#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qlm s ILE 13 N 0.00 3.60 0.11 1.69 -4.36 -1.26 -5.07 121.20 115.91 2qlm s ILE 13 Ca 0.00 -1.02 -0.25 0.00 -0.26 0.00 0.00 60.65 59.12 2qlm s ILE 13 Cb 0.00 -2.64 -0.10 0.00 1.25 0.00 0.00 42.46 40.97 2qlm s ILE 13 CO 0.00 0.23 1.68 -1.28 0.24 0.00 0.00 174.94 175.81 2qlm h SER 14 N 3.94 -0.40 0.15 4.36 0.87 -1.96 -2.88 113.55 117.64 2qlm h SER 14 Ca -0.48 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 2qlm h SER 14 Cb 1.17 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 2qlm h SER 14 CO 0.54 -0.21 0.00 1.33 -0.53 0.00 0.00 176.83 177.96 2qlm n VAL 15 N -5.27 1.47 1.54 2.23 0.24 -1.26 -1.70 118.33 115.58 2qlm n VAL 15 Ca -0.06 0.50 0.12 0.00 -2.04 0.00 0.00 64.34 62.85 2qlm n VAL 15 Cb 0.19 -1.45 0.52 0.00 -1.47 0.00 0.00 33.84 31.63 2qlm n VAL 15 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2qlm n ARG 16 N -1.77 1.48 0.00 7.34 1.74 -1.09 -5.04 116.66 119.32 2qlm n ARG 16 Ca 0.00 -0.71 0.00 0.00 -0.77 0.00 0.00 57.85 56.37 2qlm n ARG 16 Cb 0.06 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.09 2qlm n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qlm n GLY 17 N 1.06 -3.12 3.82 -0.13 0.00 -0.69 -1.46 105.19 104.67 2qlm n GLY 17 Ca 0.17 -1.86 -0.35 0.00 0.00 0.00 0.00 46.02 43.98 2qlm n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qlm s LEU 18 N 0.00 4.20 -0.71 0.99 2.01 -1.26 -4.68 118.68 119.23 2qlm s LEU 18 Ca 0.00 1.44 0.04 0.00 0.01 0.00 0.00 54.13 55.63 2qlm s LEU 18 Cb 0.00 -3.91 0.26 0.00 0.01 0.00 0.00 46.19 42.54 2qlm s LEU 18 CO 0.00 -0.11 0.85 0.00 1.01 0.00 0.00 176.35 178.10 2qlm n ALA 19 N 0.17 4.22 -1.77 4.21 0.00 -1.26 -3.62 120.51 122.45 2qlm n ALA 19 Ca 0.01 -4.78 -0.36 0.00 0.00 0.00 0.00 53.44 48.32 2qlm n ALA 19 Cb 0.52 -1.12 -0.00 0.00 0.00 0.00 0.00 19.45 18.85 2qlm n ALA 19 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2qlm s GLY 20 N -2.34 2.68 0.20 0.00 0.00 -1.26 -4.88 107.32 101.72 2qlm s GLY 20 Ca 0.38 0.85 -0.11 0.00 0.00 0.00 0.00 44.72 45.85 2qlm s GLY 20 CO 0.00 1.24 1.74 -2.08 0.00 0.00 0.00 173.10 174.01 2qlm h VAL 21 N 1.45 0.79 -0.21 1.40 2.07 -1.99 -1.15 116.25 118.60 2qlm h VAL 21 Ca -0.50 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 2qlm h VAL 21 Cb 1.26 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2qlm h VAL 21 CO 0.58 0.07 0.07 -0.08 0.02 0.00 0.00 177.57 178.23 2qlm h GLU 22 N 0.38 0.32 -0.37 1.57 4.57 -1.99 -2.38 114.58 116.68 2qlm h GLU 22 Ca 0.28 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.37 2qlm h GLU 22 Cb 0.33 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.86 2qlm h GLU 22 CO -0.29 0.40 0.13 -0.91 -1.18 0.00 0.00 179.01 177.17 2qlm h ASN 23 N 0.18 0.52 -0.36 1.04 4.21 -1.87 -1.51 115.58 117.79 2qlm h ASN 23 Ca 0.07 -0.18 -0.01 0.00 1.21 0.00 0.00 56.30 57.38 2qlm h ASN 23 Cb 0.21 -0.14 -0.02 0.00 -1.12 0.00 0.00 38.32 37.26 2qlm h ASN 23 CO -0.00 0.57 0.18 0.58 -1.29 0.00 0.00 177.43 177.46 2qlm h VAL 24 N 0.45 1.16 -0.64 2.81 2.07 -1.23 0.62 116.25 121.49 2qlm h VAL 24 Ca 0.12 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2qlm h VAL 24 Cb 0.22 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2qlm h VAL 24 CO -0.01 0.17 0.41 0.74 0.02 0.00 0.00 177.57 178.89 2qlm h THR 25 N 0.45 1.18 -0.55 2.57 2.02 -1.39 -1.19 112.91 116.00 2qlm h THR 25 Ca 0.12 -0.36 -0.11 0.00 0.77 0.00 0.00 66.41 66.83 2qlm h THR 25 Cb 0.10 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.76 2qlm h THR 25 CO -0.02 0.18 -0.10 -0.08 0.37 0.00 0.00 175.52 175.87 2qlm h GLU 26 N 0.87 1.04 -0.54 6.66 4.57 -0.98 -2.64 114.58 123.55 2qlm h GLU 26 Ca 0.23 -0.38 -0.04 0.00 -1.18 0.00 0.00 59.36 57.99 2qlm h GLU 26 Cb -0.06 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.44 2qlm h GLU 26 CO -0.05 1.07 0.17 -0.07 -1.18 0.00 0.00 179.01 178.96 2qlm h LEU 27 N 0.91 0.79 -0.75 1.64 3.38 -0.69 -2.40 115.31 118.19 2qlm h LEU 27 Ca 0.14 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2qlm h LEU 27 Cb 0.68 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 2qlm h LEU 27 CO 0.05 0.78 0.47 0.11 0.09 0.00 0.00 178.44 179.94 2qlm h LYS 28 N 0.75 1.00 -0.01 1.13 1.57 -1.10 -0.20 116.57 119.71 2qlm h LYS 28 Ca 0.18 -0.08 -0.21 0.00 -1.87 0.00 0.00 60.65 58.67 2qlm h LYS 28 Cb 0.27 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2qlm h LYS 28 CO -0.01 0.69 -0.88 1.57 -0.57 0.00 0.00 179.45 180.26 2qlm h LYS 29 N 1.02 0.30 -0.00 3.15 2.10 -1.45 -2.33 116.57 119.37 2qlm h LYS 29 Ca 0.27 -0.32 -0.11 0.00 -2.00 0.00 0.00 60.65 58.49 2qlm h LYS 29 Cb -0.07 0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.33 2qlm h LYS 29 CO -0.05 1.01 -0.54 -0.91 -2.00 0.00 0.00 179.45 176.95 2qlm h ASN 30 N 0.18 0.01 -0.04 7.07 2.35 -1.28 0.10 115.58 123.98 2qlm h ASN 30 Ca -0.06 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2qlm h ASN 30 Cb 1.50 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.87 2qlm h ASN 30 CO 0.14 0.55 0.01 0.15 -1.65 0.00 0.00 177.43 176.63 2qlm h PHE 31 N 0.01 0.06 -0.43 1.19 3.57 -0.96 -1.99 116.94 118.38 2qlm h PHE 31 Ca -0.01 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 2qlm h PHE 31 Cb 0.96 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.66 2qlm h PHE 31 CO 0.00 0.24 -0.01 -0.91 -2.23 0.00 0.00 178.31 175.41 2qlm h ASN 32 N -0.14 0.67 -0.41 0.41 2.35 -1.27 -1.53 115.58 115.66 2qlm h ASN 32 Ca 0.01 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.61 2qlm h ASN 32 Cb 0.21 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 2qlm h ASN 32 CO -0.00 0.74 0.24 -0.09 -1.65 0.00 0.00 177.43 176.67 2qlm h ARG 33 N 0.66 0.56 -0.43 0.81 2.43 -0.94 -2.13 114.38 115.35 2qlm h ARG 33 Ca 0.13 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 59.12 2qlm h ARG 33 Cb 0.42 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 2qlm h ARG 33 CO 0.02 0.43 -0.23 0.45 -1.51 0.00 0.00 179.97 179.12 2qlm h HIS 34 N 0.54 1.00 -0.99 2.20 3.86 -1.12 0.19 115.15 120.83 2qlm h HIS 34 Ca 0.15 -0.24 0.01 0.00 -1.16 0.00 0.00 60.37 59.13 2qlm h HIS 34 Cb 0.02 -0.23 -0.05 0.00 1.06 0.00 0.00 27.41 28.21 2qlm h HIS 34 CO -0.03 1.02 0.65 1.25 0.86 0.00 0.00 177.93 181.68 2qlm h LEU 35 N 0.75 1.13 0.06 2.43 5.85 -1.19 0.05 115.31 124.39 2qlm h LEU 35 Ca 0.10 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2qlm h LEU 35 Cb 0.78 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2qlm h LEU 35 CO 0.06 0.81 -0.03 -0.74 -0.34 0.00 0.00 178.44 178.21 2qlm h HIS 36 N 1.33 -0.07 0.16 1.25 2.76 -1.17 -1.84 115.15 117.57 2qlm h HIS 36 Ca 0.37 -0.00 -0.30 0.00 -2.20 0.00 0.00 60.37 58.23 2qlm h HIS 36 Cb -0.13 0.02 0.01 0.00 1.55 0.00 0.00 27.41 28.86 2qlm h HIS 36 CO -0.00 -0.05 -1.39 0.74 -1.30 0.00 0.00 177.93 175.93 2qlm h PHE 37 N -0.91 0.63 0.09 5.26 0.04 -0.71 -2.40 116.94 118.94 2qlm h PHE 37 Ca -0.01 -0.46 -0.28 0.00 2.80 0.00 0.00 57.97 60.02 2qlm h PHE 37 Cb 0.06 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 2qlm h PHE 37 CO 0.00 1.40 -1.46 1.15 -0.60 0.00 0.00 178.31 178.79 2qlm h THR 38 N 0.09 0.95 0.00 -1.55 2.02 -1.19 -3.38 112.91 109.85 2qlm h THR 38 Ca -0.20 -2.34 0.00 0.00 0.77 0.00 0.00 66.41 64.64 2qlm h THR 38 Cb 2.04 2.59 0.00 0.00 -1.74 0.00 0.00 68.15 71.05 2qlm h THR 38 CO 0.21 0.66 -0.99 0.18 0.37 0.00 0.00 175.52 175.96 2qlm n LEU 39 N -3.95 0.63 -3.46 2.58 4.77 -0.18 -5.00 117.00 112.40 2qlm n LEU 39 Ca -0.27 -0.08 -0.21 0.00 -0.03 0.00 0.00 56.01 55.41 2qlm n LEU 39 Cb 0.88 -0.10 0.06 0.00 -2.33 0.00 0.00 43.42 41.93 2qlm n LEU 39 CO 0.37 0.08 -0.01 0.52 -1.33 0.00 0.00 177.39 177.02 2qlm n VAL 40 N -1.85 -7.28 -3.98 4.08 0.31 -0.90 -5.00 118.33 103.71 2qlm n VAL 40 Ca 0.02 -1.05 -0.09 0.00 -0.01 0.00 0.00 64.34 63.22 2qlm n VAL 40 Cb 0.41 -5.37 -0.10 0.00 -0.91 0.00 0.00 33.84 27.88 2qlm n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2qlm s LYS 41 N -5.17 0.56 0.38 5.55 -0.14 -0.71 -5.03 119.74 115.17 2qlm s LYS 41 Ca 0.36 -0.87 0.08 0.00 -1.36 0.00 0.00 55.97 54.18 2qlm s LYS 41 Cb -0.08 0.21 -0.05 0.00 -1.68 0.00 0.00 37.83 36.23 2qlm s LYS 41 CO 0.79 -0.13 0.09 0.16 -0.76 0.00 0.00 175.35 175.50 2qlm s ASP 42 N -2.28 4.30 0.12 2.83 -4.77 -1.26 -3.83 116.67 111.77 2qlm s ASP 42 Ca -0.03 -1.04 0.07 0.00 -3.30 0.00 0.00 52.55 48.25 2qlm s ASP 42 Cb 0.00 -0.52 0.39 0.00 -1.09 0.00 0.00 42.92 41.70 2qlm s ASP 42 CO -0.06 -0.39 1.16 0.54 0.70 0.00 0.00 175.17 177.12 2qlm n ARG 43 N -1.09 0.05 0.08 2.11 5.12 -1.26 -1.79 116.66 119.87 2qlm n ARG 43 Ca -0.03 0.50 -0.01 0.00 -1.93 0.00 0.00 57.85 56.38 2qlm n ARG 43 Cb 0.64 -1.74 -0.05 0.00 -1.16 0.00 0.00 32.46 30.14 2qlm n ARG 43 CO 0.00 0.00 0.00 -0.91 -1.93 0.00 0.00 177.63 174.79 2qlm h ASN 44 N 0.00 0.00 -0.00 0.55 2.35 -2.05 -3.37 115.58 113.06 2qlm h ASN 44 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2qlm h ASN 44 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2qlm h ASN 44 CO 0.00 0.68 -0.01 1.33 -1.65 0.00 0.00 177.43 177.78 2qlm n VAL 45 N -3.14 0.00 -2.44 2.81 0.24 -0.74 -5.04 118.33 110.02 2qlm n VAL 45 Ca -0.04 -0.49 -0.41 0.00 -2.04 0.00 0.00 64.34 61.36 2qlm n VAL 45 Cb 0.84 1.04 -0.03 0.00 -1.47 0.00 0.00 33.84 34.22 2qlm n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qlm s ALA 46 N -0.33 3.39 0.43 2.33 0.00 -1.01 -4.97 121.76 121.60 2qlm s ALA 46 Ca 0.03 0.86 0.04 0.00 0.00 0.00 0.00 51.96 52.89 2qlm s ALA 46 Cb 0.02 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.74 2qlm s ALA 46 CO 0.04 -0.33 0.61 0.95 0.00 0.00 0.00 175.76 177.03 2qlm s THR 47 N 0.24 3.65 0.43 0.00 -4.23 -1.26 -4.97 115.64 109.49 2qlm s THR 47 Ca 0.53 -0.76 0.17 0.00 -1.18 0.00 0.00 61.69 60.45 2qlm s THR 47 Cb -0.30 -3.30 0.37 0.00 1.34 0.00 0.00 72.50 70.60 2qlm s THR 47 CO 0.34 -0.17 1.90 -0.65 -0.54 0.00 0.00 174.62 175.50 2qlm h PRO 48 N 0.54 0.38 -0.71 3.99 0.11 -2.00 -1.26 132.00 133.06 2qlm h PRO 48 Ca -0.44 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.60 2qlm h PRO 48 Cb 1.27 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2qlm h PRO 48 CO 0.53 0.25 0.26 -0.09 -0.21 0.00 0.00 178.00 178.74 2qlm h ARG 49 N 0.40 1.07 -0.87 1.05 2.43 -1.96 -0.97 114.38 115.52 2qlm h ARG 49 Ca 0.40 -0.21 0.01 0.00 -0.81 0.00 0.00 59.98 59.37 2qlm h ARG 49 Cb 0.97 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 30.31 2qlm h ARG 49 CO -0.13 0.90 0.57 -0.44 -1.51 0.00 0.00 179.97 179.37 2qlm h ASP 50 N 1.02 0.99 -0.65 -3.80 3.45 -1.63 -1.71 116.42 114.10 2qlm h ASP 50 Ca 0.23 -0.02 -0.07 0.00 0.43 0.00 0.00 57.03 57.60 2qlm h ASP 50 Cb 0.25 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 38.74 2qlm h ASP 50 CO -0.01 0.72 0.14 1.88 -1.57 0.00 0.00 179.24 180.39 2qlm h TYR 51 N 1.17 1.10 -0.05 4.55 0.05 -0.94 -0.90 116.97 121.96 2qlm h TYR 51 Ca 0.32 -0.14 0.02 0.00 0.05 0.00 0.00 58.73 58.98 2qlm h TYR 51 Cb -0.13 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 37.28 2qlm h TYR 51 CO -0.01 0.92 -0.07 -0.92 -1.05 0.00 0.00 178.16 177.03 2qlm h TYR 52 N 0.97 -0.18 -0.74 4.88 3.20 -0.93 -1.95 116.97 122.23 2qlm h TYR 52 Ca 0.20 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 2qlm h TYR 52 Cb 0.39 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 2qlm h TYR 52 CO 0.03 -0.12 0.33 0.74 -1.64 0.00 0.00 178.16 177.50 2qlm h PHE 53 N -0.11 1.07 -0.85 -3.82 -1.00 -1.10 0.14 116.94 111.27 2qlm h PHE 53 Ca 0.05 -0.06 0.00 0.00 2.81 0.00 0.00 57.97 60.77 2qlm h PHE 53 Cb 0.17 -0.33 -0.04 0.00 3.61 0.00 0.00 35.95 39.36 2qlm h PHE 53 CO -0.16 0.79 0.54 0.00 -1.61 0.00 0.00 178.31 177.87 2qlm h ALA 54 N 1.31 1.08 -0.14 2.45 0.00 -1.06 -0.83 119.26 122.08 2qlm h ALA 54 Ca 0.25 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2qlm h ALA 54 Cb 0.14 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2qlm h ALA 54 CO -0.03 0.52 -0.02 1.25 0.00 0.00 0.00 179.25 180.97 2qlm h LEU 55 N 1.16 0.25 -0.30 0.00 5.85 -0.74 -2.37 115.31 119.16 2qlm h LEU 55 Ca 0.31 -0.34 0.06 0.00 0.84 0.00 0.00 57.88 58.74 2qlm h LEU 55 Cb -0.09 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 2qlm h LEU 55 CO -0.06 0.54 -0.03 0.00 -0.34 0.00 0.00 178.44 178.55 2qlm h ALA 56 N 0.73 0.24 -0.53 1.25 0.00 -0.54 -0.97 119.26 119.45 2qlm h ALA 56 Ca 0.04 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2qlm h ALA 56 Cb 0.42 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2qlm h ALA 56 CO 0.01 -0.43 0.28 0.45 0.00 0.00 0.00 179.25 179.56 2qlm h HIS 57 N 0.05 0.71 -0.14 0.00 3.86 -1.19 -0.19 115.15 118.26 2qlm h HIS 57 Ca 0.15 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.33 2qlm h HIS 57 Cb 0.21 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.44 2qlm h HIS 57 CO -0.25 0.50 0.00 1.15 0.86 0.00 0.00 177.93 180.20 2qlm h THR 58 N 0.73 1.25 -0.56 2.45 2.02 -0.79 -2.29 112.91 115.72 2qlm h THR 58 Ca 0.19 -0.82 -0.08 0.00 0.77 0.00 0.00 66.41 66.47 2qlm h THR 58 Cb 0.03 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2qlm h THR 58 CO -0.03 0.24 0.05 0.58 0.37 0.00 0.00 175.52 176.73 2qlm h VAL 59 N -0.02 1.26 -0.91 3.16 2.07 -1.05 -2.86 116.25 117.91 2qlm h VAL 59 Ca 0.04 -1.04 0.11 0.00 0.82 0.00 0.00 66.70 66.63 2qlm h VAL 59 Cb 0.37 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 30.90 2qlm h VAL 59 CO 0.01 0.38 0.58 -0.09 0.02 0.00 0.00 177.57 178.47 2qlm h ARG 60 N 0.84 0.82 -0.74 1.57 2.43 -0.98 -1.53 114.38 116.80 2qlm h ARG 60 Ca 0.17 -0.05 0.10 0.00 -0.81 0.00 0.00 59.98 59.39 2qlm h ARG 60 Cb 0.47 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 29.79 2qlm h ARG 60 CO 0.02 0.54 0.49 -0.44 -1.51 0.00 0.00 179.97 179.07 2qlm h ASP 61 N 0.85 0.57 1.08 -3.80 3.45 -1.17 -1.47 116.42 115.93 2qlm h ASP 61 Ca 0.44 0.02 -0.00 0.00 0.43 0.00 0.00 57.03 57.91 2qlm h ASP 61 Cb 0.52 -0.10 -0.00 0.00 -0.56 0.00 0.00 39.33 39.18 2qlm h ASP 61 CO -0.20 0.34 -0.01 0.45 -1.57 0.00 0.00 179.24 178.24 2qlm h HIS 62 N 0.63 0.00 0.05 4.55 3.86 -1.34 -3.05 115.15 119.85 2qlm h HIS 62 Ca 0.35 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.32 2qlm h HIS 62 Cb 0.50 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.96 2qlm h HIS 62 CO -0.00 0.01 -1.03 -0.07 0.86 0.00 0.00 177.93 177.70 2qlm h LEU 63 N 0.00 0.34 0.04 2.43 3.38 -1.27 -3.41 115.31 116.82 2qlm h LEU 63 Ca -0.00 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.67 2qlm h LEU 63 Cb 0.56 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 2qlm h LEU 63 CO 0.00 1.17 -0.17 0.58 0.09 0.00 0.00 178.44 180.12 2qlm h VAL 64 N 0.11 0.61 -0.49 1.22 2.07 -1.45 0.84 116.25 119.16 2qlm h VAL 64 Ca -0.08 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 2qlm h VAL 64 Cb 1.71 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 32.05 2qlm h VAL 64 CO 0.16 0.00 0.24 1.23 0.02 0.00 0.00 177.57 179.22 2qlm h GLY 65 N -0.30 0.68 1.23 2.17 0.00 -1.79 -1.12 103.07 103.94 2qlm h GLY 65 