#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kyh s GLU 12 N 0.00 4.38 0.13 -0.52 2.56 -1.26 -4.96 118.70 119.03 3kyh s GLU 12 Ca 0.00 2.01 -0.31 0.00 0.00 0.00 0.00 54.97 56.67 3kyh s GLU 12 Cb 0.00 -3.23 -0.08 0.00 2.00 0.00 0.00 34.13 32.82 3kyh s GLU 12 CO 0.00 -0.30 1.37 -1.50 -0.56 0.00 0.00 175.26 174.27 3kyh s ILE 13 N 0.55 3.31 0.55 -3.70 1.10 -1.26 -4.94 121.20 116.82 3kyh s ILE 13 Ca 0.59 0.96 0.28 0.00 -0.51 0.00 0.00 60.65 61.98 3kyh s ILE 13 Cb -0.35 -3.62 0.33 0.00 0.15 0.00 0.00 42.46 38.97 3kyh s ILE 13 CO 0.34 0.09 2.21 -0.65 -2.11 0.00 0.00 174.94 174.82 3kyh h PRO 14 N 6.52 0.00 0.00 3.50 0.11 -1.99 -3.43 132.00 136.71 3kyh h PRO 14 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3kyh h PRO 14 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3kyh h PRO 14 CO 0.84 0.03 0.00 0.41 -0.21 0.00 0.00 178.00 179.07 3kyh n GLY 15 N -1.22 1.82 3.76 -0.55 0.00 -1.26 -4.81 105.19 102.93 3kyh n GLY 15 Ca -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 3kyh n GLY 15 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3kyh s LEU 16 N 0.00 -0.25 0.27 0.99 2.34 -1.26 -4.85 118.68 115.92 3kyh s LEU 16 Ca 0.00 -0.43 -0.19 0.00 0.06 0.00 0.00 54.13 53.57 3kyh s LEU 16 Cb 0.00 2.41 -0.09 0.00 -0.56 0.00 0.00 46.19 47.96 3kyh s LEU 16 CO 0.00 -1.07 0.76 -0.63 -1.06 0.00 0.00 176.35 174.35 3kyh s ILE 17 N -3.56 4.56 0.40 1.48 1.01 -1.23 0.04 121.20 123.89 3kyh s ILE 17 Ca 0.10 1.25 -0.04 0.00 0.00 0.00 0.00 60.65 61.97 3kyh s ILE 17 Cb -0.03 -3.80 0.09 0.00 0.01 0.00 0.00 42.46 38.73 3kyh s ILE 17 CO 0.02 0.08 0.55 0.00 0.00 0.00 0.00 174.94 175.59 3kyh n GLN 18 N 0.37 -0.19 -0.65 2.79 1.13 -1.24 -4.94 117.38 114.64 3kyh n GLN 18 Ca -0.00 -1.11 -0.20 0.00 -1.94 0.00 0.00 57.00 53.75 3kyh n GLN 18 Cb 0.52 -0.49 0.11 0.00 0.11 0.00 0.00 30.24 30.49 3kyh n GLN 18 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 3kyh n PRO 19 N -2.11 -1.46 0.07 -1.09 -0.02 -1.26 -4.78 135.00 124.36 3kyh n PRO 19 Ca 0.08 -0.43 -0.23 0.00 -2.02 0.00 0.00 63.50 60.90 3kyh n PRO 19 Cb 0.27 -1.35 -0.15 0.00 -0.02 0.00 0.00 33.50 32.25 3kyh n PRO 19 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3kyh h GLY 20 N -2.25 0.44 0.93 -1.23 0.00 -1.99 -2.65 103.07 96.32 3kyh h GLY 20 Ca -0.26 -1.11 -0.02 0.00 0.00 0.00 0.00 47.33 45.94 3kyh h GLY 20 CO 0.17 0.97 -0.16 3.45 0.00 0.00 0.00 176.54 180.97 3kyh h ASN 21 N -0.03 -0.38 0.12 0.19 -1.07 -1.99 -1.72 115.58 110.70 3kyh h ASN 21 Ca -0.30 -0.04 0.00 0.00 0.07 0.00 0.00 56.30 56.03 3kyh h ASN 21 Cb 1.99 0.10 0.00 0.00 -2.07 0.00 0.00 38.32 38.34 3kyh h ASN 21 CO 0.17 -0.21 0.00 0.52 0.07 0.00 0.00 177.43 177.98 3kyh n VAL 22 N -5.25 1.73 -0.02 6.14 0.31 -1.25 -0.01 118.33 119.97 3kyh n VAL 22 Ca -0.10 0.45 -0.20 0.00 -0.01 0.00 0.00 64.34 64.48 3kyh n VAL 22 Cb 0.22 -1.40 -0.13 0.00 -0.91 0.00 0.00 33.84 31.62 3kyh n VAL 22 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 3kyh h THR 23 N 0.00 1.18 -0.75 2.52 2.02 -1.20 -3.37 112.91 113.31 3kyh h THR 23 Ca 0.00 -2.37 0.13 0.00 0.77 0.00 0.00 66.41 64.93 3kyh h THR 23 Cb 0.06 2.79 -0.09 0.00 -1.74 0.00 0.00 68.15 69.17 3kyh h THR 23 CO 0.00 0.62 0.34 1.56 0.37 0.00 0.00 175.52 178.41 3kyh h GLN 24 N -0.53 0.50 -0.49 6.66 4.20 0.50 -1.27 115.11 124.68 3kyh h GLN 24 Ca -0.25 -0.03 0.08 0.00 0.06 0.00 0.00 58.65 58.51 3kyh h GLN 24 Cb 1.56 -0.11 -0.07 0.00 0.30 0.00 0.00 27.48 29.16 3kyh h GLN 24 CO 0.02 0.33 0.12 -0.44 -0.67 0.00 0.00 178.83 178.19 3kyh h ASP 25 N 0.52 0.05 -0.05 1.46 3.45 -1.30 -1.20 116.42 119.35 3kyh h ASP 25 Ca 0.40 0.08 -0.21 0.00 0.43 0.00 0.00 57.03 57.73 3kyh h ASP 25 Cb 0.54 0.10 0.01 0.00 -0.56 0.00 0.00 39.33 39.42 3kyh h ASP 25 CO -0.35 0.05 -0.77 -0.07 -1.57 0.00 0.00 179.24 176.53 3kyh h LEU 26 N 0.26 0.77 -1.03 1.55 4.07 -1.62 -2.68 115.31 116.63 3kyh h LEU 26 Ca 0.25 -0.70 0.27 0.00 0.08 0.00 0.00 57.88 57.77 3kyh h LEU 26 Cb 0.31 -0.23 -0.13 0.00 1.08 0.00 0.00 40.66 41.69 3kyh h LEU 26 CO -0.30 1.36 0.60 0.11 -1.08 0.00 0.00 178.44 179.13 3kyh h LYS 27 N 0.24 0.49 0.64 1.13 1.57 -0.91 -0.12 116.57 119.59 3kyh h LYS 27 Ca -0.08 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 3kyh h LYS 27 Cb 1.43 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 33.64 3kyh h LYS 27 CO 0.15 0.32 -0.31 0.52 -0.57 0.00 0.00 179.45 179.57 3kyh h MET 28 N 0.50 -0.82 -0.96 3.15 2.86 -1.04 -2.25 114.93 116.37 3kyh h MET 28 Ca 0.67 0.06 0.30 0.00 -2.06 0.00 0.00 59.70 58.66 3kyh h MET 28 Cb 1.37 0.19 -0.17 0.00 0.06 0.00 0.00 31.60 33.05 3kyh h MET 28 CO -0.50 -0.51 0.26 0.52 1.06 0.00 0.00 176.91 177.75 3kyh h MET 29 N -1.13 0.09 -0.24 1.72 2.86 -1.00 0.28 114.93 117.52 3kyh h MET 29 Ca -0.09 -0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.44 3kyh h MET 29 Cb 0.69 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 3kyh h MET 29 CO 0.14 0.06 -0.31 0.28 1.06 0.00 0.00 176.91 178.15 3kyh h VAL 30 N 0.09 1.28 -0.10 -2.22 2.07 -0.96 -2.75 116.25 113.67 3kyh h VAL 30 Ca 0.66 -1.38 0.04 0.00 0.82 0.00 0.00 66.70 66.84 3kyh h VAL 30 Cb 1.48 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.65 3kyh h VAL 30 CO -0.78 0.43 -0.14 0.00 0.02 0.00 0.00 177.57 177.11 3kyh h LYS 32 N -0.18 0.77 -0.12 0.00 1.79 -1.54 -0.74 116.57 116.54 3kyh h LYS 32 Ca 0.08 -0.56 0.03 0.00 -2.18 0.00 0.00 60.65 58.03 3kyh h LYS 32 Cb 0.29 0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 31.03 3kyh h LYS 32 CO -0.20 1.18 0.29 1.25 -1.08 0.00 0.00 179.45 180.88 3kyh h LEU 33 N 0.50 0.00 -2.74 2.94 6.46 -1.39 0.22 115.31 121.29 3kyh h LEU 33 Ca -0.02 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.74 3kyh h LEU 33 Cb 1.23 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.15 3kyh h LEU 33 CO 0.13 0.00 -0.19 0.18 -0.62 0.00 0.00 178.44 177.94 3kyh n LEU 34 N -3.25 1.73 -4.04 2.25 4.77 -1.21 -4.21 117.00 113.04 3kyh n LEU 34 Ca 0.00 -2.57 -0.28 0.00 -0.03 0.00 0.00 56.01 53.13 3kyh n LEU 34 Cb 0.38 -0.31 -0.04 0.00 -2.33 0.00 0.00 43.42 41.12 3kyh n LEU 34 CO 0.20 0.63 -0.29 -0.46 -1.33 0.00 0.00 177.39 176.14 3kyh n ASN 35 N -1.00 -0.30 -3.65 -1.43 0.23 0.76 -4.98 115.26 104.90 3kyh n ASN 35 Ca 0.12 -1.09 -0.01 0.00 -0.53 0.00 0.00 54.58 53.07 3kyh n ASN 35 Cb 0.67 -2.64 -0.06 0.00 -2.08 0.00 0.00 39.78 35.66 3kyh n ASN 35 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 3kyh s SER 36 N -4.31 -0.39 0.00 0.53 0.15 -0.31 -5.02 113.70 104.34 3kyh s SER 36 Ca 0.04 0.63 0.14 0.00 0.70 0.00 0.00 55.95 57.45 3kyh s SER 36 Cb -0.02 1.14 0.72 0.00 -1.71 0.00 0.00 66.02 66.15 3kyh s SER 36 CO 0.92 -0.10 1.48 -0.81 1.20 0.00 0.00 173.24 175.93 3kyh n PRO 37 N 3.47 1.21 -0.33 5.44 -0.04 -1.26 -4.30 135.00 139.18 3kyh n PRO 37 Ca -0.18 -0.31 0.24 0.00 -0.04 0.00 0.00 63.50 63.21 3kyh n PRO 37 Cb 0.57 -1.24 0.48 0.00 -0.04 0.00 0.00 33.50 33.27 3kyh n PRO 37 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3kyh h LYS 38 N 0.59 0.28 0.00 0.54 1.79 -1.95 0.11 116.57 117.94 3kyh h LYS 38 Ca 0.00 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 3kyh h LYS 38 Cb 0.13 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 3kyh h LYS 38 CO 0.00 0.19 0.49 -2.30 -1.08 0.00 0.00 179.45 176.75 3kyh n PRO 39 N -5.08 0.00 -0.23 3.15 -0.02 -1.26 -0.18 135.00 131.38 3kyh n PRO 39 Ca 0.32 0.10 -0.05 0.00 -2.02 0.00 0.00 63.50 61.85 3kyh n PRO 39 Cb 1.01 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 3kyh n PRO 39 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3kyh h THR 40 N 0.00 0.13 0.00 3.45 1.35 -1.00 -3.45 112.91 113.40 3kyh h THR 40 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3kyh h THR 40 Cb 0.98 0.13 0.00 0.00 -1.73 0.00 0.00 68.15 67.53 3kyh h THR 40 CO 0.00 0.00 0.00 2.29 -0.25 0.00 0.00 175.52 177.56 3kyh n LYS 41 N -5.43 0.00 -0.90 4.72 0.00 0.75 -5.08 118.16 112.21 3kyh n LYS 41 Ca 0.04 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 58.02 3kyh n LYS 41 Cb 0.36 0.00 0.12 0.00 -0.00 0.00 0.00 35.03 35.51 3kyh n LYS 41 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 3kyh n THR 42 N -2.22 0.53 -2.06 0.58 -2.24 -1.10 -4.47 114.28 103.30 3kyh n THR 42 Ca 0.00 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 3kyh n THR 42 Cb 0.00 -0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 67.47 3kyh n THR 42 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3kyh s PHE 43 N -2.30 2.07 0.11 4.78 5.36 -1.26 -4.46 117.98 122.28 3kyh s PHE 43 Ca 0.61 0.33 -0.29 0.00 -0.96 0.00 0.00 56.93 56.61 3kyh s PHE 43 Cb -0.25 -3.89 -0.10 0.00 -0.34 0.00 0.00 43.02 38.45 3kyh s PHE 43 CO 0.63 -3.51 1.61 -1.35 -1.46 0.00 0.00 175.22 171.14 3kyh h PRO 44 N 9.66 -0.59 -7.07 10.12 0.11 -1.89 -3.32 132.00 139.03 3kyh h PRO 44 Ca -0.37 0.04 -0.47 0.00 0.11 0.00 0.00 66.00 65.30 3kyh h PRO 44 Cb 1.17 0.13 0.22 0.00 0.11 0.00 0.00 31.00 32.63 3kyh h PRO 44 CO 0.96 -0.39 -0.16 0.41 -0.21 0.00 0.00 178.00 178.61 3kyh n GLY 45 N -1.44 -1.62 3.80 -0.55 0.00 -1.26 -3.38 105.19 100.74 3kyh n GLY 45 Ca -0.08 -0.95 -0.37 0.00 0.00 0.00 0.00 46.02 44.62 3kyh n GLY 45 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3kyh s SER 46 N -2.35 7.15 -0.19 1.61 0.15 -1.26 -4.42 113.70 114.39 3kyh s SER 46 Ca 0.65 1.47 0.01 0.00 0.70 0.00 0.00 55.95 58.78 3kyh s SER 46 Cb -0.22 -2.44 0.02 0.00 -1.71 0.00 0.00 66.02 61.67 3kyh s SER 46 CO 0.64 0.10 -0.17 -1.10 1.20 0.00 0.00 173.24 173.91 3kyh s GLN 47 N -1.66 2.94 0.64 5.44 -1.52 -1.24 -5.04 119.66 119.21 3kyh s GLN 47 Ca 0.40 -0.87 -0.15 0.00 -1.95 0.00 0.00 55.36 52.78 3kyh s GLN 47 Cb -0.19 -2.66 -0.01 0.00 -0.22 0.00 0.00 33.01 29.93 3kyh s GLN 47 CO 0.22 -0.25 1.10 -1.25 -0.25 0.00 0.00 175.29 174.86 3kyh s PRO 48 N 1.29 2.96 0.20 2.91 0.04 -1.26 -3.15 135.00 137.98 3kyh s PRO 48 Ca 0.03 1.36 0.04 0.00 0.04 0.00 0.00 61.00 62.48 3kyh s PRO 48 Cb -0.14 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 3kyh s PRO 48 CO -0.11 -1.12 0.28 0.54 0.04 0.00 0.00 177.00 176.63 3kyh s VAL 49 N -2.33 5.08 0.10 -0.36 0.11 0.91 -4.86 120.40 119.06 3kyh s VAL 49 Ca 0.67 -0.94 -0.30 0.00 -2.93 0.00 0.00 61.98 58.47 3kyh s VAL 49 Cb -0.20 -3.69 -0.06 0.00 -1.53 0.00 0.00 36.38 30.90 3kyh s VAL 49 CO 0.39 -0.22 1.12 -0.44 -3.33 0.00 0.00 175.10 172.63 3kyh s SER 50 N -3.58 7.20 0.56 3.54 0.01 -1.26 -0.94 113.70 119.23 3kyh s SER 50 Ca 0.34 2.00 -0.19 0.00 1.31 0.00 0.00 55.95 59.40 3kyh s SER 50 Cb -0.10 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.49 3kyh s SER 50 CO 0.28 -0.33 1.17 0.12 0.41 0.00 0.00 173.24 174.89 3kyh s PHE 51 N 0.48 2.55 0.01 2.43 5.36 -1.20 -4.86 117.98 122.75 3kyh s PHE 51 Ca 0.54 1.53 -0.03 0.00 -0.96 0.00 0.00 56.93 58.00 3kyh s PHE 51 Cb -0.28 -3.39 -0.01 0.00 -0.34 0.00 0.00 43.02 39.00 3kyh s PHE 51 CO 0.31 -1.88 0.04 -0.65 -1.46 0.00 0.00 175.22 171.59 3kyh s GLN 52 N -3.26 0.37 0.18 10.12 -0.21 -1.26 -4.61 119.66 121.00 3kyh s GLN 52 Ca 0.74 -0.48 -0.13 0.00 0.02 0.00 0.00 55.36 55.51 3kyh s GLN 52 Cb -0.27 0.14 0.17 0.00 1.00 0.00 0.00 33.01 34.05 3kyh s GLN 52 CO 0.30 -0.07 1.75 1.25 -2.12 0.00 0.00 175.29 176.40 3kyh h HIS 53 N 4.58 0.33 -0.99 0.91 -0.00 -1.95 -1.91 115.15 116.13 3kyh h HIS 53 Ca -0.31 0.02 0.23 0.00 -0.00 0.00 0.00 60.37 60.31 3kyh h HIS 53 Cb 1.20 -0.07 -0.19 0.00 -0.00 0.00 0.00 27.41 28.35 3kyh h HIS 53 CO 0.62 0.11 -0.13 0.66 -0.00 0.00 0.00 177.93 179.19 3kyh h SER 54 N 0.37 -0.73 -0.75 3.26 4.64 -1.96 0.36 113.55 118.73 3kyh h SER 54 Ca 0.24 0.29 0.14 0.00 -0.47 0.00 0.00 61.79 61.99 3kyh h SER 54 Cb 0.24 0.56 -0.05 0.00 -0.31 0.00 0.00 62.40 62.84 3kyh h SER 54 CO -0.24 -0.34 0.50 0.44 -0.87 0.00 0.00 176.83 176.32 3kyh h ASP 55 N 0.00 0.41 0.04 4.97 3.32 -1.75 -3.18 116.42 120.23 3kyh h ASP 55 Ca 0.53 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.62 3kyh h ASP 55 Cb 0.94 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.39 3kyh h ASP 55 CO -0.98 0.21 -0.44 0.58 -1.72 0.00 0.00 179.24 176.90 3kyh h VAL 56 N 0.44 0.00 -0.33 -1.35 2.07 -0.26 0.25 116.25 117.07 3kyh h VAL 56 Ca 0.37 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.87 3kyh h VAL 56 Cb 0.81 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3kyh h VAL 56 CO -0.12 0.00 0.12 1.05 0.02 0.00 0.00 177.57 178.64 3kyh h GLU 57 N -0.58 0.47 -0.24 1.57 9.09 -1.72 0.13 114.58 123.30 3kyh h GLU 57 Ca 0.00 -0.06 -0.12 0.00 0.05 0.00 0.00 59.36 59.23 3kyh h GLU 57 Cb 0.60 -0.09 -0.00 0.00 -1.65 0.00 0.00 28.75 27.61 3kyh h GLU 57 CO -0.27 0.41 -0.33 0.93 0.05 0.00 0.00 179.01 179.79 3kyh h GLU 58 N 0.47 0.65 0.00 1.06 5.08 -0.78 -3.38 114.58 117.68 3kyh h GLU 58 Ca 0.12 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 3kyh h GLU 58 Cb 0.13 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.41 3kyh h GLU 58 CO -0.01 0.99 -0.31 1.63 -1.00 0.00 0.00 179.01 180.30 3kyh n LYS 59 N -4.27 0.00 0.19 2.33 4.76 0.60 -4.52 118.16 117.26 3kyh n LYS 59 Ca -0.05 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.51 3kyh n LYS 59 Cb 0.49 -0.65 0.22 0.00 -1.84 0.00 0.00 35.03 33.25 3kyh n LYS 59 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3kyh h LEU 60 N 0.00 0.00 0.14 -0.35 7.12 -1.50 -3.22 115.31 117.50 3kyh h LEU 60 Ca 0.00 -0.00 -0.31 0.00 0.13 0.00 0.00 57.88 57.70 3kyh h LEU 60 Cb 0.31 