2jjm h GLU 339 Cb 0.65 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 29.34 2jjm h GLU 339 CO 0.00 -0.35 0.50 1.25 -1.16 0.00 0.00 179.01 179.25 2jjm h LEU 340 N -1.15 0.68 -1.00 1.33 5.85 -1.92 -1.54 115.31 117.57 2jjm h LEU 340 Ca -0.06 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.64 2jjm h LEU 340 Cb 0.44 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2jjm h LEU 340 CO 0.09 0.35 -0.26 -0.74 -0.34 0.00 0.00 178.44 177.54 2jjm h HIS 341 N 0.78 0.45 -0.02 1.25 2.76 -1.63 0.13 115.15 118.87 2jjm h HIS 341 Ca 0.45 -0.09 -0.19 0.00 -2.20 0.00 0.00 60.37 58.33 2jjm h HIS 341 Cb 0.51 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.35 2jjm h HIS 341 CO -0.06 0.64 -0.83 0.00 -1.30 0.00 0.00 177.93 176.38 2jjm h ARG 342 N 0.36 0.26 0.14 5.26 2.47 -0.81 -2.65 114.38 119.41 2jjm h ARG 342 Ca 0.05 -0.26 -0.01 0.00 -1.26 0.00 0.00 59.98 58.51 2jjm h ARG 342 Cb 0.65 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.04 2jjm h ARG 342 CO 0.05 0.95 -0.07 -0.91 0.56 0.00 0.00 179.97 180.55 2jjm h ASN 343 N 0.16 -0.16 0.16 7.04 2.35 -1.08 -2.70 115.58 121.34 2jjm h ASN 343 Ca -0.04 -0.39 0.01 0.00 -0.55 0.00 0.00 56.30 55.34 2jjm h ASN 343 Cb 1.43 0.04 -0.03 0.00 0.05 0.00 0.00 38.32 39.81 2jjm h ASN 343 CO 0.13 0.39 -0.26 -0.03 -1.65 0.00 0.00 177.43 176.00 2jjm h MET 344 N -0.81 -0.48 -0.46 0.81 4.05 -0.86 0.71 114.93 117.89 2jjm h MET 344 Ca -0.02 0.03 0.13 0.00 -0.28 0.00 0.00 59.70 59.57 2jjm h MET 344 Cb 0.54 0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.43 2jjm h MET 344 CO 0.03 -0.32 0.41 0.78 0.23 0.00 0.00 176.91 178.04 2jjm h GLY 345 N -0.50 0.00 0.28 1.39 0.00 -1.58 0.38 103.07 103.05 2jjm h GLY 345 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.17 2jjm h GLY 345 CO -0.13 0.00 -0.92 -2.09 0.00 0.00 0.00 176.54 173.40 2jjm h GLU 346 N 0.00 0.12 -0.35 4.80 4.57 -0.82 -3.10 114.58 119.81 2jjm h GLU 346 Ca 0.22 -0.21 0.08 0.00 -1.18 0.00 0.00 59.36 58.26 2jjm h GLU 346 Cb 1.04 0.08 -0.08 0.00 -0.16 0.00 0.00 28.75 29.63 2jjm h GLU 346 CO -0.00 1.10 -0.21 0.00 -1.18 0.00 0.00 179.01 178.72 2jjm h ARG 347 N -0.68 -0.15 0.23 1.92 2.47 0.16 -2.50 114.38 115.83 2jjm h ARG 347 Ca -0.21 0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.51 2jjm h ARG 347 Cb 1.43 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 29.76 2jjm h ARG 347 CO -0.01 -0.10 -0.34 0.00 0.56 0.00 0.00 179.97 180.08 2jjm h ALA 348 N 1.04 -0.95 0.00 0.04 0.00 -0.43 -0.31 119.26 118.65 2jjm h ALA 348 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2jjm h ALA 348 Cb 0.43 0.64 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2jjm h ALA 348 CO -0.44 -1.00 0.00 2.89 0.00 0.00 0.00 179.25 180.70 2jjm n ARG 349 N -4.42 0.03 -0.10 0.00 1.85 -1.16 -1.85 116.66 111.01 2jjm n ARG 349 Ca -0.07 0.18 -0.17 0.00 -1.00 0.00 0.00 57.85 56.79 2jjm n ARG 349 Cb 0.29 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 30.13 2jjm n ARG 349 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2jjm n GLU 350 N -1.19 0.53 0.34 2.89 1.02 -0.51 -3.44 120.64 120.28 2jjm n GLU 350 Ca 0.01 0.44 0.22 0.00 -0.02 0.00 0.00 57.16 57.81 2jjm n GLU 350 Cb 0.01 -1.63 1.17 0.00 -0.02 0.00 0.00 31.44 30.97 2jjm n GLU 350 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2jjm h SER 351 N -1.00 0.00 0.07 1.62 