Ca 0.04 -0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 2qlm h GLY 65 CO -0.13 0.10 0.07 3.21 0.00 0.00 0.00 176.54 179.79 2qlm h ARG 66 N 0.47 0.95 -0.15 4.80 3.08 -1.65 -1.89 114.38 119.98 2qlm h ARG 66 Ca 0.22 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 2qlm h ARG 66 Cb 0.14 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2qlm h ARG 66 CO -0.16 0.89 0.05 2.35 -1.07 0.00 0.00 179.97 182.04 2qlm h TRP 67 N 0.89 0.24 -0.42 3.04 7.01 -0.33 -0.40 115.95 125.98 2qlm h TRP 67 Ca 0.18 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.15 2qlm h TRP 67 Cb 0.42 -0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.39 2qlm h TRP 67 CO 0.03 0.33 0.22 0.82 -2.79 0.00 0.00 178.44 177.05 2qlm h ILE 68 N 0.08 1.16 0.00 2.65 2.04 -1.15 -2.69 117.51 119.60 2qlm h ILE 68 Ca 0.05 -0.43 -0.12 0.00 1.00 0.00 0.00 64.86 65.36 2qlm h ILE 68 Cb 0.20 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2qlm h ILE 68 CO -0.00 0.17 -0.56 0.08 0.00 0.00 0.00 178.15 177.84 2qlm h ARG 69 N 0.54 0.00 -0.26 2.37 0.11 -1.28 -2.04 114.38 113.83 2qlm h ARG 69 Ca 0.15 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.21 2qlm h ARG 69 Cb 0.07 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.14 2qlm h ARG 69 CO -0.02 0.56 0.08 1.15 0.10 0.00 0.00 179.97 181.84 2qlm h THR 70 N 0.00 1.19 -0.44 0.08 2.02 -1.03 -0.54 112.91 114.20 2qlm h THR 70 Ca -0.01 -0.61 -0.12 0.00 0.77 0.00 0.00 66.41 66.45 2qlm h THR 70 Cb 1.27 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.78 2qlm h THR 70 CO 0.07 0.20 -0.19 1.56 0.37 0.00 0.00 175.52 177.53 2qlm h GLN 71 N 0.25 0.86 -0.10 6.66 1.08 -1.42 -2.05 115.11 120.40 2qlm h GLN 71 Ca 0.08 -0.34 -0.10 0.00 -1.45 0.00 0.00 58.65 56.84 2qlm h GLN 71 Cb 0.23 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 2qlm h GLN 71 CO -0.00 0.98 -0.37 -0.56 -0.95 0.00 0.00 178.83 177.93 2qlm h GLN 72 N 0.76 0.21 -0.21 1.46 3.07 -1.36 -2.54 115.11 116.50 2qlm h GLN 72 Ca 0.11 -0.09 0.00 0.00 0.09 0.00 0.00 58.65 58.76 2qlm h GLN 72 Cb 0.73 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.27 2qlm h GLN 72 CO 0.06 0.55 0.13 1.25 0.09 0.00 0.00 178.83 180.91 2qlm h HIS 73 N 0.18 0.27 -0.27 0.06 2.76 -0.72 -2.15 115.15 115.29 2qlm h HIS 73 Ca 0.02 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 2qlm h HIS 73 Cb 0.73 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.59 2qlm h HIS 73 CO 0.01 0.19 0.06 1.88 -1.30 0.00 0.00 177.93 178.77 2qlm h TYR 74 N 0.27 0.38 -0.39 5.26 0.05 -1.24 -0.73 116.97 120.58 2qlm h TYR 74 Ca 0.08 -0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.78 2qlm h TYR 74 Cb -0.01 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 37.60 2qlm h TYR 74 CO -0.06 0.35 -0.01 -0.92 -1.05 0.00 0.00 178.16 176.48 2qlm h TYR 75 N 0.38 0.75 -0.05 4.88 3.20 -1.17 0.42 116.97 125.38 2qlm h TYR 75 Ca 0.09 -0.13 -0.04 0.00 3.14 0.00 0.00 58.73 61.79 2qlm h TYR 75 Cb 0.16 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.24 2qlm h TYR 75 CO 0.00 0.78 -0.13 0.93 -1.64 0.00 0.00 178.16 178.10 2qlm h GLU 76 N 0.51 0.19 0.00 1.82 4.39 -1.03 -3.29 114.58 117.16 2qlm h GLU 76 Ca 0.11 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 2qlm h GLU 76 Cb 0.48 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2qlm h GLU 76 CO 0.02 0.73 -0.20 0.87 -1.16 0.00 0.00 179.01 179.27 2qlm h LYS 77 N -0.33 0.00 -6.74 2.33 1.57 -1.22 -3.48 116.57 108.70 2qlm h LYS 77 Ca -0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 2qlm h LYS 77 Cb 0.73 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 2qlm h LYS 77 CO 0.03 0.20 -0.98 -3.47 -0.57 0.00 0.00 179.45 174.66 2qlm n ASP 78 N -3.18 -3.23 -4.57 0.86 2.03 0.14 -4.97 116.55 103.63 2qlm n ASP 78 Ca 0.02 -1.20 -0.29 0.00 0.52 0.00 0.00 54.79 53.84 2qlm n ASP 78 Cb 0.56 -2.23 0.15 0.00 -0.72 0.00 0.00 41.12 38.88 2qlm n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2qlm s PRO 79 N -6.99 0.99 0.22 -0.67 0.04 -1.26 -4.98 135.00 122.36 2qlm s PRO 79 Ca 0.36 0.05 -0.31 0.00 0.04 0.00 0.00 61.00 61.14 2qlm s PRO 79 Cb -0.18 -1.84 -0.11 0.00 0.04 0.00 0.00 34.50 32.41 2qlm s PRO 79 CO 0.94 -2.25 1.55 0.21 0.04 0.00 0.00 177.00 177.50 2qlm s LYS 80 N -5.51 4.20 -0.12 4.56 2.20 -1.26 -4.95 119.74 118.86 2qlm s LYS 80 Ca 0.66 2.42 -0.09 0.00 -0.36 0.00 0.00 55.97 58.60 2qlm s LYS 80 Cb -0.11 -3.10 -0.04 0.00 -1.51 0.00 0.00 37.83 33.06 2qlm s LYS 80 CO 0.52 -0.57 0.18 1.03 -0.36 0.00 0.00 175.35 176.15 2qlm s ARG 81 N 0.34 3.67 -0.22 4.03 1.81 -0.14 -4.53 118.95 123.91 2qlm s ARG 81 Ca 0.66 -0.06 -0.09 0.00 -1.72 0.00 0.00 55.73 54.52 2qlm s ARG 81 Cb -0.45 -3.24 -0.04 0.00 -0.45 0.00 0.00 34.95 30.76 2qlm s ARG 81 CO 0.38 0.66 0.11 0.42 -0.68 0.00 0.00 175.30 176.20 2qlm s ILE 82 N -0.73 5.04 -0.31 1.52 -1.09 -0.36 -1.23 121.20 124.05 2qlm s ILE 82 Ca 0.15 0.07 -0.01 0.00 -2.23 0.00 0.00 60.65 58.63 2qlm s ILE 82 Cb -0.13 -3.32 0.06 0.00 -1.58 0.00 0.00 42.46 37.49 2qlm s ILE 82 CO 0.04 0.39 0.00 -0.31 -1.23 0.00 0.00 174.94 173.83 2qlm s TYR 83 N 0.84 3.33 -0.47 3.97 2.02 0.11 -0.95 117.35 126.20 2qlm s TYR 83 Ca 0.06 -2.08 -0.18 0.00 -0.37 0.00 0.00 57.07 54.50 2qlm s TYR 83 Cb -0.13 -2.23 0.05 0.00 -0.40 0.00 0.00 41.96 39.24 2qlm s TYR 83 CO 0.02 -0.84 0.52 -0.47 -1.57 0.00 0.00 175.55 173.21 2qlm s TYR 84 N 1.19 3.13 -0.25 2.71 5.04 -0.43 -0.39 117.35 128.35 2qlm s TYR 84 Ca -0.04 -0.52 -0.12 0.00 -2.44 0.00 0.00 57.07 53.95 2qlm s TYR 84 Cb -0.20 -3.23 -0.05 0.00 0.35 0.00 0.00 41.96 38.83 2qlm s TYR 84 CO -0.02 -0.86 0.24 -0.51 -1.34 0.00 0.00 175.55 173.06 2qlm s LEU 85 N 2.28 4.08 -0.09 6.97 1.02 -0.14 -1.59 118.68 131.21 2qlm s LEU 85 Ca 0.12 0.18 -0.11 0.00 0.02 0.00 0.00 54.13 54.34 2qlm s LEU 85 Cb -0.19 -2.23 0.03 0.00 0.02 0.00 0.00 46.19 43.82 2qlm s LEU 85 CO 0.12 -0.03 0.29 -0.55 0.02 0.00 0.00 176.35 176.20 2qlm s SER 86 N 1.33 -0.27 0.00 2.29 0.15 -0.93 -1.44 113.70 114.83 2qlm s SER 86 Ca 0.11 0.46 0.29 0.00 0.70 0.00 0.00 55.95 57.50 2qlm s SER 86 Cb -0.15 0.53 1.26 0.00 -1.71 0.00 0.00 66.02 65.96 2qlm s SER 86 CO 0.08 -0.18 1.92 0.18 1.20 0.00 0.00 173.24 176.44 2qlm n LEU 87 N 2.53 0.06 -3.95 3.45 7.99 -1.26 -4.13 117.00 121.69 2qlm n LEU 87 Ca -0.15 0.38 -0.20 0.00 -0.01 0.00 0.00 56.01 56.03 2qlm n LEU 87 Cb 0.57 -0.41 -0.16 0.00 -0.11 0.00 0.00 43.42 43.32 2qlm n LEU 87 CO 0.18 0.01 -0.42 -1.61 -1.51 0.00 0.00 177.39 174.04 2qlm s GLU 88 N -2.86 0.91 -0.31 3.23 2.02 -1.26 -4.68 118.70 115.74 2qlm s GLU 88 Ca 0.18 -0.21 -0.02 0.00 0.02 0.00 0.00 54.97 54.95 2qlm s GLU 88 Cb 0.19 -0.86 0.10 0.00 0.10 0.00 0.00 34.13 33.66 2qlm s GLU 88 CO 0.52 0.01 0.12 -0.06 0.02 0.00 0.00 175.26 175.88 2qlm s PHE 89 N 0.55 1.11 -1.17 1.61 0.40 -0.18 -4.64 117.98 115.65 2qlm s PHE 89 Ca -0.08 -1.41 -0.16 0.00 -0.60 0.00 0.00 56.93 54.68 2qlm s PHE 89 Cb -0.12 -1.35 0.14 0.00 0.51 0.00 0.00 43.02 42.21 2qlm s PHE 89 CO 0.01 -0.85 1.44 -0.47 0.70 0.00 0.00 175.22 176.04 2qlm s TYR 90 N 1.74 3.29 0.06 0.36 6.14 -0.04 -3.55 117.35 125.35 2qlm s TYR 90 Ca 0.10 -1.89 0.04 0.00 0.64 0.00 0.00 57.07 55.97 2qlm s TYR 90 Cb -0.17 -4.40 -0.24 0.00 0.42 0.00 0.00 41.96 37.57 2qlm s TYR 90 CO -0.28 -1.50 1.07 0.52 0.64 0.00 0.00 175.55 176.01 2qlm h MET 91 N 7.59 0.09 0.00 4.97 2.86 -1.74 -3.42 114.93 125.28 2qlm h MET 91 Ca 0.31 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2qlm h MET 91 Cb 0.90 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.62 2qlm h MET 91 CO 1.27 0.96 0.00 0.41 1.06 0.00 0.00 176.91 180.61 2qlm n GLY 92 N 1.47 0.39 3.86 8.32 0.00 -0.82 -4.82 105.19 113.59 2qlm n GLY 92 Ca -0.07 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 44.80 2qlm n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qlm s ARG 93 N 0.00 3.80 -0.04 1.61 0.52 -1.26 -1.60 118.95 121.98 2qlm s ARG 93 Ca 0.00 0.69 0.07 0.00 -0.52 0.00 0.00 55.73 55.97 2qlm s ARG 93 Cb 0.00 -2.24 -0.11 0.00 0.52 0.00 0.00 34.95 33.13 2qlm s ARG 93 CO 0.00 -0.23 0.10 2.41 0.02 0.00 0.00 175.30 177.60 2qlm n THR 94 N -1.71 0.27 0.31 0.02 -1.04 -1.26 -4.68 114.28 106.20 2qlm n THR 94 Ca 0.04 -0.25 -0.17 0.00 -2.04 0.00 0.00 64.05 61.64 2qlm n THR 94 Cb 0.54 -0.28 -0.09 0.00 -1.82 0.00 0.00 70.33 68.68 2qlm n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2qlm h LEU 95 N 0.00 -0.64 -0.53 -4.42 5.85 -1.96 -1.10 115.31 112.51 2qlm h LEU 95 Ca -0.11 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.54 2qlm h LEU 95 Cb 0.94 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 2qlm h LEU 95 CO 0.01 -0.43 0.02 -0.61 -0.34 0.00 0.00 178.44 177.08 2qlm h GLN 96 N -0.79 0.92 -0.96 1.25 4.15 -1.96 -2.21 115.11 115.52 2qlm h GLN 96 Ca -0.08 -0.29 0.06 0.00 0.77 0.00 0.00 58.65 59.12 2qlm h GLN 96 Cb 0.59 -0.09 -0.06 0.00 0.21 0.00 0.00 27.48 28.13 2qlm h GLN 96 CO 0.13 0.93 0.61 -0.97 -1.93 0.00 0.00 178.83 177.60 2qlm h ASN 97 N 0.80 0.98 -0.34 -0.69 -0.73 -1.81 -0.24 115.58 113.54 2qlm h ASN 97 Ca 0.15 0.01 -0.06 0.00 1.87 0.00 0.00 56.30 58.27 2qlm h ASN 97 Cb 0.51 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.88 2qlm h ASN 97 CO 0.02 0.63 -0.01 0.74 -0.37 0.00 0.00 177.43 178.44 2qlm h THR 98 N 1.12 1.26 -0.35 -3.57 2.02 -0.95 -2.11 112.91 110.34 2qlm h THR 98 Ca 0.41 -1.00 0.00 0.00 0.77 0.00 0.00 66.41 66.59 2qlm h THR 98 Cb 0.15 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 2qlm h THR 98 CO -0.17 0.33 0.23 0.24 0.37 0.00 0.00 175.52 176.52 2qlm h MET 99 N 0.42 0.46 -0.20 6.66 2.86 -0.97 -1.85 114.93 122.31 2qlm h MET 99 Ca 0.10 -0.03 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 2qlm h MET 99 Cb 0.47 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.00 2qlm h MET 99 CO 0.02 0.31 -0.03 0.28 1.06 0.00 0.00 176.91 178.56 2qlm h VAL 100 N 0.47 0.83 0.00 -2.22 2.07 -0.99 0.38 116.25 116.78 2qlm h VAL 100 Ca 0.13 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.64 2qlm h VAL 100 Cb -0.04 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2qlm h VAL 100 CO -0.03 0.00 0.00 0.78 0.02 0.00 0.00 177.57 178.35 2qlm h ASN 101 N 0.03 0.00 -0.19 0.57 4.21 -1.24 -2.83 115.58 116.14 2qlm h ASN 101 Ca 0.09 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.60 2qlm h ASN 101 Cb 0.13 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.33 2qlm h ASN 101 CO -0.19 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.13 2qlm n LEU 102 N -2.81 2.89 -3.64 1.61 4.32 -0.71 -0.91 117.00 117.76 2qlm n LEU 102 Ca 0.02 -1.28 -0.26 0.00 -0.02 0.00 0.00 56.01 54.47 2qlm n LEU 102 Cb 0.32 -0.11 0.06 0.00 -1.62 0.00 0.00 43.42 42.07 2qlm n LEU 102 CO 0.26 0.58 0.18 0.00 -1.22 0.00 0.00 177.39 177.19 2qlm n ALA 103 N 1.14 -1.26 0.58 -1.18 0.00 -0.28 -4.91 120.51 114.59 2qlm n ALA 103 Ca 0.14 0.33 0.06 0.00 0.00 0.00 0.00 53.44 53.97 2qlm n ALA 103 Cb 0.50 -5.02 -0.03 0.00 0.00 0.00 0.00 19.45 14.90 2qlm n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qlm n LEU 104 N -4.80 1.03 -0.06 0.00 4.32 -0.03 -4.48 117.00 112.98 2qlm n LEU 104 Ca 0.01 -0.64 -0.08 0.00 -0.02 0.00 0.00 56.01 55.27 2qlm n LEU 104 Cb 0.55 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.34 2qlm n LEU 104 CO 0.66 0.22 0.92 -0.08 -1.22 0.00 0.00 177.39 177.89 2qlm h GLU 105 N 0.78 0.20 -0.50 3.23 4.81 -1.63 -0.05 114.58 121.41 2qlm h GLU 105 Ca 0.00 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 2qlm h GLU 105 Cb 0.37 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2qlm h GLU 105 CO 0.00 0.13 -0.19 -0.91 -0.73 0.00 0.00 179.01 177.31 2qlm h ASN 106 N 0.20 1.04 -0.29 1.04 2.35 -1.53 -1.13 115.58 117.26 2qlm h ASN 106 Ca 0.11 -0.38 -0.01 0.00 -0.55 0.00 0.00 56.30 55.47 2qlm h ASN 106 Cb 0.07 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 2qlm h ASN 106 CO -0.11 1.18 0.15 0.00 -1.65 0.00 0.00 177.43 177.00 2qlm h ALA 107 N 0.89 0.37 -0.47 -0.83 0.00 -1.55 -0.70 119.26 116.97 2qlm h ALA 107 Ca 0.12 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2qlm h ALA 107 Cb 0.77 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2qlm h ALA 107 CO 0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 179.25 179.23 2qlm h ASP 109 N 0.73 0.41 -0.10 0.00 3.58 -0.97 -1.20 116.42 118.88 2qlm h ASP 109 Ca 0.14 -0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 2qlm h ASP 109 Cb 0.45 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.39 2qlm h ASP 109 CO 0.02 0.44 0.02 -0.08 -2.88 0.00 0.00 179.24 176.76 2qlm h GLU 110 N 0.35 0.16 -0.50 0.28 4.57 -0.99 -1.35 114.58 117.10 2qlm h GLU 110 Ca 0.10 -0.04 0.07 0.00 -1.18 0.00 0.00 59.36 58.31 2qlm h GLU 110 Cb 0.15 -0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.66 2qlm h GLU 110 CO -0.01 0.35 0.17 0.00 -1.18 0.00 0.00 179.01 178.34 2qlm h ALA 111 N 0.81 0.61 -0.29 2.92 0.00 -0.87 -1.09 119.26 121.34 2qlm h ALA 111 Ca 0.03 0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 2qlm h ALA 111 Cb 0.26 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2qlm h ALA 111 CO 0.00 -0.22 -0.48 1.79 0.00 0.00 0.00 179.25 180.34 2qlm h THR 112 N 0.35 1.29 -0.47 0.00 1.35 -1.21 -2.54 112.91 111.67 2qlm h THR 112 Ca 0.24 -1.67 0.06 0.00 -0.55 0.00 0.00 66.41 64.49 2qlm h THR 112 Cb 0.26 1.57 -0.05 0.00 -1.73 0.00 0.00 68.15 68.20 2qlm h THR 112 CO -0.25 0.54 0.16 0.22 -0.25 0.00 0.00 175.52 175.94 2qlm h TYR 113 N 0.63 0.27 0.00 4.73 3.20 -0.86 0.21 116.97 125.15 2qlm h TYR 113 Ca 0.03 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.87 2qlm h TYR 113 Cb 1.06 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 2qlm h TYR 113 CO 0.06 0.09 -0.27 1.96 -1.64 0.00 0.00 178.16 178.36 2qlm h GLN 114 N 0.32 0.00 0.00 1.82 4.20 -1.13 -0.83 115.11 119.49 2qlm h GLN 114 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 2qlm h GLN 114 Cb 0.