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.44 3kyh h LEU 60 CO 0.00 0.00 -1.51 0.25 -0.13 0.00 0.00 178.44 177.05 3kyh h LEU 61 N 0.00 0.45 -2.01 2.25 5.85 -0.90 -3.40 115.31 117.55 3kyh h LEU 61 Ca 0.00 -0.59 0.00 0.00 0.84 0.00 0.00 57.88 58.13 3kyh h LEU 61 Cb 0.94 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.83 3kyh h LEU 61 CO 0.00 1.49 0.00 0.00 -0.34 0.00 0.00 178.44 179.59 3kyh n ALA 62 N -2.67 2.43 -3.00 1.25 0.00 -1.23 -4.94 120.51 112.35 3kyh n ALA 62 Ca -0.16 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.35 3kyh n ALA 62 Cb 1.05 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.54 3kyh n ALA 62 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3kyh n HIS 63 N 1.12 -0.07 -3.95 0.00 8.25 -1.22 -5.05 115.22 114.31 3kyh n HIS 63 Ca 0.19 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.36 3kyh n HIS 63 Cb 0.49 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.43 3kyh n HIS 63 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3kyh s ASP 64 N -0.42 2.98 0.28 0.41 -0.00 -1.26 -4.91 116.67 113.75 3kyh s ASP 64 Ca 0.00 -0.70 0.09 0.00 -0.00 0.00 0.00 52.55 51.94 3kyh s ASP 64 Cb 0.00 -1.07 -0.06 0.00 -0.00 0.00 0.00 42.92 41.80 3kyh s ASP 64 CO 0.00 -0.15 -0.12 -0.31 -0.00 0.00 0.00 175.17 174.59 3kyh s TYR 65 N 1.53 2.12 0.17 4.23 1.51 -1.26 -0.75 117.35 124.89 3kyh s TYR 65 Ca 0.01 -0.52 0.10 0.00 -1.01 0.00 0.00 57.07 55.64 3kyh s TYR 65 Cb -0.15 -1.09 -0.04 0.00 -0.11 0.00 0.00 41.96 40.56 3kyh s TYR 65 CO -0.08 0.49 -0.16 0.71 -1.11 0.00 0.00 175.55 175.40 3kyh s TYR 66 N -2.76 2.51 -0.06 2.71 4.12 0.44 -0.34 117.35 123.96 3kyh s TYR 66 Ca 0.29 -0.27 -0.03 0.00 0.02 0.00 0.00 57.07 57.08 3kyh s TYR 66 Cb 0.00 -1.26 0.03 0.00 -1.52 0.00 0.00 41.96 39.22 3kyh s TYR 66 CO 0.13 0.48 0.14 0.14 0.02 0.00 0.00 175.55 176.45 3kyh s VAL 67 N -1.55 -0.04 0.13 0.71 -7.23 0.16 -0.93 120.40 111.66 3kyh s VAL 67 Ca 0.22 0.16 0.03 0.00 -1.81 0.00 0.00 61.98 60.57 3kyh s VAL 67 Cb -0.09 -0.22 -0.04 0.00 0.56 0.00 0.00 36.38 36.58 3kyh s VAL 67 CO 0.12 0.06 -0.06 0.00 -0.31 0.00 0.00 175.10 174.92 3kyh n GLU 69 N -0.14 1.19 -2.57 0.00 -0.00 -1.26 -1.20 120.64 116.66 3kyh n GLU 69 Ca -0.10 0.45 -0.41 0.00 -0.00 0.00 0.00 57.16 57.09 3kyh n GLU 69 Cb 0.61 -2.27 -0.03 0.00 -0.00 0.00 0.00 31.44 29.76 3kyh n GLU 69 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 3kyh s LYS 70 N -2.69 3.29 0.23 3.44 2.20 -0.28 -4.61 119.74 121.31 3kyh s LYS 70 Ca 0.73 -0.51 -0.32 0.00 -0.36 0.00 0.00 55.97 55.52 3kyh s LYS 70 Cb -0.44 -4.48 -0.12 0.00 -1.51 0.00 0.00 37.83 31.29 3kyh s LYS 70 CO 0.49 -2.14 1.70 0.95 -0.36 0.00 0.00 175.35 175.99 3kyh s THR 71 N 5.42 2.02 -1.05 3.43 -4.23 -1.26 -2.22 115.64 117.75 3kyh s THR 71 Ca 0.37 0.02 -0.02 0.00 -1.18 0.00 0.00 61.69 60.87 3kyh s THR 71 Cb -0.07 -3.01 0.31 0.00 1.34 0.00 0.00 72.50 71.08 3kyh s THR 71 CO 0.08 0.00 1.71 -0.67 -0.54 0.00 0.00 174.62 175.20 3kyh n ASP 72 N 3.56 7.02 0.00 3.99 -0.08 0.21 -4.90 116.55 126.36 3kyh n ASP 72 Ca 0.14 -3.58 0.00 0.00 -1.51 0.00 0.00 54.79 49.84 3kyh n ASP 72 Cb 0.36 -1.21 0.00 0.00 2.34 0.00 0.00 41.12 42.61 3kyh n ASP 72 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3kyh n GLY 73 N 0.47 2.72 3.08 0.27 0.00 -1.26 -4.80 105.19 105.67 3kyh n GLY 73 Ca 0.39 -1.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.24 3kyh n GLY 73 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kyh s LEU 74 N 0.00 5.14 -0.13 0.99 2.96 -1.19 -4.92 118.68 121.53 3kyh s LEU 74 Ca 0.00 -2.73 -0.35 0.00 -0.22 0.00 0.00 54.13 50.83 3kyh s LEU 74 Cb 0.00 -1.83 -0.12 0.00 0.50 0.00 0.00 46.19 44.74 3kyh s LEU 74 CO 0.00 -0.38 1.89 -1.14 -1.32 0.00 0.00 176.35 175.39 3kyh n ARG 75 N 3.63 2.02 -3.41 1.98 3.00 -1.26 -3.46 116.66 119.15 3kyh n ARG 75 Ca 0.06 0.73 -0.08 0.00 -0.00 0.00 0.00 57.85 58.57 3kyh n ARG 75 Cb 0.38 -2.59 -0.08 0.00 0.00 0.00 0.00 32.46 30.17 3kyh n ARG 75 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 3kyh s VAL 76 N 4.23 -0.65 0.81 5.15 1.01 -1.10 -3.79 120.40 126.05 3kyh s VAL 76 Ca 0.94 -0.00 -0.11 0.00 0.00 0.00 0.00 61.98 62.81 3kyh s VAL 76 Cb -0.74 -0.79 0.08 0.00 0.00 0.00 0.00 36.38 34.93 3kyh s VAL 76 CO 0.53 -0.06 1.09 -0.76 0.00 0.00 0.00 175.10 175.90 3kyh s LEU 77 N 2.59 2.59 -0.16 3.92 1.02 -0.47 -3.39 118.68 124.78 3kyh s LEU 77 Ca 0.10 1.39 -0.06 0.00 0.02 0.00 0.00 54.13 55.57 3kyh s LEU 77 Cb -0.14 -3.99 -0.04 0.00 0.02 0.00 0.00 46.19 42.04 3kyh s LEU 77 CO -0.15 -2.07 0.06 -0.32 0.02 0.00 0.00 176.35 173.88 3kyh s MET 78 N -5.09 3.73 -0.17 1.70 -2.45 0.05 -2.34 119.30 114.74 3kyh s MET 78 Ca 0.61 -0.33 0.00 0.00 -1.25 0.00 0.00 55.69 54.73 3kyh s MET 78 Cb -0.15 -3.13 0.04 0.00 1.25 0.00 0.00 34.83 32.83 3kyh s MET 78 CO 0.55 0.42 -0.10 0.12 1.05 0.00 0.00 175.02 177.06 3kyh s PHE 79 N -0.04 2.08 -0.19 4.11 5.36 0.13 -2.83 117.98 126.60 3kyh s PHE 79 Ca 0.06 -1.29 0.01 0.00 -0.96 0.00 0.00 56.93 54.75 3kyh s PHE 79 Cb -0.12 -1.50 0.04 0.00 -0.34 0.00 0.00 43.02 41.10 3kyh s PHE 79 CO 0.01 -0.67 -0.10 0.96 -1.46 0.00 0.00 175.22 173.96 3kyh s ILE 80 N 1.51 1.61 0.04 3.12 -5.25 -1.10 -1.16 121.20 119.96 3kyh s ILE 80 Ca 0.01 -0.95 -0.08 0.00 -0.99 0.00 0.00 60.65 58.64 3kyh s ILE 80 Cb -0.15 -1.67 0.00 0.00 2.95 0.00 0.00 42.46 43.59 3kyh s ILE 80 CO -0.09 0.20 0.17 0.68 -1.79 0.00 0.00 174.94 174.11 3kyh s VAL 81 N 1.42 0.11 -0.43 8.37 -7.23 -1.17 -3.08 120.40 118.39 3kyh s VAL 81 Ca -0.00 -0.94 -0.03 0.00 -1.81 0.00 0.00 61.98 59.20 3kyh s VAL 81 Cb -0.16 -0.90 0.12 0.00 0.56 0.00 0.00 36.38 36.00 3kyh s VAL 81 CO -0.08 -0.52 0.23 -0.63 -0.31 0.00 0.00 175.10 173.79 3kyh s ILE 82 N -2.57 3.36 -0.38 -0.62 1.01 -1.26 -0.17 121.20 120.57 3kyh s ILE 82 Ca -0.05 -2.15 -0.35 0.00 0.00 0.00 0.00 60.65 58.10 3kyh s ILE 82 Cb -0.01 -3.29 -0.12 0.00 0.01 0.00 0.00 42.46 39.05 3kyh s ILE 82 CO -0.04 -0.72 2.21 -0.46 0.00 0.00 0.00 174.94 175.93 3kyh n ASN 83 N 4.49 1.97 -0.30 3.58 6.94 -0.40 -4.66 115.26 126.89 3kyh n ASN 83 Ca -0.01 0.40 0.00 0.00 -0.02 0.00 0.00 54.58 54.94 3kyh n ASN 83 Cb 0.41 -1.23 0.00 0.00 -2.36 0.00 0.00 39.78 36.59 3kyh n ASN 83 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 3kyh n PRO 84 N 8.18 0.59 0.00 -0.53 -0.02 -1.26 0.32 135.00 142.28 3kyh n PRO 84 Ca 0.43 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 3kyh n PRO 84 Cb 0.21 -1.17 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 3kyh n PRO 84 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3kyh n VAL 85 N -0.08 0.00 -0.30 -1.45 0.31 -1.26 -4.85 118.33 110.71 3kyh n VAL 85 Ca 0.00 0.14 0.04 0.00 -0.01 0.00 0.00 64.34 64.50 3kyh n VAL 85 Cb 0.09 -0.51 0.08 0.00 -0.91 0.00 0.00 33.84 32.59 3kyh n VAL 85 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3kyh n THR 86 N -1.03 1.25 -2.29 2.52 -2.24 -1.15 -5.10 114.28 106.24 3kyh n THR 86 Ca 0.00 -1.27 0.00 0.00 -2.27 0.00 0.00 64.05 60.51 3kyh n THR 86 Cb 0.00 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 3kyh n THR 86 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kyh n GLY 87 N -0.40 -4.84 0.00 3.38 0.00 0.15 -5.03 105.19 98.45 3kyh n GLY 87 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3kyh n GLY 87 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3kyh n GLU 88 N 1.89 0.00 -2.33 1.61 4.07 -1.26 -4.92 120.64 119.70 3kyh n GLU 88 Ca 0.00 0.00 -0.40 0.00 -0.06 0.00 0.00 57.16 56.70 3kyh n GLU 88 Cb 0.00 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.35 3kyh n GLU 88 CO 0.00 0.00 0.00 -1.14 -0.06 0.00 0.00 177.13 175.93 3kyh s GLN 89 N -1.51 4.35 -0.05 5.31 0.74 -1.26 -1.27 119.66 125.97 3kyh s GLN 89 Ca 0.00 1.91 0.06 0.00 0.05 0.00 0.00 55.36 57.38 3kyh s GLN 89 Cb 0.00 -2.96 -0.01 0.00 1.10 0.00 0.00 33.01 31.14 3kyh s GLN 89 CO 0.00 -0.08 -0.25 0.20 -0.55 0.00 0.00 175.29 174.61 3kyh s GLY 90 N -0.90 1.28 -0.39 2.59 0.00 0.75 -4.94 107.32 105.71 3kyh s GLY 90 Ca 0.50 -1.05 -0.07 0.00 0.00 0.00 0.00 44.72 44.11 3kyh s GLY 90 CO 0.43 -0.69 0.19 0.00 0.00 0.00 0.00 173.10 173.03 3kyh s PHE 92 N 1.34 1.69 -0.07 0.00 0.40 -0.31 -1.57 117.98 119.46 3kyh s PHE 92 Ca 0.02 -0.43 0.01 0.00 -0.60 0.00 0.00 56.93 55.93 3kyh s PHE 92 Cb -0.22 -0.93 0.02 0.00 0.51 0.00 0.00 43.02 42.40 3kyh s PHE 92 CO 0.01 0.18 -0.06 -1.64 0.70 0.00 0.00 175.22 174.40 3kyh s MET 93 N -1.89 1.19 -0.37 0.44 -1.94 -0.65 0.19 119.30 116.27 3kyh s MET 93 Ca 0.05 -0.18 -0.01 0.00 -1.71 0.00 0.00 55.69 53.84 3kyh s MET 93 Cb -0.10 -1.20 0.09 0.00 2.01 0.00 0.00 34.83 35.64 3kyh s MET 93 CO 0.04 -0.14 0.12 0.96 -0.01 0.00 0.00 175.02 175.99 3kyh s ILE 94 N 1.25 3.01 0.14 2.53 -4.36 -0.99 -0.06 121.20 122.72 3kyh s ILE 94 Ca -0.05 -1.96 -0.02 0.00 -0.26 0.00 0.00 60.65 58.36 3kyh s ILE 94 Cb -0.14 -3.01 0.03 0.00 1.25 0.00 0.00 42.46 40.59 3kyh s ILE 94 CO -0.02 -0.54 0.15 -0.90 0.24 0.00 0.00 174.94 173.87 3kyh n ASP 95 N 4.53 -0.65 -0.03 4.36 3.85 -1.02 -1.37 116.55 126.21 3kyh n ASP 95 Ca -0.04 -0.78 -0.12 0.00 -0.71 0.00 0.00 54.79 53.14 3kyh n ASP 95 Cb 0.42 -0.13 -0.07 0.00 -1.35 0.00 0.00 41.12 39.99 3kyh n ASP 95 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.20 176.10 3kyh h ARG 96 N 0.00 0.19 -6.72 0.11 9.65 -1.92 -3.36 114.38 112.33 3kyh h ARG 96 Ca -0.05 -0.07 -0.50 0.00 -1.10 0.00 0.00 59.98 58.26 3kyh h ARG 96 Cb 0.15 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.71 3kyh h ARG 96 CO 0.04 0.47 0.40 -2.00 2.80 0.00 0.00 179.97 181.68 3kyh s GLU 97 N -4.88 4.74 -0.98 0.20 2.56 -1.26 -4.70 118.70 114.38 3kyh s GLU 97 Ca -0.14 1.60 -0.24 0.00 0.00 0.00 0.00 54.97 56.19 3kyh s GLU 97 Cb 0.05 -3.27 -0.07 0.00 2.00 0.00 0.00 34.13 32.83 3kyh s GLU 97 CO 0.71 0.32 1.99 -0.80 -0.56 0.00 0.00 175.26 176.92 3kyh s ASN 98 N -0.76 4.92 -0.01 -1.70 0.01 -1.26 -4.90 114.94 111.25 3kyh s ASN 98 Ca 0.44 -0.89 0.02 0.00 -0.71 0.00 0.00 52.86 51.73 3kyh s ASN 98 Cb -0.28 -2.57 -0.00 0.00 0.41 0.00 0.00 41.25 38.81 3kyh s ASN 98 CO 0.34 -3.03 -0.08 0.20 -1.51 0.00 0.00 177.10 173.03 3kyh s ASN 99 N 7.90 0.94 -0.24 -1.22 0.01 -1.26 -4.98 114.94 116.10 3kyh s ASN 99 Ca 0.72 -0.14 -0.04 0.00 -0.71 0.00 0.00 52.86 52.69 3kyh s ASN 99 Cb -0.06 -0.13 -0.00 0.00 0.41 0.00 0.00 41.25 41.47 3kyh s ASN 99 CO 0.05 0.09 -0.02 -0.31 -1.51 0.00 0.00 177.10 175.39 3kyh s TYR 100 N -0.12 3.00 0.05 2.20 1.51 -1.25 -2.44 117.35 120.30 3kyh s TYR 100 Ca 0.02 -1.01 -0.00 0.00 -1.01 0.00 0.00 57.07 55.07 3kyh s TYR 100 Cb -0.04 -2.12 -0.04 0.00 -0.11 0.00 0.00 41.96 39.65 3kyh s TYR 100 CO -0.00 -0.57 0.20 0.71 -1.11 0.00 0.00 175.55 174.78 3kyh s TYR 101 N 1.47 3.51 -0.49 2.71 1.51 0.91 -3.56 117.35 123.41 3kyh s TYR 101 Ca 0.05 0.26 0.04 0.00 -1.01 0.00 0.00 57.07 56.40 3kyh s TYR 101 Cb -0.15 -1.76 0.13 0.00 -0.11 0.00 0.00 41.96 40.06 3kyh s TYR 101 CO -0.02 0.59 0.24 -1.17 -1.11 0.00 0.00 175.55 174.08 3kyh s LEU 102 N -2.42 4.13 0.77 -1.29 0.20 0.11 -1.64 118.68 118.53 3kyh s LEU 102 Ca 0.34 -2.88 -0.11 0.00 0.69 0.00 0.00 54.13 52.17 3kyh s LEU 102 Cb -0.13 -1.56 0.05 0.00 -0.43 0.00 0.00 46.19 44.13 3kyh s LEU 102 CO 0.26 -0.25 1.08 -0.69 -0.29 0.00 0.00 176.35 176.47 3kyh s VAL 103 N -0.09 3.37 0.00 1.68 1.01 -0.61 -4.35 120.40 121.43 3kyh s VAL 103 Ca 0.16 0.45 0.00 0.00 0.00 0.00 0.00 61.98 62.59 3kyh s VAL 103 Cb -0.25 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 32.96 3kyh s VAL 103 CO -0.01 -0.58 0.00 0.59 0.00 0.00 0.00 175.10 175.10 3kyh n ASN 104 N -3.35 0.00 -4.63 3.32 5.03 -1.26 -4.47 115.26 109.89 3kyh n ASN 104 Ca 0.07 0.00 -0.43 0.00 0.87 0.00 0.00 54.58 55.09 3kyh n ASN 104 Cb 0.55 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.29 3kyh n ASN 104 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3kyh s GLY 105 N 0.00 1.26 -0.10 7.41 0.00 -0.95 -4.70 107.32 110.24 3kyh s GLY 105 Ca 0.00 0.45 -0.05 0.00 0.00 0.00 0.00 44.72 45.12 3kyh s GLY 105 CO 0.00 2.95 0.23 -1.36 0.00 0.00 0.00 173.10 174.92 3kyh s PHE 106 N 5.02 -0.30 -0.84 1.90 0.08 -1.26 -2.85 117.98 119.72 3kyh s PHE 106 Ca 0.69 0.74 -0.03 0.00 0.12 0.00 0.00 56.93 58.45 3kyh s PHE 106 Cb -0.24 0.03 0.21 0.00 -0.57 0.00 0.00 43.02 42.45 3kyh s PHE 106 CO 0.28 -0.22 0.73 1.03 -0.10 0.00 0.00 175.22 176.94 3kyh s ARG 107 N 1.17 3.20 -0.30 0.44 3.00 -1.26 -4.93 118.95 120.27 3kyh s ARG 107 Ca -0.09 -3.05 -0.22 0.00 0.00 0.00 0.00 55.73 52.36 3kyh s ARG 107 Cb -0.10 -3.98 -0.00 0.00 0.00 0.00 0.00 34.95 30.87 3kyh s ARG 107 CO -0.08 -1.24 0.74 -0.06 0.00 0.00 0.00 175.30 174.66 3kyh s PHE 108 N -0.96 3.21 0.00 -0.53 2.99 -1.26 -4.78 117.98 116.65 3kyh s PHE 108 Ca 0.25 0.75 0.00 0.00 0.00 0.00 0.00 56.93 57.93 3kyh s PHE 108 Cb -0.11 -3.13 0.00 0.00 0.00 0.00 0.00 43.02 39.78 3kyh s PHE 108 CO -0.10 -0.53 0.00 -0.35 -0.00 0.00 0.00 175.22 174.24 3kyh n PRO 109 N 6.08 1.67 0.00 0.24 -0.05 -1.26 -0.08 135.00 141.59 3kyh n PRO 109 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.47 3kyh n PRO 109 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.93 3kyh n PRO 109 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 175.50 175.99 3kyh n ARG 110 N 0.00 0.00 -2.76 0.54 1.74 -1.25 -3.37 116.66 111.56 3kyh n ARG 110 Ca 0.00 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.03 3kyh n ARG 110 Cb 0.00 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 