4.64 -0.48 0.11 113.55 118.51 2jjm h SER 351 Ca -0.27 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2jjm h SER 351 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2jjm h SER 351 CO -0.16 0.00 -0.04 0.58 -0.87 0.00 0.00 176.83 176.34 2jjm h VAL 352 N 0.00 1.18 -0.31 0.95 2.07 -1.53 -2.67 116.25 115.95 2jjm h VAL 352 Ca 0.00 -1.42 0.05 0.00 0.82 0.00 0.00 66.70 66.15 2jjm h VAL 352 Cb 0.08 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 2jjm h VAL 352 CO 0.00 0.32 0.21 0.22 0.02 0.00 0.00 177.57 178.35 2jjm h TYR 353 N -0.80 0.19 0.86 1.57 3.20 -1.11 -0.70 116.97 120.19 2jjm h TYR 353 Ca -0.01 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 2jjm h TYR 353 Cb 0.61 -0.06 0.01 0.00 1.54 0.00 0.00 36.73 38.82 2jjm h TYR 353 CO 0.13 0.11 -0.41 0.93 -1.64 0.00 0.00 178.16 177.27 2jjm h GLU 354 N 0.20 -1.12 -0.00 1.82 4.39 -0.82 -3.20 114.58 115.84 2jjm h GLU 354 Ca 0.14 0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.91 2jjm h GLU 354 Cb 0.30 0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2jjm h GLU 354 CO -0.02 -0.74 -0.23 0.00 -1.16 0.00 0.00 179.01 176.86 2jjm n GLN 355 N -5.57 3.77 -0.03 2.33 10.64 -1.01 -4.65 117.38 122.87 2jjm n GLN 355 Ca -0.15 -0.22 0.03 0.00 -1.83 0.00 0.00 57.00 54.84 2jjm n GLN 355 Cb 0.46 -0.88 0.04 0.00 -0.86 0.00 0.00 30.24 29.01 2jjm n GLN 355 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2jjm n PHE 356 N -0.79 0.00 -1.66 2.61 3.72 -0.29 -4.93 117.46 116.12 2jjm n PHE 356 Ca 0.02 -0.63 -0.55 0.00 -0.05 0.00 0.00 57.45 56.24 2jjm n PHE 356 Cb 0.12 -0.08 -0.07 0.00 -0.94 0.00 0.00 39.48 38.51 2jjm n PHE 356 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 2jjm n ARG 357 N -0.77 1.14 0.02 -1.08 3.00 -1.10 -4.34 116.66 113.54 2jjm n ARG 357 Ca 0.05 0.42 -0.10 0.00 -0.00 0.00 0.00 57.85 58.22 2jjm n ARG 357 Cb 0.39 -2.08 -0.03 0.00 0.00 0.00 0.00 32.46 30.74 2jjm n ARG 357 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 2jjm h SER 358 N 6.13 -0.57 -0.10 6.15 4.64 -1.90 -1.06 113.55 126.85 2jjm h SER 358 Ca -0.47 0.09 0.03 0.00 -0.47 0.00 0.00 61.79 60.97 2jjm h SER 358 Cb 1.33 0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 63.67 2jjm h SER 358 CO 0.89 -0.24 0.09 1.05 -0.87 0.00 0.00 176.83 177.75 2jjm h GLU 359 N -0.26 0.00 0.27 4.77 -0.00 -1.91 -0.74 114.58 116.71 2jjm h GLU 359 Ca 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.43 2jjm h GLU 359 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.13 2jjm h GLU 359 CO -0.24 0.00 -0.13 -0.22 -0.00 0.00 0.00 179.01 178.42 2jjm h LYS 360 N 0.00 -0.35 -0.46 1.06 3.64 -1.59 -2.95 116.57 115.91 2jjm h LYS 360 Ca 0.05 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2jjm h LYS 360 Cb 0.23 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.09 2jjm h LYS 360 CO -0.00 -0.04 0.24 0.82 -2.27 0.00 0.00 179.45 178.20 2jjm h ILE 361 N -0.98 0.98 -0.93 2.00 5.03 -1.02 -0.99 117.51 121.60 2jjm h ILE 361 Ca -0.04 -0.16 0.13 0.00 -0.12 0.00 0.00 64.86 64.67 2jjm h ILE 361 Cb 0.47 0.46 -0.07 0.00 -3.03 0.00 0.00 36.82 34.65 2jjm h ILE 361 CO 0.06 0.09 0.59 0.58 -0.68 0.00 0.00 178.15 178.79 2jjm h VAL 362 N 0.48 0.88 0.00 1.67 2.07 -1.25 0.53 116.25 120.63 2jjm h VAL 362 Ca 0.20 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.37 2jjm h VAL 362 Cb 0.09 