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2qlm h GLN 114 CO -0.24 0.27 0.00 1.28 -0.67 0.00 0.00 178.83 179.47 2qlm n LEU 115 N -4.04 0.00 0.00 1.46 4.32 -0.82 -4.91 117.00 113.01 2qlm n LEU 115 Ca -0.02 0.06 0.00 0.00 -0.02 0.00 0.00 56.01 56.04 2qlm n LEU 115 Cb 0.33 -0.06 0.00 0.00 -1.62 0.00 0.00 43.42 42.07 2qlm n LEU 115 CO 0.36 -0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.14 2qlm n GLY 116 N 1.05 0.57 3.33 -0.72 0.00 -0.32 -5.07 105.19 104.04 2qlm n GLY 116 Ca 0.22 -0.81 -0.24 0.00 0.00 0.00 0.00 46.02 45.19 2qlm n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qlm s LEU 117 N 0.00 2.36 -0.33 0.99 1.43 0.65 -4.99 118.68 118.79 2qlm s LEU 117 Ca 0.00 -0.77 -0.10 0.00 -1.03 0.00 0.00 54.13 52.22 2qlm s LEU 117 Cb 0.00 -0.95 -0.00 0.00 0.03 0.00 0.00 46.19 45.27 2qlm s LEU 117 CO 0.00 0.06 0.18 -0.62 0.23 0.00 0.00 176.35 176.19 2qlm s ASP 118 N -2.26 5.67 0.32 2.29 3.68 -1.26 -3.01 116.67 122.10 2qlm s ASP 118 Ca 0.12 -0.61 0.02 0.00 2.13 0.00 0.00 52.55 54.20 2qlm s ASP 118 Cb -0.08 -2.03 0.54 0.00 -1.45 0.00 0.00 42.92 39.90 2qlm s ASP 118 CO 0.06 -0.24 1.90 -0.03 0.13 0.00 0.00 175.17 176.99 2qlm h MET 119 N 8.39 0.73 -0.65 4.34 1.85 -1.92 -2.58 114.93 125.10 2qlm h MET 119 Ca -0.31 -0.11 -0.03 0.00 -0.61 0.00 0.00 59.70 58.64 2qlm h MET 119 Cb 1.14 -0.13 -0.03 0.00 0.43 0.00 0.00 31.60 33.01 2qlm h MET 119 CO 0.63 0.62 0.28 0.93 -0.40 0.00 0.00 176.91 178.98 2qlm h GLU 120 N 0.72 0.93 -0.43 0.39 5.08 -1.99 0.37 114.58 119.66 2qlm h GLU 120 Ca 0.17 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 2qlm h GLU 120 Cb 0.18 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2qlm h GLU 120 CO -0.01 0.74 0.10 1.49 -1.00 0.00 0.00 179.01 180.33 2qlm h GLU 121 N 0.92 0.69 -0.53 2.33 4.81 -1.91 -2.88 114.58 118.02 2qlm h GLU 121 Ca 0.22 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 2qlm h GLU 121 Cb 0.14 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2qlm h GLU 121 CO -0.02 0.70 0.10 -0.07 -0.73 0.00 0.00 179.01 178.99 2qlm h LEU 122 N 0.56 0.78 -1.37 1.64 4.07 -1.08 -2.88 115.31 117.02 2qlm h LEU 122 Ca 0.13 -0.15 -0.02 0.00 0.08 0.00 0.00 57.88 57.92 2qlm h LEU 122 Cb 0.32 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 2qlm h LEU 122 CO 0.00 0.78 0.15 -0.33 -1.08 0.00 0.00 178.44 177.96 2qlm h GLU 123 N 0.79 0.58 0.00 1.13 5.08 -0.81 -2.72 114.58 118.64 2qlm h GLU 123 Ca 0.17 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2qlm h GLU 123 Cb 0.33 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2qlm h GLU 123 CO 0.00 0.49 0.00 0.93 -1.00 0.00 0.00 179.01 179.43 2qlm h GLU 124 N 0.58 0.00 0.00 2.33 4.39 -1.29 -3.01 114.58 117.57 2qlm h GLU 124 Ca 0.14 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.71 2qlm h GLU 124 Cb 0.14 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2qlm h GLU 124 CO -0.01 0.00 -0.61 0.82 -1.16 0.00 0.00 179.01 178.05 2qlm h ILE 125 N 0.00 1.10 -3.12 3.13 2.04 -1.56 -3.46 117.51 115.65 2qlm h ILE 125 Ca 0.00 -2.41 -0.53 0.00 1.00 0.00 0.00 64.86 62.92 2qlm h ILE 125 Cb 0.32 2.45 0.05 0.00 -0.74 0.00 0.00 36.82 38.89 2qlm h ILE 125 CO 0.00 0.60 0.79 -0.70 0.00 0.00 0.00 178.15 178.84 2qlm s GLU 126 N -3.02 4.26 0.28 2.37 2.12 -1.14 -5.00 118.70 118.58 2qlm s GLU 126 Ca 0.02 2.28 -0.29 0.00 0.36 0.00 0.00 54.97 57.35 2qlm s GLU 126 Cb 0.09 -3.15 -0.09 0.00 0.26 0.00 0.00 34.13 31.24 2qlm s GLU 126 CO 0.76 -0.48 1.05 -1.21 -0.54 0.00 0.00 175.26 174.83 2qlm s GLU 127 N 0.41 4.64 0.32 4.30 0.41 -1.26 -4.96 118.70 122.55 2qlm s GLU 127 Ca 0.64 1.67 -0.29 0.00 -0.41 0.00 0.00 54.97 56.58 2qlm s GLU 127 Cb -0.42 -3.12 -0.11 0.00 -1.78 0.00 0.00 34.13 28.70 2qlm s GLU 127 CO 0.37 0.25 1.48 -0.51 -0.49 0.00 0.00 175.26 176.36 2qlm s ASP 128 N -1.06 6.48 -0.91 -0.19 1.11 -1.26 -4.59 116.67 116.24 2qlm s ASP 128 Ca 0.45 2.88 -0.24 0.00 0.18 0.00 0.00 52.55 55.82 2qlm s ASP 128 Cb -0.29 -2.65 0.04 0.00 1.07 0.00 0.00 42.92 41.10 2qlm s ASP 128 CO 0.37 -0.80 1.38 0.00 1.18 0.00 0.00 175.17 177.30 2qlm s ALA 129 N -0.55 2.73 -0.91 5.23 0.00 -0.63 -4.90 121.76 122.73 2qlm s ALA 129 Ca 0.57 -1.93 -0.03 0.00 0.00 0.00 0.00 51.96 50.57 2qlm s ALA 129 Cb -0.45 -4.42 0.23 0.00 0.00 0.00 0.00 23.12 18.48 2qlm s ALA 129 CO 0.53 -3.49 2.21 0.41 0.00 0.00 0.00 175.76 175.41 2qlm n GLY 130 N 6.31 5.39 1.88 0.00 0.00 -1.26 -1.95 105.19 115.56 2qlm n GLY 130 Ca 0.22 -2.29 -0.16 0.00 0.00 0.00 0.00 46.02 43.78 2qlm n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qlm n LEU 131 N 0.37 6.43 -3.56 0.99 4.77 -1.23 -0.53 117.00 124.24 2qlm n LEU 131 Ca 0.53 -3.27 -0.10 0.00 -0.03 0.00 0.00 56.01 53.14 2qlm n LEU 131 Cb 0.31 -1.06 -0.02 0.00 -2.33 0.00 0.00 43.42 40.32 2qlm n LEU 131 CO 0.51 1.22 0.44 -0.83 -1.33 0.00 0.00 177.39 177.39 2qlm s GLY 132 N 0.25 -0.45 -0.13 -0.72 0.00 -1.26 -1.01 107.32 104.00 2qlm s GLY 132 Ca 0.30 0.27 -0.16 0.00 0.00 0.00 0.00 44.72 45.12 2qlm s GLY 132 CO -0.00 0.09 0.48 3.43 0.00 0.00 0.00 173.10 177.09 2qlm h ASN 133 N 2.00 0.30 0.00 1.64 2.35 -1.91 -3.41 115.58 116.55 2qlm h ASN 133 Ca -0.29 -0.81 0.00 0.00 -0.55 0.00 0.00 56.30 54.65 2qlm h ASN 133 Cb 1.29 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2qlm h ASN 133 CO 0.33 1.60 0.00 0.61 -1.65 0.00 0.00 177.43 178.32 2qlm n GLY 134 N 1.71 0.52 0.22 2.83 0.00 -1.26 -4.93 105.19 104.28 2qlm n GLY 134 Ca -0.27 0.48 -0.09 0.00 0.00 0.00 0.00 46.02 46.15 2qlm n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2qlm h GLY 135 N 0.00 0.74 0.97 -0.02 0.00 -1.98 -0.69 103.07 102.10 2qlm h GLY 135 Ca 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 2qlm h GLY 135 CO 0.00 0.38 0.22 -2.00 0.00 0.00 0.00 176.54 175.15 2qlm h LEU 136 N 0.60 0.70 -0.63 3.11 6.46 -1.99 -0.36 115.31 123.19 2qlm h LEU 136 Ca 0.15 -0.15 -0.14 0.00 -0.12 0.00 0.00 57.88 57.61 2qlm h LEU 136 Cb 0.21 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.95 2qlm h LEU 136 CO -0.01 0.66 -0.49 1.23 -0.62 0.00 0.00 178.44 179.21 2qlm h GLY 137 N 0.69 0.52 1.82 3.75 0.00 -1.78 -2.95 103.07 105.13 2qlm h GLY 137 Ca 0.17 -0.57 -0.16 0.00 0.00 0.00 0.00 47.33 46.77 2qlm h GLY 137 CO -0.02 0.51 -0.72 -0.09 0.00 0.00 0.00 176.54 176.23 2qlm h ARG 138 N 0.38 0.17 -0.61 4.80 9.65 -1.00 -0.03 114.38 127.74 2qlm h ARG 138 Ca 0.02 -0.15 -0.00 0.00 -1.10 0.00 0.00 59.98 58.75 2qlm h ARG 138 Cb 1.00 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.58 2qlm h ARG 138 CO 0.09 0.82 0.37 1.25 2.80 0.00 0.00 179.97 185.30 2qlm h LEU 139 N 0.11 0.73 -0.93 3.80 5.85 -0.99 -0.98 115.31 122.91 2qlm h LEU 139 Ca -0.02 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.67 2qlm h LEU 139 Cb 1.27 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 42.06 2qlm h LEU 139 CO 0.11 0.58 0.61 0.00 -0.34 0.00 0.00 178.44 179.39 2qlm h ALA 140 N 1.19 1.21 -0.21 1.25 0.00 -1.48 -0.16 119.26 121.06 2qlm h ALA 140 Ca 0.22 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2qlm h ALA 140 Cb -0.03 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 2qlm h ALA 140 CO -0.04 0.51 -0.03 0.00 0.00 0.00 0.00 179.25 179.69 2qlm h ALA 141 N 1.37 0.29 -0.97 0.00 0.00 -1.30 -1.47 119.26 117.17 2qlm h ALA 141 Ca 0.36 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2qlm h ALA 141 Cb -0.06 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 2qlm h ALA 141 CO -0.10 0.06 0.63 0.00 0.00 0.00 0.00 179.25 179.83 2qlm h PHE 143 N 1.33 1.00 -0.55 0.00 -1.00 -0.84 -2.03 116.94 114.86 2qlm h PHE 143 Ca 0.35 -0.05 0.02 0.00 2.81 0.00 0.00 57.97 61.10 2qlm h PHE 143 Cb -0.12 -0.31 -0.03 0.00 3.61 0.00 0.00 35.95 39.10 2qlm h PHE 143 CO 0.00 0.75 0.35 -0.07 -1.61 0.00 0.00 178.31 177.72 2qlm h LEU 144 N 0.97 0.58 -0.57 1.54 3.38 -1.01 -0.50 115.31 119.70 2qlm h LEU 144 Ca 0.24 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2qlm h LEU 144 Cb 0.12 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2qlm h LEU 144 CO -0.03 0.41 0.35 -0.78 0.09 0.00 0.00 178.44 178.49 2qlm h ASP 145 N 0.69 0.67 -0.36 -0.43 3.58 -1.26 -2.45 116.42 116.86 2qlm h ASP 145 Ca 0.21 -0.04 -0.15 0.00 0.42 0.00 0.00 57.03 57.46 2qlm h ASP 145 Cb -0.03 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.85 2qlm h ASP 145 CO -0.07 0.51 -0.36 0.28 -2.88 0.00 0.00 179.24 176.72 2qlm h SER 146 N 0.77 0.97 -0.62 2.28 0.02 -1.07 -1.69 113.55 114.20 2qlm h SER 146 Ca 0.21 -0.43 -0.04 0.00 -0.84 0.00 0.00 61.79 60.69 2qlm h SER 146 Cb -0.04 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.19 2qlm h SER 146 CO -0.04 1.22 0.26 0.24 -1.14 0.00 0.00 176.83 177.37 2qlm h MET 147 N 0.75 0.96 -0.25 3.45 2.86 -0.99 0.11 114.93 121.82 2qlm h MET 147 Ca 0.07 -0.16 -0.07 0.00 -2.06 0.00 0.00 59.70 57.48 2qlm h MET 147 Cb 0.95 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.44 2qlm h MET 147 CO 0.09 0.79 -0.11 0.00 1.06 0.00 0.00 176.91 178.74 2qlm h ALA 148 N 1.34 0.35 -0.19 6.32 0.00 -1.39 -0.10 119.26 125.59 2qlm h ALA 148 Ca 0.22 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2qlm h ALA 148 Cb 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2qlm h ALA 148 CO -0.02 0.21 -0.03 1.15 0.00 0.00 0.00 179.25 180.56 2qlm h THR 149 N 0.25 1.14 -0.54 0.00 2.02 -0.96 -2.29 112.91 112.53 2qlm h THR 149 Ca 0.06 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.68 2qlm h THR 149 Cb 0.61 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 2qlm h THR 149 CO 0.04 0.18 0.00 0.18 0.37 0.00 0.00 175.52 176.29 2qlm n LEU 150 N -4.35 3.65 -2.78 2.58 4.77 0.35 -4.74 117.00 116.48 2qlm n LEU 150 Ca -0.00 -1.84 -0.20 0.00 -0.03 0.00 0.00 56.01 53.94 2qlm n LEU 150 Cb 0.20 -0.48 0.04 0.00 -2.33 0.00 0.00 43.42 40.85 2qlm n LEU 150 CO 0.37 0.70 0.02 0.61 -1.33 0.00 0.00 177.39 177.76 2qlm n GLY 151 N 1.12 -0.40 3.84 -0.72 0.00 -0.86 -0.33 105.19 107.84 2qlm n GLY 151 Ca 0.20 0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.91 2qlm n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qlm s LEU 152 N -6.11 4.42 -1.28 0.99 1.43 -0.08 -4.65 118.68 113.39 2qlm s LEU 152 Ca 0.30 1.00 -0.18 0.00 -1.03 0.00 0.00 54.13 54.22 2qlm s LEU 152 Cb -0.13 -2.91 0.01 0.00 0.03 0.00 0.00 46.19 43.19 2qlm s LEU 152 CO 0.37 0.22 1.96 0.00 0.23 0.00 0.00 176.35 179.13 2qlm n ALA 153 N 1.31 4.02 -2.47 4.21 0.00 -1.26 -4.65 120.51 121.66 2qlm n ALA 153 Ca -0.10 -3.69 -0.31 0.00 0.00 0.00 0.00 53.44 49.35 2qlm n ALA 153 Cb 0.52 -3.57 -0.12 0.00 0.00 0.00 0.00 19.45 16.27 2qlm n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qlm s ALA 154 N 4.81 2.64 -0.05 0.00 0.00 -1.26 -1.22 121.76 126.68 2qlm s ALA 154 Ca 0.54 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 51.33 2qlm s ALA 154 Cb 0.08 -0.77 0.01 0.00 0.00 0.00 0.00 23.12 22.45 2qlm s ALA 154 CO 0.03 0.58 -0.10 0.71 0.00 0.00 0.00 175.76 176.98 2qlm s TYR 155 N -0.95 1.20 -0.11 0.00 2.02 -0.12 -4.04 117.35 115.35 2qlm s TYR 155 Ca 0.15 -0.41 -0.18 0.00 -0.37 0.00 0.00 57.07 56.27 2qlm s TYR 155 Cb -0.11 -0.91 -0.04 0.00 -0.40 0.00 0.00 41.96 40.50 2qlm s TYR 155 CO 0.06 -0.23 0.46 0.20 -1.57 0.00 0.00 175.55 174.47 2qlm s GLY 156 N 0.69 2.39 -0.10 0.71 0.00 -0.92 -1.31 107.32 108.78 2qlm s GLY 156 Ca -0.13 -0.20 0.03 0.00 0.00 0.00 0.00 44.72 44.42 2qlm s GLY 156 CO 0.02 0.71 -0.19 -0.19 0.00 0.00 0.00 173.10 173.46 2qlm s TYR 157 N 0.48 2.16 0.00 1.90 2.02 -0.62 -0.07 117.35 123.22 2qlm s TYR 157 Ca 0.25 -0.93 0.00 0.00 -0.37 0.00 0.00 57.07 56.03 2qlm s TYR 157 Cb -0.15 -1.49 0.00 0.00 -0.40 0.00 0.00 41.96 39.91 2qlm s TYR 157 CO 0.10 -0.42 0.00 0.41 -1.57 0.00 0.00 175.55 174.07 2qlm n GLY 158 N 3.81 3.25 3.47 0.71 0.00 -0.94 -2.19 105.19 113.31 2qlm n GLY 158 Ca -0.20 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 44.78 2qlm n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qlm s ILE 159 N -2.28 3.26 -1.03 -0.61 1.01 -1.26 -1.24 121.20 119.05 2qlm s ILE 159 Ca 0.00 -0.63 -0.20 0.00 0.00 0.00 0.00 60.65 59.82 2qlm s ILE 159 Cb 0.00 -2.33 0.09 0.00 0.01 0.00 0.00 42.46 40.24 2qlm s ILE 159 CO 0.00 0.57 1.35 -0.60 0.00 0.00 0.00 174.94 176.26 2qlm s ARG 160 N -0.35 3.68 0.19 2.79 3.52 -0.28 -4.76 118.95 123.73 2qlm s ARG 160 Ca 0.04 -1.58 -0.30 0.00 -0.13 0.00 0.00 55.73 53.76 2qlm s ARG 160 Cb -0.12 -5.18 -0.08 0.00 -1.56 0.00 0.00 34.95 28.00 2qlm s ARG 160 CO 0.02 -2.01 1.27 0.71 -0.81 0.00 0.00 175.30 174.48 2qlm s TYR 161 N 3.73 3.32 0.27 5.12 2.02 -1.26 -4.75 117.35 125.80 2qlm s TYR 161 Ca 0.41 1.28 0.04 0.00 -0.37 0.00 0.00 57.07 58.44 2qlm s TYR 161 Cb -0.02 -3.54 0.36 0.00 -0.40 0.00 0.00 41.96 38.36 2qlm s TYR 161 CO -0.07 -1.65 1.65 1.49 -1.57 0.00 0.00 175.55 175.39 2qlm h GLU 162 N 5.42 0.32 -4.53 -0.62 4.81 -1.07 -3.41 114.58 115.50 2qlm h GLU 162 Ca -0.44 -0.16 -0.59 0.00 -0.13 0.00 0.00 59.36 58.03 2qlm h GLU 162 Cb 1.21 0.00 -0.36 0.00 0.63 0.00 0.00 28.75 30.23 2qlm h GLU 162 CO 0.77 0.71 -0.82 -0.06 -0.73 0.00 0.00 179.01 178.87 2qlm s PHE 163 N -4.10 2.04 0.00 0.92 0.40 -0.27 -5.39 117.98 111.58 2qlm s PHE 163 Ca -0.05 -1.18 0.00 0.00 -0.60 0.00 0.00 56.93 55.10 2qlm s PHE 163 Cb 0.13 -1.51 0.00 0.00 0.51 0.00 0.00 43.02 42.15 2qlm s PHE 163 CO 0.79 -0.65 0.00 0.41 0.70 0.00 0.00 175.22 176.47 2qlm n GLY 164 N 4.80 0.20 3.69 4.36 0.00 -1.22 -1.83 105.19 115.18 2qlm n GLY 164 Ca -0.15 -1.73 -0.44 0.00 0.00 0.00 0.00 46.02 43.70 2qlm n GLY 164 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qlm n ILE 165 N 0.00 1.01 -1.65 -0.61 0.13 0.31 -4.54 119.36 114.00 2qlm n ILE 165 Ca 0.00 -0.25 -0.39 0.00 -1.10 0.00 0.00 62.75 61.01 2qlm n ILE 165 Cb 0.00 -1.57 0.04 0.00 -0.84 0.00 0.00 39.64 37.27 2qlm n ILE 165 CO 0.00 0.00 0.00 2.22 2.80 0.00 0.00 176.55 181.57 2qlm n PHE 166 N 1.88 1.31 -2.44 9.51 1.16 -1.26 -4.54 117.46 123.08 2qlm n PHE 166 Ca 0.11 0.47 -0.42 0.00 -1.87 0.00 0.00 57.45 55.74 2qlm n PHE 166 Cb 0.33 -2.23 -0.03 0.00 -1.61 0.00 0.00 39.48 35.94 2qlm n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 2qlm s ASN 167 N -0.99 7.13 -0.26 5.98 0.01 -0.41 -4.89 114.94 121.51 2qlm s ASN 167 Ca 0.71 2.05 -0.13 0.00 -0.71 0.00 0.00 52.86 54.78 2qlm s ASN 167 Cb -0.46 -2.59 -0.05 0.00 0.41 0.00 0.00 41.25 38.57 2qlm s ASN 167 CO 0.51 -0.40 0.26 -1.58 -1.51 0.00 0.00 177.10 174.38 2qlm s GLN 168 N 0.55 4.02 0.02 -0.60 0.74 -1.26 -1.47 119.66 121.66 2qlm s GLN 168 Ca 0.56 -0.15 0.04 0.00 0.05 0.00 0.00 55.36 55.85 2qlm s GLN 168 Cb -0.30 -3.62 -0.03 0.00 1.10 0.00 0.00 33.01 30.16 2qlm s GLN 168 CO 0.32 -0.13 -0.07 0.15 -0.55 0.00 0.00 175.29 175.01 2qlm s LYS 169 N 1.63 2.52 -0.32 1.67 -0.14 -0.42 -3.86 119.74 120.83 2qlm s LYS 169 Ca 0.11 -0.75 -0.07 0.00 -1.36 0.00 0.00 55.97 53.89 2qlm s LYS 169 Cb -0.15 -2.49 0.02 0.00 -1.68 0.00 0.00 37.83 33.53 2qlm s LYS 169 CO 0.09 0.59 0.10 0.42 -0.76 0.00 0.00 175.35 175.79 2qlm s ILE 170 N -1.03 4.00 -0.23 2.17 -1.09 -1.26 0.47 121.20 124.23 2qlm s ILE 170 Ca 0.18 -0.83 0.02 0.00 -2.23 0.00 0.00 60.65 57.79 2qlm s ILE 170 Cb -0.11 -3.14 0.04 0.00 -1.58 0.00 0.00 42.46 37.68 2qlm s ILE 170 CO 0.09 -0.03 -0.15 0.00 -1.23 0.00 0.00 174.94 173.62 2qlm n GLY 172 N 4.51 -0.24 1.57 0.00 0.00 -1.26 -2.03 105.19 107.74 2qlm n GLY 172 Ca -0.17 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2qlm n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qlm n GLY 173 N -1.00 1.49 3.89 -0.02 0.00 -1.26 -5.05 105.19 103.25 2qlm n GLY 173 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 2qlm n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qlm s TRP 174 N -2.58 3.54 0.07 1.61 0.52 -0.86 -3.74 118.94 117.49 2qlm s TRP 174 Ca 0.00 0.36 -0.31 0.00 0.02 0.00 0.00 56.10 56.17 2qlm s TRP 174 Cb 0.00 -1.83 -0.07 0.00 -1.15 0.00 0.00 33.47 30.42 2qlm s TRP 174 CO 0.00 0.65 1.39 -1.14 0.02 0.00 0.00 176.95 177.87 2qlm s GLN 175 N -1.85 4.31 0.01 4.98 0.74 -1.26 -0.70 119.66 125.89 2qlm s GLN 175 Ca 0.26 2.02 0.06 0.00 0.05 0.00 0.00 55.36 57.75 2qlm s GLN 175 Cb -0.13 -3.39 -0.03 0.00 1.10 0.00 0.00 33.01 30.56 2qlm s GLN 175 CO 0.17 -0.49 -0.17 -1.64 -0.55 0.00 0.00 175.29 172.61 2qlm s MET 176 N 1.65 2.19 -0.13 1.67 -1.94 0.18 -4.92 119.30 117.99 2qlm s MET 176 Ca 0.64 -0.90 -0.04 0.00 -1.71 0.00 0.00 55.69 53.68 2qlm s MET 176 Cb -0.34 -2.23 -0.03 0.00 2.01 0.00 0.00 34.83 34.23 2qlm s MET 176 CO 0.29 0.56 0.02 -1.21 -0.01 0.00 0.00 175.02 174.67 2qlm s GLU 177 N -1.21 3.48 0.07 2.03 8.01 -1.26 -1.30 118.70 128.53 2qlm s GLU 177 Ca 0.14 -0.40 0.05 0.00 0.01 0.00 0.00 54.97 54.77 2qlm s GLU 177 Cb -0.10 -2.97 -0.03 0.00 -4.31 0.00 0.00 34.13 26.71 2qlm s GLU 177 CO 0.04 0.47 -0.13 -1.83 0.01 0.00 0.00 175.26 173.81 2qlm s GLU 178 N -0.21 0.82 0.23 1.61 -1.05 -0.54 -4.99 118.70 114.56 2qlm s GLU 178 Ca 0.06 -0.98 -0.32 0.00 -0.15 0.00 0.00 54.97 53.59 2qlm s GLU 178 Cb -0.12 -0.78 -0.13 0.00 -0.44 0.00 0.00 34.13 32.66 2qlm s GLU 178 CO 0.02 0.17 1.50 0.00 0.95 0.00 0.00 175.26 177.90 2qlm n ALA 179 N 1.18 1.55 -3.01 -0.84 0.00 -1.26 -1.29 120.51 116.85 2qlm n ALA 179 Ca -0.21 0.41 -0.44 0.00 0.00 0.00 0.00 53.44 53.20 2qlm n ALA 179 Cb 0.55 -2.34 -0.01 0.00 0.00 0.00 0.00 19.45 17.64 2qlm n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qlm s ASP 180 N 0.53 6.91 -1.47 0.00 3.68 -1.26 -4.66 116.67 120.39 2qlm s ASP 180 Ca 0.70 -2.69 -0.10 0.00 2.13 0.00 0.00 52.55 52.60 2qlm s ASP 180 Cb -0.62 -2.36 0.03 0.00 -1.45 0.00 0.00 42.92 38.51 2qlm s ASP 180 CO 0.46 -0.80 2.49 -0.67 0.13 0.00 0.00 175.17 176.78 2qlm n ASP 181 N 5.52 6.81 0.15 -0.34 2.03 -1.26 -3.39 116.55 126.07 2qlm n ASP 181 Ca 0.29 -2.84 0.12 0.00 0.52 0.00 0.00 54.79 52.88 2qlm n ASP 181 Cb 0.45 -1.53 0.52 0.00 -0.72 0.00 0.00 41.12 39.84 2qlm n ASP 181 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 2qlm h TRP 182 N 5.29 0.00 -0.41 -0.67 5.08 -1.91 -2.66 115.95 120.66 2qlm h TRP 182 Ca 0.69 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.66 2qlm h TRP 182 Cb 0.43 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.59 2qlm h TRP 182 CO 1.62 0.00 0.00 1.28 -1.28 0.00 0.00 178.44 180.06 2qlm n LEU 183 N -2.32 3.49 -0.19 0.11 4.77 -1.26 -4.64 117.00 116.97 2qlm n LEU 183 Ca 0.02 -1.54 -0.02 0.00 -0.03 0.00 0.00 56.01 54.44 2qlm n LEU 183 Cb 0.22 -0.26 0.05 0.00 -2.33 0.00 0.00 43.42 41.09 2qlm n LEU 183 CO 0.19 0.76 0.74 -0.09 -1.33 0.00 0.00 177.39 177.66 2qlm h ARG 184 N 4.42 -0.02 -0.02 3.23 2.43 -1.88 -1.57 114.38 120.96 2qlm h ARG 184 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2qlm h ARG 184 Cb 0.98 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2qlm h ARG 184 CO 0.00 -0.01 0.00 0.66 -1.51 0.00 0.00 179.97 179.11 2qlm n TYR 185 N -5.41 0.01 0.00 2.20 4.01 -1.26 -5.05 117.16 111.66 2qlm n TYR 185 Ca 0.06 -0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 2qlm n TYR 185 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 2qlm n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qlm n GLY 186 N 1.21 1.67 2.92 2.72 0.00 -0.59 -4.99 105.19 108.13 2qlm n GLY 186 Ca 0.18 -1.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.02 2qlm n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2qlm s ASN 187 N -0.37 4.07 0.38 1.61 2.47 -1.26 -4.86 114.94 116.98 2qlm s ASN 187 Ca 0.00 -1.45 0.28 0.00 0.42 0.00 0.00 52.86 52.11 2qlm s ASN 187 Cb 0.00 -1.22 1.18 0.00 -1.45 0.00 0.00 41.25 39.75 2qlm s ASN 187 CO 0.00 -0.29 1.83 1.55 -3.72 0.00 0.00 177.10 176.47 2qlm h PRO 188 N 7.90 0.00 0.00 0.43 0.13 -1.98 -3.24 132.00 135.24 2qlm h PRO 188 Ca -0.15 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.76 2qlm h PRO 188 Cb 1.05 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.14 2qlm h PRO 188 CO 0.44 0.00 -1.27 -1.49 -0.23 0.00 0.00 178.00 175.45 2qlm h TRP 189 N 0.00 0.00 -3.72 1.56 4.06 -1.95 -3.47 115.95 112.43 2qlm h TRP 189 Ca 0.00 0.00 -0.49 0.00 2.06 0.00 0.00 58.89 60.46 2qlm h TRP 189 Cb 0.40 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.53 2qlm h TRP 189 CO 0.00 0.92 0.14 -1.83 -3.56 0.00 0.00 178.44 174.11 2qlm s GLU 190 N -2.71 4.15 -0.20 0.49 -1.05 -1.23 -4.31 118.70 113.85 2qlm s GLU 190 Ca -0.01 0.83 0.01 0.00 -0.15 0.00 0.00 54.97 55.65 2qlm s GLU 190 Cb 0.09 -2.58 0.04 0.00 -0.44 0.00 0.00 34.13 31.24 2qlm s GLU 190 CO 0.81 0.22 -0.12 0.21 0.95 0.00 0.00 175.26 177.34 2qlm s LYS 191 N -2.61 2.21 0.31 -4.83 2.47 0.37 -4.95 119.74 112.71 2qlm s LYS 191 Ca 0.51 -0.88 -0.29 0.00 -1.56 0.00 0.00 55.97 53.75 2qlm s LYS 191 Cb -0.13 -2.47 -0.10 0.00 -1.46 0.00 0.00 37.83 33.67 2qlm s LYS 191 CO 0.19 -0.40 1.43 0.00 0.16 0.00 0.00 175.35 176.73 2qlm s ALA 192 N 1.35 3.59 -0.54 3.13 0.00 -1.26 -0.91 121.76 127.13 2qlm s ALA 192 Ca -0.01 1.40 0.07 0.00 0.00 0.00 0.00 51.96 53.42 2qlm s ALA 192 Cb -0.16 -3.56 0.33 0.00 0.00 0.00 0.00 23.12 19.73 2qlm s ALA 192 CO -0.09 -0.82 0.87 0.54 0.00 0.00 0.00 175.76 176.27 2qlm n ARG 193 N 1.45 2.65 0.17 0.00 5.12 0.08 -4.93 116.66 121.21 2qlm n ARG 193 Ca 0.04 -4.51 0.11 0.00 -1.93 0.00 0.00 57.85 51.56 2qlm n ARG 193 Cb 0.40 -2.11 0.60 0.00 -1.16 0.00 0.00 32.46 30.19 2qlm n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2qlm h PRO 194 N 3.13 0.00 0.00 5.56 0.13 -1.94 0.38 132.00 139.26 2qlm h PRO 194 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2qlm h PRO 194 Cb 0.62 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.75 2qlm h PRO 194 CO 0.75 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.57 2qlm h GLU 195 N 0.00 0.00 -0.66 0.86 9.09 -1.95 -3.12 114.58 118.80 2qlm h GLU 195 Ca 0.00 0.00 -0.23 0.00 0.05 0.00 0.00 59.36 59.18 2qlm h GLU 195 Cb 0.06 0.00 -0.14 0.00 -1.65 0.00 0.00 28.75 27.02 2qlm h GLU 195 CO 0.00 0.00 0.24 1.19 0.05 0.00 0.00 179.01 180.49 2qlm n PHE 196 N -2.81 2.17 -2.20 2.06 3.72 0.12 -5.01 117.46 115.52 2qlm n PHE 196 Ca 0.03 -1.31 -0.41 0.00 -0.05 0.00 0.00 57.45 55.70 2qlm n PHE 196 Cb 0.39 -0.65 -0.03 0.00 -0.94 0.00 0.00 39.48 38.25 2qlm n PHE 196 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2qlm s THR 197 N -3.06 3.20 0.03 4.37 2.01 -1.18 -4.64 115.64 116.38 2qlm s THR 197 Ca 0.52 0.96 0.07 0.00 0.31 0.00 0.00 61.69 63.56 2qlm s THR 197 Cb 0.43 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 69.30 2qlm s THR 197 CO 0.11 0.13 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.19 2qlm s LEU 198 N 0.12 2.15 0.19 4.42 1.02 -0.55 -4.94 118.68 121.09 2qlm s LEU 198 Ca 0.58 -0.51 -0.24 0.00 0.02 0.00 0.00 54.13 53.98 2qlm s LEU 198 Cb -0.37 -1.04 -0.08 0.00 0.02 0.00 0.00 46.19 44.72 2qlm s LEU 198 CO 0.37 0.19 0.78 -2.16 0.02 0.00 0.00 176.35 175.55 2qlm s PRO 199 N -1.08 4.49 -0.05 1.29 0.04 -1.26 0.51 135.00 138.94 2qlm s PRO 199 Ca 0.08 1.10 0.06 0.00 0.04 0.00 0.00 61.00 62.28 2qlm s PRO 199 Cb -0.09 -3.13 -0.01 0.00 0.04 0.00 0.00 34.50 31.31 2qlm s PRO 199 CO 0.01 0.50 -0.23 0.08 0.04 0.00 0.00 177.00 177.41 2qlm s VAL 200 N -1.28 1.85 -0.05 -0.36 1.01 0.15 -4.85 120.40 116.88 2qlm s VAL 200 Ca 0.39 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 2qlm s VAL 200 Cb -0.21 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2qlm s VAL 200 CO 0.25 0.52 0.05 -1.00 0.00 0.00 0.00 175.10 174.92 2qlm s HIS 201 N -0.15 3.26 0.07 5.22 3.76 -1.26 -0.50 115.29 125.70 2qlm s HIS 201 Ca -0.02 0.23 0.02 0.00 -0.15 0.00 0.00 55.06 55.14 2qlm s HIS 201 Cb -0.13 -1.78 -0.03 0.00 1.11 0.00 0.00 32.58 31.75 2qlm s HIS 201 CO 0.03 0.54 -0.07 -0.06 -0.85 0.00 0.00 174.74 174.33 2qlm s PHE 202 N -1.05 0.79 0.00 1.40 0.40 0.41 -4.97 117.98 114.97 2qlm s PHE 202 Ca 0.18 -0.75 0.00 0.00 -0.60 0.00 0.00 56.93 55.76 2qlm s PHE 202 Cb -0.12 -0.47 0.00 0.00 0.51 0.00 0.00 43.02 42.95 2qlm s PHE 202 CO 0.08 -0.13 0.00 0.66 0.70 0.00 0.00 175.22 176.53 2qlm n TYR 203 N 0.56 0.00 -4.25 0.36 4.01 0.49 -0.70 117.16 117.64 2qlm n TYR 203 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 2qlm n TYR 203 Cb 0.58 0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 2qlm n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qlm n GLY 204 N 0.00 -0.60 3.39 2.72 0.00 -1.23 -4.59 105.19 104.88 2qlm n GLY 204 Ca 0.00 -1.12 -0.10 0.00 0.00 0.00 0.00 46.02 44.80 2qlm n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qlm s ARG 205 N 0.00 1.19 -0.22 1.61 1.70 -0.41 -4.87 118.95 117.95 2qlm s ARG 205 Ca 0.00 -0.83 -0.10 0.00 -0.47 0.00 0.00 55.73 54.33 2qlm s ARG 205 Cb 0.00 0.47 -0.05 0.00 -0.57 0.00 0.00 34.95 34.81 2qlm s ARG 205 CO 0.00 -0.48 0.13 0.08 -1.08 0.00 0.00 175.30 173.95 2qlm s VAL 206 N -3.85 5.22 -0.14 4.99 1.01 -1.26 -1.29 120.40 125.07 2qlm s VAL 206 Ca 0.07 0.12 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 2qlm s VAL 206 Cb 0.01 -3.40 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 2qlm s VAL 206 CO -0.07 0.40 -0.10 -0.70 0.00 0.00 0.00 175.10 174.63 2qlm s GLU 207 N 0.71 3.45 -0.26 2.72 2.12 0.77 -4.95 118.70 123.26 2qlm s GLU 207 Ca 0.07 -0.64 -0.11 0.00 0.36 0.00 0.00 54.97 54.65 2qlm s GLU 207 Cb -0.12 -2.73 -0.05 0.00 0.26 0.00 0.00 34.13 31.48 2qlm s GLU 207 CO 0.01 0.18 0.18 -1.01 -0.54 0.00 0.00 175.26 174.09 2qlm s HIS 208 N 0.45 3.27 0.50 5.30 3.76 -1.26 -0.02 115.29 127.29 2qlm s HIS 208 Ca -0.08 0.18 0.05 0.00 -0.15 0.00 0.00 55.06 55.06 2qlm s HIS 208 Cb -0.15 -2.33 0.01 0.00 1.11 0.00 0.00 32.58 31.21 2qlm s HIS 208 CO 0.04 -0.05 0.29 0.95 -0.85 0.00 0.00 174.74 175.11 2qlm s THR 209 N 1.43 1.76 0.33 1.30 -4.23 -0.56 -5.02 115.64 110.65 2qlm s THR 209 Ca 0.07 -1.61 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 2qlm s THR 209 Cb -0.15 -2.37 0.30 0.00 1.34 0.00 0.00 72.50 71.62 2qlm s THR 209 CO 0.08 0.00 1.91 0.28 -0.54 0.00 0.00 174.62 176.34 2qlm h SER 210 N 1.01 0.77 -2.30 3.99 0.02 -2.03 -3.18 113.55 111.83 2qlm h SER 210 Ca -0.40 0.02 -0.63 0.00 -0.84 0.00 0.00 61.79 59.94 2qlm h SER 210 Cb 1.29 -0.14 -0.40 0.00 0.14 0.00 0.00 62.40 63.29 2qlm h SER 210 CO 0.63 0.46 -0.37 1.67 -1.14 0.00 0.00 176.83 178.08 2qlm n GLN 211 N -4.52 2.88 0.00 3.45 -0.06 -1.26 -5.07 117.38 112.80 2qlm n GLN 211 Ca 0.14 -4.67 0.00 0.00 -2.00 0.00 0.00 57.00 50.48 2qlm n GLN 211 Cb 0.29 -2.30 0.00 0.00 -4.06 0.00 0.00 30.24 24.18 2qlm n GLN 211 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2qlm n GLY 212 N 0.87 0.59 3.85 1.69 0.00 -1.20 -5.00 105.19 105.99 2qlm n GLY 212 Ca 0.30 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.01 2qlm n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qlm s ALA 213 N -1.54 3.29 -0.05 4.61 0.00 -1.26 -1.49 121.76 125.32 2qlm s ALA 213 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.98 2qlm s ALA 213 Cb 0.00 -2.80 0.03 0.00 0.00 0.00 0.00 23.12 20.35 2qlm s ALA 213 CO 0.00 0.20 -0.02 0.15 0.00 0.00 0.00 175.76 176.10 2qlm s LYS 214 N -3.27 0.60 -0.43 0.00 -0.14 0.97 -4.90 119.74 112.57 2qlm s LYS 214 Ca 0.54 0.02 -0.17 0.00 -1.36 0.00 0.00 55.97 55.00 2qlm s LYS 214 Cb -0.10 -0.77 0.03 0.00 -1.68 0.00 0.00 37.83 35.30 2qlm s LYS 214 CO 0.21 -0.17 0.42 -0.46 -0.76 0.00 0.00 175.35 174.59 2qlm s TRP 215 N 1.28 3.18 0.33 3.18 -0.00 -1.26 -0.16 118.94 125.49 2qlm s TRP 215 Ca -0.06 -0.47 0.06 0.00 -0.00 0.00 0.00 56.10 55.64 2qlm s TRP 215 Cb -0.13 -2.89 -0.07 0.00 -0.00 0.00 0.00 33.47 30.38 2qlm s TRP 215 CO -0.02 -0.70 -0.01 0.14 -0.00 0.00 0.00 176.95 176.35 2qlm s VAL 216 N 2.04 1.66 -1.42 5.86 -7.23 -0.41 -4.82 120.40 116.08 2qlm s VAL 216 Ca 0.10 -2.07 -0.10 0.00 -1.81 0.00 0.00 61.98 58.10 2qlm s VAL 216 Cb -0.18 -2.69 0.04 0.00 0.56 0.00 0.00 36.38 34.11 2qlm s VAL 216 CO 0.12 -0.14 1.05 0.47 -0.31 0.00 0.00 175.10 176.30 2qlm n ASP 217 N -0.72 -5.04 -4.91 4.85 8.00 -1.26 -1.29 116.55 116.17 2qlm n ASP 217 Ca -0.04 -0.67 -0.27 0.00 0.71 0.00 0.00 54.79 54.51 2qlm n ASP 217 Cb 0.65 -4.47 -0.02 0.00 -0.02 0.00 0.00 41.12 37.26 2qlm n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2qlm s THR 218 N -3.34 4.95 -0.01 -3.53 -4.23 -1.26 -3.48 115.64 104.74 2qlm s THR 218 Ca 0.54 0.10 -0.16 0.00 -1.18 0.00 0.00 61.69 60.99 2qlm s THR 218 Cb -0.26 -3.81 -0.06 0.00 1.34 0.00 0.00 72.50 69.72 2qlm s THR 218 CO 0.78 -0.62 0.44 -1.10 -0.54 0.00 0.00 174.62 173.59 2qlm s GLN 219 N -4.23 4.03 -0.18 3.99 -0.21 0.12 -4.90 119.66 118.28 2qlm s GLN 219 Ca 0.46 0.46 -0.05 0.00 0.02 0.00 0.00 55.36 56.25 2qlm s GLN 219 Cb -0.10 -3.26 -0.03 0.00 1.00 0.00 0.00 33.01 30.62 2qlm s GLN 219 CO 0.37 0.60 -0.01 0.08 -2.12 0.00 0.00 175.29 174.21 2qlm s VAL 220 N -0.81 4.03 -0.07 1.09 1.01 -1.26 -0.44 120.40 123.95 2qlm s VAL 220 Ca 0.25 -0.30 0.05 0.00 0.00 0.00 0.00 61.98 61.98 2qlm s VAL 220 Cb -0.17 -2.80 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 2qlm s VAL 220 CO 0.14 0.46 -0.22 -0.69 0.00 0.00 0.00 175.10 174.79 2qlm s VAL 221 N 0.61 2.35 0.18 2.92 1.01 0.34 -4.51 120.40 123.30 2qlm s VAL 221 Ca -0.01 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 60.81 2qlm s VAL 221 Cb -0.14 -1.89 -0.08 0.00 0.00 0.00 0.00 36.38 34.28 2qlm s VAL 221 CO 0.02 0.57 0.70 -0.76 0.00 0.00 0.00 175.10 175.63 2qlm s LEU 222 N -0.18 4.43 -0.31 3.92 1.43 0.22 0.35 118.68 128.54 2qlm s LEU 222 Ca -0.02 1.43 -0.04 0.00 -1.03 0.00 0.00 54.13 54.46 2qlm s LEU 222 Cb -0.14 -3.40 0.04 0.00 0.03 0.00 0.00 46.19 42.73 2qlm s LEU 222 CO 0.04 0.11 0.03 0.00 0.23 0.00 0.00 176.35 176.76 2qlm s ALA 223 N -1.37 2.90 -0.24 4.21 0.00 0.18 -0.81 121.76 126.63 2qlm s ALA 223 Ca 0.39 -1.69 -0.11 0.00 0.00 0.00 0.00 51.96 50.55 2qlm s ALA 223 Cb -0.18 -2.03 -0.05 0.00 0.00 0.00 0.00 23.12 20.85 2qlm s ALA 223 CO 0.22 -1.21 0.17 1.41 0.00 0.00 0.00 175.76 176.35 2qlm s MET 224 N 1.33 4.06 0.21 0.00 1.75 0.37 -1.49 119.30 125.54 2qlm s MET 224 Ca -0.03 -0.26 -0.21 0.00 -1.25 0.00 0.00 55.69 53.95 2qlm s MET 224 Cb -0.19 -3.55 -0.08 0.00 2.84 0.00 0.00 34.83 33.84 2qlm s MET 224 CO 0.00 0.03 0.73 -1.25 -0.65 0.00 0.00 175.02 173.88 2qlm s PRO 225 N 1.15 4.31 -0.14 4.11 0.04 -1.26 -0.29 135.00 142.92 2qlm s PRO 225 Ca 0.08 0.93 0.02 0.00 0.04 0.00 0.00 61.00 62.07 2qlm s PRO 225 Cb -0.14 -2.96 0.01 0.00 0.04 0.00 0.00 34.50 31.46 2qlm s PRO 225 CO 0.05 0.43 -0.21 0.71 0.04 0.00 0.00 177.00 178.02 2qlm s TYR 226 N -1.44 2.62 -0.16 0.56 1.51 0.04 -0.74 117.35 119.74 2qlm s TYR 226 Ca 0.41 -1.33 -0.10 0.00 -1.01 0.00 0.00 57.07 55.04 2qlm s TYR 226 Cb -0.18 -1.79 -0.05 0.00 -0.11 0.00 0.00 41.96 39.83 2qlm s TYR 226 CO 0.22 -0.62 0.17 -0.51 -1.11 0.00 0.00 175.55 173.70 2qlm s ASP 227 N 0.86 6.32 -0.08 2.29 -0.00 -0.09 -1.14 116.67 124.82 2qlm s ASP 227 Ca -0.06 0.36 0.05 0.00 -0.00 0.00 0.00 52.55 52.90 2qlm s ASP 227 Cb -0.15 -2.10 -0.01 0.00 -0.00 0.00 0.00 42.92 40.66 2qlm s ASP 227 CO -0.03 0.24 -0.24 -0.89 -0.00 0.00 0.00 175.17 174.26 2qlm s THR 228 N -0.07 2.14 0.31 -1.27 2.01 -0.06 -0.48 115.64 118.22 2qlm s THR 228 Ca 0.12 -1.01 -0.29 0.00 0.31 0.00 0.00 61.69 60.82 2qlm s THR 228 Cb -0.12 -1.80 -0.10 0.00 0.01 0.00 0.00 72.50 70.49 2qlm s THR 228 CO 0.01 0.56 1.17 -2.16 -0.69 0.00 0.00 174.62 173.51 2qlm