31.46 3kyh n ARG 110 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3kyh n LEU 111 N 0.00 -3.27 0.08 0.55 7.94 -1.26 -4.48 117.00 116.56 3kyh n LEU 111 Ca 0.00 -3.01 -0.11 0.00 -1.11 0.00 0.00 56.01 51.78 3kyh n LEU 111 Cb 0.00 0.78 -0.03 0.00 0.53 0.00 0.00 43.42 44.71 3kyh n LEU 111 CO 0.00 1.95 0.22 1.55 -1.11 0.00 0.00 177.39 180.00 3kyh h PRO 112 N 4.68 0.28 0.00 1.96 0.13 -1.99 -3.44 132.00 133.62 3kyh h PRO 112 Ca -0.01 -0.31 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3kyh h PRO 112 Cb 1.09 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3kyh h PRO 112 CO 0.10 1.02 0.00 1.04 -0.23 0.00 0.00 178.00 179.93 3kyh n GLN 113 N -3.69 0.00 0.00 0.86 1.13 -1.26 -5.12 117.38 109.30 3kyh n GLN 113 Ca -0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.01 3kyh n GLN 113 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.17 3kyh n GLN 113 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 3kyh n LYS 114 N 0.00 0.00 -1.47 -1.09 3.00 -1.26 -5.14 118.16 112.20 3kyh n LYS 114 Ca 0.00 0.00 -0.54 0.00 -0.00 0.00 0.00 58.31 57.77 3kyh n LYS 114 Cb 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 35.03 34.96 3kyh n LYS 114 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 3kyh n LYS 115 N -2.47 0.10 0.00 1.64 2.85 -1.26 -4.83 118.16 114.19 3kyh n LYS 115 Ca 0.00 0.03 0.05 0.00 -1.05 0.00 0.00 58.31 57.35 3kyh n LYS 115 Cb 0.00 -1.36 0.32 0.00 -0.65 0.00 0.00 35.03 33.34 3kyh n LYS 115 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3kyh n LYS 116 N 1.35 0.53 -0.09 -1.58 4.76 -1.26 -0.87 118.16 121.00 3kyh n LYS 116 Ca 0.19 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.41 3kyh n LYS 116 Cb 0.15 -1.31 -0.12 0.00 -1.84 0.00 0.00 35.03 31.91 3kyh n LYS 116 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3kyh n GLU 117 N -0.81 0.66 0.00 1.97 4.71 -1.26 -4.87 120.64 121.04 3kyh n GLU 117 Ca 0.08 0.25 0.00 0.00 -0.01 0.00 0.00 57.16 57.48 3kyh n GLU 117 Cb 0.04 -1.59 0.00 0.00 -1.01 0.00 0.00 31.44 28.87 3kyh n GLU 117 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 3kyh n GLU 118 N -3.65 0.00 -0.24 3.49 4.07 -0.05 -1.24 120.64 123.02 3kyh n GLU 118 Ca -0.42 0.00 0.23 0.00 -0.06 0.00 0.00 57.16 56.91 3kyh n GLU 118 Cb 0.95 0.00 0.43 0.00 -0.06 0.00 0.00 31.44 32.76 3kyh n GLU 118 CO 0.00 0.00 0.00 1.47 -0.06 0.00 0.00 177.13 178.54 3kyh n LEU 119 N -1.69 0.24 0.20 4.31 -0.00 -1.26 -2.94 117.00 115.85 3kyh n LEU 119 Ca 0.00 1.23 0.14 0.00 -0.00 0.00 0.00 56.01 57.37 3kyh n LEU 119 Cb 0.00 -0.59 0.71 0.00 -0.00 0.00 0.00 43.42 43.54 3kyh n LEU 119 CO 0.00 -1.37 0.91 -0.07 -0.00 0.00 0.00 177.39 176.86 3kyh h LEU 120 N 0.00 0.00 0.00 1.47 3.38 -1.57 -2.96 115.31 115.63 3kyh h LEU 120 Ca 0.62 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.59 3kyh h LEU 120 Cb 1.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.38 3kyh h LEU 120 CO -0.57 0.00 -0.50 1.21 0.09 0.00 0.00 178.44 178.66 3kyh n GLU 121 N -2.43 2.80 -0.86 1.13 4.07 -1.15 -5.08 120.64 119.12 3kyh n GLU 121 Ca -0.01 0.00 -0.29 0.00 -0.06 0.00 0.00 57.16 56.80 3kyh n GLU 121 Cb 0.06 -0.75 0.20 0.00 -0.06 0.00 0.00 31.44 30.89 3kyh n GLU 121 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 3kyh s THR 122 N -1.10 2.15 0.30 6.31 -4.23 -1.12 -5.07 115.64 112.88 3kyh s THR 122 Ca 0.00 0.05 -0.14 0.00 -1.18 0.00 0.00 61.69 60.42 3kyh s THR 122 Cb 0.00 -2.31 0.02 0.00 1.34 0.00 0.00 72.50 71.55 3kyh s THR 122 CO 0.00 -0.06 0.61 -0.76 -0.54 0.00 0.00 174.62 173.87 3kyh s LEU 123 N -6.77 0.22 -0.05 4.79 2.01 -1.26 -4.58 118.68 113.04 3kyh s LEU 123 Ca 0.66 -0.99 0.03 0.00 0.01 0.00 0.00 54.13 53.84 3kyh s LEU 123 Cb -0.22 2.21 0.00 0.00 0.01 0.00 0.00 46.19 48.19 3kyh s LEU 123 CO 0.61 -1.35 -0.14 -1.58 1.01 0.00 0.00 176.35 174.90 3kyh s GLN 124 N -3.44 1.66 -0.10 1.70 2.00 0.88 -3.86 119.66 118.50 3kyh s GLN 124 Ca 0.19 -0.50 -0.04 0.00 -2.00 0.00 0.00 55.36 53.01 3kyh s GLN 124 Cb -0.03 -1.41 0.05 0.00 0.80 0.00 0.00 33.01 32.42 3kyh s GLN 124 CO 0.11 0.15 0.21 0.34 -0.50 0.00 0.00 175.29 175.60 3kyh s ASP 125 N 0.28 0.17 -0.35 6.67 -1.08 -1.26 -4.61 116.67 116.49 3kyh s ASP 125 Ca -0.08 0.45 -0.01 0.00 -0.52 0.00 0.00 52.55 52.40 3kyh s ASP 125 Cb -0.13 0.41 0.00 0.00 -1.46 0.00 0.00 42.92 41.75 3kyh s ASP 125 CO 0.03 -0.20 0.35 0.61 0.52 0.00 0.00 175.17 176.47 3kyh n GLY 126 N 4.78 -0.80 2.67 2.66 0.00 -1.20 0.59 105.19 113.89 3kyh n GLY 126 Ca -0.16 0.19 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 3kyh n GLY 126 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kyh s THR 127 N -2.87 0.22 -0.25 2.61 2.01 -1.18 -0.28 115.64 115.91 3kyh s THR 127 Ca 0.01 -0.42 -0.01 0.00 0.31 0.00 0.00 61.69 61.59 3kyh s THR 127 Cb -0.00 -0.84 0.03 0.00 0.01 0.00 0.00 72.50 71.70 3kyh s THR 127 CO 0.38 -0.29 -0.07 -0.22 -0.69 0.00 0.00 174.62 173.73 3kyh s LEU 128 N 1.99 3.24 -0.07 4.42 2.96 0.10 -2.72 118.68 128.61 3kyh s LEU 128 Ca 0.01 -0.98 -0.00 0.00 -0.22 0.00 0.00 54.13 52.94 3kyh s LEU 128 Cb -0.17 -1.64 0.03 0.00 0.50 0.00 0.00 46.19 44.91 3kyh s LEU 128 CO -0.11 -0.14 -0.03 -1.48 -1.32 0.00 0.00 176.35 173.27 3kyh s LEU 129 N 1.28 0.93 -0.24 -0.68 2.34 -1.13 0.63 118.68 121.81 3kyh s LEU 129 Ca -0.01 -0.15 -0.22 0.00 0.06 0.00 0.00 54.13 53.81 3kyh s LEU 129 Cb -0.17 -0.54 -0.02 0.00 -0.56 0.00 0.00 46.19 44.91 3kyh s LEU 129 CO -0.05 -0.14 0.69 -0.62 -1.06 0.00 0.00 176.35 175.18 3kyh s ASP 130 N 1.61 6.67 0.25 1.48 2.15 0.96 -0.77 116.67 129.02 3kyh s ASP 130 Ca 0.00 0.83 0.03 0.00 0.43 0.00 0.00 52.55 53.85 3kyh s ASP 130 Cb -0.13 -2.37 -0.05 0.00 -0.30 0.00 0.00 42.92 40.07 3kyh s ASP 130 CO -0.04 -0.40 0.02 -0.83 -0.17 0.00 0.00 175.17 173.74 3kyh s GLY 131 N 1.40 1.68 -0.25 2.66 0.00 -1.22 -2.57 107.32 109.01 3kyh s GLY 131 Ca 0.29 -1.84 0.02 0.00 0.00 0.00 0.00 44.72 43.20 3kyh s GLY 131 CO 0.08 -1.69 -0.09 -0.54 0.00 0.00 0.00 173.10 170.87 3kyh s GLU 132 N -3.89 2.03 -1.09 2.90 0.41 0.33 -2.72 118.70 116.67 3kyh s GLU 132 Ca 0.31 -1.25 -0.20 0.00 -0.41 0.00 0.00 54.97 53.42 3kyh s GLU 132 Cb 0.06 -2.80 0.08 0.00 -1.78 0.00 0.00 34.13 29.69 3kyh s GLU 132 CO 0.11 -0.59 1.48 -1.17 -0.49 0.00 0.00 175.26 174.59 3kyh s LEU 133 N 1.19 3.93 0.00 1.80 2.96 -1.22 -2.36 118.68 124.97 3kyh s LEU 133 Ca -0.08 -1.91 -0.15 0.00 -0.22 0.00 0.00 54.13 51.78 3kyh s LEU 133 Cb -0.20 -2.54 0.20 0.00 0.50 0.00 0.00 46.19 44.16 3kyh s LEU 133 CO -0.05 -1.30 1.21 1.33 -1.32 0.00 0.00 176.35 176.22 3kyh n VAL 134 N 6.39 0.00 -4.26 1.68 0.24 0.41 -3.17 118.33 119.63 3kyh n VAL 134 Ca 0.36 -0.94 -0.23 0.00 -2.04 0.00 0.00 64.34 61.49 3kyh n VAL 134 Cb 0.49 -1.51 -0.07 0.00 -1.47 0.00 0.00 33.84 31.28 3kyh n VAL 134 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3kyh s ILE 135 N -3.64 3.47 -0.11 1.34 1.09 -1.26 -2.14 121.20 119.94 3kyh s ILE 135 Ca 0.69 -1.84 -0.04 0.00 -1.10 0.00 0.00 60.65 58.36 3kyh s ILE 135 Cb -0.02 -2.91 0.06 0.00 -1.06 0.00 0.00 42.46 38.53 3kyh s ILE 135 CO 0.48 -0.35 0.18 -1.10 -0.10 0.00 0.00 174.94 174.06 3kyh s GLN 136 N -3.71 0.07 -0.03 2.79 -1.52 0.54 -4.38 119.66 113.42 3kyh s GLN 136 Ca 0.32 0.49 -0.21 0.00 -1.95 0.00 0.00 55.36 54.02 3kyh s GLN 136 Cb -0.06 -0.49 -0.05 0.00 -0.22 0.00 0.00 33.01 32.19 3kyh s GLN 136 CO 0.21 -0.38 0.60 0.99 -0.25 0.00 0.00 175.29 176.45 3kyh s THR 137 N 2.31 4.98 -0.01 -0.19 2.01 -1.26 -1.15 115.64 122.33 3kyh s THR 137 Ca 0.03 1.23 -0.30 0.00 0.31 0.00 0.00 61.69 62.97 3kyh s THR 137 Cb -0.13 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 3kyh s THR 137 CO -0.07 0.37 1.19 0.21 -0.69 0.00 0.00 174.62 175.63 3kyh s ASN 138 N 0.12 7.08 0.07 3.53 3.84 -0.63 -4.85 114.94 124.10 3kyh s ASN 138 Ca 0.31 1.88 -0.04 0.00 0.21 0.00 0.00 52.86 55.22 3kyh s ASN 138 Cb -0.18 -2.57 -0.28 0.00 -0.55 0.00 0.00 41.25 37.67 3kyh s ASN 138 CO 0.16 -0.52 1.11 1.55 -2.79 0.00 0.00 177.10 176.60 3kyh h PRO 139 N 7.19 0.27 0.00 0.43 0.13 -1.94 0.11 132.00 138.19 3kyh h PRO 139 Ca -0.37 -0.46 0.00 0.00 -0.87 0.00 0.00 66.00 64.30 3kyh h PRO 139 Cb 1.18 0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.49 3kyh h PRO 139 CO 0.85 1.21 0.00 1.98 -0.23 0.00 0.00 178.00 181.80 3kyh h MET 140 N 0.07 0.00 0.00 0.86 -1.53 -2.01 -3.37 114.93 108.95 3kyh h MET 140 Ca -0.15 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.11 3kyh h MET 140 Cb 1.98 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 33.03 3kyh h MET 140 CO 0.20 0.00 -0.43 2.41 0.14 0.00 0.00 176.91 179.23 3kyh n THR 141 N -2.37 0.00 -0.33 -0.77 -1.04 -1.24 -5.05 114.28 103.47 3kyh n THR 141 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 3kyh n THR 141 Cb 0.32 -0.33 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 3kyh n THR 141 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3kyh n LYS 142 N -1.52 0.00 -2.23 -2.82 4.76 0.37 -5.02 118.16 111.69 3kyh n LYS 142 Ca 0.00 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.01 3kyh n LYS 142 Cb 0.21 -0.96 -0.02 0.00 -1.84 0.00 0.00 35.03 32.42 3kyh n LYS 142 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3kyh s LEU 143 N 0.00 3.88 0.36 -0.35 1.43 -1.26 -4.49 118.68 118.26 3kyh s LEU 143 Ca 0.00 1.45 -0.24 0.00 -1.03 0.00 0.00 54.13 54.31 3kyh s LEU 143 Cb 0.00 -3.53 -0.10 0.00 0.03 0.00 0.00 46.19 42.59 3kyh s LEU 143 CO 0.00 -1.20 0.97 0.00 0.23 0.00 0.00 176.35 176.35 3kyh s GLN 144 N 4.50 4.42 -0.08 1.70 0.00 -1.25 -1.61 119.66 127.34 3kyh s GLN 144 Ca 0.66 1.31 -0.20 0.00 -0.00 0.00 0.00 55.36 57.13 3kyh s GLN 144 Cb -0.22 -2.60 0.04 0.00 0.00 0.00 0.00 33.01 30.24 3kyh s GLN 144 CO 0.27 0.12 0.47 -1.21 0.00 0.00 0.00 175.29 174.94 3kyh s GLU 145 N -2.42 0.74 0.23 9.60 2.02 -0.30 -4.91 118.70 123.67 3kyh s GLU 145 Ca 0.55 0.20 -0.30 0.00 0.02 0.00 0.00 54.97 55.44 3kyh s GLU 145 Cb -0.17 0.35 -0.09 0.00 0.10 0.00 0.00 34.13 34.32 3kyh s GLU 145 CO 0.22 -0.19 1.12 -1.17 0.02 0.00 0.00 175.26 175.26 3kyh s LEU 146 N -0.79 4.51 -0.10 1.80 1.98 -1.26 -0.34 118.68 124.48 3kyh s LEU 146 Ca -0.09 2.21 -0.15 0.00 -2.89 0.00 0.00 54.13 53.21 3kyh s LEU 146 Cb -0.03 -3.62 0.03 0.00 0.66 0.00 0.00 46.19 43.24 3kyh s LEU 146 CO 0.05 -0.21 0.38 -0.60 -1.89 0.00 0.00 176.35 174.07 3kyh s ARG 147 N -0.88 0.55 -0.15 1.98 3.52 -0.91 -3.42 118.95 119.64 3kyh s ARG 147 Ca 0.47 0.30 0.01 0.00 -0.13 0.00 0.00 55.73 56.38 3kyh s ARG 147 Cb -0.31 0.26 0.02 0.00 -1.56 0.00 0.00 34.95 33.35 3kyh s ARG 147 CO 0.38 -0.11 -0.18 -0.47 -0.81 0.00 0.00 175.30 174.11 3kyh s TYR 148 N -0.34 2.44 0.03 5.12 5.04 -1.07 -0.44 117.35 128.13 3kyh s TYR 148 Ca -0.05 -1.33 0.07 0.00 -2.44 0.00 0.00 57.07 53.32 3kyh s TYR 148 Cb -0.03 -1.72 -0.03 0.00 0.35 0.00 0.00 41.96 40.53 3kyh s TYR 148 CO 0.02 -0.66 -0.19 -0.51 -1.34 0.00 0.00 175.55 172.87 3kyh s LEU 149 N 1.16 2.56 -0.05 6.97 1.43 -1.00 -2.71 118.68 127.03 3kyh s LEU 149 Ca -0.00 -0.42 0.04 0.00 -1.03 0.00 0.00 54.13 52.72 3kyh s LEU 149 Cb -0.14 -1.49 -0.00 0.00 0.03 0.00 0.00 46.19 44.59 3kyh s LEU 149 CO -0.07 0.27 -0.18 -0.04 0.23 0.00 0.00 176.35 176.55 3kyh s MET 150 N -1.32 2.02 0.00 1.70 -1.94 -1.12 -0.52 119.30 118.12 3kyh s MET 150 Ca 0.14 -0.65 0.00 0.00 -1.71 0.00 0.00 55.69 53.46 3kyh s MET 150 Cb -0.10 -1.70 0.00 0.00 2.01 0.00 0.00 34.83 35.04 3kyh s MET 150 CO 0.04 0.23 0.00 1.97 -0.01 0.00 0.00 175.02 177.25 3kyh n PHE 151 N 3.25 0.00 -3.73 -0.03 -1.74 -1.06 -0.28 117.46 113.86 3kyh n PHE 151 Ca -0.19 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.60 3kyh n PHE 151 Cb 0.53 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.47 3kyh n PHE 151 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 3kyh s ASP 152 N -2.62 -0.09 -0.01 5.98 2.15 -1.25 -4.91 116.67 115.92 3kyh s ASP 152 Ca 0.00 -0.40 -0.00 0.00 0.43 0.00 0.00 52.55 52.58 3kyh s ASP 152 Cb 0.00 0.40 0.01 0.00 -0.30 0.00 0.00 42.92 43.04 3kyh s ASP 152 CO 0.00 -0.76 0.03 0.00 -0.17 0.00 0.00 175.17 174.27 3kyh n LEU 154 N 3.55 1.13 -3.70 0.00 -0.00 0.21 -4.65 117.00 113.54 3kyh n LEU 154 Ca -0.19 -1.13 -0.13 0.00 -0.00 0.00 0.00 56.01 54.57 3kyh n LEU 154 Cb 0.56 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.85 3kyh n LEU 154 CO 0.24 0.28 -0.11 0.00 -0.00 0.00 0.00 177.39 177.80 3kyh s ALA 155 N -0.26 -0.62 -0.06 1.47 0.00 -0.69 -0.46 121.76 121.14 3kyh s ALA 155 Ca 0.00 1.04 0.01 0.00 0.00 0.00 0.00 51.96 53.01 3kyh s ALA 155 Cb 0.00 -0.84 0.02 0.00 0.00 0.00 0.00 23.12 22.30 3kyh s ALA 155 CO 0.00 -0.40 -0.08 -1.50 0.00 0.00 0.00 175.76 173.78 3kyh s ILE 156 N 1.79 0.84 -0.69 0.00 1.10 -0.76 0.02 121.20 123.51 3kyh s ILE 156 Ca -0.05 -0.29 -0.00 0.00 -0.51 0.00 0.00 60.65 59.80 3kyh s ILE 156 Cb -0.11 -0.82 0.00 0.00 0.15 0.00 0.00 42.46 41.69 3kyh s ILE 156 CO -0.09 0.30 0.50 0.59 -2.11 0.00 0.00 174.94 174.12 3kyh n ASN 157 N 4.06 -3.97 0.00 4.50 3.02 0.62 -0.87 115.26 122.62 3kyh n ASN 157 Ca -0.22 -0.82 0.00 0.00 -0.03 0.00 0.00 54.58 53.51 3kyh n ASN 157 Cb 0.51 -1.32 0.00 0.00 -0.61 0.00 0.00 39.78 38.36 3kyh n ASN 157 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kyh n GLY 158 N -1.44 0.72 3.61 7.41 0.00 0.20 -4.88 105.19 110.81 3kyh n GLY 158 Ca -0.27 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 3kyh n GLY 158 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3kyh s ARG 