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 2jjm h VAL 362 CO -0.13 0.15 -0.30 0.28 0.02 0.00 0.00 177.57 177.58 2jjm h SER 363 N 0.82 0.00 -0.22 0.57 0.02 -1.01 -0.36 113.55 113.38 2jjm h SER 363 Ca 0.46 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.36 2jjm h SER 363 Cb 0.60 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 2jjm h SER 363 CO -0.22 0.30 -0.06 1.56 -1.14 0.00 0.00 176.83 177.27 2jjm h GLN 364 N 0.00 0.43 -0.78 3.45 4.20 -0.49 -0.21 115.11 121.71 2jjm h GLN 364 Ca -0.00 -0.17 -0.05 0.00 0.06 0.00 0.00 58.65 58.49 2jjm h GLN 364 Cb 0.58 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.30 2jjm h GLN 364 CO 0.04 0.68 0.30 1.88 -0.67 0.00 0.00 178.83 181.07 2jjm h TYR 365 N 0.16 1.20 -0.49 2.96 -1.99 -1.07 -0.53 116.97 117.21 2jjm h TYR 365 Ca 0.05 -0.09 0.00 0.00 2.00 0.00 0.00 58.73 60.69 2jjm h TYR 365 Cb 0.53 -0.36 -0.02 0.00 2.00 0.00 0.00 36.73 38.88 2jjm h TYR 365 CO 0.05 0.91 0.31 1.49 -0.00 0.00 0.00 178.16 180.93 2jjm h GLU 366 N 1.15 0.65 -0.01 4.88 4.81 -0.84 -1.61 114.58 123.61 2jjm h GLU 366 Ca 0.26 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.32 2jjm h GLU 366 Cb 0.23 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 2jjm h GLU 366 CO -0.02 0.45 -0.57 1.79 -0.73 0.00 0.00 179.01 179.93 2jjm h THR 367 N 0.66 1.40 -0.66 0.32 1.35 -0.62 -2.64 112.91 112.73 2jjm h THR 367 Ca 0.18 -1.94 -0.02 0.00 -0.55 0.00 0.00 66.41 64.07 2jjm h THR 367 Cb -0.05 2.03 -0.03 0.00 -1.73 0.00 0.00 68.15 68.37 2jjm h THR 367 CO -0.04 0.56 0.31 0.40 -0.25 0.00 0.00 175.52 176.51 2jjm h ILE 368 N 0.03 1.21 0.26 6.82 2.04 -0.31 0.67 117.51 128.23 2jjm h ILE 368 Ca -0.00 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 2jjm h ILE 368 Cb 1.01 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 2jjm h ILE 368 CO 0.08 0.25 -0.13 1.88 0.00 0.00 0.00 178.15 180.23 2jjm h TYR 369 N 0.92 -0.32 -0.92 1.37 0.05 -1.04 -1.62 116.97 115.41 2jjm h TYR 369 Ca 0.23 -0.01 0.07 0.00 0.05 0.00 0.00 58.73 59.07 2jjm h TYR 369 Cb 0.10 0.11 -0.07 0.00 1.01 0.00 0.00 36.73 37.88 2jjm h TYR 369 CO 0.01 -0.02 0.58 1.88 -1.05 0.00 0.00 178.16 179.56 2jjm h TYR 370 N -0.63 1.07 -0.73 4.88 0.05 -1.26 -2.27 116.97 118.08 2jjm h TYR 370 Ca -0.04 0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.73 2jjm h TYR 370 Cb 0.45 -0.35 -0.03 0.00 1.01 0.00 0.00 36.73 37.81 2jjm h TYR 370 CO 0.01 0.54 0.30 -0.44 -1.05 0.00 0.00 178.16 177.52 2jjm h ASP 371 N 1.04 0.99 0.00 3.88 5.19 -0.78 -2.13 116.42 124.62 2jjm h ASP 371 Ca 0.41 -0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 2jjm h ASP 371 Cb 0.20 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 39.45 2jjm h ASP 371 CO -0.18 0.89 0.00 0.55 -3.12 0.00 0.00 179.24 177.37 2jjm n VAL 372 N -4.36 0.00 0.00 -1.35 3.14 -0.62 -4.20 118.33 110.95 2jjm n VAL 372 Ca 0.06 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.44 2jjm n VAL 372 Cb 0.17 -0.71 0.00 0.00 -1.06 0.00 0.00 33.84 32.25 2jjm n VAL 372 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2jjm n LEU 373 N -0.89 0.00 0.00 6.55 4.77 -0.82 -5.01 117.00 121.61 2jjm n LEU 373 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2jjm n LEU 373 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2jjm n LEU 373 CO 0.05 0.00 0.00 -1.14 -1.33 0.00 0.00 177.39 174.97