s PRO 229 N 0.13 4.50 -0.40 4.92 0.04 -1.26 -0.95 135.00 141.97 2qlm s PRO 229 Ca -0.12 1.92 0.03 0.00 0.04 0.00 0.00 61.00 62.88 2qlm s PRO 229 Cb -0.16 -3.10 0.11 0.00 0.04 0.00 0.00 34.50 31.39 2qlm s PRO 229 CO 0.07 0.04 0.14 0.08 0.04 0.00 0.00 177.00 177.36 2qlm s VAL 230 N -1.19 2.11 0.11 -0.36 1.01 0.91 -4.87 120.40 118.13 2qlm s VAL 230 Ca 0.47 -2.54 -0.30 0.00 0.00 0.00 0.00 61.98 59.61 2qlm s VAL 230 Cb -0.34 -2.53 -0.06 0.00 0.00 0.00 0.00 36.38 33.46 2qlm s VAL 230 CO 0.44 -0.70 1.02 -2.16 0.00 0.00 0.00 175.10 173.70 2qlm s PRO 231 N 0.58 4.64 0.80 2.72 0.04 -1.26 -0.80 135.00 141.72 2qlm s PRO 231 Ca 0.13 1.54 -0.11 0.00 0.04 0.00 0.00 61.00 62.60 2qlm s PRO 231 Cb -0.21 -3.36 0.07 0.00 0.04 0.00 0.00 34.50 31.04 2qlm s PRO 231 CO -0.07 0.11 1.09 0.20 0.04 0.00 0.00 177.00 178.37 2qlm s GLY 232 N 0.17 1.64 -0.66 0.56 0.00 1.00 -4.77 107.32 105.25 2qlm s GLY 232 Ca 0.49 -0.03 -0.27 0.00 0.00 0.00 0.00 44.72 44.91 2qlm s GLY 232 CO 0.31 0.37 1.60 -0.47 0.00 0.00 0.00 173.10 174.91 2qlm s TYR 233 N -3.04 1.94 -1.29 1.90 6.14 -1.26 -4.17 117.35 117.57 2qlm s TYR 233 Ca 0.61 0.43 -0.08 0.00 0.64 0.00 0.00 57.07 58.66 2qlm s TYR 233 Cb -0.16 -4.33 0.06 0.00 0.42 0.00 0.00 41.96 37.96 2qlm s TYR 233 CO 0.55 -2.21 0.46 0.54 0.64 0.00 0.00 175.55 175.54 2qlm n ARG 234 N 9.24 -3.48 -0.03 4.97 1.74 -0.08 -4.82 116.66 124.20 2qlm n ARG 234 Ca 0.13 0.53 0.01 0.00 -0.77 0.00 0.00 57.85 57.76 2qlm n ARG 234 Cb 0.51 -5.25 0.03 0.00 -1.02 0.00 0.00 32.46 26.72 2qlm n ARG 234 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2qlm n ASN 235 N -2.27 1.95 -1.11 0.55 2.04 -1.26 -4.96 115.26 110.19 2qlm n ASN 235 Ca -0.04 -1.78 -0.14 0.00 -0.44 0.00 0.00 54.58 52.18 2qlm n ASN 235 Cb 0.56 -0.04 -0.06 0.00 -2.53 0.00 0.00 39.78 37.71 2qlm n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 2qlm n ASN 236 N -0.18 -5.67 -4.74 0.53 3.02 -1.26 -1.36 115.26 105.61 2qlm n ASN 236 Ca 0.02 0.36 -0.38 0.00 -0.03 0.00 0.00 54.58 54.56 2qlm n ASN 236 Cb 0.23 -4.44 -0.06 0.00 -0.61 0.00 0.00 39.78 34.90 2qlm n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2qlm s VAL 237 N -2.23 5.20 -0.22 2.41 1.01 -1.26 -4.78 120.40 120.52 2qlm s VAL 237 Ca 0.00 0.85 -0.01 0.00 0.00 0.00 0.00 61.98 62.82 2qlm s VAL 237 Cb 0.00 -3.76 0.06 0.00 0.00 0.00 0.00 36.38 32.68 2qlm s VAL 237 CO 0.00 0.37 0.01 -0.69 0.00 0.00 0.00 175.10 174.78 2qlm s VAL 238 N 0.40 0.98 0.74 2.92 1.01 -1.26 -0.00 120.40 125.19 2qlm s VAL 238 Ca 0.24 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.27 2qlm s VAL 238 Cb -0.15 -1.42 0.15 0.00 0.00 0.00 0.00 36.38 34.97 2qlm s VAL 238 CO 0.09 -0.22 1.01 0.59 0.00 0.00 0.00 175.10 176.58 2qlm n ASN 239 N 4.87 1.20 -4.20 3.32 3.02 0.02 -4.67 115.26 118.82 2qlm n ASN 239 Ca -0.09 -2.05 -0.29 0.00 -0.03 0.00 0.00 54.58 52.11 2qlm n ASN 239 Cb 0.45 -0.67 -0.16 0.00 -0.61 0.00 0.00 39.78 38.79 2qlm n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2qlm s THR 240 N -3.11 1.80 -0.31 3.41 2.01 -1.26 -0.06 115.64 118.13 2qlm s THR 240 Ca 0.66 -0.91 -0.08 0.00 0.31 0.00 0.00 61.69 61.66 2qlm s THR 240 Cb -0.04 -1.54 0.00 0.00 0.01 0.00 0.00 72.50 70.93 2qlm s THR 240 CO 0.44 0.51 0.12 -0.32 -0.69 0.00 0.00 174.62 174.68 2qlm s MET 241 N 0.04 3.20 -0.27 4.92 1.75 -0.13 -2.16 119.30 126.67 2qlm s MET 241 Ca -0.07 -0.80 -0.09 0.00 -1.25 0.00 0.00 55.69 53.48 2qlm s MET 241 Cb -0.14 -3.48 -0.03 0.00 2.84 0.00 0.00 34.83 34.02 2qlm s MET 241 CO 0.04 -0.44 0.12 0.50 -0.65 0.00 0.00 175.02 174.59 2qlm s ARG 242 N 1.56 3.70 -0.12 4.11 3.52 0.90 -0.88 118.95 131.74 2qlm s ARG 242 Ca 0.04 -0.46 0.01 0.00 -0.13 0.00 0.00 55.73 55.18 2qlm s ARG 242 Cb -0.17 -3.46 -0.01 0.00 -1.56 0.00 0.00 34.95 29.75 2qlm s ARG 242 CO 0.04 -0.22 -0.17 -0.51 -0.81 0.00 0.00 175.30 173.64 2qlm s LEU 243 N 1.66 2.50 0.02 -0.88 1.43 -0.29 -2.21 118.68 120.90 2qlm s LEU 243 Ca 0.06 -0.41 -0.21 0.00 -1.03 0.00 0.00 54.13 52.54 2qlm s LEU 243 Cb -0.16 -1.54 -0.06 0.00 0.03 0.00 0.00 46.19 44.47 2qlm s LEU 243 CO 0.06 0.16 0.63 0.26 0.23 0.00 0.00 176.35 177.69 2qlm s TRP 244 N 0.37 3.72 -0.02 0.29 0.52 -0.37 -0.78 118.94 122.66 2qlm s TRP 244 Ca -0.13 1.27 0.04 0.00 0.02 0.00 0.00 56.10 57.30 2qlm s TRP 244 Cb -0.17 -2.63 -0.03 0.00 -1.15 0.00 0.00 33.47 29.49 2qlm s TRP 244 CO 0.07 0.38 -0.15 0.45 0.02 0.00 0.00 176.95 177.71 2qlm s SER 245 N -0.32 4.01 -0.05 2.95 0.15 0.60 -1.12 113.70 119.91 2qlm s SER 245 Ca 0.32 -0.25 -0.22 0.00 0.70 0.00 0.00 55.95 56.50 2qlm s SER 245 Cb -0.19 -0.81 -0.04 0.00 -1.71 0.00 0.00 66.02 63.27 2qlm s SER 245 CO 0.19 0.32 0.66 0.00 1.20 0.00 0.00 173.24 175.61 2qlm s ALA 246 N -0.79 3.38 -0.03 5.45 0.00 -1.26 -0.48 121.76 128.02 2qlm s ALA 246 Ca 0.13 0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.20 2qlm s ALA 246 Cb -0.11 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 20.14 2qlm s ALA 246 CO 0.02 -0.03 -0.10 0.15 0.00 0.00 0.00 175.76 175.80 2qlm s LYS 247 N 0.56 1.15 0.24 0.00 -0.14 0.01 -4.60 119.74 116.96 2qlm s LYS 247 Ca 0.35 -0.34 -0.30 0.00 -1.36 0.00 0.00 55.97 54.32 2qlm s LYS 247 Cb -0.18 -1.04 -0.09 0.00 -1.68 0.00 0.00 37.83 34.84 2qlm s LYS 247 CO 0.17 0.10 1.16 0.00 -0.76 0.00 0.00 175.35 176.02 2qlm s ALA 248 N 0.30 3.42 0.67 5.17 0.00 -1.26 -0.61 121.76 129.46 2qlm s ALA 248 Ca -0.06 0.94 -0.15 0.00 0.00 0.00 0.00 51.96 52.69 2qlm s ALA 248 Cb -0.10 -3.38 0.01 0.00 0.00 0.00 0.00 23.12 19.65 2qlm s ALA 248 CO 0.01 -0.29 1.15 -1.25 0.00 0.00 0.00 175.76 175.38 2qlm s PRO 249 N -0.89 2.60 0.53 0.00 0.04 -1.26 -4.88 135.00 131.14 2qlm s PRO 249 Ca 0.49 1.56 0.32 0.00 0.04 0.00 0.00 61.00 63.40 2qlm s PRO 249 Cb -0.33 -1.91 1.32 0.00 0.04 0.00 0.00 34.50 33.62 2qlm s PRO 249 CO 0.40 -1.44 1.97 -0.91 0.04 0.00 0.00 177.00 177.06 2qlm h ASN 250 N 0.03 0.00 -0.42 6.66 2.35 -1.99 -1.76 115.58 120.45 2qlm h ASN 250 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 2qlm h ASN 250 Cb 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 2qlm h ASN 250 CO 0.53 0.06 0.00 -0.90 -1.65 0.00 0.00 177.43 175.46 2qlm n ASP 251 N -3.19 3.98 -4.71 5.81 5.68 -1.26 -4.89 116.55 117.97 2qlm n ASP 251 Ca 0.00 -2.52 -0.42 0.00 -0.50 0.00 0.00 54.79 51.35 2qlm n ASP 251 Cb 0.32 -0.58 -0.03 0.00 -1.14 0.00 0.00 41.12 39.69 2qlm n ASP 251 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 2qlm s PHE 252 N -2.05 2.59 0.00 2.11 5.36 -0.67 -0.81 117.98 124.51 2qlm s PHE 252 Ca 0.37 0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.54 2qlm s PHE 252 Cb 0.27 -4.14 0.00 0.00 -0.34 0.00 0.00 43.02 38.80 2qlm s PHE 252 CO 0.13 -4.50 0.00 0.09 -1.46 0.00 0.00 175.22 169.48 2qlm n ASN 253 N 4.72 -1.12 -4.08 6.13 4.13 -1.26 -4.76 115.26 119.01 2qlm n ASN 253 Ca 0.17 0.00 -0.31 0.00 1.68 0.00 0.00 54.58 56.12 2qlm n ASN 253 Cb 0.37 -2.67 -0.16 0.00 -1.54 0.00 0.00 39.78 35.77 2qlm n ASN 253 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2qlm s LEU 254 N 0.00 1.86 0.00 3.41 1.43 0.01 -4.90 118.68 120.49 2qlm s LEU 254 Ca 0.00 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 2qlm s LEU 254 Cb 0.00 -1.25 0.00 0.00 0.03 0.00 0.00 46.19 44.97 2qlm s LEU 254 CO 0.00 0.01 0.01 0.61 0.23 0.00 0.00 176.35 177.21 2qlm n GLY 261 N 4.37 -0.05 0.10 -3.19 0.00 -1.26 -5.02 105.19 100.14 2qlm n GLY 261 Ca -0.19 0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 2qlm n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2qlm h TYR 262 N 0.00 0.21 0.09 1.61 3.20 -1.99 -1.46 116.97 118.62 2qlm h TYR 262 Ca 0.00 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.89 2qlm h TYR 262 Cb 0.00 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 2qlm h TYR 262 CO 0.00 0.13 -0.19 0.82 -1.64 0.00 0.00 178.16 177.28 2qlm h ILE 263 N 0.23 0.56 -1.00 1.81 1.08 -2.03 -2.40 117.51 115.75 2qlm h ILE 263 Ca 0.07 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.59 2qlm h ILE 263 Cb -0.01 0.56 -0.06 0.00 -3.07 0.00 0.00 36.82 34.23 2qlm h ILE 263 CO -0.03 0.00 0.65 -0.61 -0.69 0.00 0.00 178.15 177.48 2qlm h GLN 264 N -0.36 1.18 -0.64 2.37 5.75 -1.97 -1.13 115.11 120.31 2qlm h GLN 264 Ca 0.03 -0.07 0.05 0.00 -0.15 0.00 0.00 58.65 58.51 2qlm h GLN 264 Cb 0.39 -0.27 -0.05 0.00 1.07 0.00 0.00 27.48 28.62 2qlm h GLN 264 CO -0.12 0.78 0.36 0.00 -2.65 0.00 0.00 178.83 177.20 2qlm h ALA 265 N 1.44 0.85 -0.43 3.38 0.00 -0.97 0.16 119.26 123.70 2qlm h ALA 265 Ca 0.41 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.29 2qlm h ALA 265 Cb 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2qlm h ALA 265 CO -0.15 0.04 0.07 0.28 0.00 0.00 0.00 179.25 179.50 2qlm h VAL 266 N 0.67 1.24 -0.11 0.00 2.07 -0.88 -3.05 116.25 116.19 2qlm h VAL 266 Ca 0.28 -0.87 -0.07 0.00 0.82 0.00 0.00 66.70 66.86 2qlm h VAL 266 Cb 0.16 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2qlm h VAL 266 CO -0.17 0.30 -0.24 -0.07 0.02 0.00 0.00 177.57 177.42 2qlm h LEU 267 N 0.56 0.18 -0.26 2.57 3.38 -0.73 -2.74 115.31 118.27 2qlm h LEU 267 Ca 0.13 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2qlm h LEU 267 Cb 0.37 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2qlm h LEU 267 CO 0.01 0.43 0.00 0.47 0.09 0.00 0.00 178.44 179.44 2qlm n ASP 268 N -4.19 0.22 0.20 -0.43 8.00 0.53 -2.47 116.55 118.41 2qlm n ASP 268 Ca -0.01 0.56 0.16 0.00 0.71 0.00 0.00 54.79 56.21 2qlm n ASP 268 Cb 0.34 -0.60 0.81 0.00 -0.02 0.00 0.00 41.12 41.65 2qlm n ASP 268 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2qlm h ARG 269 N 0.00 0.00 -0.89 -1.24 3.08 -1.52 -1.90 114.38 111.91 2qlm h ARG 269 Ca 0.00 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.18 2qlm h ARG 269 Cb 0.25 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.23 2qlm h ARG 269 CO 0.00 0.00 0.57 -0.91 -1.07 0.00 0.00 179.97 178.56 2qlm h ASN 270 N 0.00 0.70 -0.44 7.04 -0.26 -1.72 -2.61 115.58 118.29 2qlm h ASN 270 Ca 0.09 0.03 0.08 0.00 -0.56 0.00 0.00 56.30 55.94 2qlm h ASN 270 Cb 0.45 -0.11 -0.07 0.00 -1.06 0.00 0.00 38.32 37.53 2qlm h ASN 270 CO -0.00 0.38 0.03 -0.07 -1.06 0.00 0.00 177.43 176.71 2qlm h LEU 271 N 0.75 -0.12 -0.43 1.61 4.07 -1.59 0.46 115.31 120.06 2qlm h LEU 271 Ca 0.43 0.10 -0.11 0.00 0.08 0.00 0.00 57.88 58.38 2qlm h LEU 271 Cb 0.61 0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.49 2qlm h LEU 271 CO -0.20 -0.03 -0.16 0.00 -1.08 0.00 0.00 178.44 176.98 2qlm h ALA 272 N 1.37 0.60 0.00 1.53 0.00 -1.64 -3.17 119.26 117.96 2qlm h ALA 272 Ca 0.22 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2qlm h ALA 272 Cb 0.31 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2qlm h ALA 272 CO -0.34 0.53 0.00 0.39 0.00 0.00 0.00 179.25 179.83 2qlm n GLU 273 N -4.24 0.04 0.29 0.00 1.02 -0.94 -3.05 120.64 113.76 2qlm n GLU 273 Ca -0.01 0.04 0.19 0.00 -0.02 0.00 0.00 57.16 57.37 2qlm n GLU 273 Cb 0.41 -1.55 0.96 0.00 -0.02 0.00 0.00 31.44 31.24 2qlm n GLU 273 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2qlm h ASN 274 N 0.00 0.00 -0.77 1.62 2.35 -0.89 -3.15 115.58 114.74 2qlm h ASN 274 Ca 0.00 0.00 0.10 0.00 -0.55 0.00 0.00 56.30 55.85 2qlm h ASN 274 Cb 0.52 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.81 2qlm h ASN 274 CO 0.00 0.00 0.40 0.40 -1.65 0.00 0.00 177.43 176.58 2qlm h ILE 275 N 0.00 0.84 -0.52 2.81 2.04 -1.74 -2.31 117.51 118.63 2qlm h ILE 275 Ca 0.00 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 2qlm h ILE 275 Cb 0.14 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 2qlm h ILE 275 CO 0.00 0.12 0.01 -1.54 0.00 0.00 0.00 178.15 176.74 2qlm n SER 276 N -4.83 5.36 -0.01 1.72 3.41 -1.19 -4.65 113.62 113.43 2qlm n SER 276 Ca 0.13 -2.97 -0.16 0.00 -0.26 0.00 0.00 58.87 55.60 2qlm n SER 276 Cb 0.31 -0.66 -0.10 0.00 -0.26 0.00 0.00 64.21 63.49 2qlm n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2qlm h ARG 277 N 3.52 0.45 -3.04 4.33 9.65 -1.54 -2.38 114.38 125.38 2qlm h ARG 277 Ca 0.01 -0.41 -0.15 0.00 -1.10 0.00 0.00 59.98 58.33 2qlm h ARG 277 Cb 1.91 0.10 -0.25 0.00 -1.39 0.00 0.00 29.97 30.33 2qlm h ARG 277 CO 0.46 1.05 -0.38 0.54 2.80 0.00 0.00 179.97 184.44 2qlm s VAL 278 N -3.47 -0.00 0.03 0.20 0.11 -1.26 -1.12 120.40 114.89 2qlm s VAL 278 Ca -0.13 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.62 2qlm s VAL 278 Cb 0.04 -0.41 -0.05 0.00 -1.53 0.00 0.00 36.38 34.43 2qlm s VAL 278 CO 0.82 0.00 1.26 -0.22 -3.33 0.00 0.00 175.10 173.63 2qlm s LEU 279 N 0.19 4.34 -0.08 2.54 2.96 -0.76 -5.00 118.68 122.87 2qlm s LEU 279 Ca -0.00 2.03 -0.30 0.00 -0.22 0.00 0.00 54.13 55.64 2qlm s LEU 279 Cb -0.02 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.04 2qlm s LEU 279 CO 0.00 -0.56 1.68 -0.31 -1.32 0.00 0.00 176.35 175.84 2qlm s TYR 280 N 1.52 1.94 -2.22 5.38 1.51 -1.26 -4.83 117.35 119.39 2qlm s TYR 280 Ca 0.60 0.23 0.19 0.00 -1.01 0.00 0.00 57.07 57.08 2qlm s TYR 280 Cb -0.30 -3.94 0.59 0.00 -0.11 0.00 0.00 41.96 38.20 2qlm s TYR 280 CO 0.27 -3.79 1.45 -0.35 -1.11 0.00 0.00 175.55 172.03 2qlm n PRO 281 N 7.28 1.91 -2.70 -1.71 -0.04 -1.26 -4.82 135.00 133.66 2qlm n PRO 281 Ca 0.18 -1.39 -0.42 0.00 -0.04 0.00 0.00 63.50 61.83 2qlm n PRO 281 Cb 0.43 -1.39 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 2qlm n PRO 281 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2qlm s ASN 282 N -1.38 6.24 -0.02 3.54 4.22 -1.26 -4.50 114.94 121.78 2qlm s ASN 282 Ca 0.32 -0.53 0.16 0.00 -2.14 0.00 0.00 52.86 50.67 2qlm s ASN 282 Cb 0.17 -2.49 0.46 0.00 1.28 0.00 0.00 41.25 40.67 2qlm s ASN 282 CO 0.25 -1.55 1.39 -0.90 -2.04 0.00 0.00 177.10 174.24 2qlm n ASP 283 N 8.37 3.45 -0.05 3.54 5.75 -1.26 -4.56 116.55 131.78 2qlm n ASP 283 Ca 0.01 -2.07 -0.06 0.00 -0.01 0.00 0.00 54.79 52.66 2qlm n ASP 283 Cb 0.48 -0.36 -0.07 0.00 -1.03 0.00 0.00 41.12 40.14 2qlm n ASP 283 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2qlm n ASN 284 N 0.90 2.67 -3.72 -1.12 6.94 -1.26 -5.03 115.26 114.64 2qlm n ASN 284 Ca 0.17 -0.02 -0.14 0.00 -0.02 0.00 0.00 54.58 54.57 2qlm n ASN 284 Cb 0.54 0.43 -0.15 0.00 -2.36 0.00 0.00 39.78 38.25 2qlm n ASN 284 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 2qlm s PHE 285 N -2.25 -0.20 0.19 -2.53 5.36 -1.26 -4.22 117.98 113.07 2qlm s PHE 285 Ca -0.09 0.59 -0.30 0.00 -0.96 0.00 0.00 56.93 56.16 2qlm s PHE 285 Cb 0.03 -0.12 -0.09 0.00 -0.34 0.00 0.00 43.02 42.51 2qlm s PHE 285 CO 0.37 -0.22 1.29 0.12 -1.46 0.00 0.00 175.22 175.33 2qlm s PHE 286 N 1.59 3.28 -0.13 10.12 2.19 0.46 -4.93 117.98 130.55 2qlm s PHE 286 Ca -0.05 1.25 0.01 0.00 0.33 0.00 0.00 56.93 58.46 2qlm s PHE 286 Cb -0.12 -3.58 0.02 0.00 -1.31 0.00 0.00 43.02 38.04 2qlm s PHE 286 CO -0.06 -1.79 -0.14 -2.00 1.83 0.00 0.00 175.22 173.06 2qlm s GLU 287 N -0.10 2.17 -1.40 10.12 2.12 -1.26 -5.00 118.70 125.34 2qlm s GLU 287 Ca 0.56 -0.52 -0.14 0.00 0.36 0.00 0.00 54.97 55.24 2qlm s GLU 287 Cb -0.36 -1.98 -0.01 0.00 0.26 0.00 0.00 34.13 32.04 2qlm s GLU 287 CO 