159 N 0.00 3.72 -0.49 1.61 3.52 -0.05 -4.95 118.95 122.30 3kyh s ARG 159 Ca 0.00 1.10 -0.26 0.00 -0.13 0.00 0.00 55.73 56.43 3kyh s ARG 159 Cb 0.00 -3.97 -0.06 0.00 -1.56 0.00 0.00 34.95 29.36 3kyh s ARG 159 CO 0.00 -1.38 2.32 0.00 -0.81 0.00 0.00 175.30 175.43 3kyh n LEU 161 N 15.27 6.76 -0.07 0.00 4.77 0.39 -4.48 117.00 139.65 3kyh n LEU 161 Ca 0.34 -4.26 -0.05 0.00 -0.03 0.00 0.00 56.01 52.01 3kyh n LEU 161 Cb 0.54 -1.23 -0.02 0.00 -2.33 0.00 0.00 43.42 40.39 3kyh n LEU 161 CO 0.71 1.78 -0.39 0.41 -1.33 0.00 0.00 177.39 178.56 3kyh n THR 162 N 0.79 1.24 0.43 -5.08 -1.04 -1.18 -4.21 114.28 105.23 3kyh n THR 162 Ca 0.51 0.24 0.03 0.00 -2.04 0.00 0.00 64.05 62.78 3kyh n THR 162 Cb 0.48 -2.26 0.17 0.00 -1.82 0.00 0.00 70.33 66.90 3kyh n THR 162 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3kyh n GLN 163 N -4.26 0.21 -4.18 -2.82 3.00 -1.26 -3.37 117.38 104.71 3kyh n GLN 163 Ca -0.08 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.58 3kyh n GLN 163 Cb 0.30 -1.41 -0.08 0.00 0.00 0.00 0.00 30.24 29.05 3kyh n GLN 163 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 3kyh s SER 164 N -1.96 5.52 0.74 1.08 1.04 -1.26 -4.88 113.70 113.97 3kyh s SER 164 Ca 0.08 0.13 -0.16 0.00 0.48 0.00 0.00 55.95 56.48 3kyh s SER 164 Cb 0.04 -1.56 -0.07 0.00 0.10 0.00 0.00 66.02 64.53 3kyh s SER 164 CO 0.07 0.30 0.22 -2.65 0.98 0.00 0.00 173.24 172.16 3kyh n PRO 165 N 1.44 0.17 -0.02 4.02 -0.02 -1.26 -4.26 135.00 135.07 3kyh n PRO 165 Ca -0.15 0.08 -0.09 0.00 -2.02 0.00 0.00 63.50 61.33 3kyh n PRO 165 Cb 0.53 -1.57 -0.03 0.00 -0.02 0.00 0.00 33.50 32.41 3kyh n PRO 165 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3kyh h THR 166 N -0.47 0.77 -0.58 3.45 2.02 -0.94 -0.25 112.91 116.91 3kyh h THR 166 Ca -0.44 0.00 0.11 0.00 0.77 0.00 0.00 66.41 66.84 3kyh h THR 166 Cb 1.36 0.77 -0.11 0.00 -1.74 0.00 0.00 68.15 68.42 3kyh h THR 166 CO 0.39 0.00 -0.30 0.77 0.37 0.00 0.00 175.52 176.75 3kyh h SER 167 N -0.05 -1.04 0.61 4.18 4.64 -1.90 0.72 113.55 120.71 3kyh h SER 167 Ca 0.08 0.22 -0.10 0.00 -0.47 0.00 0.00 61.79 61.52 3kyh h SER 167 Cb 0.18 0.53 -0.01 0.00 -0.31 0.00 0.00 62.40 62.79 3kyh h SER 167 CO -0.19 -0.29 -0.47 0.77 -0.87 0.00 0.00 176.83 175.78 3kyh h SER 168 N -0.14 0.00 0.65 4.97 4.64 -1.91 0.15 113.55 121.91 3kyh h SER 168 Ca 0.24 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.53 3kyh h SER 168 Cb 0.54 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.63 3kyh h SER 168 CO -0.66 0.47 -0.31 0.03 -0.87 0.00 0.00 176.83 175.49 3kyh h ARG 169 N 0.00 -0.85 -0.55 4.77 3.08 0.19 -3.16 114.38 117.87 3kyh h ARG 169 Ca -0.00 0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.21 3kyh h ARG 169 Cb 0.91 0.19 -0.10 0.00 0.08 0.00 0.00 29.97 31.04 3kyh h ARG 169 CO 0.06 -0.53 -0.14 -0.07 -1.07 0.00 0.00 179.97 178.22 3kyh h LEU 170 N -1.16 -0.52 0.00 3.04 3.38 0.14 -3.27 115.31 116.92 3kyh h LEU 170 Ca -0.09 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3kyh h LEU 170 Cb 0.70 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3kyh h LEU 170 CO 0.15 -0.18 0.00 0.00 0.09 0.00 0.00 178.44 178.49 3kyh n ALA 171 N -2.94 -0.09 -0.23 1.53 0.00 0.51 -2.54 120.51 116.74 3kyh n ALA 171 Ca 0.06 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.44 3kyh n ALA 171 Cb 0.29 0.22 -0.05 0.00 0.00 0.00 0.00 19.45 19.90 3kyh n ALA 171 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3kyh n HIS 172 N -1.62 -0.24 -0.36 0.00 8.25 -1.19 0.03 115.22 120.09 3kyh n HIS 172 Ca 0.00 0.69 0.36 0.00 -0.26 0.00 0.00 57.72 58.51 3kyh n HIS 172 Cb 0.00 -0.52 0.60 0.00 1.12 0.00 0.00 29.99 31.19 3kyh n HIS 172 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3kyh h LEU 173 N 0.00 0.00 0.00 2.41 5.85 -1.54 0.34 115.31 122.37 3kyh h LEU 173 Ca 0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 3kyh h LEU 173 Cb 0.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.26 3kyh h LEU 173 CO -0.52 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.19 3kyh n GLY 174 N -1.77 -1.35 0.30 3.75 0.00 0.10 -2.40 105.19 103.82 3kyh n GLY 174 Ca 0.29 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.19 3kyh n GLY 174 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kyh h LYS 175 N 0.00 -0.69 0.00 1.61 1.79 -1.25 -0.10 116.57 117.94 3kyh h LYS 175 Ca 0.00 0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 3kyh h LYS 175 Cb 0.00 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 3kyh h LYS 175 CO 0.00 -0.46 0.00 0.39 -1.08 0.00 0.00 179.45 178.30 3kyh n GLU 176 N -4.13 0.00 -0.03 3.15 4.71 0.11 -3.52 120.64 120.92 3kyh n GLU 176 Ca -0.09 0.30 -0.15 0.00 -0.01 0.00 0.00 57.16 57.22 3kyh n GLU 176 Cb 0.30 -0.86 -0.12 0.00 -1.01 0.00 0.00 31.44 29.75 3kyh n GLU 176 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 177.13 177.57 3kyh h PHE 177 N 0.00 0.17 0.06 -0.32 3.57 -1.68 -3.39 116.94 115.36 3kyh h PHE 177 Ca 0.00 -0.10 -0.00 0.00 3.53 0.00 0.00 57.97 61.40 3kyh h PHE 177 Cb 0.00 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.72 3kyh h PHE 177 CO 0.00 0.90 -0.03 0.35 -2.23 0.00 0.00 178.31 177.30 3kyh h PHE 178 N -0.60 -0.08 -0.99 0.41 3.57 -1.06 -2.70 116.94 115.49 3kyh h PHE 178 Ca -0.02 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.58 3kyh h PHE 178 Cb 0.95 0.03 -0.13 0.00 2.79 0.00 0.00 35.95 39.58 3kyh h PHE 178 CO 0.19 0.49 -0.53 1.17 -2.23 0.00 0.00 178.31 177.40 3kyh n LYS 179 N -4.78 -0.38 0.10 1.11 0.00 -0.10 0.82 118.16 114.93 3kyh n LYS 179 Ca -0.07 1.51 -0.01 0.00 0.00 0.00 0.00 58.31 59.74 3kyh n LYS 179 Cb 0.30 -2.23 0.28 0.00 0.00 0.00 0.00 35.03 33.38 3kyh n LYS 179 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 3kyh h PRO 180 N 0.00 0.25 0.17 1.64 0.13 -1.71 0.44 132.00 132.92 3kyh h PRO 180 Ca 0.21 -0.09 0.01 0.00 -0.87 0.00 0.00 66.00 65.26 3kyh h PRO 180 Cb 0.46 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.54 3kyh h PRO 180 CO -0.95 0.54 -0.29 -0.92 -0.23 0.00 0.00 178.00 176.14 3kyh h TYR 181 N 0.22 -0.79 -0.03 1.56 3.20 -1.03 -2.54 116.97 117.56 3kyh h TYR 181 Ca 0.03 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 3kyh h TYR 181 Cb 0.66 0.33 -0.00 0.00 1.54 0.00 0.00 36.73 39.26 3kyh h TYR 181 CO 0.01 -0.41 -0.01 0.35 -1.64 0.00 0.00 178.16 176.46 3kyh h PHE 182 N -0.54 0.06 -0.27 -3.82 3.57 0.21 -1.34 116.94 114.82 3kyh h PHE 182 Ca 0.02 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.56 3kyh h PHE 182 Cb 0.55 -0.01 -0.08 0.00 2.79 0.00 0.00 35.95 39.20 3kyh h PHE 182 CO -0.24 0.45 -0.37 -0.44 -2.23 0.00 0.00 178.31 175.48 3kyh h ASP 183 N -0.34 -1.18 -0.85 0.41 3.45 -0.35 0.18 116.42 117.73 3kyh h ASP 183 Ca 0.01 0.18 0.17 0.00 0.43 0.00 0.00 57.03 57.82 3kyh h ASP 183 Cb 0.43 0.51 -0.06 0.00 -0.56 0.00 0.00 39.33 39.65 3kyh h ASP 183 CO 0.00 -0.37 0.56 0.25 -1.57 0.00 0.00 179.24 178.12 3kyh h LEU 184 N -0.36 0.45 0.00 1.55 6.46 -1.09 0.62 115.31 122.93 3kyh h LEU 184 Ca 0.12 0.04 -0.10 0.00 -0.12 0.00 0.00 57.88 57.82 3kyh h LEU 184 Cb 0.57 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.44 3kyh h LEU 184 CO -0.46 0.21 -0.80 -0.09 -0.62 0.00 0.00 178.44 176.67 3kyh h ARG 185 N 0.46 0.00 0.14 1.25 2.43 -0.51 -3.17 114.38 114.98 3kyh h ARG 185 Ca 0.43 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 59.28 3kyh h ARG 185 Cb 0.98 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.53 3kyh h ARG 185 CO -0.16 0.30 -1.66 0.00 -1.51 0.00 0.00 179.97 176.94 3kyh h ALA 186 N 1.61 0.23 0.45 2.80 0.00 0.26 -3.34 119.26 121.28 3kyh h ALA 186 Ca -0.05 -1.18 -0.02 0.00 0.00 0.00 0.00 54.91 53.65 3kyh h ALA 186 Cb 1.34 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.68 3kyh h ALA 186 CO 0.04 1.00 -0.22 0.00 0.00 0.00 0.00 179.25 180.07 3kyh h ALA 187 N 0.01 -0.61 -3.35 0.00 0.00 -0.14 -3.42 119.26 111.75 3kyh h ALA 187 Ca -0.35 -0.19 -0.64 0.00 0.00 0.00 0.00 54.91 53.74 3kyh h ALA 187 Cb 1.92 0.24 -0.41 0.00 0.00 0.00 0.00 17.79 19.53 3kyh h ALA 187 CO 0.09 -0.70 -0.65 0.71 0.00 0.00 0.00 179.25 178.71 3kyh s TYR 188 N -4.81 3.06 0.38 0.00 1.51 -1.20 -4.96 117.35 111.33 3kyh s TYR 188 Ca -0.14 -3.08 0.05 0.00 -1.01 0.00 0.00 57.07 52.89 3kyh s TYR 188 Cb 0.02 -2.71 0.74 0.00 -0.11 0.00 0.00 41.96 39.90 3kyh s TYR 188 CO 0.51 -0.75 2.00 -1.00 -1.11 0.00 0.00 175.55 175.20 3kyh h PRO 189 N 6.57 0.60 -0.13 -1.71 0.13 -1.81 -3.28 132.00 132.38 3kyh h PRO 189 Ca -0.07 -0.06 -0.22 0.00 -0.87 0.00 0.00 66.00 64.78 3kyh h PRO 189 Cb 0.90 -0.12 0.01 0.00 0.13 0.00 0.00 31.00 31.92 3kyh h PRO 189 CO 0.66 0.46 -0.80 -0.91 -0.23 0.00 0.00 178.00 177.17 3kyh h ASN 190 N 0.61 0.88 0.00 1.44 4.21 -1.93 -3.32 115.58 117.47 3kyh h ASN 190 Ca 0.16 -0.59 0.00 0.00 1.21 0.00 0.00 56.30 57.08 3kyh h ASN 190 Cb 0.04 -0.26 0.00 0.00 -1.12 0.00 0.00 38.32 36.98 3kyh h ASN 190 CO -0.02 1.38 0.03 -1.14 -1.29 0.00 0.00 177.43 176.39 3kyh n ARG 191 N -3.91 0.00 -3.07 0.81 3.00 -1.24 -4.08 116.66 108.18 3kyh n ARG 191 Ca -0.07 0.17 -0.07 0.00 -0.00 0.00 0.00 57.85 57.87 3kyh n ARG 191 Cb 0.76 -1.53 -0.02 0.00 0.00 0.00 0.00 32.46 31.67 3kyh n ARG 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3kyh n THR 193 N 3.61 0.00 0.27 0.00 -1.04 -1.26 -4.37 114.28 111.49 3kyh n THR 193 Ca 0.16 -0.23 0.11 0.00 -2.04 0.00 0.00 64.05 62.05 3kyh n THR 193 Cb 0.54 0.89 0.48 0.00 -1.82 0.00 0.00 70.33 70.42 3kyh n THR 193 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3kyh h THR 194 N 0.00 0.03 -3.37 12.58 1.35 -1.88 -3.40 112.91 118.23 3kyh h THR 194 Ca 0.00 0.00 -0.56 0.00 -0.55 0.00 0.00 66.41 65.30 3kyh h THR 194 Cb 0.32 0.37 -0.07 0.00 -1.73 0.00 0.00 68.15 67.05 3kyh h THR 194 CO 0.00 0.00 1.00 -0.36 -0.25 0.00 0.00 175.52 175.91 3kyh s PHE 195 N -4.13 2.59 -0.68 4.73 2.99 -1.13 -2.23 117.98 120.12 3kyh s PHE 195 Ca -0.02 0.60 0.25 0.00 0.00 0.00 0.00 56.93 57.76 3kyh s PHE 195 Cb 0.06 -4.43 0.90 0.00 0.00 0.00 0.00 43.02 39.56 3kyh s PHE 195 CO 0.21 -1.62 1.75 -0.35 -0.00 0.00 0.00 175.22 175.21 3kyh n PRO 196 N 8.16 0.20 -3.55 0.24 -0.04 -1.26 -4.92 135.00 133.83 3kyh n PRO 196 Ca 0.12 0.28 -0.09 0.00 -0.04 0.00 0.00 63.50 63.77 3kyh n PRO 196 Cb 0.49 -1.78 -0.03 0.00 -0.04 0.00 0.00 33.50 32.13 3kyh n PRO 196 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3kyh s PHE 197 N -3.17 -0.34 0.56 0.54 -0.12 -1.26 -4.94 117.98 109.25 3kyh s PHE 197 Ca 0.08 0.40 -0.09 0.00 -0.05 0.00 0.00 56.93 57.27 3kyh s PHE 197 Cb 0.12 0.49 -0.04 0.00 -0.63 0.00 0.00 43.02 42.96 3kyh s PHE 197 CO 0.49 -0.42 0.93 0.21 -0.05 0.00 0.00 175.22 176.39 3kyh s LYS 198 N -2.09 3.61 -0.01 1.99 2.20 -1.22 -4.96 119.74 119.26 3kyh s LYS 198 Ca 0.02 0.57 0.06 0.00 -0.36 0.00 0.00 55.97 56.26 3kyh s LYS 198 Cb -0.01 -2.20 -0.02 0.00 -1.51 0.00 0.00 37.83 34.10 3kyh s LYS 198 CO -0.03 -0.40 -0.20 0.42 -0.36 0.00 0.00 175.35 174.77 3kyh s ILE 199 N -2.96 1.62 0.06 5.43 1.09 -1.26 -2.61 121.20 122.57 3kyh s ILE 199 Ca 0.53 -0.92 -0.14 0.00 -1.10 0.00 0.00 60.65 59.01 3kyh s ILE 199 Cb -0.11 -1.36 0.02 0.00 -1.06 0.00 0.00 42.46 39.96 3kyh s ILE 199 CO 0.48 0.42 0.32 -0.55 -0.10 0.00 0.00 174.94 175.51 3kyh s SER 200 N -0.58 -0.13 0.35 3.58 0.15 -1.10 -5.02 113.70 110.95 3kyh s SER 200 Ca 0.08 -0.23 -0.27 0.00 0.70 0.00 0.00 55.95 56.23 3kyh s SER 200 Cb -0.08 0.38 -0.09 0.00 -1.71 0.00 0.00 66.02 64.52 3kyh s SER 200 CO -0.00 -0.67 1.11 -0.04 1.20 0.00 0.00 173.24 174.84 3kyh s MET 201 N -2.87 4.34 -0.13 5.44 -1.94 -1.26 -2.79 119.30 120.09 3kyh s MET 201 Ca -0.03 1.74 -0.29 0.00 -1.71 0.00 0.00 55.69 55.40 3kyh s MET 201 Cb 0.00 -2.86 -0.04 0.00 2.01 0.00 0.00 34.83 33.94 3kyh s MET 201 CO -0.05 -0.05 1.58 0.21 -0.01 0.00 0.00 175.02 176.71 3kyh s LYS 202 N -1.99 4.05 -0.28 2.03 2.20 0.61 -4.69 119.74 121.67 3kyh s LYS 202 Ca 0.52 1.93 -0.23 0.00 -0.36 0.00 0.00 55.97 57.82 3kyh s LYS 202 Cb -0.29 -3.97 -0.26 0.00 -1.51 0.00 0.00 37.83 31.80 3kyh s LYS 202 CO 0.37 -0.99 1.52 -2.39 -0.36 0.00 0.00 175.35 173.50 3kyh n HIS 203 N 7.54 0.23 -2.14 4.03 1.44 -1.26 -4.92 115.22 120.13 3kyh n HIS 203 Ca 0.17 -0.30 -0.39 0.00 -2.01 0.00 0.00 57.72 55.19 3kyh n HIS 203 Cb 0.44 -1.16 -0.01 0.00 0.12 0.00 0.00 29.99 29.39 3kyh n HIS 203 CO 0.00 0.00 0.00 1.41 -2.81 0.00 0.00 176.34 174.94 3kyh s MET 204 N 6.67 3.92 0.00 -1.40 1.75 -1.26 -4.87 119.30 124.11 3kyh s MET 204 Ca 0.57 2.02 -0.02 0.00 -1.25 0.00 0.00 55.69 57.01 3kyh s MET 204 Cb 0.07 -2.66 -0.01 0.00 2.84 0.00 0.00 34.83 35.06 3kyh s MET 204 CO 0.23 -0.49 0.02 -0.51 -0.65 0.00 0.00 175.02 173.63 3kyh s ASP 205 N -0.95 0.10 0.66 1.11 1.01 -1.15 -5.06 116.67 112.39 3kyh s ASP 205 Ca 0.59 -0.25 -0.11 0.00 0.71 0.00 0.00 52.55 53.49 3kyh s ASP 205 Cb -0.35 0.11 -0.02 0.00 1.01 0.00 0.00 42.92 43.68 3kyh s ASP 205 CO 0.44 -0.21 1.05 -0.36 0.21 0.00 0.00 175.17 176.30 3kyh s PHE 206 N -0.92 3.40 0.12 4.23 0.40 -1.26 0.40 117.98 124.36 3kyh s PHE 206 Ca -0.10 1.31 -0.19 0.00 -0.60 0.00 0.00 56.93 57.35 3kyh s PHE 206 Cb -0.06 -2.81 0.01 0.00 0.51 0.00 0.00 43.02 40.66 3kyh s PHE 206 CO -0.00 -0.95 1.04 -1.13 0.70 0.00 0.00 175.22 174.88 3kyh n SER 207 N -2.92 -0.65 -0.45 1.36 3.41 0.54 -2.88 113.62 112.02 3kyh n SER 207 Ca 0.07 1.20 0.00 0.00 -0.26 0.00 0.00 58.87 59.88 3kyh n SER 207 Cb 0.54 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 3kyh n SER 207 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kyh n TYR 208 N -4.89 0.00 -0.25 7.33 0.18 -1.26 -2.63 117.16 115.64 3kyh n TYR 208 Ca 0.03 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.81 3kyh n TYR 208 Cb 0.20 -0.03 0.00 0.00 -0.38 0.00 0.00 39.34 39.13 3kyh n TYR 208 CO 0.00 0.00 0.00 1.04 -2.08 0.00 0.00 176.86 175.82 3kyh n GLN 209 N 0.25 1.91 -0.33 -3.48 6.02 -1.14 -4.81 117.38 115.79 3kyh n GLN 209 Ca 0.00 -1.15 0.22 0.00 -0.01 0.00 0.00 57.00 56.06 3kyh n GLN 209 Cb 0.08 -0.88 0.42 0.00 1.02 0.00 0.00 30.24 30.88 3kyh n GLN 209 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3kyh n LEU 210 N -0.33 0.08 -0.07 1.08 4.77 -1.08 0.50 117.00 121.95 3kyh n LEU 210 Ca 0.00 1.68 -0.10 0.00 -0.03 0.00 0.00 56.01 57.55 3kyh n LEU 210 Cb 0.28 -0.70 -0.07 0.00 -2.33 0.00 0.00 43.42 40.60 3kyh n LEU 210 CO 0.00 -1.78 0.50 -0.37 -1.33 0.00 0.00 177.39 174.41 3kyh h VAL 211 N 0.00 0.00 -0.57 4.08 -1.51 -1.90 0.21 116.25 116.56 3kyh h VAL 211 Ca 0.71 0.00 0.14 0.00 -1.23 0.00 0.00 66.70 66.32 3kyh h VAL 211 Cb 1.68 0.00 -0.03 0.00 -2.13 0.00 0.00 31.29 30.81 3kyh h VAL 211 CO -0.86 0.00 0.40 0.11 -1.23 0.00 0.00 177.57 175.98 3kyh h LYS 212 N -0.33 0.15 0.00 5.19 1.79 -0.32 -3.23 116.57 119.82 3kyh h LYS 212 Ca 0.04 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 3kyh h LYS 212 Cb 0.45 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 3kyh h LYS 212 CO -0.40 0.10 0.00 0.28 -1.08 0.00 0.00 179.45 178.36 3kyh n VAL 213 N -4.42 0.00 -0.33 0.50 0.31 0.75 -3.86 118.33 111.29 3kyh n VAL 213 Ca 0.10 0.42 0.26 0.00 -0.01 0.00 0.00 64.34 65.11 3kyh n VAL 213 Cb 0.53 -0.84 0.48 0.00 -0.91 0.00 0.00 33.84 33.10 3kyh n VAL 213 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kyh h ALA 214 N -2.00 1.82 0.00 3.52 0.00 -0.83 0.62 119.26 122.39 3kyh h ALA 214 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3kyh h ALA 214 Cb 0.00 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3kyh h ALA 214 CO 0.00 -0.80 0.02 0.87 0.00 0.00 0.00 179.25 179.34 3kyh h LYS 215 N 0.03 0.00 0.06 0.00 1.57 -1.72 -0.87 116.57 115.64 3kyh h LYS 215 Ca 0.76 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 59.17 3kyh h LYS 215 Cb 1.87 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 34.13 3kyh h LYS 215 CO -0.80 0.00 -2.19 -1.13 -0.57 0.00 0.00 179.45 174.75 3kyh n SER 216 N -2.58 1.90 -0.15 0.86 3.41 0.21 -4.75 113.62 112.52 3kyh n SER 216 Ca -0.02 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 3kyh n SER 216 Cb 0.07 -0.55 0.03 0.00 -0.26 0.00 0.00 64.21 63.49 3kyh n SER 216 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3kyh n LEU 217 N -3.34 -0.23 -0.01 1.04 -0.00 -0.33 -0.22 117.00 113.91 3kyh n LEU 217 Ca -0.37 0.69 0.14 0.00 -0.00 0.00 0.00 56.01 56.47 3kyh n LEU 217 Cb 1.03 -0.17 0.58 0.00 -0.00 0.00 0.00 43.42 44.86 3kyh n LEU 217 CO 0.36 -0.63 0.87 0.47 -0.00 0.00 0.00 177.39 178.46 3kyh n ASP 218 N -4.60 0.15 -0.73 1.96 10.43 -1.25 -4.18 116.55 118.32 3kyh n ASP 218 Ca 0.05 0.13 0.05 0.00 2.57 0.00 0.00 54.79 57.59 3kyh n ASP 218 Cb 0.17 -0.28 0.21 0.00 1.84 0.00 0.00 41.12 43.05 3kyh n ASP 218 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3kyh n LYS 219 N -1.40 2.06 -3.45 -1.24 4.01 0.69 -5.01 118.16 113.81 3kyh n LYS 219 Ca 0.09 -2.92 -0.38 0.00 -0.51 0.00 0.00 58.31 54.59 3kyh n LYS 219 Cb 0.32 -1.73 -0.06 0.00 -0.51 0.00 0.00 35.03 33.05 3kyh n LYS 219 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 3kyh s LEU 220 N -3.01 4.40 0.35 -0.35 1.43 -1.21 -5.03 118.68 115.26 3kyh s LEU 220 Ca 0.40 0.88 0.06 0.00 -1.03 0.00 0.00 54.13 54.44 3kyh s LEU 220 Cb 0.35 -2.59 0.72 0.00 0.03 0.00 0.00 46.19 44.69 3kyh s LEU 220 CO 0.03 0.22 1.93 1.55 0.23 0.00 0.00 176.35 180.31 3kyh h PRO 221 N 5.43 0.77 0.00 1.29 0.13 -1.95 -3.43 132.00 134.24 3kyh h PRO 221 Ca -0.48 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 3kyh h PRO 221 Cb 1.20 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3kyh h PRO 221 CO 0.67 0.51 0.00 -2.39 -0.23 0.00 0.00 178.00 176.55 3kyh n HIS 222 N -4.50 -0.49 -4.39 1.56 1.44 -1.26 -4.26 115.22 103.32 3kyh n HIS 222 Ca 0.13 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.52 3kyh n HIS 222 Cb 0.28 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.29 3kyh n HIS 222 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3kyh s LEU 223 N 0.00 3.19 -0.31 2.39 1.02 -1.26 -5.03 118.68 118.68 3kyh s LEU 223 Ca 0.00 -0.18 0.01 0.00 0.02 0.00 0.00 54.13 53.98 3kyh s LEU 223 Cb 0.00 -1.86 0.14 0.00 0.02 0.00 0.00 46.19 44.49 3kyh s LEU 223 CO 0.00 0.26 0.33 -0.94 0.02 0.00 0.00 176.35 176.02 3kyh s SER 224 N -1.61 1.36 -0.92 2.29 1.04 -1.26 -0.62 113.70 113.99 3kyh s SER 224 Ca 0.19 -0.86 -0.03 0.00 0.48 0.00 0.00 55.95 55.72 3kyh s SER 224 Cb -0.11 0.62 0.21 0.00 0.10 0.00 0.00 66.02 66.83 3kyh s SER 224 CO 0.09 -0.36 2.27 -0.90 0.98 0.00 0.00 173.24 175.33 3kyh n ASP 225 N 5.10 7.36 0.00 7.02 5.75 -0.94 -4.84 116.55 136.00 3kyh n ASP 225 Ca 0.01 -3.45 0.00 0.00 -0.01 0.00 0.00 54.79 51.34 3kyh n ASP 225 Cb 0.47 -1.21 0.00 0.00 -1.03 0.00 0.00 41.12 39.34 3kyh n ASP 225 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3kyh n GLY 226 N 0.55 0.75 3.71 6.12 0.00 -1.26 -4.61 105.19 110.46 3kyh n GLY 226 Ca 0.53 -2.06 -0.28 0.00 0.00 0.00 0.00 46.02 44.21 3kyh n GLY 226 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kyh s LEU 227 N 0.00 3.52 0.04 0.99 1.02 -1.06 -1.13 118.68 122.07 3kyh s LEU 227 Ca 0.00 -0.22 0.08 0.00 0.02 0.00 0.00 54.13 54.01 3kyh s LEU 227 Cb 0.00 -2.20 -0.03 0.00 0.02 0.00 0.00 46.19 43.98 3kyh s LEU 227 CO 0.00 0.13 -0.23 -0.51 0.02 0.00 0.00 176.35 175.76 3kyh s ILE 228 N -1.53 1.83 -0.10 -0.59 -1.16 -0.34 0.69 121.20 120.00 3kyh s ILE 228 Ca 0.28 -1.27 0.02 0.00 -0.51 0.00 0.00 60.65 59.17 3kyh s ILE 228 Cb -0.11 -1.58 0.01 0.00 0.61 0.00 0.00 42.46 41.40 3kyh s ILE 228 CO 0.20 0.26 -0.15 -0.36 -2.81 0.00 0.00 174.94 172.08 3kyh s PHE 229 N -0.80 1.84 -0.05 3.50 0.40 -0.27 -2.63 117.98 119.98 3kyh s PHE 229 Ca 0.09 -0.81 0.03 0.00 -0.60 0.00 0.00 56.93 55.64 3kyh s PHE 229 Cb -0.09 -1.33 0.00 0.00 0.51 0.00 0.00 43.02 42.11 3kyh s PHE 229 CO 0.02 -0.42 -0.14 0.99 0.70 0.00 0.00 175.22 176.38 3kyh s THR 230 N 0.89 1.18 -0.13 0.64 2.01 -0.10 -2.50 115.64 117.62 3kyh s THR 230 Ca -0.09 -0.55 -0.21 0.00 0.31 0.00 0.00 61.69 61.15 3kyh s THR 230 Cb -0.15 -1.04 -0.03 0.00 0.01 0.00 0.00 72.50 71.28 3kyh s THR 230 CO 0.00 0.35 0.60 -2.16 -0.69 0.00 0.00 174.62 172.73 3kyh s PRO 231 N 0.28 4.32 0.00 4.92 0.04 -1.26 0.17 135.00 143.47 3kyh s PRO 231 Ca -0.07 0.65 0.00 0.00 0.04 0.00 0.00 61.00 61.61 3kyh s PRO 231 Cb -0.12 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.93 3kyh s PRO 231 CO 0.02 -0.02 0.09 0.28 0.04 0.00 0.00 177.00 177.42 3kyh n VAL 232 N 4.08 0.00 -0.07 -0.36 0.31 0.07 -3.42 118.33 118.94 3kyh n VAL 232 Ca -0.03 0.59 0.12 0.00 -0.01 0.00 0.00 64.34 65.01 3kyh n VAL 232 Cb 0.51 -1.47 0.19 0.00 -0.91 0.00 0.00 33.84 32.16 3kyh n VAL 232 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3kyh n LYS 233 N -0.11 0.01 -2.49 5.55 5.02 -1.26 -1.76 118.16 123.11 3kyh n LYS 233 Ca 0.00 0.51 -0.33 0.00 -2.02 0.00 0.00 58.31 56.48 3kyh n LYS 233 Cb 0.00 -1.29 -0.04 0.00 -0.02 0.00 0.00 35.03 33.68 3kyh n LYS 233 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kyh s ALA 234 N -3.16 2.99 0.33 7.82 0.00 -1.22 -4.63 121.76 123.88 3kyh s ALA 234 Ca -0.01 0.33 -0.08 0.00 0.00 0.00 0.00 51.96 52.20 3kyh s ALA 234 Cb 0.06 -3.16 -0.06 0.00 0.00 0.00 0.00 23.12 19.96 3kyh s ALA 234 CO 0.20 -0.22 0.64 -1.25 0.00 0.00 0.00 175.76 175.13 3kyh s PRO 235 N -3.70 3.72 0.00 0.00 0.04 -1.26 -2.33 135.00 131.46 3kyh s PRO 235 Ca 0.62 0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.88 3kyh s PRO 235 Cb -0.11 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.88 3kyh s PRO 235 CO 0.25 0.13 0.00 0.98 0.04 0.00 0.00 177.00 178.40 3kyh n TYR 236 N -0.96 -0.02 -3.64 0.56 9.36 -1.22 -5.01 117.16 116.24 3kyh n TYR 236 Ca 0.00 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 61.15 3kyh n TYR 236 Cb 0.54 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.18 3kyh n TYR 236 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 3kyh s THR 237 N 0.00 0.00 0.00 2.97 2.01 -1.26 -4.96 115.64 114.40 3kyh s THR 237 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 3kyh s THR 237 Cb 0.00 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.51 3kyh s THR 237 CO 0.00 0.00 0.00 0.00 -0.69 0.00 0.00 174.62 173.93 3kyh n ALA 238 N 1.92 0.00 -1.77 7.40 0.00 -1.26 -4.34 120.51 122.46 3kyh n ALA 238 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.93 3kyh n ALA 238 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.02 3kyh n ALA 238 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3kyh s GLY 239 N 0.00 2.92 0.00 0.00 0.00 -1.22 -4.41 107.32 104.62 3kyh s GLY 239 Ca 0.00 1.37 0.00 0.00 0.00 0.00 0.00 44.72 46.09 3kyh s GLY 239 CO 0.00 1.97 0.00 0.61 0.00 0.00 0.00 173.10 175.68 3kyh n GLY 240 N 0.61 0.77 3.77 0.20 0.00 -1.25 -4.97 105.19 104.32 3kyh n GLY 240 Ca 0.04 -0.84 -0.33 0.00 0.00 0.00 0.00 46.02 44.90 3kyh n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kyh s LYS 241 N 0.00 2.64 -0.17 1.61 1.02 -1.26 -3.68 119.74 119.90 3kyh s LYS 241 Ca 0.00 1.36 -0.04 0.00 0.02 0.00 0.00 55.97 57.31 3kyh s LYS 241 Cb 0.00 -1.93 0.08 0.00 -0.52 0.00 0.00 37.83 35.46 3kyh s LYS 241 CO 0.00 -1.37 0.27 0.34 -0.92 0.00 0.00 175.35 173.67 3kyh s ASP 242 N -2.73 0.60 0.22 2.83 -1.08 -1.19 -4.92 116.67 110.40 3kyh s ASP 242 Ca 0.66 0.34 0.08 0.00 -0.52 0.00 0.00 52.55 53.11 3kyh s ASP 242 Cb -0.20 0.68 0.44 0.00 -1.46 0.00 0.00 42.92 42.38 3kyh s ASP 242 CO 0.45 -0.27 1.10 -0.24 0.52 0.00 0.00 175.17 176.72 3kyh n SER 243 N 5.35 0.21 -0.17 -0.34 2.88 -1.26 -0.66 113.62 119.62 3kyh n SER 243 Ca -0.06 0.45 0.02 0.00 -1.33 0.00 0.00 58.87 57.95 3kyh n SER 243 Cb 0.50 -0.40 0.03 0.00 -0.75 0.00 0.00 64.21 63.58 3kyh n SER 243 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3kyh n LEU 244 N -1.78 1.65 -4.53 2.46 4.32 -1.26 -4.97 117.00 112.89 3kyh n LEU 244 Ca -0.01 -1.35 -0.37 0.00 -0.02 0.00 0.00 56.01 54.26 3kyh n LEU 244 Cb 0.31 -0.03 -0.12 0.00 -1.62 0.00 0.00 43.42 41.97 3kyh n LEU 244 CO 0.04 0.39 -0.22 -0.22 -1.22 0.00 0.00 177.39 176.16 3kyh s LEU 245 N -0.55 3.78 -0.08 2.23 2.96 0.16 -4.44 118.68 122.74 3kyh s LEU 245 Ca 0.05 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 53.89 3kyh s LEU 245 Cb 0.03 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.67 3kyh s LEU 245 CO 0.05 -0.05 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.10 3kyh s LEU 246 N 1.70 2.54 -0.25 -0.68 1.43 -1.04 -0.06 118.68 122.32 3kyh s LEU 246 Ca 0.07 -0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 52.83 3kyh s LEU 246 Cb -0.16 -1.52 0.03 0.00 0.03 0.00 0.00 46.19 44.57 3kyh s LEU 246 CO 0.08 0.26 -0.07 -1.59 0.23 0.00 0.00 176.35 175.26 3kyh s LYS 247 N -0.24 2.82 0.02 1.70 -2.85 -0.11 -1.11 119.74 119.97 3kyh s LYS 247 Ca 0.00 -0.99 -0.22 0.00 -1.00 0.00 0.00 55.97 53.77 3kyh s LYS 247 Cb -0.13 -2.97 -0.06 0.00 -2.06 0.00 0.00 37.83 32.62 3kyh s LYS 247 CO 0.03 -0.40 0.64 -0.46 0.10 0.00 0.00 175.35 175.26 3kyh s TRP 248 N 1.31 3.71 0.12 1.78 -0.00 0.22 -3.24 118.94 122.85 3kyh s TRP 248 Ca -0.00 1.29 0.02 0.00 -0.00 0.00 0.00 56.10 57.40 3kyh s TRP 248 Cb -0.17 -2.66 -0.04 0.00 -0.00 0.00 0.00 33.47 30.60 3kyh s TRP 248 CO -0.05 0.36 -0.04 -1.59 -0.00 0.00 0.00 176.95 175.63 3kyh s LYS 249 N -0.27 0.90 0.29 5.86 -2.85 -1.26 -2.55 119.74 119.87 3kyh s LYS 249 Ca 0.33 -1.39 -0.30 0.00 -1.00 0.00 0.00 55.97 53.61 3kyh s LYS 249 Cb -0.19 -0.20 -0.12 0.00 -2.06 0.00 0.00 37.83 35.26 3kyh s LYS 249 CO 0.19 -0.06 1.53 -2.30 0.10 0.00 0.00 175.35 174.81 3kyh n PRO 250 N -0.09 2.52 -0.18 1.78 -0.01 -1.26 -4.86 135.00 132.90 3kyh n PRO 250 Ca -0.10 0.90 0.30 0.00 -0.01 0.00 0.00 63.50 64.58 3kyh n PRO 250 Cb 0.61 -2.63 0.72 0.00 -0.01 0.00 0.00 33.50 32.19 3kyh n PRO 250 CO 0.00 0.00 0.00 1.05 -0.01 0.00 0.00 175.50 176.54 3kyh h GLU 251 N 4.35 0.00 0.00 -0.52 9.09 -1.94 0.36 114.58 125.91 3kyh h GLU 251 Ca -0.47 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 58.77 3kyh h GLU 251 Cb 1.24 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.32 3kyh h GLU 251 CO 0.76 0.00 -0.80 1.96 0.05 0.00 0.00 179.01 180.98 3kyh h GLN 252 N 0.00 0.01 0.43 1.06 7.50 -1.92 -3.39 115.11 118.80 3kyh h GLN 252 Ca 0.44 -0.01 -0.02 0.00 0.50 0.00 0.00 58.65 59.57 3kyh h GLN 252 Cb 1.94 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 29.46 3kyh h GLN 252 CO -0.00 0.80 -0.36 1.49 -1.50 0.00 0.00 178.83 179.26 3kyh h GLU 253 N 0.00 -0.74 -6.56 1.46 4.81 -0.62 -3.40 114.58 109.53 3kyh h GLU 253 Ca -0.01 0.05 -0.56 0.00 -0.13 0.00 0.00 59.36 58.71 3kyh h GLU 253 Cb 1.42 0.17 0.06 0.00 0.63 0.00 0.00 28.75 31.03 3kyh h GLU 253 CO 0.10 -0.49 0.88 0.27 -0.73 0.00 0.00 179.01 179.04 3kyh n ASN 254 N -4.57 3.44 -3.60 1.04 6.94 -1.24 -4.96 115.26 112.30 3kyh n ASN 254 Ca -0.09 1.07 -0.06 0.00 -0.02 0.00 0.00 54.58 55.48 3kyh n ASN 254 Cb 0.34 -1.48 -0.02 0.00 -2.36 0.00 0.00 39.78 36.26 3kyh n ASN 254 