0.38 -0.20 2.37 0.41 -0.54 0.00 0.00 175.26 177.68 2qlm n GLY 288 N 4.65 4.13 3.78 -1.50 0.00 -1.26 -4.92 105.19 110.06 2qlm n GLY 288 Ca -0.17 -1.50 -0.36 0.00 0.00 0.00 0.00 46.02 43.99 2qlm n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qlm s LYS 289 N 3.16 3.98 0.24 1.61 -0.14 -1.26 -5.00 119.74 122.33 2qlm s LYS 289 Ca 0.53 -0.07 -0.07 0.00 -1.36 0.00 0.00 55.97 55.01 2qlm s LYS 289 Cb 0.15 -3.34 0.27 0.00 -1.68 0.00 0.00 37.83 33.22 2qlm s LYS 289 CO -0.06 0.44 1.89 1.49 -0.76 0.00 0.00 175.35 178.35 2qlm h GLU 290 N 6.07 1.11 -0.82 1.68 4.81 -2.00 -1.99 114.58 123.43 2qlm h GLU 290 Ca -0.46 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 58.74 2qlm h GLU 290 Cb 1.18 -0.25 -0.05 0.00 0.63 0.00 0.00 28.75 30.27 2qlm h GLU 290 CO 0.70 0.73 0.54 1.25 -0.73 0.00 0.00 179.01 181.50 2qlm h LEU 291 N 1.14 0.89 -0.53 1.64 5.85 -1.99 -1.02 115.31 121.29 2qlm h LEU 291 Ca 0.35 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.97 2qlm h LEU 291 Cb -0.02 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 2qlm h LEU 291 CO -0.11 0.62 0.01 -0.09 -0.34 0.00 0.00 178.44 178.53 2qlm h ARG 292 N 1.04 0.93 -0.64 1.25 9.65 -1.76 -1.90 114.38 122.97 2qlm h ARG 292 Ca 0.32 -0.29 -0.00 0.00 -1.10 0.00 0.00 59.98 58.91 2qlm h ARG 292 Cb -0.00 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.46 2qlm h ARG 292 CO -0.09 0.95 0.39 1.25 2.80 0.00 0.00 179.97 185.27 2qlm h LEU 293 N 0.81 0.76 -0.80 3.80 5.85 -1.07 -1.50 115.31 123.16 2qlm h LEU 293 Ca 0.15 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.88 2qlm h LEU 293 Cb 0.52 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 2qlm h LEU 293 CO 0.03 0.59 0.49 0.11 -0.34 0.00 0.00 178.44 179.31 2qlm h LYS 294 N 0.87 0.87 -0.59 1.25 1.57 -0.99 -1.39 116.57 118.16 2qlm h LYS 294 Ca 0.23 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2qlm h LYS 294 Cb -0.03 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.05 2qlm h LYS 294 CO -0.04 0.57 0.35 1.96 -0.57 0.00 0.00 179.45 181.72 2qlm h GLN 295 N 0.89 0.80 -0.58 3.15 4.20 -0.90 0.04 115.11 122.72 2qlm h GLN 295 Ca 0.35 -0.08 -0.06 0.00 0.06 0.00 0.00 58.65 58.92 2qlm h GLN 295 Cb 0.16 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 2qlm h GLN 295 CO -0.17 0.58 0.11 0.93 -0.67 0.00 0.00 178.83 179.61 2qlm h GLU 296 N 0.79 0.95 -0.21 1.46 5.08 -0.74 -2.47 114.58 119.44 2qlm h GLU 296 Ca 0.21 -0.25 -0.20 0.00 -1.00 0.00 0.00 59.36 58.13 2qlm h GLU 296 Cb -0.01 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 29.13 2qlm h GLU 296 CO -0.04 0.89 -0.64 -0.92 -1.00 0.00 0.00 179.01 177.31 2qlm h TYR 297 N 0.85 1.04 -0.28 4.33 3.20 -1.14 -2.96 116.97 122.00 2qlm h TYR 297 Ca 0.18 -0.42 0.06 0.00 3.14 0.00 0.00 58.73 61.69 2qlm h TYR 297 Cb 0.40 -0.18 -0.07 0.00 1.54 0.00 0.00 36.73 38.42 2qlm h TYR 297 CO 0.03 1.24 -0.15 0.35 -1.64 0.00 0.00 178.16 177.99 2qlm h PHE 298 N 0.54 -0.38 -0.53 -3.82 3.57 -0.84 0.37 116.94 115.85 2qlm h PHE 298 Ca -0.02 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 2qlm h PHE 298 Cb 1.26 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 40.19 2qlm h PHE 298 CO 0.08 -0.23 0.08 -0.24 -2.23 0.00 0.00 178.31 175.78 2qlm h VAL 299 N -0.12 1.25 -0.02 1.41 3.04 -1.52 -2.51 116.25 117.78 2qlm h VAL 299 Ca 0.15 -0.96 -0.00 0.00 -1.01 0.00 0.00 66.70 64.88 2qlm h VAL 299 Cb 0.35 0.84 -0.00 0.00 -2.01 0.00 0.00 31.29 30.47 2qlm h VAL 299 CO -0.36 0.34 0.01 0.58 -1.01 0.00 0.00 177.57 177.13 2qlm h VAL 300 N 0.76 1.16 -0.24 1.51 2.07 -1.23 -1.38 116.25 118.90 2qlm h VAL 300 Ca 0.16 -0.48 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 2qlm h VAL 300 Cb 0.41 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 2qlm h VAL 300 CO 0.01 0.13 -0.02 0.00 0.02 0.00 0.00 177.57 177.71 2qlm h ALA 301 N 0.81 0.33 -0.46 1.67 0.00 -0.30 -1.59 119.26 119.72 2qlm h ALA 301 Ca 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2qlm h ALA 301 Cb 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2qlm h ALA 301 CO -0.00 0.09 0.17 0.00 0.00 0.00 0.00 179.25 179.51 2qlm h ALA 302 N 0.79 0.59 -0.20 0.00 0.00 -1.50 -2.86 119.26 116.08 2qlm h ALA 302 Ca 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2qlm h ALA 302 Cb 0.46 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2qlm h ALA 302 CO 0.02 0.21 0.11 1.15 0.00 0.00 0.00 179.25 180.74 2qlm h THR 303 N 0.60 1.11 -0.38 0.00 2.02 -1.20 -2.77 112.91 112.28 2qlm h THR 303 Ca 0.15 -0.29 -0.06 0.00 0.77 0.00 0.00 66.41 66.98 2qlm h THR 303 Cb 0.21 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 2qlm h THR 303 CO -0.01 0.10 -0.02 -0.07 0.37 0.00 0.00 175.52 175.89 2qlm h LEU 304 N 0.22 0.59 -0.93 2.58 4.07 -1.30 -0.59 115.31 119.96 2qlm h LEU 304 Ca 0.07 -0.13 -0.03 0.00 0.08 0.00 0.00 57.88 57.88 2qlm h LEU 304 Cb 0.07 -0.15 -0.04 0.00 1.08 0.00 0.00 40.66 41.61 2qlm h LEU 304 CO -0.01 0.67 0.42 1.56 -1.08 0.00 0.00 178.44 180.00 2qlm h GLN 305 N 0.58 1.19 -0.25 1.13 4.20 -1.46 -1.45 115.11 119.06 2qlm h GLN 305 Ca 0.12 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 2qlm h GLN 305 Cb 0.40 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2qlm h GLN 305 CO 0.02 0.90 0.00 0.22 -0.67 0.00 0.00 178.83 179.29 2qlm h ASP 306 N 1.19 0.42 -0.07 1.46 -0.00 -1.12 -1.56 116.42 116.74 2qlm h ASP 306 Ca 0.29 -0.31 0.02 0.00 -0.00 0.00 0.00 57.03 57.04 2qlm h ASP 306 Cb 0.08 -0.11 -0.02 0.00 -0.00 0.00 0.00 39.33 39.28 2qlm h ASP 306 CO -0.04 0.63 -0.06 0.40 -0.00 0.00 0.00 179.24 180.17 2qlm h ILE 307 N 0.21 0.83 -0.53 2.25 2.04 -1.01 -1.76 117.51 119.54 2qlm h ILE 307 Ca 0.07 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.87 2qlm h ILE 307 Cb 0.41 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 2qlm h ILE 307 CO 0.01 0.00 0.09 0.40 0.00 0.00 0.00 178.15 178.66 2qlm h ILE 308 N -0.07 1.25 -0.20 -0.67 2.04 -1.25 -0.76 117.51 117.84 2qlm h ILE 308 Ca 0.05 -0.93 0.04 0.00 1.00 0.00 0.00 64.86 65.02 2qlm h ILE 308 Cb 0.14 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 2qlm h ILE 308 CO -0.11 0.34 -0.04 -0.09 0.00 0.00 0.00 178.15 178.24 2qlm h ARG 309 N 0.75 0.01 -0.41 2.37 2.43 -1.20 -0.91 114.38 117.42 2qlm h ARG 309 Ca 0.16 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 2qlm h ARG 309 Cb 0.39 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2qlm h ARG 309 CO 0.01 0.01 0.07 -0.09 -1.51 0.00 0.00 179.97 178.46 2qlm h ARG 310 N 0.02 0.62 -0.59 0.20 2.43 -1.11 -1.21 114.38 114.74 2qlm h ARG 310 Ca 0.10 -0.12 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 2qlm h ARG 310 Cb 0.14 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 2qlm h ARG 310 CO -0.20 0.59 -0.02 0.35 -1.51 0.00 0.00 179.97 179.18 2qlm h PHE 311 N 0.60 1.15 -0.09 2.20 3.57 -0.71 -3.12 116.94 120.54 2qlm h PHE 311 Ca 0.14 -0.21 -0.16 0.00 3.53 0.00 0.00 57.97 61.27 2qlm h PHE 311 Cb 0.27 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 2qlm h PHE 311 CO 0.01 1.03 -0.64 0.87 -2.23 0.00 0.00 178.31 177.35 2qlm h LYS 312 N 0.95 0.35 -1.82 1.11 1.57 -0.79 -3.24 116.57 114.70 2qlm h LYS 312 Ca 0.16 -0.25 -0.20 0.00 -1.87 0.00 0.00 60.65 58.49 2qlm h LYS 312 Cb 0.58 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.85 2qlm h LYS 312 CO 0.03 0.88 0.15 0.43 -0.57 0.00 0.00 179.45 180.37 2qlm n SER 313 N -3.87 5.88 -0.01 0.86 7.64 -0.49 -5.01 113.62 118.62 2qlm n SER 313 Ca -0.03 -2.75 -0.01 0.00 1.01 0.00 0.00 58.87 57.08 2qlm n SER 313 Cb 0.65 -1.15 -0.00 0.00 -1.01 0.00 0.00 64.21 62.69 2qlm n SER 313 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2qlm h SER 314 N 1.66 -0.05 0.00 6.43 0.02 -1.66 -3.48 113.55 116.47 2qlm h SER 314 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2qlm h SER 314 Cb 1.01 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2qlm h SER 314 CO 0.41 0.33 0.00 0.41 -1.14 0.00 0.00 176.83 176.84 2qlm n THR 324 N -4.23 0.00 -3.10 -2.27 -1.04 -1.26 -5.04 114.28 97.34 2qlm n THR 324 Ca -0.01 0.00 -0.45 0.00 -2.04 0.00 0.00 64.05 61.55 2qlm n THR 324 Cb 0.03 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.50 2qlm n THR 324 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2qlm s ASN 325 N 0.00 6.28 0.00 8.00 3.04 -1.26 -4.91 114.94 126.10 2qlm s ASN 325 Ca 0.00 -1.59 0.31 0.00 0.04 0.00 0.00 52.86 51.62 2qlm s ASN 325 Cb 0.00 -2.31 1.72 0.00 -1.54 0.00 0.00 41.25 39.12 2qlm s ASN 325 CO 0.00 -1.08 2.14 0.49 -3.04 0.00 0.00 177.10 175.60 2qlm n PHE 326 N 6.23 0.00 0.08 0.43 3.72 -1.26 -3.48 117.46 123.18 2qlm n PHE 326 Ca -0.04 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.40 2qlm n PHE 326 Cb 0.44 -0.08 0.43 0.00 -0.94 0.00 0.00 39.48 39.33 2qlm n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2qlm h ASP 327 N 0.18 0.32 0.16 4.37 5.19 -1.97 -2.12 116.42 122.55 2qlm h ASP 327 Ca 0.00 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 2qlm h ASP 327 Cb 0.12 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.55 2qlm h ASP 327 CO 0.00 0.34 -0.08 0.00 -3.12 0.00 0.00 179.24 176.38 2qlm n ALA 328 N -2.49 2.74 -0.07 3.45 0.00 -1.23 -4.35 120.51 118.57 2qlm n ALA 328 Ca 0.01 -0.33 -0.07 0.00 0.00 0.00 0.00 53.44 53.04 2qlm n ALA 328 Cb 0.17 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.33 2qlm n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2qlm h PHE 329 N 1.12 -0.33 0.00 0.00 3.04 -1.58 -1.36 116.94 117.83 2qlm h PHE 329 Ca 0.00 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.98 2qlm h PHE 329 Cb 0.36 0.19 0.00 0.00 2.56 0.00 0.00 35.95 39.06 2qlm h PHE 329 CO 0.00 -0.21 0.00 -1.35 -2.02 0.00 0.00 178.31 174.73 2qlm h PRO 330 N -0.10 0.00 0.00 6.41 0.11 -1.79 -0.34 132.00 136.30 2qlm h PRO 330 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2qlm h PRO 330 Cb 0.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.43 2qlm h PRO 330 CO -0.34 0.00 -0.08 -0.44 -0.21 0.00 0.00 178.00 176.92 2qlm h ASP 331 N 0.00 0.00 -0.00 -2.05 3.32 -1.53 -3.34 116.42 112.82 2qlm h ASP 331 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2qlm h ASP 331 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2qlm h ASP 331 CO 0.00 0.00 -0.14 0.29 -1.72 0.00 0.00 179.24 177.67 2qlm n LYS 332 N -2.85 4.94 -4.01 3.56 4.76 -0.89 -4.53 118.16 119.14 2qlm n LYS 332 Ca 0.04 -0.10 -0.20 0.00 -2.87 0.00 0.00 58.31 55.18 2qlm n LYS 332 Cb 0.51 -0.73 -0.17 0.00 -1.84 0.00 0.00 35.03 32.80 2qlm n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2qlm s VAL 333 N -1.20 0.41 -0.08 -0.18 1.01 -0.19 -0.97 120.40 119.21 2qlm s VAL 333 Ca 0.02 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.03 2qlm s VAL 333 Cb 0.03 -0.48 -0.00 0.00 0.00 0.00 0.00 36.38 35.92 2qlm s VAL 333 CO 0.13 0.21 -0.24 0.00 0.00 0.00 0.00 175.10 175.21 2qlm s ALA 334 N 1.18 2.12 -0.23 5.51 0.00 -0.37 -4.50 121.76 125.47 2qlm s ALA 334 Ca -0.07 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 50.90 2qlm s ALA 334 Cb -0.14 -0.74 0.02 0.00 0.00 0.00 0.00 23.12 22.27 2qlm s ALA 334 CO -0.02 0.34 -0.09 0.42 0.00 0.00 0.00 175.76 176.41 2qlm s ILE 335 N 0.13 2.74 -0.23 0.00 1.01 -0.41 0.06 121.20 124.50 2qlm s ILE 335 Ca -0.12 -0.93 -0.10 0.00 0.00 0.00 0.00 60.65 59.50 2qlm s ILE 335 Cb -0.16 -2.32 -0.05 0.00 0.01 0.00 0.00 42.46 39.95 2qlm s ILE 335 CO 0.06 0.31 0.14 -1.58 0.00 0.00 0.00 174.94 173.88 2qlm s GLN 336 N 1.34 4.01 -0.39 2.79 2.00 0.47 -1.80 119.66 128.09 2qlm s GLN 336 Ca 0.02 -0.30 -0.17 0.00 -2.00 0.00 0.00 55.36 52.90 2qlm s GLN 336 Cb -0.15 -3.47 0.01 0.00 0.80 0.00 0.00 33.01 30.19 2qlm s GLN 336 CO -0.06 0.06 0.46 -0.51 -0.50 0.00 0.00 175.29 174.74 2qlm s LEU 337 N 1.02 4.61 -0.89 3.68 1.43 -0.25 -0.97 118.68 127.30 2qlm s LEU 337 Ca 0.07 -0.39 -0.25 0.00 -1.03 0.00 0.00 54.13 52.53 2qlm s LEU 337 Cb -0.14 -2.45 0.03 0.00 0.03 0.00 0.00 46.19 43.66 2qlm s LEU 337 CO 0.04 -0.52 1.48 0.21 0.23 0.00 0.00 176.35 177.80 2qlm s ASN 338 N 1.80 6.16 0.62 2.29 2.47 -0.52 -2.26 114.94 125.50 2qlm s ASN 338 Ca 0.14 -0.94 0.00 0.00 0.42 0.00 0.00 52.86 52.49 2qlm s ASN 338 Cb -0.16 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.07 2qlm s ASN 338 CO 0.14 -1.81 0.00 -0.67 -3.72 0.00 0.00 177.10 171.03 2qlm n ASP 339 N 9.89 -3.19 -0.19 -4.21 -0.08 -0.68 -4.11 116.55 113.97 2qlm n ASP 339 Ca 0.24 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.66 2qlm n ASP 339 Cb 0.50 0.00 0.61 0.00 2.34 0.00 0.00 41.12 44.57 2qlm n ASP 339 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2qlm n THR 340 N -0.88 0.00 -0.28 5.18 -2.24 -1.26 -4.33 114.28 110.47 2qlm n THR 340 Ca 0.00 -0.10 0.03 0.00 -2.27 0.00 0.00 64.05 61.71 2qlm n THR 340 Cb 0.00 0.03 0.17 0.00 -2.10 0.00 0.00 70.33 68.43 2qlm n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2qlm h HIS 341 N 0.94 0.75 -0.76 4.78 3.86 -1.96 0.11 115.15 122.88 2qlm h HIS 341 Ca 0.00 0.03 -0.32 0.00 -1.16 0.00 0.00 60.37 58.92 2qlm h HIS 341 Cb 0.35 -0.22 -0.19 0.00 1.06 0.00 0.00 27.41 28.42 2qlm h HIS 341 CO 0.00 0.27 0.41 -0.35 0.86 0.00 0.00 177.93 179.11 2qlm n PRO 342 N -4.82 2.74 0.33 2.45 -0.04 -1.26 -4.65 135.00 129.75 2qlm n PRO 342 Ca 0.13 -2.63 0.21 0.00 -0.04 0.00 0.00 63.50 61.17 2qlm n PRO 342 Cb 0.31 -2.06 1.15 0.00 -0.04 0.00 0.00 33.50 32.86 2qlm n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2qlm h SER 343 N 1.61 0.00 0.23 3.54 4.64 -1.02 -1.75 113.55 120.80 2qlm h SER 343 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2qlm h SER 343 Cb 2.