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 3kyh s THR 255 N 1.01 0.00 0.10 5.53 -1.32 -1.26 -4.68 115.64 115.02 3kyh s THR 255 Ca 0.77 -0.26 -0.00 0.00 -1.21 0.00 0.00 61.69 61.00 3kyh s THR 255 Cb -0.61 -1.40 -0.04 0.00 -1.51 0.00 0.00 72.50 68.93 3kyh s THR 255 CO 0.36 0.00 -0.00 -0.69 -2.21 0.00 0.00 174.62 172.07 3kyh s VAL 256 N -3.15 0.33 -0.19 5.08 1.01 -1.26 -4.95 120.40 117.27 3kyh s VAL 256 Ca 0.08 -1.89 -0.25 0.00 0.00 0.00 0.00 61.98 59.93 3kyh s VAL 256 Cb -0.01 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.55 3kyh s VAL 256 CO -0.05 -0.73 0.81 -1.81 0.00 0.00 0.00 175.10 173.33 3kyh s ASP 257 N -3.02 6.89 -0.17 3.32 1.01 -1.23 -3.51 116.67 119.96 3kyh s ASP 257 Ca 0.16 1.10 -0.01 0.00 0.71 0.00 0.00 52.55 54.51 3kyh s ASP 257 Cb 0.07 -2.44 -0.00 0.00 1.01 0.00 0.00 42.92 41.56 3kyh s ASP 257 CO -0.03 -0.41 -0.12 -0.36 0.21 0.00 0.00 175.17 174.45 3kyh s PHE 258 N 2.30 2.84 -0.25 4.23 0.40 0.01 -3.79 117.98 123.72 3kyh s PHE 258 Ca 0.36 -0.99 -0.29 0.00 -0.60 0.00 0.00 56.93 55.41 3kyh s PHE 258 Cb -0.16 -1.95 -0.01 0.00 0.51 0.00 0.00 43.02 41.41 3kyh s PHE 258 CO 0.11 -0.47 1.42 0.21 0.70 0.00 0.00 175.22 177.18 3kyh s LYS 259 N 0.96 3.92 -0.23 0.44 2.47 -1.06 -0.40 119.74 125.84 3kyh s LYS 259 Ca -0.02 1.47 -0.20 0.00 -1.56 0.00 0.00 55.97 55.65 3kyh s LYS 259 Cb -0.15 -3.92 -0.02 0.00 -1.46 0.00 0.00 37.83 32.28 3kyh s LYS 259 CO -0.01 -1.13 0.62 -1.17 0.16 0.00 0.00 175.35 173.82 3kyh s LEU 260 N 4.55 4.09 0.19 5.43 2.96 0.49 -0.35 118.68 136.04 3kyh s LEU 260 Ca 0.62 0.75 0.09 0.00 -0.22 0.00 0.00 54.13 55.37 3kyh s LEU 260 Cb -0.21 -2.86 -0.04 0.00 0.50 0.00 0.00 46.19 43.58 3kyh s LEU 260 CO 0.24 -0.33 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.13 3kyh s ILE 261 N 2.26 2.01 -0.31 6.68 1.01 -0.43 -0.68 121.20 131.74 3kyh s ILE 261 Ca 0.27 -2.04 0.03 0.00 0.00 0.00 0.00 60.65 58.91 3kyh s ILE 261 Cb -0.16 -1.99 0.09 0.00 0.01 0.00 0.00 42.46 40.41 3kyh s ILE 261 CO 0.09 -0.32 -0.00 -0.76 0.00 0.00 0.00 174.94 173.95 3kyh s LEU 262 N -2.86 4.03 -0.14 2.97 1.43 -1.26 -2.15 118.68 120.70 3kyh s LEU 262 Ca 0.19 -1.82 -0.28 0.00 -1.03 0.00 0.00 54.13 51.19 3kyh s LEU 262 Cb -0.05 -1.52 -0.01 0.00 0.03 0.00 0.00 46.19 44.64 3kyh s LEU 262 CO 0.08 -0.32 0.97 1.51 0.23 0.00 0.00 176.35 178.83 3kyh s ASP 263 N 1.05 7.15 -0.18 2.29 3.84 -1.24 -4.96 116.67 124.62 3kyh s ASP 263 Ca 0.04 1.42 -0.28 0.00 -0.00 0.00 0.00 52.55 53.73 3kyh s ASP 263 Cb -0.19 -2.53 0.09 0.00 -1.38 0.00 0.00 42.92 38.91 3kyh s ASP 263 CO -0.08 -0.47 0.82 -0.63 -0.00 0.00 0.00 175.17 174.81 3kyh s ILE 264 N 2.24 0.00 -0.01 2.11 1.09 -1.26 -3.57 121.20 121.81 3kyh s ILE 264 Ca 0.45 0.00 -0.00 0.00 -1.10 0.00 0.00 60.65 60.00 3kyh s ILE 264 Cb -0.17 -1.00 -0.00 0.00 -1.06 0.00 0.00 42.46 40.23 3kyh s ILE 264 CO 0.15 0.00 -0.01 -2.65 -0.10 0.00 0.00 174.94 172.33 3kyh n PRO 265 N 1.63 0.02 0.00 2.79 -0.02 -1.26 -5.10 135.00 133.05 3kyh n PRO 265 Ca -0.15 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 3kyh n PRO 265 Cb 0.56 -0.64 0.00 0.00 -0.02 0.00 0.00 33.50 33.40 3kyh n PRO 265 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 3kyh n TYR 284 N -2.46 0.00 -0.29 6.00 -0.00 -1.26 -5.24 117.16 113.90 3kyh n TYR 284 Ca -0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.90 58.00 3kyh n TYR 284 Cb 0.01 0.00 0.29 0.00 -0.00 0.00 0.00 39.34 39.64 3kyh n TYR 284 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.86 176.46 3kyh n ASP 285 N 0.00 3.76 -3.99 2.98 5.75 -1.26 -4.94 116.55 118.86 3kyh n ASP 285 Ca 0.00 -2.00 -0.17 0.00 -0.01 0.00 0.00 54.79 52.61 3kyh n ASP 285 Cb 0.00 -0.43 -0.14 0.00 -1.03 0.00 0.00 41.12 39.51 3kyh n ASP 285 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3kyh s VAL 286 N -1.03 0.54 0.08 2.12 1.01 -1.26 -5.12 120.40 116.74 3kyh s VAL 286 Ca 0.44 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 61.96 3kyh s VAL 286 Cb 0.23 -0.46 -0.09 0.00 0.00 0.00 0.00 36.38 36.07 3kyh s VAL 286 CO 0.30 0.14 0.30 2.29 0.00 0.00 0.00 175.10 178.13 3kyh n LYS 287 N 2.87 0.00 -0.65 2.72 2.85 -1.26 -5.06 118.16 119.63 3kyh n LYS 287 Ca -0.13 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.13 3kyh n LYS 287 Cb 0.58 -0.53 0.00 0.00 -0.65 0.00 0.00 35.03 34.43 3kyh n LYS 287 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 3kyh n PRO 288 N 0.53 3.23 -2.96 -1.58 -0.05 -1.26 -5.10 135.00 127.81 3kyh n PRO 288 Ca 0.09 0.00 -0.40 0.00 -0.05 0.00 0.00 63.50 63.14 3kyh n PRO 288 Cb 0.11 0.00 -0.05 0.00 -0.05 0.00 0.00 33.50 33.51 3kyh n PRO 288 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 175.50 175.53 3kyh s VAL 289 N 0.44 4.84 -0.61 0.52 1.01 -1.23 -5.02 120.40 120.34 3kyh s VAL 289 Ca 0.00 1.64 0.04 0.00 0.00 0.00 0.00 61.98 63.67 3kyh s VAL 289 Cb 0.00 -4.12 0.15 0.00 0.00 0.00 0.00 36.38 32.41 3kyh s VAL 289 CO 0.00 0.30 0.38 0.72 0.00 0.00 0.00 175.10 176.50 3kyh s PHE 290 N 0.34 3.28 0.11 5.22 -0.71 -1.26 -3.67 117.98 121.28 3kyh s PHE 290 Ca 0.40 -3.21 -0.30 0.00 -1.04 0.00 0.00 56.93 52.78 3kyh s PHE 290 Cb -0.20 -2.68 -0.06 0.00 -1.21 0.00 0.00 43.02 38.87 3kyh s PHE 290 CO 0.22 -0.65 1.01 -1.54 -1.34 0.00 0.00 175.22 172.93 3kyh s SER 291 N -0.84 7.41 -0.35 1.98 1.04 -0.91 -3.52 113.70 118.51 3kyh s SER 291 Ca 0.21 1.85 -0.08 0.00 0.48 0.00 0.00 55.95 58.42 3kyh s SER 291 Cb -0.15 -2.59 0.04 0.00 0.10 0.00 0.00 66.02 63.42 3kyh s SER 291 CO -0.09 -0.15 0.13 -1.48 0.98 0.00 0.00 173.24 172.63 3kyh s LEU 292 N 0.12 4.39 0.11 2.42 2.34 -0.83 -1.31 118.68 125.92 3kyh s LEU 292 Ca 0.49 -1.09 0.02 0.00 0.06 0.00 0.00 54.13 53.62 3kyh s LEU 292 Cb -0.25 -1.91 -0.04 0.00 -0.56 0.00 0.00 46.19 43.44 3kyh s LEU 292 CO 0.31 -0.33 0.18 -0.31 -1.06 0.00 0.00 176.35 175.13 3kyh s TYR 293 N 1.44 3.36 -0.14 3.48 1.51 0.52 -2.72 117.35 124.80 3kyh s TYR 293 Ca -0.01 0.12 0.02 0.00 -1.01 0.00 0.00 57.07 56.20 3kyh s TYR 293 Cb -0.19 -1.65 0.01 0.00 -0.11 0.00 0.00 41.96 40.02 3kyh s TYR 293 CO 0.04 0.54 -0.20 0.14 -1.11 0.00 0.00 175.55 174.96 3kyh s VAL 294 N -1.58 1.95 0.05 0.71 -7.23 -1.06 -2.55 120.40 110.70 3kyh s VAL 294 Ca 0.33 -0.90 -0.31 0.00 -1.81 0.00 0.00 61.98 59.29 3kyh s VAL 294 Cb -0.12 -1.74 -0.06 0.00 0.56 0.00 0.00 36.38 35.02 3kyh s VAL 294 CO 0.26 0.53 1.34 -1.66 -0.31 0.00 0.00 175.10 175.25 3kyh s TRP 295 N 0.97 3.15 0.07 2.82 1.48 -1.23 -4.18 118.94 122.02 3kyh s TRP 295 Ca -0.04 1.00 0.10 0.00 -1.06 0.00 0.00 56.10 56.10 3kyh s TRP 295 Cb -0.15 -3.60 -0.03 0.00 -1.16 0.00 0.00 33.47 28.53 3kyh s TRP 295 CO -0.05 -2.10 -0.27 -1.14 -4.06 0.00 0.00 176.95 169.34 3kyh s GLN 296 N 1.60 1.69 7.79 3.25 0.74 -1.07 -3.22 119.66 130.44 3kyh s GLN 296 Ca 0.63 -1.17 0.00 0.00 0.05 0.00 0.00 55.36 54.86 3kyh s GLN 296 Cb -0.33 -1.95 0.00 0.00 1.10 0.00 0.00 33.01 31.83 3kyh s GLN 296 CO 0.28 0.49 0.00 0.41 -0.55 0.00 0.00 175.29 175.93 3kyh n GLY 297 N 1.55 3.04 2.72 2.59 0.00 -1.26 -4.19 105.19 109.64 3kyh n GLY 297 Ca -0.17 -0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.60 3kyh n GLY 297 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kyh n GLY 298 N 0.00 0.75 0.01 -0.02 0.00 -1.26 -4.98 105.19 99.69 3kyh n GLY 298 Ca 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.00 3kyh n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kyh n ALA 299 N 0.22 2.25 0.02 4.61 0.00 -1.26 -4.70 120.51 121.64 3kyh n ALA 299 Ca 0.05 -0.12 -0.12 0.00 0.00 0.00 0.00 53.44 53.25 3kyh n ALA 299 Cb 0.72 -0.06 -0.07 0.00 0.00 0.00 0.00 19.45 20.05 3kyh n ALA 299 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 3kyh h ASP 300 N 0.05 0.05 0.19 0.00 1.82 -1.92 -1.30 116.42 115.32 3kyh h ASP 300 Ca 0.00 -0.06 -0.01 0.00 -0.39 0.00 0.00 57.03 56.57 3kyh h ASP 300 Cb 0.04 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.04 3kyh h ASP 300 CO 0.00 0.10 -0.09 0.58 -1.61 0.00 0.00 179.24 178.22 3kyh h VAL 301 N -0.00 0.88 -0.98 2.25 2.07 -2.02 -2.79 116.25 115.66 3kyh h VAL 301 Ca 0.01 -0.39 0.28 0.00 0.82 0.00 0.00 66.70 67.43 3kyh h VAL 301 Cb 0.06 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 3kyh h VAL 301 CO -0.00 0.09 0.77 0.78 0.02 0.00 0.00 177.57 179.23 3kyh h ASN 302 N -0.45 0.00 0.08 0.57 2.35 -1.83 0.11 115.58 116.41 3kyh h ASN 302 Ca -0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 3kyh h ASN 302 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 3kyh h ASN 302 CO 0.04 0.00 -0.04 0.28 -1.65 0.00 0.00 177.43 176.06 3kyh h SER 303 N 0.00 -0.10 -0.81 5.81 0.02 -0.96 -3.31 113.55 114.21 3kyh h SER 303 Ca 0.46 -0.17 0.17 0.00 -0.84 0.00 0.00 61.79 61.41 3kyh h SER 303 Cb 2.00 0.02 -0.06 0.00 0.14 0.00 0.00 62.40 64.50 3kyh h SER 303 CO -0.00 0.12 0.54 0.03 -1.14 0.00 0.00 176.83 176.37 3kyh h ARG 304 N -0.31 0.40 -0.27 3.45 2.47 -0.69 0.12 114.38 119.55 3kyh h ARG 304 Ca -0.01 -0.02 0.07 0.00 -1.26 0.00 0.00 59.98 58.75 3kyh h ARG 304 Cb 0.26 -0.09 -0.08 0.00 -1.65 0.00 0.00 29.97 28.42 3kyh h ARG 304 CO 0.02 0.27 -0.27 -0.07 0.56 0.00 0.00 179.97 180.47 3kyh h LEU 305 N 0.41 -0.87 -1.47 3.04 4.07 -1.63 -2.58 115.31 116.27 3kyh h LEU 305 Ca 0.41 0.15 0.00 0.00 0.08 0.00 0.00 57.88 58.52 3kyh h LEU 305 Cb 0.97 0.41 0.00 0.00 1.08 0.00 0.00 40.66 43.12 3kyh h LEU 305 CO -0.14 -0.30 -0.01 2.29 -1.08 0.00 0.00 178.44 179.20 3kyh n LYS 306 N -5.39 2.00 -0.11 1.13 0.00 -0.82 -4.15 118.16 110.82 3kyh n LYS 306 Ca -0.00 -1.47 -0.04 0.00 -0.00 0.00 0.00 58.31 56.80 3kyh n LYS 306 Cb 0.31 -1.47 0.18 0.00 -0.00 0.00 0.00 35.03 34.05 3kyh n LYS 306 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3kyh h HIS 307 N 3.59 0.83 0.00 5.58 3.86 -0.58 -2.25 115.15 126.18 3kyh h HIS 307 Ca 0.00 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.11 3kyh h HIS 307 Cb 0.77 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 29.01 3kyh h HIS 307 CO 0.00 0.74 0.00 1.19 0.86 0.00 0.00 177.93 180.72 3kyh n PHE 308 N -4.24 0.00 -1.11 2.45 0.99 -1.21 -2.67 117.46 111.68 3kyh n PHE 308 Ca 0.03 0.00 -0.27 0.00 -0.00 0.00 0.00 57.45 57.21 3kyh n PHE 308 Cb 0.27 -0.11 0.11 0.00 -1.00 0.00 0.00 39.48 38.75 3kyh n PHE 308 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 3kyh n ASP 309 N -1.11 5.77 -4.92 4.37 10.43 -0.85 -5.00 116.55 125.24 3kyh n ASP 309 Ca 0.13 -3.53 -0.28 0.00 2.57 0.00 0.00 54.79 53.68 3kyh n ASP 309 Cb 0.10 -0.91 -0.03 0.00 1.84 0.00 0.00 41.12 42.12 3kyh n ASP 309 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3kyh s GLN 310 N -3.17 3.53 -0.22 -1.24 0.00 -1.09 -5.01 119.66 112.47 3kyh s GLN 310 Ca 0.54 -0.31 -0.03 0.00 -0.00 0.00 0.00 55.36 55.56 3kyh s GLN 310 Cb 0.44 -2.83 -0.12 0.00 0.00 0.00 0.00 33.01 30.50 3kyh s GLN 310 CO 0.04 0.39 -0.23 -0.35 0.00 0.00 0.00 175.29 175.14 3kyh n PRO 311 N -0.66 0.51 -3.61 9.60 -0.04 -1.26 -5.12 135.00 134.42 3kyh n PRO 311 Ca -0.04 0.16 -0.05 0.00 -0.04 0.00 0.00 63.50 63.52 3kyh n PRO 311 Cb 0.54 -1.38 -0.03 0.00 -0.04 0.00 0.00 33.50 32.58 3kyh n PRO 311 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3kyh s PHE 312 N -2.42 -0.15 0.63 0.54 5.36 -1.26 -5.09 117.98 115.59 3kyh s PHE 312 Ca -0.30 0.18 0.30 0.00 -0.96 0.00 0.00 56.93 56.15 3kyh s PHE 312 Cb 0.09 0.50 1.60 0.00 -0.34 0.00 0.00 43.02 44.87 3kyh s PHE 312 CO 0.46 -0.18 1.95 0.22 -1.46 0.00 0.00 175.22 176.21 3kyh h ASP 313 N 2.12 0.00 -0.10 6.13 1.82 -1.94 -3.38 116.42 121.08 3kyh h ASP 313 Ca -0.11 0.00 0.01 0.00 -0.39 0.00 0.00 57.03 56.55 3kyh h ASP 313 Cb 1.17 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.17 3kyh h ASP 313 CO 0.24 0.00 -0.05 -2.11 -1.61 0.00 0.00 179.24 175.72 3kyh n ARG 314 N -3.33 -0.03 0.05 0.28 1.85 -1.26 -0.10 116.66 114.12 3kyh n ARG 314 Ca 0.02 0.15 -0.22 0.00 -1.00 0.00 0.00 57.85 56.80 3kyh n ARG 314 Cb 0.47 -0.23 -0.15 0.00 -1.05 0.00 0.00 32.46 31.51 3kyh n ARG 314 CO 0.00 0.00 0.00 1.57 -0.01 0.00 0.00 177.63 179.19 3kyh h LYS 315 N 0.00 0.34 -0.51 2.89 2.10 -2.05 -3.38 116.57 115.96 3kyh h LYS 315 Ca 0.03 -0.59 0.15 0.00 -2.00 0.00 0.00 60.65 58.24 3kyh h LYS 315 Cb 0.05 0.22 -0.02 0.00 -0.90 0.00 0.00 32.23 31.58 3kyh h LYS 315 CO -0.10 1.28 0.57 1.49 -2.00 0.00 0.00 179.45 180.70 3kyh h GLU 316 N 0.01 0.00 -0.73 0.07 4.57 -0.77 0.11 114.58 117.84 3kyh h GLU 316 Ca -0.35 0.00 0.21 0.00 -1.18 0.00 0.00 59.36 58.04 3kyh h GLU 316 Cb 2.02 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 30.58 3kyh h GLU 316 CO 0.14 0.00 0.76 0.74 -1.18 0.00 0.00 179.01 179.46 3kyh h PHE 317 N 0.00 0.00 0.12 0.92 -1.00 -1.66 -2.72 116.94 112.61 3kyh h PHE 317 Ca 0.24 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.02 3kyh h PHE 317 Cb 1.39 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.94 3kyh h PHE 317 CO 0.00 0.00 -0.12 1.49 -1.61 0.00 0.00 178.31 178.07 3kyh h GLU 318 N 0.00 -0.23 0.43 1.51 4.57 -1.09 -2.89 114.58 116.88 3kyh h GLU 318 Ca 0.35 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.52 3kyh h GLU 318 Cb 1.86 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 30.50 3kyh h GLU 318 CO -0.00 -0.15 -0.21 -0.84 -1.18 0.00 0.00 179.01 176.63 3kyh h ILE 319 N -0.24 0.36 -0.60 2.32 3.07 -1.79 -3.35 117.51 117.29 3kyh h ILE 319 Ca -0.01 -0.57 0.22 0.00 1.55 0.00 0.00 64.86 66.04 3kyh h ILE 319 Cb 0.21 0.55 -0.08 0.00 -0.27 0.00 0.00 36.82 37.22 3kyh h ILE 319 CO -0.02 0.07 0.36 -0.11 -1.05 0.00 0.00 178.15 177.40 3kyh n LEU 320 N -5.19 0.14 -0.29 0.16 0.00 -1.03 0.26 117.00 111.05 3kyh n LEU 320 Ca -0.09 0.75 0.17 0.00 0.00 0.00 0.00 56.01 56.84 3kyh n LEU 320 Cb 0.29 -0.37 0.33 0.00 0.00 0.00 0.00 43.42 43.67 3kyh n LEU 320 CO 0.26 -0.83 0.75 -1.84 0.00 0.00 0.00 177.39 175.73 3kyh n GLU 321 N -3.87 -0.06 0.13 1.96 0.00 -1.09 -0.58 120.64 117.13 3kyh n GLU 321 Ca 0.19 1.25 0.17 0.00 0.00 0.00 0.00 57.16 58.78 3kyh n GLU 321 Cb 0.71 -2.06 0.59 0.00 0.00 0.00 0.00 31.44 30.68 3kyh n GLU 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3kyh h ARG 322 N 0.00 0.00 0.00 3.44 -0.00 -0.46 -2.39 114.38 114.97 3kyh h ARG 322 Ca 0.58 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 60.06 3kyh h ARG 322 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.29 3kyh h ARG 322 CO -0.76 0.00 0.00 -2.37 0.00 0.00 0.00 179.97 176.84 3kyh n THR 323 N -3.19 0.00 -3.80 2.04 5.66 0.25 -4.70 114.28 110.54 3kyh n THR 323 Ca 0.07 -0.26 -0.23 0.00 -3.05 0.00 0.00 64.05 60.58 3kyh n THR 323 Cb 0.80 1.10 -0.17 0.00 -1.55 0.00 0.00 70.33 70.51 3kyh n THR 323 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 3kyh s TYR 324 N -0.41 0.75 -0.04 1.09 1.51 -0.51 -2.60 117.35 117.13 3kyh s TYR 324 Ca 0.00 -0.22 0.03 0.00 -1.01 0.00 0.00 57.07 55.86 3kyh s TYR 324 Cb 0.00 -0.83 0.01 0.00 -0.11 0.00 0.00 41.96 41.02 3kyh s TYR 324 CO 0.00 -0.34 -0.11 0.50 -1.11 0.00 0.00 175.55 174.50 3kyh s ARG 325 N 1.89 1.29 0.08 -0.62 3.52 -1.26 -4.57 118.95 119.28 3kyh s ARG 325 Ca 0.04 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.29 3kyh s ARG 325 Cb -0.12 -1.14 -0.04 0.00 -1.56 0.00 0.00 34.95 32.09 3kyh s ARG 325 CO -0.05 0.08 0.23 -1.59 -0.81 0.00 0.00 175.30 173.16 3kyh s LYS 326 N 0.40 3.45 -0.05 5.12 0.00 -1.26 -2.55 119.74 124.86 3kyh s LYS 326 Ca -0.08 -0.45 0.00 0.00 0.00 0.00 0.00 55.97 55.45 3kyh s LYS 326 Cb -0.12 -3.02 -0.03 0.00 0.00 0.00 0.00 37.83 34.66 3kyh s LYS 326 CO 0.02 0.59 -0.05 1.97 0.00 0.00 0.00 175.35 177.88 3kyh n PHE 327 N 0.14 0.00 -4.30 1.78 -0.00 -1.10 -4.98 117.46 109.01 3kyh n PHE 327 Ca -0.05 0.00 -0.25 0.00 -0.00 0.00 0.00 57.45 57.14 3kyh n PHE 327 Cb 0.52 -0.18 -0.09 0.00 -0.00 0.00 0.00 39.48 39.73 3kyh n PHE 327 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3kyh s ALA 328 N -2.10 3.02 -0.12 1.98 0.00 -1.26 -4.96 121.76 118.32 3kyh s ALA 328 Ca -0.07 -1.54 -0.08 0.00 0.00 0.00 0.00 51.96 50.27 3kyh s ALA 328 Cb 0.02 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 3kyh s ALA 328 CO 0.11 0.40 0.17 -1.21 0.00 0.00 0.00 175.76 175.23 3kyh s GLU 329 N -3.13 3.60 0.00 0.00 8.01 -1.26 -1.96 118.70 123.96 3kyh s GLU 329 Ca 0.27 -0.07 0.00 0.00 0.01 0.00 0.00 54.97 55.18 3kyh s GLU 329 Cb -0.08 -3.23 0.00 0.00 -4.31 0.00 0.00 34.13 26.51 3kyh s GLU 329 CO 0.17 0.70 0.00 -0.11 0.01 0.00 0.00 175.26 176.03 3kyh n LEU 330 N 2.18 0.00 0.00 1.80 7.94 -1.23 -4.76 117.00 122.93 3kyh n LEU 330 Ca -0.19 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.71 3kyh n LEU 330 Cb 0.54 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.49 3kyh n LEU 330 CO 0.33 0.00 0.00 -1.54 -1.11 0.00 0.00 177.39 175.07 3kyh n SER 331 N 0.00 0.00 -4.11 1.96 3.41 -1.26 -4.72 113.62 108.90 3kyh n SER 331 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.27 3kyh n SER 331 Cb 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.81 3kyh n SER 331 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3kyh s VAL 332 N 0.00 2.80 1.14 -3.33 1.01 -1.26 -4.83 120.40 115.93 3kyh s VAL 332 Ca 0.00 -1.85 -0.15 0.00 0.00 0.00 0.00 61.98 59.98 3kyh s VAL 332 Cb 0.00 -2.82 0.26 0.00 0.00 0.00 0.00 36.38 33.82 3kyh s VAL 332 CO 0.00 -0.39 1.06 -0.94 0.00 0.00 0.00 175.10 174.83 3kyh s SER 333 N 1.32 1.35 0.22 3.32 1.04 -1.26 -4.71 113.70 114.99 3kyh s SER 333 Ca 0.02 1.11 0.26 0.00 0.48 0.00 0.00 55.95 57.82 3kyh s SER 333 Cb -0.21 -1.70 0.85 0.00 0.10 0.00 0.00 66.02 65.06 3kyh s SER 333 CO -0.04 -3.91 1.77 0.47 0.98 0.00 0.00 173.24 172.50 3kyh n ASP 334 N -4.68 0.78 -0.56 7.02 10.43 -1.26 -0.30 116.55 127.97 3kyh n ASP 334 Ca 0.07 0.60 0.09 0.00 2.57 0.00 0.00 54.79 58.11 3kyh n ASP 334 Cb 0.57 -0.80 0.03 0.00 1.84 0.00 0.00 41.12 42.77 3kyh n ASP 334 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 3kyh n GLU 335 N -2.25 1.59 -0.00 -1.24 2.13 -1.26 -4.20 120.64 115.40 3kyh n GLU 335 Ca 0.05 -1.21 0.09 0.00 0.66 0.00 0.00 57.16 56.75 3kyh n GLU 335 Cb 0.39 -1.34 -0.13 0.00 0.27 0.00 0.00 31.44 30.63 3kyh n GLU 335 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3kyh n GLU 336 N 0.44 0.61 -0.06 5.31 1.02 -0.74 -3.92 120.64 123.30 3kyh n GLU 336 Ca 0.09 -0.07 -0.18 0.00 -0.02 0.00 0.00 57.16 56.98 3kyh n GLU 336 Cb 0.42 -1.44 -0.13 0.00 -0.02 0.00 0.00 31.44 30.27 3kyh n GLU 336 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 3kyh h TRP 337 N 0.00 0.11 -0.95 -0.32 -0.00 -0.82 -3.31 115.95 110.65 3kyh h TRP 337 Ca 0.00 -0.08 0.22 0.00 -0.00 0.00 0.00 58.89 59.03 3kyh h TRP 337 Cb 0.63 -0.00 -0.12 0.00 -0.00 0.00 0.00 29.16 29.67 3kyh h TRP 337 CO 0.00 1.25 0.52 1.96 -0.00 0.00 0.00 178.44 182.17 3kyh h GLN 338 N -0.85 0.55 -0.61 2.65 1.08 -1.78 -2.27 115.11 113.88 3kyh h GLN 338 Ca -0.16 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 56.97 3kyh h GLN 338 Cb 1.25 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 28.53 3kyh h GLN 338 CO -0.04 0.36 0.25 -0.91 -0.95 0.00 0.00 178.83 177.54 3kyh h ASN 339 N 0.56 0.83 0.78 1.46 -0.26 -1.69 -2.36 115.58 114.90 3kyh h ASN 339 Ca 0.58 -0.16 0.00 0.00 -0.56 0.00 0.00 56.30 56.16 3kyh h ASN 339 Cb 1.04 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 38.09 3kyh h ASN 339 CO -0.46 0.76 -0.02 -0.11 -1.06 0.00 0.00 177.43 176.54 3kyh n LEU 340 N -4.47 0.04 0.07 1.61 0.00 -1.09 -4.45 117.00 108.71 3kyh n LEU 340 Ca 0.04 0.37 -0.03 0.00 0.00 0.00 0.00 56.01 56.39 3kyh n LEU 340 Cb 0.16 -0.39 -0.01 0.00 0.00 0.00 0.00 43.42 43.17 3kyh n LEU 340 CO 0.39 0.01 0.37 0.11 0.00 0.00 0.00 177.39 178.26 3kyh h LYS 341 N 0.03 -0.17 -0.63 1.96 1.57 -0.85 -3.38 116.57 115.09 3kyh h LYS 341 Ca 0.00 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.87 3kyh h LYS 341 Cb 0.41 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.70 3kyh h LYS 341 CO 0.00 -0.12 0.30 -2.95 -0.57 0.00 0.00 179.45 176.11 3kyh h ASN 342 N -0.23 0.38 -2.73 0.86 -1.07 -1.78 -3.39 115.58 107.62 3kyh h ASN 342 Ca -0.02 0.06 -0.66 0.00 0.07 0.00 0.00 56.30 55.75 3kyh h ASN 342 Cb 0.14 -0.01 -0.07 0.00 -2.07 0.00 0.00 38.32 36.31 3kyh h ASN 342 CO 0.03 0.23 -0.49 -1.48 0.07 0.00 0.00 177.43 175.79 3kyh s LEU 343 N -10.33 4.34 0.18 6.14 2.34 -1.26 -5.10 118.68 114.99 3kyh s LEU 343 Ca -0.13 0.41 -0.22 0.00 0.06 0.00 0.00 54.13 54.25 3kyh s LEU 343 Cb 0.17 -2.23 0.08 0.00 -0.56 0.00 0.00 46.19 43.65 3kyh s LEU 343 CO 0.75 0.36 1.05 -1.83 -1.06 0.00 0.00 176.35 175.62 3kyh s GLU 344 N -1.31 1.28 -0.13 1.48 1.03 -1.26 -4.71 118.70 115.09 3kyh s GLU 344 Ca 0.19 -0.83 -0.34 0.00 0.03 0.00 0.00 54.97 54.03 3kyh s GLU 344 Cb -0.12 0.36 0.14 0.00 -0.80 0.00 0.00 34.13 33.70 3kyh s GLU 344 CO 0.09 -0.60 1.28 1.14 -1.33 0.00 0.00 175.26 175.83 3kyh s GLN 345 N -2.17 0.28 0.36 -4.83 -2.07 -1.26 -5.15 119.66 104.81 3kyh s GLN 345 Ca 0.22 -0.13 -0.28 0.00 -1.82 0.00 0.00 55.36 53.34 3kyh s GLN 345 Cb -0.03 0.11 -0.11 0.00 -1.09 0.00 0.00 33.01 31.90 3kyh s GLN 345 CO 0.05 -0.13 1.46 -1.25 -1.32 0.00 0.00 175.29 174.11 3kyh s PRO 346 N -2.34 4.16 -0.04 9.60 0.04 -1.26 -4.95 135.00 140.21 3kyh s PRO 346 Ca 0.12 2.50 0.03 0.00 0.04 0.00 0.00 61.00 63.69 3kyh s PRO 346 Cb 0.02 -3.00 -0.05 0.00 0.04 0.00 0.00 34.50 31.52 3kyh s PRO 346 CO -0.04 -0.48 0.00 1.28 0.04 0.00 0.00 177.00 177.80 3kyh n LEU 347 N 0.76 0.62 -3.55 -3.56 4.77 -1.26 -4.67 117.00 110.11 3kyh n LEU 347 Ca 0.02 -0.01 -0.42 0.00 -0.03 0.00 0.00 56.01 55.57 3kyh n LEU 347 Cb 0.40 0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 3kyh n LEU 347 CO 0.63 0.20 1.90 -3.20 -1.33 0.00 0.00 177.39 175.59 3kyh n ASN 348 N -2.25 2.09 0.00 -1.43 2.85 -1.26 -0.20 115.26 115.05 3kyh n ASN 348 Ca -0.07 -2.59 0.00 0.00 -0.11 0.00 0.00 54.58 51.81 3kyh n ASN 348 Cb 0.62 -0.91 0.00 0.00 1.24 0.00 0.00 39.78 40.73 3kyh n ASN 348 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3kyh n GLY 349 N 4.63 0.14 3.42 8.20 0.00 0.14 -4.85 105.19 116.86 3kyh n GLY 349 Ca 0.47 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.27 3kyh n GLY 349 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3kyh n ARG 350 N 0.00 -0.51 -4.61 1.61 -4.01 0.71 -4.86 116.66 105.00 3kyh n ARG 350 Ca 0.00 -2.15 -0.23 0.00 -1.04 0.00 0.00 57.85 54.43 3kyh n ARG 350 Cb 0.00 -0.85 -0.16 0.00 -3.04 0.00 0.00 32.46 28.41 3kyh n ARG 350 CO 0.00 0.00 0.00 0.42 -3.04 0.00 0.00 177.63 175.01 3kyh s ILE 351 N -3.07 1.09 0.03 8.89 -1.09 -1.26 -0.38 121.20 125.42 3kyh s ILE 351 Ca 0.62 -0.54 0.04 0.00 -2.23 0.00 0.00 60.65 58.54 3kyh s ILE 351 Cb -0.03 -0.95 -0.02 0.00 -1.58 0.00 0.00 42.46 39.89 3kyh s ILE 351 CO 0.42 0.32 -0.13 -0.69 -1.23 0.00 0.00 174.94 173.64 3kyh s VAL 352 N 0.04 0.98 -0.23 2.92 1.01 0.47 -2.17 120.40 123.42 3kyh s VAL 352 Ca -0.02 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.02 3kyh s VAL 352 Cb -0.09 -0.90 0.07 0.00 0.00 0.00 0.00 36.38 35.46 3kyh s VAL 352 CO 0.01 -0.03 0.01 -0.70 0.00 0.00 0.00 175.10 174.39 3kyh s GLU 353 N -1.09 1.06 -0.08 2.72 2.12 -1.00 -0.81 118.70 121.62 3kyh s GLU 353 Ca 0.00 -0.80 -0.03 0.00 0.36 0.00 0.00 54.97 54.50 3kyh s GLU 353 Cb -0.08 -2.31 0.04 0.00 0.26 0.00 0.00 34.13 32.05 3kyh s GLU 353 CO 0.01 -0.69 0.16 0.00 -0.54 0.00 0.00 175.26 174.20 3kyh s ALA 355 N 1.81 3.37 -0.83 0.00 0.00 -1.23 -4.44 121.76 120.44 3kyh s ALA 355 Ca -0.02 0.83 -0.25 0.00 0.00 0.00 0.00 51.96 52.51 3kyh s ALA 355 Cb -0.12 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.62 3kyh s ALA 355 CO -0.06 -0.32 1.56 0.21 0.00 0.00 0.00 175.76 177.15 3kyh s LYS 356 N 0.27 3.09 -0.30 0.00 2.20 -1.26 -3.19 119.74 120.55 3kyh s LYS 356 Ca 0.54 -0.35 -0.38 0.00 -0.36 0.00 0.00 55.97 55.42 3kyh s LYS 356 Cb -0.29 -4.73 -0.14 0.00 -1.51 0.00 0.00 37.83 31.16 3kyh s LYS 356 CO 0.33 -2.49 1.98 -1.71 -0.36 0.00 0.00 175.35 173.09 3kyh n ASN 357 N 10.67 2.29 0.15 1.43 4.05 -0.58 -4.80 115.26 128.47 3kyh n ASN 357 Ca 0.22 0.75 0.13 0.00 0.45 0.00 0.00 54.58 56.13 3kyh n ASN 357 Cb 0.50 -1.20 0.51 0.00 1.23 0.00 0.00 39.78 40.82 3kyh n ASN 357 CO 0.00 0.00 0.00 -0.61 -3.05 0.00 0.00 177.26 173.60 3kyh h GLN 358 N 9.79 0.00 0.00 1.20 5.75 -1.93 0.31 115.11 130.22 3kyh h GLN 358 Ca -0.36 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.02 3kyh h GLN 358 Cb 1.32 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.85 3kyh h GLN 358 CO 0.99 0.00 -0.57 1.49 -2.65 0.00 0.00 178.83 178.10 3kyh h GLU 359 N 0.00 0.00 0.00 1.69 4.81 -1.94 -3.37 114.58 115.77 3kyh h GLU 359 Ca 0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 3kyh h GLU 359 Cb 0.41 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 3kyh h GLU 359 CO 0.00 0.57 -1.25 0.25 -0.73 0.00 0.00 179.01 177.84 3kyh n THR 360 N -3.70 0.20 0.00 0.32 -2.24 -0.96 -5.03 114.28 102.86 3kyh n THR 360 Ca -0.01 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3kyh n THR 360 Cb 0.60 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 3kyh n THR 360 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kyh n GLY 361 N 2.61 3.25 2.82 3.38 0.00 0.10 -5.02 105.19 112.34 3kyh n GLY 361 Ca -0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.78 3kyh n GLY 361 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kyh n ALA 362 N -1.11 -0.40 -3.68 4.61 0.00 -1.25 -4.85 120.51 113.82 3kyh n ALA 362 Ca 0.00 -1.36 -0.29 0.00 0.00 0.00 0.00 53.44 51.79 3kyh n ALA 362 Cb 0.00 0.11 -0.15 0.00 0.00 0.00 0.00 19.45 19.41 3kyh n ALA 362 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 3kyh s TRP 363 N -2.59 1.29 0.22 0.00 -2.14 -1.26 -1.53 118.94 112.93 3kyh s TRP 363 Ca 0.51 -1.45 -0.30 0.00 2.66 0.00 0.00 56.10 57.52 3kyh s TRP 363 Cb -0.02 -1.45 -0.09 0.00 -3.10 0.00 0.00 33.47 28.80 3kyh s TRP 363 CO 0.35 -0.85 1.33 -1.21 -2.66 0.00 0.00 176.95 173.91 3kyh s GLU 364 N 1.76 4.37 0.35 3.25 8.01 -1.19 -4.62 118.70 130.64 3kyh s GLU 364 Ca 0.09 2.10 -0.08 0.00 0.01 0.00 0.00 54.97 57.09 3kyh s GLU 364 Cb -0.17 -3.17 -0.06 0.00 -4.31 0.00 0.00 34.13 26.42 3kyh s GLU 364 CO -0.28 -0.27 0.67 0.00 0.01 0.00 0.00 175.26 175.40 3kyh s MET 365 N -0.30 3.72 0.00 1.61 0.23 -1.26 -3.52 119.30 119.78 3kyh s MET 365 Ca 0.56 0.28 0.00 0.00 -1.03 0.00 0.00 55.69 55.50 3kyh s MET 365 Cb -0.38 -2.50 0.00 0.00 -1.53 0.00 0.00 34.83 30.42 3kyh s MET 365 CO 0.40 0.08 0.56 1.47 -2.03 0.00 0.00 175.02 175.50 3kyh n LEU 366 N -1.10 0.45 0.00 0.18 -0.00 -1.21 -5.02 117.00 110.30 3kyh n LEU 366 Ca 0.01 -0.45 0.00 0.00 -0.00 0.00 0.00 56.01 55.56 3kyh n LEU 366 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 3kyh n LEU 366 CO 0.48 0.11 0.00 -2.11 -0.00 0.00 0.00 177.39 175.87 3kyh n ARG 367 N -0.11 0.00 -2.59 1.47 1.85 -1.26 -5.11 116.66 110.92 3kyh n ARG 367 Ca 0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.62 3kyh n ARG 367 Cb 0.41 0.00 0.09 0.00 -1.05 0.00 0.00 32.46 31.91 3kyh n ARG 367 