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.47 2qlm h SER 343 CO 0.80 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.94 2qlm n LEU 344 N -3.27 0.16 -0.13 5.97 4.77 -1.26 -1.88 117.00 121.37 2qlm n LEU 344 Ca -0.03 0.56 0.13 0.00 -0.03 0.00 0.00 56.01 56.64 2qlm n LEU 344 Cb 0.07 -0.56 0.49 0.00 -2.33 0.00 0.00 43.42 41.09 2qlm n LEU 344 CO 0.22 -0.50 1.20 0.00 -1.33 0.00 0.00 177.39 176.97 2qlm h ALA 345 N 2.18 2.04 0.54 -1.18 0.00 -1.68 -0.27 119.26 120.90 2qlm h ALA 345 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2qlm h ALA 345 Cb 0.12 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.83 2qlm h ALA 345 CO 0.00 -0.21 -0.26 0.82 0.00 0.00 0.00 179.25 179.60 2qlm h ILE 346 N 0.43 0.24 0.00 0.00 2.04 -1.63 -0.52 117.51 118.08 2qlm h ILE 346 Ca 0.32 -0.43 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 2qlm h ILE 346 Cb 0.67 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 2qlm h ILE 346 CO -0.10 0.04 -0.16 1.55 0.00 0.00 0.00 178.15 179.48 2qlm h PRO 347 N -1.07 0.00 -0.34 2.37 0.13 -1.74 -2.45 132.00 128.89 2qlm h PRO 347 Ca -0.07 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.94 2qlm h PRO 347 Cb 0.62 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 2qlm h PRO 347 CO 0.12 0.16 -0.24 1.49 -0.23 0.00 0.00 178.00 179.31 2qlm h GLU 348 N 0.00 0.76 -0.62 0.86 4.57 -1.03 0.03 114.58 119.14 2qlm h GLU 348 Ca -0.00 -0.36 -0.00 0.00 -1.18 0.00 0.00 59.36 57.81 2qlm h GLU 348 Cb 0.65 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.20 2qlm h GLU 348 CO 0.02 0.98 0.38 1.25 -1.18 0.00 0.00 179.01 180.47 2qlm h LEU 349 N 0.53 0.74 -0.54 1.64 5.85 -1.00 -1.35 115.31 121.18 2qlm h LEU 349 Ca 0.07 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.75 2qlm h LEU 349 Cb 0.79 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 2qlm h LEU 349 CO 0.06 0.57 0.34 0.24 -0.34 0.00 0.00 178.44 179.32 2qlm h MET 350 N 0.84 0.67 -0.12 1.25 2.86 -1.36 -1.20 114.93 117.86 2qlm h MET 350 Ca 0.22 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.85 2qlm h MET 350 Cb -0.04 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.45 2qlm h MET 350 CO -0.04 0.44 -0.02 -0.09 1.06 0.00 0.00 176.91 178.26 2qlm h ARG 351 N 0.69 0.02 -0.24 1.72 2.43 -0.67 0.28 114.38 118.60 2qlm h ARG 351 Ca 0.21 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 2qlm h ARG 351 Cb -0.03 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 2qlm h ARG 351 CO -0.07 0.01 0.13 0.28 -1.51 0.00 0.00 179.97 178.81 2qlm h VAL 352 N 0.02 1.12 -0.43 0.20 2.07 -1.12 0.81 116.25 118.92 2qlm h VAL 352 Ca 0.06 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.18 2qlm h VAL 352 Cb 0.08 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2qlm h VAL 352 CO -0.11 0.12 -0.01 -0.07 0.02 0.00 0.00 177.57 177.51 2qlm h LEU 353 N 0.28 0.76 0.00 2.57 3.38 -1.03 -0.96 115.31 120.31 2qlm h LEU 353 Ca 0.08 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 2qlm h LEU 353 Cb 0.07 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2qlm h LEU 353 CO -0.01 0.89 -0.13 0.58 0.09 0.00 0.00 178.44 179.86 2qlm h VAL 354 N 0.60 0.85 -0.05 1.22 2.07 -0.94 -1.39 116.25 118.62 2qlm h VAL 354 Ca 0.12 -1.68 -0.20 0.00 0.82 0.00 0.00 66.70 65.76 2qlm h VAL 354 Cb 0.51 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.93 2qlm h VAL 354 CO 0.02 0.29 -0.82 0.44 0.02 0.00 0.00 177.57 177.52 2qlm h ASP 355 N -1.00 0.53 0.00 0.57 3.45 -0.96 -2.94 116.42 116.06 2qlm h ASP 355 Ca -0.03 -0.38 -0.38 0.00 0.43 0.00 0.00 57.03 56.68 2qlm h ASP 355 Cb 0.57 -0.16 -0.06 0.00 -0.56 0.00 0.00 39.33 39.12 2qlm h ASP 355 CO -0.02 1.15 -2.35 0.18 -1.57 0.00 0.00 179.24 176.63 2qlm n LEU 356 N -3.80 2.53 -0.00 1.55 4.77 -0.75 -4.57 117.00 116.73 2qlm n LEU 356 Ca -0.05 0.03 0.12 0.00 -0.03 0.00 0.00 56.01 56.08 2qlm n LEU 356 Cb 0.76 -0.79 0.19 0.00 -2.33 0.00 0.00 43.42 41.26 2qlm n LEU 356 CO 0.50 0.76 0.37 -0.62 -1.33 0.00 0.00 177.39 177.06 2qlm n GLU 357 N -3.53 0.00 -1.39 3.23 -0.58 -0.44 -4.97 120.64 112.97 2qlm n GLU 357 Ca -0.44 -0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.18 2qlm n GLU 357 Cb 0.91 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 30.23 2qlm n GLU 357 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2qlm n ARG 358 N -1.50 -0.82 -2.03 3.49 5.12 -0.82 -4.96 116.66 115.14 2qlm n ARG 358 Ca 0.05 0.90 -0.35 0.00 -1.93 0.00 0.00 57.85 56.52 2qlm n ARG 358 Cb 0.33 -4.90 0.03 0.00 -1.16 0.00 0.00 32.46 26.76 2qlm n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2qlm s LEU 359 N -2.71 3.62 0.71 0.55 1.02 -0.59 -4.98 118.68 116.30 2qlm s LEU 359 Ca 0.00 2.20 -0.13 0.00 0.02 0.00 0.00 54.13 56.22 2qlm s LEU 359 Cb 0.00 -4.58 0.03 0.00 0.02 0.00 0.00 46.19 41.66 2qlm s LEU 359 CO 0.00 -1.48 1.11 1.51 0.02 0.00 0.00 176.35 177.51 2qlm s ASP 360 N -1.92 4.81 0.12 2.29 -4.77 -1.26 -4.41 116.67 111.52 2qlm s ASP 360 Ca 0.73 1.94 -0.25 0.00 -3.30 0.00 0.00 52.55 51.67 2qlm s ASP 360 Cb -0.25 -2.54 -0.05 0.00 -1.09 0.00 0.00 42.92 38.99 2qlm s ASP 360 CO 0.33 -1.83 1.65 -0.25 0.70 0.00 0.00 175.17 175.77 2qlm h TRP 361 N -0.46 -0.54 -0.97 2.11 2.91 -1.98 -2.04 115.95 114.98 2qlm h TRP 361 Ca -0.45 0.02 0.01 0.00 1.13 0.00 0.00 58.89 59.60 2qlm h TRP 361 Cb 1.24 0.24 -0.05 0.00 -0.51 0.00 0.00 29.16 30.09 2qlm h TRP 361 CO 0.56 -0.29 0.64 -0.44 -1.03 0.00 0.00 178.44 177.87 2qlm h ASP 362 N -0.32 1.10 -0.21 2.65 3.45 -1.99 0.44 116.42 121.54 2qlm h ASP 362 Ca 0.06 -0.03 -0.05 0.00 0.43 0.00 0.00 57.03 57.45 2qlm h ASP 362 Cb 0.41 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.90 2qlm h ASP 362 CO -0.20 0.79 -0.08 0.50 -1.57 0.00 0.00 179.24 178.68 2qlm h LYS 363 N 1.29 0.42 -0.60 3.56 1.63 -1.92 -1.99 116.57 118.97 2qlm h LYS 363 Ca 0.36 -0.17 0.04 0.00 -0.85 0.00 0.00 60.65 60.03 2qlm h LYS 363 Cb -0.12 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 31.44 2qlm h LYS 363 CO -0.08 0.69 0.34 0.00 -3.45 0.00 0.00 179.45 176.94 2qlm h ALA 364 N 0.72 0.79 -0.83 5.00 0.00 -0.92 -1.80 119.26 122.21 2qlm h ALA 364 Ca 0.05 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2qlm h ALA 364 Cb 0.55 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 2qlm h ALA 364 CO 0.03 0.03 0.39 2.35 0.00 0.00 0.00 179.25 182.04 2qlm h TRP 365 N 0.65 1.22 -0.21 0.00 2.91 -0.88 -0.18 115.95 119.45 2qlm h TRP 365 Ca 0.26 -0.07 0.01 0.00 1.13 0.00 0.00 58.89 60.22 2qlm h TRP 365 Cb 0.11 -0.37 -0.01 0.00 -0.51 0.00 0.00 29.16 28.38 2qlm h TRP 365 CO -0.08 0.89 0.13 1.49 -1.03 0.00 0.00 178.44 179.84 2qlm h GLU 366 N 1.19 0.26 -0.18 2.65 4.81 -0.95 -1.24 114.58 121.12 2qlm h GLU 366 Ca 0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2qlm h GLU 366 Cb 0.14 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2qlm h GLU 366 CO -0.03 0.17 0.12 0.28 -0.73 0.00 0.00 179.01 178.82 2qlm h VAL 367 N 0.27 1.05 0.01 0.32 2.07 -1.03 -2.66 116.25 116.29 2qlm h VAL 367 Ca 0.08 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.51 2qlm h VAL 367 Cb -0.02 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2qlm h VAL 367 CO -0.03 0.05 -0.11 0.74 0.02 0.00 0.00 177.57 178.24 2qlm h THR 368 N 0.23 0.73 -0.21 2.57 2.02 -0.84 -1.51 112.91 115.90 2qlm h THR 368 Ca 0.06 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.26 2qlm h THR 368 Cb -0.01 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 2qlm h THR 368 CO -0.01 0.00 0.09 0.58 0.37 0.00 0.00 175.52 176.54 2qlm h VAL 369 N -0.19 0.97 0.00 3.16 2.07 -1.23 -1.47 116.25 119.56 2qlm h VAL 369 Ca 0.04 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2qlm h VAL 369 Cb 0.24 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2qlm h VAL 369 CO -0.10 0.04 0.00 0.11 0.02 0.00 0.00 177.57 177.63 2qlm h LYS 370 N 0.19 0.00 0.13 1.57 1.57 -1.36 -1.82 116.57 116.85 2qlm h LYS 370 Ca 0.09 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.54 2qlm h LYS 370 Cb 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 2qlm h LYS 370 CO -0.08 0.00 -1.71 1.15 -0.57 0.00 0.00 179.45 178.23 2qlm h THR 371 N 0.00 0.95 -2.78 -0.16 2.02 -0.54 -3.47 112.91 108.93 2qlm h THR 371 Ca 0.00 -2.60 -0.65 0.00 0.77 0.00 0.00 66.41 63.92 2qlm h THR 371 Cb 0.32 2.68 -0.07 0.00 -1.74 0.00 0.00 68.15 69.35 2qlm h THR 371 CO 0.00 0.82 -0.50 0.00 0.37 0.00 0.00 175.52 176.21 2qlm s ALA 373 N -1.18 0.31 -0.06 0.00 0.00 -0.74 -1.60 121.76 118.49 2qlm s ALA 373 Ca 0.21 -0.65 0.04 0.00 0.00 0.00 0.00 51.96 51.57 2qlm s ALA 373 Cb -0.12 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.10 2qlm s ALA 373 CO 0.12 -0.09 -0.18 -0.47 0.00 0.00 0.00 175.76 175.13 2qlm s TYR 374 N -1.37 1.90 -0.20 0.00 6.14 -0.28 -1.09 117.35 122.45 2qlm s TYR 374 Ca -0.13 -0.65 -0.03 0.00 0.64 0.00 0.00 57.07 56.90 2qlm s TYR 374 Cb -0.10 -1.30 -0.01 0.00 0.42 0.00 0.00 41.96 40.98 2qlm s TYR 374 CO -0.00 -0.26 -0.06 0.99 0.64 0.00 0.00 175.55 176.86 2qlm s THR 375 N 0.27 3.33 0.02 4.34 2.01 -0.96 -1.67 115.64 122.97 2qlm s THR 375 Ca -0.10 -0.52 -0.11 0.00 0.31 0.00 0.00 61.69 61.27 2qlm s THR 375 Cb -0.14 -2.49 -0.05 0.00 0.01 0.00 0.00 72.50 69.82 2qlm s THR 375 CO 0.04 0.45 0.36 0.21 -0.69 0.00 0.00 174.62 174.99 2qlm s ASN 376 N 1.24 6.67 0.00 3.53 3.84 -0.58 -1.69 114.94 127.95 2qlm s ASN 376 Ca 0.03 0.80 0.00 0.00 0.21 0.00 0.00 52.86 53.90 2qlm s ASN 376 Cb -0.14 -2.19 0.00 0.00 -0.55 0.00 0.00 41.25 38.37 2qlm s ASN 376 CO -0.02 0.27 0.40 1.41 -2.79 0.00 0.00 177.10 176.37 2qlm n HIS 377 N 1.43 0.00 -3.52 0.43 8.25 -1.26 -4.24 115.22 116.30 2qlm n HIS 377 Ca -0.12 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.18 2qlm n HIS 377 Cb 0.53 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.58 2qlm n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2qlm s THR 378 N -0.15 0.00 -1.86 1.59 -1.32 -1.26 -4.48 115.64 108.16 2qlm s THR 378 Ca 0.00 0.00 0.20 0.00 -1.21 0.00 0.00 61.69 60.68 2qlm s THR 378 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 2qlm s THR 378 CO 0.00 0.00 1.00 1.33 -2.21 0.00 0.00 174.62 174.74 2qlm n VAL 379 N 0.80 0.00 -2.14 5.08 0.24 -1.26 -4.95 118.33 116.09 2qlm n VAL 379 Ca -0.17 -0.30 -0.43 0.00 -2.04 0.00 0.00 64.34 61.40 2qlm n VAL 379 Cb 0.58 1.24 -0.03 0.00 -1.47 0.00 0.00 33.84 34.16 2qlm n VAL 379 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2qlm s LEU 380 N -2.27 4.18 0.29 1.34 1.43 -1.26 -4.91 118.68 117.47 2qlm s LEU 380 Ca 0.17 1.94 -0.00 0.00 -1.03 0.00 0.00 54.13 55.20 2qlm s LEU 380 Cb 0.16 -3.53 0.45 0.00 0.03 0.00 0.00 46.19 43.30 2qlm s LEU 380 CO 0.49 -0.97 1.85 1.55 0.23 0.00 0.00 176.35 179.51 2qlm h PRO 381 N 9.49 0.78 0.00 1.29 0.13 -1.98 -2.39 132.00 139.32 2qlm h PRO 381 Ca -0.34 -0.15 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2qlm h PRO 381 Cb 1.15 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2qlm h PRO 381 CO 0.97 0.70 0.00 1.05 -0.23 0.00 0.00 178.00 180.49 2qlm h GLU 382 N 0.76 0.00 0.00 0.86 9.09 -1.91 -2.29 114.58 121.09 2qlm h GLU 382 Ca 0.17 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.58 2qlm h GLU 382 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 2qlm h GLU 382 CO -0.00 0.00 -0.71 0.00 0.05 0.00 0.00 179.01 178.34 2qlm n ALA 383 N -1.87 3.50 -1.75 1.06 0.00 -0.90 -0.40 120.51 120.14 2qlm n ALA 383 Ca -0.00 -0.37 -0.40 0.00 0.00 0.00 0.00 53.44 52.67 2qlm n ALA 383 Cb 0.14 -1.06 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 2qlm n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qlm s LEU 384 N -3.49 4.63 -0.16 0.00 1.43 -0.86 -4.53 118.68 115.70 2qlm s LEU 384 Ca 0.08 2.01 -0.29 0.00 -1.03 0.00 0.00 54.13 54.89 2qlm s LEU 384 Cb 0.16 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.75 2qlm s LEU 384 CO 0.75 0.10 1.17 -1.61 0.23 0.00 0.00 176.35 176.99 2qlm s GLU 385 N -1.24 4.28 -0.37 1.70 2.02 -1.26 -4.74 118.70 119.09 2qlm s GLU 385 Ca 0.42 1.56 0.00 0.00 0.02 0.00 0.00 54.97 56.98 2qlm s GLU 385 Cb -0.27 -3.68 0.12 0.00 0.10 0.00 0.00 34.13 30.40 2qlm s GLU 385 CO 0.34 -0.61 0.17 1.03 0.02 0.00 0.00 175.26 176.21 2qlm s ARG 386 N 3.06 0.88 -0.07 1.61 0.52 -1.26 -2.24 118.95 121.45 2qlm s ARG 386 Ca 0.52 -1.46 -0.29 0.00 -0.52 0.00 0.00 55.73 53.97 2qlm s ARG 386 Cb -0.20 -1.96 -0.02 0.00 0.52 0.00 0.00 34.95 33.28 2qlm s ARG 386 CO 0.14 -1.10 0.98 -1.58 0.02 0.00 0.00 175.30 173.76 2qlm s TRP 387 N 1.04 3.56 0.29 -0.53 0.52 -0.87 -4.73 118.94 118.22 2qlm s TRP 387 Ca 0.14 1.60 -0.30 0.00 0.02 0.00 0.00 56.10 57.56 2qlm s TRP 387 Cb -0.21 -3.14 -0.13 0.00 -1.15 0.00 0.00 33.47 28.84 2qlm s TRP 387 CO -0.11 -0.14 1.34 -2.30 0.02 0.00 0.00 176.95 175.76 2qlm n PRO 388 N 4.61 2.06 -0.11 4.98 -0.02 -1.26 -0.43 135.00 144.83 2qlm n PRO 388 Ca 0.07 0.73 -0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2qlm n PRO 388 Cb 0.50 -2.34 0.26 0.00 -0.02 0.00 0.00 33.50 31.90 2qlm n PRO 388 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2qlm h VAL 389 N 2.78 1.19 0.00 -1.45 2.07 -1.39 -2.77 116.25 116.68 2qlm h VAL 389 Ca -0.45 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.45 2qlm h VAL 389 Cb 1.28 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2qlm h VAL 389 CO 0.69 0.23 -0.18 1.12 0.02 0.00 0.00 177.57 179.45 2qlm h HIS 390 N 0.77 0.00 -0.15 1.57 2.07 -1.91 0.85 115.15 118.36 2qlm h HIS 390 Ca 0.19 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.67 2qlm h HIS 390 Cb 0.13 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.11 2qlm h HIS 390 CO 0.01 0.18 -0.06 -0.07 -3.07 0.00 0.00 177.93 174.92 2qlm h LEU 391 N 0.00 0.31 -0.64 6.12 3.38 -1.87 -2.85 115.31 119.76 2qlm h LEU 391 Ca -0.00 -0.40 -0.13 0.00 0.09 0.00 0.00 57.88 57.44 2qlm h LEU 391 Cb 0.32 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2qlm h LEU 391 CO 0.02 0.64 -0.31 -0.07 0.09 0.00 0.00 178.44 178.81 2qlm h LEU 392 N -0.02 0.75 -0.73 1.67 3.38 -1.38 -0.71 115.31 118.27 2qlm h LEU 392 Ca 0.03 -0.30 0.08 0.00 0.09 0.00 0.00 57.88 57.78 2qlm h LEU 392 Cb 0.52 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 2qlm h LEU 392 CO 0.02 1.01 0.40 -0.08 0.09 0.00 0.00 178.44 179.88 2qlm h GLU 393 N 0.62 0.69 0.04 1.13 4.81 -0.90 0.26 114.58 121.22 2qlm h GLU 393 Ca 0.07 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 2qlm h GLU 393 Cb 0.83 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 30.06 2qlm h GLU 393 CO 0.07 0.46 -0.26 1.15 -0.73 0.00 0.00 179.01 179.70 2qlm h THR 394 N 0.71 1.68 0.21 0.32 2.02 -1.32 -3.29 112.91 113.24 2qlm h THR 394 Ca 0.34 -2.32 -0.28 0.00 0.77 0.00 0.00 66.41 64.92 2qlm h THR 394 Cb 0.27 3.24 0.03 0.00 -1.74 0.00 0.00 68.15 69.95 2qlm h THR 394 CO -0.22 0.62 -1.22 0.25 0.37 0.00 0.00 175.52 175.32 2qlm h LEU 395 N -0.75 0.71 -5.96 2.58 5.85 -1.11 -3.38 115.31 113.27 2qlm h LEU 395 Ca -0.04 -0.93 -0.54 0.00 0.84 0.00 0.00 57.88 57.21 2qlm h LEU 395 Cb 1.17 -0.23 -0.40 0.00 0.37 0.00 0.00 40.66 41.57 2qlm h LEU 395 CO 0.05 1.59 -1.05 0.18 -0.34 0.00 0.00 178.44 178.87 2qlm n LEU 396 N -3.88 1.16 -0.27 2.25 4.77 0.90 -0.38 117.00 121.55 2qlm n LEU 396 Ca -0.16 -4.98 0.07 0.00 -0.03 0.00 0.00 56.01 50.92 2qlm n LEU 396 Cb 1.00 0.44 0.31 0.00 -2.33 0.00 0.00 43.42 42.83 2qlm n LEU 396 CO 0.56 2.18 1.23 1.55 -1.33 0.00 0.00 177.39 181.58 2qlm h PRO 397 N 3.54 0.83 -0.19 3.23 0.13 -1.60 -2.11 132.00 135.83 2qlm h PRO 397 Ca 0.10 -0.05 -0.17 0.00 -0.87 0.00 0.00 66.00 65.01 2qlm h PRO 397 Cb 0.86 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 2qlm h PRO 397 CO 0.54 0.55 -0.59 -0.09 -0.23 0.00 0.00 178.00 178.19 2qlm h ARG 398 N 0.86 0.62 -0.49 0.86 9.65 -1.91 -2.88 114.38 121.09 2qlm h ARG 398 Ca 0.40 -0.41 -0.07 0.00 -1.10 0.00 0.00 59.98 58.80 2qlm h ARG 398 Cb 0.40 0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.02 2qlm h ARG 398 CO -0.17 1.03 0.02 0.45 2.80 0.00 0.00 179.97 184.11 2qlm h HIS 399 N 0.47 0.84 -0.34 2.20 3.86 -1.76 -1.38 115.15 119.04 2qlm h HIS 399 Ca -0.00 -0.11 -0.02 0.00 -1.16 0.00 0.00 60.37 59.08 2qlm h HIS 399 Cb 1.16 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.38 2qlm h HIS 399 CO 0.05 0.76 0.15 1.25 0.86 0.00 0.00 177.93 181.00 2qlm h LEU 400 N 0.74 0.46 -0.63 2.43 6.46 -1.40 -0.07 115.31 123.31 2qlm h LEU 400 Ca 0.15 -0.15 0.06 0.00 -0.12 0.00 0.00 57.88 57.82 2qlm h LEU 400 Cb 0.42 -0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 