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3kyh s PHE 368 N -2.00 1.91 -0.36 2.89 0.40 -1.26 -2.37 117.98 117.18 3kyh s PHE 368 Ca 0.00 -0.20 0.00 0.00 -0.60 0.00 0.00 56.93 56.13 3kyh s PHE 368 Cb 0.00 -2.93 0.12 0.00 0.51 0.00 0.00 43.02 40.72 3kyh s PHE 368 CO 0.00 -1.51 0.17 1.03 0.70 0.00 0.00 175.22 175.61 3kyh s ARG 369 N -5.06 0.84 0.19 0.44 1.81 -0.92 -4.84 118.95 111.40 3kyh s ARG 369 Ca 0.64 -1.40 -0.10 0.00 -1.72 0.00 0.00 55.73 53.15 3kyh s ARG 369 Cb -0.07 -1.91 0.10 0.00 -0.45 0.00 0.00 34.95 32.63 3kyh s ARG 369 CO 0.43 -1.09 1.75 0.38 -0.68 0.00 0.00 175.30 176.09 3kyh h ASP 370 N 7.45 0.92 0.00 0.23 -0.00 -1.99 -3.23 116.42 119.79 3kyh h ASP 370 Ca -0.06 -0.17 0.00 0.00 -0.00 0.00 0.00 57.03 56.80 3kyh h ASP 370 Cb 0.98 -0.24 0.00 0.00 -0.00 0.00 0.00 39.33 40.07 3kyh h ASP 370 CO 0.43 0.84 0.00 -0.90 -0.00 0.00 0.00 179.24 179.61 3kyh n ASP 371 N -4.40 0.00 -3.95 4.15 5.75 -1.26 -4.54 116.55 112.30 3kyh n ASP 371 Ca 0.05 -0.92 -0.22 0.00 -0.01 0.00 0.00 54.79 53.69 3kyh n ASP 371 Cb 0.17 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.10 3kyh n ASP 371 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3kyh s LYS 372 N -2.00 1.20 0.00 0.11 1.02 -1.22 -5.10 119.74 113.75 3kyh s LYS 372 Ca 0.04 -0.24 0.00 0.00 0.02 0.00 0.00 55.97 55.79 3kyh s LYS 372 Cb 0.02 -1.08 0.00 0.00 -0.52 0.00 0.00 37.83 36.25 3kyh s LYS 372 CO 0.03 -0.03 0.54 -0.11 -0.92 0.00 0.00 175.35 174.86 3kyh n LEU 373 N 3.93 0.00 0.00 3.17 7.94 -1.26 -4.90 117.00 125.88 3kyh n LEU 373 Ca -0.24 0.54 0.00 0.00 -1.11 0.00 0.00 56.01 55.19 3kyh n LEU 373 Cb 0.51 -0.04 0.00 0.00 0.53 0.00 0.00 43.42 44.43 3kyh n LEU 373 CO 0.24 -0.04 0.00 -0.46 -1.11 0.00 0.00 177.39 176.03 3kyh n ASN 374 N -0.76 0.00 -0.01 1.96 0.23 -1.26 -4.87 115.26 110.55 3kyh n ASN 374 Ca 0.00 0.00 -0.05 0.00 -0.53 0.00 0.00 54.58 54.00 3kyh n ASN 374 Cb 0.00 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.68 3kyh n ASN 374 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3kyh n GLY 375 N 5.00 -0.18 0.00 4.83 0.00 -1.26 -4.71 105.19 108.86 3kyh n GLY 375 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3kyh n GLY 375 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3kyh n ASN 376 N -3.70 0.00 -4.74 1.61 5.03 -1.25 -3.55 115.26 108.66 3kyh n ASN 376 Ca -0.08 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 54.96 3kyh n ASN 376 Cb 0.28 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.02 3kyh n ASN 376 CO 0.00 0.00 0.00 -2.28 -1.83 0.00 0.00 177.26 173.15 3kyh s HIS 377 N -1.15 2.78 0.16 3.10 5.65 -1.24 -3.50 115.29 121.09 3kyh s HIS 377 Ca 0.00 0.68 -0.27 0.00 0.25 0.00 0.00 55.06 55.72 3kyh s HIS 377 Cb 0.00 -4.09 -0.02 0.00 -1.18 0.00 0.00 32.58 27.29 3kyh s HIS 377 CO 0.00 -3.78 1.44 2.41 -0.65 0.00 0.00 174.74 174.16 3kyh n THR 378 N 2.58 -0.61 0.04 0.89 -1.04 -1.20 -0.30 114.28 114.63 3kyh n THR 378 Ca 0.10 2.25 -0.12 0.00 -2.04 0.00 0.00 64.05 64.24 3kyh n THR 378 Cb 0.37 -2.82 -0.06 0.00 -1.82 0.00 0.00 70.33 66.00 3kyh n THR 378 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 3kyh h SER 379 N 0.00 -1.17 0.00 8.00 4.64 -1.92 0.10 113.55 123.20 3kyh h SER 379 Ca 0.18 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 3kyh h SER 379 Cb 0.41 0.47 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 3kyh h SER 379 CO -0.89 -0.42 0.00 0.52 -0.87 0.00 0.00 176.83 175.17 3kyh n VAL 380 N -5.43 0.00 -0.09 0.95 0.31 0.59 -1.72 118.33 112.93 3kyh n VAL 380 Ca -0.05 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.10 3kyh n VAL 380 Cb 0.35 -0.74 -0.07 0.00 -0.91 0.00 0.00 33.84 32.48 3kyh n VAL 380 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3kyh n VAL 381 N -0.89 1.02 -0.34 2.52 0.31 0.40 -4.68 118.33 116.66 3kyh n VAL 381 Ca 0.06 -0.28 -0.05 0.00 -0.01 0.00 0.00 64.34 64.05 3kyh n VAL 381 Cb 0.03 -1.64 -0.01 0.00 -0.91 0.00 0.00 33.84 31.31 3kyh n VAL 381 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 3kyh h GLN 382 N -0.55 -0.06 -0.73 5.55 4.15 0.04 0.96 115.11 124.47 3kyh h GLN 382 Ca -0.46 0.00 0.21 0.00 0.77 0.00 0.00 58.65 59.17 3kyh h GLN 382 Cb 1.45 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 29.13 3kyh h GLN 382 CO -0.25 -0.04 0.89 0.87 -1.93 0.00 0.00 178.83 178.38 3kyh h LYS 383 N -0.06 0.00 0.02 1.69 1.79 -1.80 0.07 116.57 118.28 3kyh h LYS 383 Ca 0.26 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.40 3kyh h LYS 383 Cb 0.54 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.14 3kyh h LYS 383 CO -0.90 0.00 -2.01 0.28 -1.08 0.00 0.00 179.45 175.74 3kyh n VAL 384 N -3.37 1.56 -0.30 0.50 0.31 0.32 -3.98 118.33 113.36 3kyh n VAL 384 Ca 0.16 -0.78 0.20 0.00 -0.01 0.00 0.00 64.34 63.91 3kyh n VAL 384 Cb 1.14 -1.00 0.47 0.00 -0.91 0.00 0.00 33.84 33.54 3kyh n VAL 384 CO 0.00 0.00 0.00 0.17 -1.32 0.00 0.00 176.83 175.68 3kyh h LEU 385 N 0.01 0.50 0.12 7.52 8.10 -0.79 -1.67 115.31 129.11 3kyh h LEU 385 Ca -0.41 0.07 0.02 0.00 0.11 0.00 0.00 57.88 57.67 3kyh h LEU 385 Cb 2.08 -0.01 -0.04 0.00 -0.44 0.00 0.00 40.66 42.24 3kyh h LEU 385 CO 0.05 0.15 -0.36 -0.08 -4.11 0.00 0.00 178.44 174.10 3kyh h GLU 386 N 0.47 -0.57 -0.61 0.17 4.57 -1.67 -3.27 114.58 113.68 3kyh h GLU 386 Ca 0.55 0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.70 3kyh h GLU 386 Cb 1.28 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.97 3kyh h GLU 386 CO -0.27 -0.38 0.10 1.03 -1.18 0.00 0.00 179.01 178.31 3kyh h SER 387 N -0.59 0.97 -0.03 1.04 0.87 -1.46 -2.92 113.55 111.42 3kyh h SER 387 Ca 0.03 -0.26 0.01 0.00 -1.23 0.00 0.00 61.79 60.34 3kyh h SER 387 Cb 0.62 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.32 3kyh h SER 387 CO -0.21 0.98 0.04 0.40 -0.53 0.00 0.00 176.83 177.51 3kyh h ILE 388 N 0.91 0.54 0.19 2.23 2.04 -1.58 0.14 117.51 122.00 3kyh h ILE 388 Ca 0.18 0.00 -0.29 0.00 1.00 0.00 0.00 64.86 65.76 3kyh h ILE 388 Cb 0.42 0.97 0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3kyh h ILE 388 CO 0.01 0.00 -1.31 0.78 0.00 0.00 0.00 178.15 177.63 3kyh h ASN 389 N 0.00 0.64 -0.93 1.72 4.21 -1.65 -3.37 115.58 116.21 3kyh h ASN 389 Ca 0.02 -0.93 0.07 0.00 1.21 0.00 0.00 56.30 56.67 3kyh h ASN 389 Cb 0.09 -0.21 -0.06 0.00 -1.12 0.00 0.00 38.32 37.02 3kyh h ASN 389 CO -0.00 1.62 0.60 0.44 -1.29 0.00 0.00 177.43 178.80 3kyh h ASP 390 N -0.07 0.92 -3.41 5.81 3.45 -0.59 -3.38 116.42 119.15 3kyh h ASP 390 Ca -0.24 0.01 -0.52 0.00 0.43 0.00 0.00 57.03 56.71 3kyh h ASP 390 Cb 1.95 -0.18 0.03 0.00 -0.56 0.00 0.00 39.33 40.57 3kyh h ASP 390 CO 0.20 0.57 0.62 -0.94 -1.57 0.00 0.00 179.24 178.12 3kyh s SER 391 N -5.96 6.95 0.00 6.45 1.04 -0.45 -3.65 113.70 118.08 3kyh s SER 391 Ca -0.12 2.34 0.00 0.00 0.48 0.00 0.00 55.95 58.66 3kyh s SER 391 Cb 0.20 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.71 3kyh s SER 391 CO 0.80 -0.48 0.00 0.52 0.98 0.00 0.00 173.24 175.06 3kyh n VAL 392 N 2.63 -0.47 -0.67 5.02 0.31 -1.26 -4.88 118.33 119.00 3kyh n VAL 392 Ca 0.06 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.09 3kyh n VAL 392 Cb 0.43 -1.39 0.21 0.00 -0.91 0.00 0.00 33.84 32.18 3kyh n VAL 392 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3kyh s SER 393 N -1.62 1.94 0.08 4.52 0.15 -1.26 -4.82 113.70 112.70 3kyh s SER 393 Ca 0.00 1.77 -0.36 0.00 0.70 0.00 0.00 55.95 58.06 3kyh s SER 393 Cb 0.00 -2.39 -0.17 0.00 -1.71 0.00 0.00 66.02 61.75 3kyh s SER 393 CO 0.00 -3.64 1.56 0.25 1.20 0.00 0.00 173.24 172.60 3kyh h LEU 394 N -2.24 -1.39 -0.86 3.45 5.85 -2.01 -1.77 115.31 116.34 3kyh h LEU 394 Ca -0.53 0.11 0.22 0.00 0.84 0.00 0.00 57.88 58.52 3kyh h LEU 394 Cb 1.30 0.46 -0.13 0.00 0.37 0.00 0.00 40.66 42.66 3kyh h LEU 394 CO 0.47 -0.67 0.26 -0.33 -0.34 0.00 0.00 178.44 177.84 3kyh h GLU 395 N -1.02 0.26 0.00 1.25 4.39 -1.97 0.15 114.58 117.64 3kyh h GLU 395 Ca -0.06 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.62 3kyh h GLU 395 Cb 0.88 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 3kyh h GLU 395 CO -0.06 0.17 0.00 -0.25 -1.16 0.00 0.00 179.01 177.71 3kyh n ASP 396 N -5.17 0.00 0.00 1.42 8.00 -0.68 -0.51 116.55 119.61 3kyh n ASP 396 Ca 0.20 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.70 3kyh n ASP 396 Cb 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.74 3kyh n ASP 396 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3kyh n LEU 397 N -0.68 1.31 -0.34 0.64 4.77 0.40 -4.74 117.00 118.35 3kyh n LEU 397 Ca 0.00 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.15 3kyh n LEU 397 Cb 0.00 0.00 0.39 0.00 -2.33 0.00 0.00 43.42 41.48 3kyh n LEU 397 CO 0.00 0.20 1.18 -0.33 -1.33 0.00 0.00 177.39 177.11 3kyh h GLU 398 N 0.00 0.58 -0.47 3.23 5.08 0.49 0.40 114.58 123.89 3kyh h GLU 398 Ca 0.00 -0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.46 3kyh h GLU 398 Cb 0.93 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 3kyh h GLU 398 CO 0.00 0.38 0.45 1.05 -1.00 0.00 0.00 179.01 179.89 3kyh h GLU 399 N 0.59 0.00 -0.03 2.33 4.11 -1.19 -1.56 114.58 118.84 3kyh h GLU 399 Ca 0.62 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.05 3kyh h GLU 399 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3kyh h GLU 399 CO -0.42 0.00 -0.00 -0.89 0.07 0.00 0.00 179.01 177.76 3kyh n ILE 400 N -3.86 0.00 -0.28 -1.06 5.41 0.14 -4.53 119.36 115.18 3kyh n ILE 400 Ca 0.09 -0.42 -0.00 0.00 1.00 0.00 0.00 62.75 63.42 3kyh n ILE 400 Cb 0.65 1.18 0.06 0.00 -0.71 0.00 0.00 39.64 40.82 3kyh n ILE 400 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3kyh h VAL 401 N 3.94 0.14 0.00 1.39 2.07 -1.33 0.05 116.25 122.50 3kyh h VAL 401 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3kyh h VAL 401 Cb 0.84 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 3kyh h VAL 401 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 3kyh n GLY 402 N -1.50 -1.29 0.96 2.17 0.00 -1.26 -3.78 105.19 100.49 3kyh n GLY 402 Ca 0.09 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3kyh n GLY 402 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kyh n ASP 403 N -1.44 3.01 -0.02 1.61 8.00 -0.00 -2.00 116.55 125.70 3kyh n ASP 403 Ca 0.08 -1.98 0.01 0.00 0.71 0.00 0.00 54.79 53.60 3kyh n ASP 403 Cb 0.27 -0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.26 3kyh n ASP 403 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3kyh n ILE 404 N 1.34 0.31 -0.01 0.53 -0.00 -1.20 -3.82 119.36 116.51 3kyh n ILE 404 Ca 0.14 -0.32 -0.17 0.00 -0.00 0.00 0.00 62.75 62.41 3kyh n ILE 404 Cb 0.59 -0.21 -0.12 0.00 -0.00 0.00 0.00 39.64 39.90 3kyh n ILE 404 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.55 177.05 3kyh h LYS 405 N 0.00 0.28 -0.42 0.38 3.64 -1.67 0.21 116.57 118.99 3kyh h LYS 405 Ca -0.12 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 58.93 3kyh h LYS 405 Cb 1.00 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 3kyh h LYS 405 CO 0.01 1.03 0.23 -0.09 -2.27 0.00 0.00 179.45 178.36 3kyh h ARG 406 N -0.34 0.59 0.00 1.90 2.43 -1.64 0.12 114.38 117.44 3kyh h ARG 406 Ca -0.06 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 3kyh h ARG 406 Cb 1.20 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 3kyh h ARG 406 CO 0.09 0.47 0.00 0.00 -1.51 0.00 0.00 179.97 179.02 3kyh h TRP 408 N 0.00 0.08 -0.88 0.00 2.91 -0.22 -3.22 115.95 114.62 3kyh h TRP 408 Ca 0.00 -0.06 0.26 0.00 1.13 0.00 0.00 58.89 60.22 3kyh h TRP 408 Cb 0.54 -0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 29.16 3kyh h TRP 408 CO 0.00 1.29 0.64 -0.44 -1.03 0.00 0.00 178.44 178.90 3kyh h ASP 409 N -0.88 0.00 0.08 2.65 3.32 -0.69 0.10 116.42 121.00 3kyh h ASP 409 Ca -0.19 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 3kyh h ASP 409 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3kyh h ASP 409 CO -0.07 0.00 -0.04 -0.08 -1.72 0.00 0.00 179.24 177.33 3kyh h GLU 410 N 0.00 -0.10 -0.33 3.56 4.81 -1.56 -3.13 114.58 117.83 3kyh h GLU 410 Ca 0.42 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.71 3kyh h GLU 410 Cb 1.69 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 31.08 3kyh h GLU 410 CO -0.00 0.45 0.23 0.00 -0.73 0.00 0.00 179.01 178.95 3kyh h ARG 411 N -0.77 0.19 -0.44 1.92 3.08 -1.39 0.20 114.38 117.17 3kyh h ARG 411 Ca -0.01 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3kyh h ARG 411 Cb 0.59 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 3kyh h ARG 411 CO 0.02 0.13 0.21 -0.09 -1.07 0.00 0.00 179.97 179.17 3kyh h ARG 412 N 0.20 0.60 0.00 0.04 2.43 -0.97 -3.20 114.38 113.48 3kyh h ARG 412 Ca 0.15 -0.06 -0.32 0.00 -0.81 0.00 0.00 59.98 58.93 3kyh h ARG 412 Cb 0.33 -0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 29.70 3kyh h ARG 412 CO -0.02 0.47 -2.20 0.00 -1.51 0.00 0.00 179.97 176.70 3kyh n ALA 413 N -2.47 1.56 0.26 2.80 0.00 -0.91 -4.57 120.51 117.17 3kyh n ALA 413 Ca 0.03 -1.05 0.09 0.00 0.00 0.00 0.00 53.44 52.51 3kyh n ALA 413 Cb 0.12 -0.07 0.66 0.00 0.00 0.00 0.00 19.45 20.15 3kyh n ALA 413 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3kyh h ASN 414 N 0.00 0.00 -0.02 0.00 -0.26 -0.68 -3.52 115.58 111.10 3kyh h ASN 414 Ca -0.47 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.27 3kyh h ASN 414 Cb 1.94 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.20 3kyh h ASN 414 CO -0.01 0.06 0.00 1.15 -1.06 0.00 0.00 177.43 177.57