40.18 2qlm h LEU 400 CO 0.02 0.48 0.34 1.56 -0.62 0.00 0.00 178.44 180.21 2qlm h GLN 401 N 0.41 0.60 -0.58 1.25 4.20 -1.27 -0.57 115.11 119.15 2qlm h GLN 401 Ca 0.12 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.71 2qlm h GLN 401 Cb 0.15 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 2qlm h GLN 401 CO -0.01 0.40 0.06 0.82 -0.67 0.00 0.00 178.83 179.43 2qlm h ILE 402 N 0.62 1.26 -0.62 2.54 2.04 -1.02 -2.27 117.51 120.06 2qlm h ILE 402 Ca 0.29 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.11 2qlm h ILE 402 Cb 0.20 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 2qlm h ILE 402 CO -0.19 0.38 0.39 0.40 0.00 0.00 0.00 178.15 179.13 2qlm h ILE 403 N 0.88 1.18 -0.92 -0.67 2.04 -0.51 0.19 117.51 119.70 2qlm h ILE 403 Ca 0.17 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 2qlm h ILE 403 Cb 0.47 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 2qlm h ILE 403 CO 0.02 0.18 0.51 1.88 0.00 0.00 0.00 178.15 180.74 2qlm h TYR 404 N 0.84 1.25 -0.44 1.37 0.05 -0.95 0.11 116.97 119.20 2qlm h TYR 404 Ca 0.23 -0.02 -0.12 0.00 0.05 0.00 0.00 58.73 58.86 2qlm h TYR 404 Cb -0.04 -0.40 -0.01 0.00 1.01 0.00 0.00 36.73 37.28 2qlm h TYR 404 CO -0.02 0.86 -0.18 1.49 -1.05 0.00 0.00 178.16 179.25 2qlm h GLU 405 N 1.28 0.89 -0.41 4.88 4.57 -1.05 -1.53 114.58 123.20 2qlm h GLU 405 Ca 0.32 -0.38 0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2qlm h GLU 405 Cb 0.01 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.53 2qlm h GLU 405 CO -0.05 1.03 0.22 0.82 -1.18 0.00 0.00 179.01 179.84 2qlm h ILE 406 N 0.72 1.00 -0.36 2.32 2.04 -0.64 -2.56 117.51 120.03 2qlm h ILE 406 Ca 0.10 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 2qlm h ILE 406 Cb 0.74 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 2qlm h ILE 406 CO 0.06 0.08 0.21 -1.13 0.00 0.00 0.00 178.15 177.37 2qlm h ASN 407 N 0.44 0.44 -0.12 1.72 -1.24 -0.72 -0.43 115.58 115.68 2qlm h ASN 407 Ca 0.17 -0.07 0.00 0.00 0.71 0.00 0.00 56.30 57.11 2qlm h ASN 407 Cb 0.06 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 38.99 2qlm h ASN 407 CO -0.11 0.38 0.07 -0.61 -1.29 0.00 0.00 177.43 175.88 2qlm h GLN 408 N 0.47 0.16 -0.44 6.67 4.15 -1.24 0.04 115.11 124.92 2qlm h GLN 408 Ca 0.13 -0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.46 2qlm h GLN 408 Cb 0.03 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.67 2qlm h GLN 408 CO -0.02 0.12 -0.06 0.00 -1.93 0.00 0.00 178.83 176.94 2qlm h ARG 409 N 0.14 0.75 -0.32 1.69 3.08 -1.33 -1.34 114.38 117.06 2qlm h ARG 409 Ca 0.04 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 59.79 2qlm h ARG 409 Cb 0.00 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2qlm h ARG 409 CO -0.01 0.80 -0.09 0.35 -1.07 0.00 0.00 179.97 179.95 2qlm h PHE 410 N 0.69 0.71 0.00 3.04 3.57 -0.86 -2.94 116.94 121.16 2qlm h PHE 410 Ca 0.13 -0.16 -0.06 0.00 3.53 0.00 0.00 57.97 61.40 2qlm h PHE 410 Cb 0.51 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 2qlm h PHE 410 CO 0.03 0.82 -0.31 -0.07 -2.23 0.00 0.00 178.31 176.54 2qlm h LEU 411 N 0.40 0.00 -0.79 0.59 3.38 -0.84 -2.06 115.31 116.00 2qlm h LEU 411 Ca 0.08 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 2qlm h LEU 411 Cb 0.60 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2qlm h LEU 411 CO 0.04 0.31 0.06 0.78 0.09 0.00 0.00 178.44 179.72 2qlm h ASN 412 N 0.00 0.94 -0.57 -0.43 -0.26 -1.19 -0.94 115.58 113.14 2qlm h ASN 412 Ca -0.00 -0.23 -0.05 0.00 -0.56 0.00 0.00 56.30 55.46 2qlm h ASN 412 Cb 0.69 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 37.68 2qlm h ASN 412 CO 0.04 0.96 0.16 0.03 -1.06 0.00 0.00 177.43 177.57 2qlm h ARG 413 N 0.92 0.89 -0.20 0.81 3.08 -1.25 -2.12 114.38 116.51 2qlm h ARG 413 Ca 0.18 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2qlm h ARG 413 Cb 0.45 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 2qlm h ARG 413 CO 0.02 0.81 0.09 0.28 -1.07 0.00 0.00 179.97 180.10 2qlm h VAL 414 N 0.80 1.15 -0.72 2.04 2.07 -1.21 -1.84 116.25 118.53 2qlm h VAL 414 Ca 0.18 -0.43 0.01 0.00 0.82 0.00 0.00 66.70 67.28 2qlm h VAL 414 Cb 0.30 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 2qlm h VAL 414 CO -0.00 0.14 0.48 0.00 0.02 0.00 0.00 177.57 178.21 2qlm h ALA 415 N 0.94 1.51 0.00 1.67 0.00 -1.14 0.15 119.26 122.39 2qlm h ALA 415 Ca 0.07 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 2qlm h ALA 415 Cb 0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2qlm h ALA 415 CO -0.01 0.44 -0.65 0.00 0.00 0.00 0.00 179.25 179.04 2qlm h ALA 416 N 1.56 0.91 0.02 0.00 0.00 -1.20 -2.81 119.26 117.73 2qlm h ALA 416 Ca 0.27 -0.59 -0.26 0.00 0.00 0.00 0.00 54.91 54.33 2qlm h ALA 416 Cb -0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2qlm h ALA 416 CO -0.06 0.81 -1.39 0.00 0.00 0.00 0.00 179.25 178.60 2qlm h ALA 417 N 1.35 0.52 -2.13 0.00 0.00 -0.65 -3.40 119.26 114.97 2qlm h ALA 417 Ca -0.01 -1.18 -0.58 0.00 0.00 0.00 0.00 54.91 53.14 2qlm h ALA 417 Cb 1.16 0.19 -0.40 0.00 0.00 0.00 0.00 17.79 18.74 2qlm h ALA 417 CO 0.08 1.38 -0.90 1.19 0.00 0.00 0.00 179.25 181.00 2qlm n PHE 418 N -3.24 1.16 -1.90 0.00 3.72 0.46 -5.09 117.46 112.57 2qlm n PHE 418 Ca -0.10 -3.78 -0.42 0.00 -0.05 0.00 0.00 57.45 53.10 2qlm n PHE 418 Cb 1.00 -0.40 -0.02 0.00 -0.94 0.00 0.00 39.48 39.12 2qlm n PHE 418 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2qlm s PRO 419 N -1.58 4.20 0.00 -1.08 0.02 -1.06 -2.39 135.00 133.11 2qlm s PRO 419 Ca 0.36 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.80 2qlm s PRO 419 Cb 0.15 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.56 2qlm s PRO 419 CO -0.08 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.43 2qlm n GLY 420 N 2.96 1.67 3.42 0.52 0.00 -1.26 -4.97 105.19 107.53 2qlm n GLY 420 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 2qlm n GLY 420 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2qlm n ASP 421 N 0.00 5.05 0.02 1.61 4.64 -1.00 -4.80 116.55 122.06 2qlm n ASP 421 Ca 0.00 -2.96 -0.03 0.00 -1.38 0.00 0.00 54.79 50.41 2qlm n ASP 421 Cb 0.00 -1.63 0.20 0.00 -1.04 0.00 0.00 41.12 38.66 2qlm n ASP 421 CO 0.00 0.00 0.00 -0.37 -0.82 0.00 0.00 177.20 176.01 2qlm h VAL 422 N 4.84 1.27 -0.26 5.18 -1.51 -1.93 -2.92 116.25 120.92 2qlm h VAL 422 Ca 0.38 -1.28 -0.13 0.00 -1.23 0.00 0.00 66.70 64.45 2qlm h VAL 422 Cb 0.84 1.37 -0.01 0.00 -2.13 0.00 0.00 31.29 31.35 2qlm h VAL 422 CO 1.38 0.40 -0.37 -0.78 -1.23 0.00 0.00 177.57 176.97 2qlm h ASP 423 N 0.41 0.61 -0.81 4.19 3.58 -2.00 -2.69 116.42 119.72 2qlm h ASP 423 Ca 0.06 -0.26 0.04 0.00 0.42 0.00 0.00 57.03 57.29 2qlm h ASP 423 Cb 0.67 -0.17 -0.05 0.00 1.72 0.00 0.00 39.33 41.50 2qlm h ASP 423 CO 0.05 0.92 0.51 -0.09 -2.88 0.00 0.00 179.24 177.76 2qlm h ARG 424 N 0.49 0.96 -0.74 0.28 2.43 -1.93 -0.62 114.38 115.25 2qlm h ARG 424 Ca 0.05 -0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.22 2qlm h ARG 424 Cb 0.87 -0.22 -0.06 0.00 -0.42 0.00 0.00 29.97 30.14 2qlm h ARG 424 CO 0.07 0.64 0.44 -0.07 -1.51 0.00 0.00 179.97 179.53 2qlm h LEU 425 N 0.99 0.67 -0.38 3.80 3.38 -1.33 0.02 115.31 122.45 2qlm h LEU 425 Ca 0.33 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.16 2qlm h LEU 425 Cb 0.04 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2qlm h LEU 425 CO -0.13 0.43 -0.76 0.08 0.09 0.00 0.00 178.44 178.15 2qlm h ARG 426 N 0.80 0.00 -0.22 1.13 -0.00 -1.18 -2.75 114.38 112.16 2qlm h ARG 426 Ca 0.33 0.00 -0.15 0.00 -0.00 0.00 0.00 59.98 60.16 2qlm h ARG 426 Cb 0.18 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.14 2qlm h ARG 426 CO -0.18 0.76 -0.49 0.00 -0.00 0.00 0.00 179.97 180.06 2qlm h ARG 427 N 0.00 0.59 0.00 0.08 3.08 -0.59 -3.29 114.38 114.26 2qlm h ARG 427 Ca -0.01 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.70 2qlm h ARG 427 Cb 1.40 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.48 2qlm h ARG 427 CO 0.10 0.95 -0.71 -1.33 -1.07 0.00 0.00 179.97 177.91 2qlm n MET 428 N -3.99 0.25 -1.68 0.04 2.81 -0.05 -4.95 117.12 109.55 2qlm n MET 428 Ca -0.03 0.05 -0.43 0.00 -1.81 0.00 0.00 57.70 55.48 2qlm n MET 428 Cb 0.57 -1.64 -0.01 0.00 -0.71 0.00 0.00 33.22 31.43 2qlm n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2qlm n SER 429 N -1.99 2.58 0.23 7.83 2.88 -1.04 -4.89 113.62 119.23 2qlm n SER 429 Ca 0.03 1.18 0.11 0.00 -1.33 0.00 0.00 58.87 58.87 2qlm n SER 429 Cb 0.42 -1.44 0.49 0.00 -0.75 0.00 0.00 64.21 62.94 2qlm n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2qlm h LEU 430 N 3.04 0.00 -8.85 2.46 3.38 -1.91 -3.42 115.31 110.00 2qlm h LEU 430 Ca -0.45 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 56.88 2qlm h LEU 430 Cb 1.29 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.88 2qlm h LEU 430 CO 0.67 0.18 -0.27 -0.69 0.09 0.00 0.00 178.44 178.42 2qlm s VAL 431 N -3.65 5.18 -0.25 1.22 1.01 -1.26 -0.27 120.40 122.37 2qlm s VAL 431 Ca 0.01 0.33 -0.16 0.00 0.00 0.00 0.00 61.98 62.16 2qlm s VAL 431 Cb 0.10 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2qlm s VAL 431 CO 0.62 0.06 0.41 -1.61 0.00 0.00 0.00 175.10 174.58 2qlm s GLU 432 N 2.04 4.06 0.61 2.72 2.02 0.75 -4.97 118.70 125.95 2qlm s GLU 432 Ca 0.13 0.15 -0.10 0.00 0.02 0.00 0.00 54.97 55.17 2qlm s GLU 432 Cb -0.16 -3.63 -0.03 0.00 0.10 0.00 0.00 34.13 30.42 2qlm s GLU 432 CO 0.11 -0.24 1.00 -1.21 0.02 0.00 0.00 175.26 174.93 2qlm s GLU 433 N 1.96 3.40 0.00 1.61 8.01 -1.26 -1.63 118.70 130.79 2qlm s GLU 433 Ca 0.17 0.56 0.00 0.00 0.01 0.00 0.00 54.97 55.71 2qlm s GLU 433 Cb -0.15 -2.13 0.00 0.00 -4.31 0.00 0.00 34.13 27.54 2qlm s GLU 433 CO 0.09 -0.62 0.00 0.41 0.01 0.00 0.00 175.26 175.16 2qlm n GLY 434 N -2.72 0.01 0.46 -1.39 0.00 -1.26 -4.92 105.19 95.37 2qlm n GLY 434 Ca 0.05 -1.37 -0.16 0.00 0.00 0.00 0.00 46.02 44.54 2qlm n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qlm h ALA 435 N 0.00 -0.95 -3.22 4.61 0.00 -2.07 -3.38 119.26 114.27 2qlm h ALA 435 Ca 0.00 -0.12 -0.64 0.00 0.00 0.00 0.00 54.91 54.15 2qlm h ALA 435 Cb 0.00 0.78 -0.22 0.00 0.00 0.00 0.00 17.79 18.35 2qlm h ALA 435 CO 0.00 -1.09 -0.66 0.14 0.00 0.00 0.00 179.25 177.64 2qlm s VAL 436 N -5.85 3.97 0.30 0.00 -7.23 -1.26 -5.10 120.40 105.23 2qlm s VAL 436 Ca -0.17 -0.32 -0.29 0.00 -1.81 0.00 0.00 61.98 59.39 2qlm s VAL 436 Cb 0.06 -2.77 -0.10 0.00 0.56 0.00 0.00 36.38 34.13 2qlm s VAL 436 CO 0.62 0.46 1.35 -0.54 -0.31 0.00 0.00 175.10 176.68 2qlm s LYS 437 N 0.65 4.32 0.08 4.82 1.02 -1.26 -4.84 119.74 124.53 2qlm s LYS 437 Ca -0.01 2.25 0.03 0.00 0.02 0.00 0.00 55.97 58.25 2qlm s LYS 437 Cb -0.14 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.05 2qlm s LYS 437 CO 0.02 -0.27 -0.09 1.03 -0.92 0.00 0.00 175.35 175.12 2qlm s ARG 438 N -1.30 0.73 -0.24 1.68 0.52 -0.64 -0.96 118.95 118.74 2qlm s ARG 438 Ca 0.52 -1.04 -0.12 0.00 -0.52 0.00 0.00 55.73 54.57 2qlm s ARG 438 Cb -0.40 -0.42 -0.05 0.00 0.52 0.00 0.00 34.95 34.60 2qlm s ARG 438 CO 0.50 0.06 0.25 0.42 0.02 0.00 0.00 175.30 176.55 2qlm s ILE 439 N -2.19 5.29 -0.55 1.52 -1.09 0.43 -0.18 121.20 124.43 2qlm s ILE 439 Ca 0.01 0.35 -0.28 0.00 -2.23 0.00 0.00 60.65 58.50 2qlm s ILE 439 Cb -0.04 -3.58 0.03 0.00 -1.58 0.00 0.00 42.46 37.28 2qlm s ILE 439 CO -0.01 0.29 1.17 0.21 -1.23 0.00 0.00 174.94 175.37 2qlm s ASN 440 N 1.23 6.50 0.37 3.58 3.84 0.63 -2.04 114.94 129.04 2qlm s ASN 440 Ca 0.11 0.19 0.15 0.00 0.21 0.00 0.00 52.86 53.52 2qlm s ASN 440 Cb -0.14 -2.55 0.74 0.00 -0.55 0.00 0.00 41.25 38.74 2qlm s ASN 440 CO 0.07 -1.41 1.80 0.24 -2.79 0.00 0.00 177.10 175.01 2qlm h MET 441 N 9.45 0.00 -0.60 0.43 2.86 -1.76 -2.54 114.93 122.77 2qlm h MET 441 Ca -0.24 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.31 2qlm h MET 441 Cb 1.06 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.69 2qlm h MET 441 CO 1.17 0.38 0.03 0.00 1.06 0.00 0.00 176.91 179.55 2qlm h ALA 442 N 1.62 0.92 -0.25 6.32 0.00 -1.91 -1.89 119.26 124.07 2qlm h ALA 442 Ca -0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.50 2qlm h ALA 442 Cb 0.74 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2qlm h ALA 442 CO 0.05 0.65 -0.34 0.45 0.00 0.00 0.00 179.25 180.06 2qlm h HIS 443 N 0.94 0.63 -0.58 0.00 3.86 -1.86 -2.22 115.15 115.92 2qlm h HIS 443 Ca 0.17 -0.16 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2qlm h HIS 443 Cb 0.50 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.80 2qlm h HIS 443 CO 0.03 0.82 0.35 1.25 0.86 0.00 0.00 177.93 181.24 2qlm h LEU 444 N 0.46 0.70 -0.69 2.43 6.46 -1.25 -2.42 115.31 121.00 2qlm h LEU 444 Ca 0.05 -0.06 -0.10 0.00 -0.12 0.00 0.00 57.88 57.66 2qlm h LEU 444 Cb 0.81 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.55 2qlm h LEU 444 CO 0.07 0.55 -0.04 0.00 -0.62 0.00 0.00 178.44 178.40 2qlm h ILE 446 N 0.89 1.31 -0.65 0.00 2.04 -1.36 -2.44 117.51 117.29 2qlm h ILE 446 Ca 0.15 -1.05 0.08 0.00 1.00 0.00 0.00 64.86 65.05 2qlm h ILE 446 Cb 0.57 1.78 -0.06 0.00 -0.74 0.00 0.00 36.82 38.36 2qlm h ILE 446 CO 0.03 0.30 0.32 0.00 0.00 0.00 0.00 178.15 178.80 2qlm h ALA 447 N 0.66 0.88 -0.56 1.87 0.00 -1.39 -3.10 119.26 117.62 2qlm h ALA 447 Ca 0.03 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2qlm h ALA 447 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2qlm h ALA 447 CO 0.01 -0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.61 2qlm n GLY 448 N -1.29 1.70 3.34 0.00 0.00 -0.60 -4.93 105.19 103.42 2qlm n GLY 448 Ca 0.09 -0.62 -0.28 0.00 0.00 0.00 0.00 46.02 45.21 2qlm n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qlm s SER 449 N -0.97 3.05 0.02 1.61 0.01 -0.92 -3.85 113.70 112.65 2qlm s SER 449 Ca 0.38 -0.66 0.26 0.00 1.31 0.00 0.00 55.95 57.24 2qlm s SER 449 Cb 0.20 -0.23 0.78 0.00 0.21 0.00 0.00 66.02 66.98 2qlm s SER 449 CO 0.25 0.18 1.61 0.00 0.41 0.00 0.00 173.24 175.70 2qlm n HIS 450 N 1.32 0.10 -3.74 2.43 1.44 -0.63 -4.86 115.22 111.28 2qlm n HIS 450 Ca -0.18 0.03 -0.12 0.00 -2.01 0.00 0.00 57.72 55.44 2qlm n HIS 450 Cb 0.53 -0.41 -0.12 0.00 0.12 0.00 0.00 29.99 30.11 2qlm n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2qlm s ALA 451 N -3.02 -0.76 -0.08 1.59 0.00 -1.26 -4.55 121.76 113.68 2qlm s ALA 451 Ca 0.12 1.04 0.03 0.00 0.00 0.00 0.00 51.96 53.15 2qlm s ALA 451 Cb 0.17 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.67 2qlm s ALA 451 CO 0.63 -0.19 -0.15 0.08 0.00 0.00 0.00 175.76 176.14 2qlm s VAL 452 N 0.75 1.37 0.02 0.00 1.01 0.67 -1.13 120.40 123.08 2qlm s VAL 452 Ca -0.05 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.36 2qlm s VAL 452 Cb -0.06 -1.23 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 2qlm s VAL 452 CO -0.05 0.41 -0.11 0.54 0.00 0.00 0.00 175.10 175.89 2qlm s ASN 453 N 0.62 1.27 0.76 3.32 4.22 -0.67 -0.06 114.94 124.40 2qlm s ASN 453 Ca -0.15 -0.34 -0.02 0.00 -2.14 0.00 0.00 52.86 50.21 2qlm s ASN 453 Cb -0.16 -0.09 0.14 0.00 1.28 0.00 0.00 41.25 42.42 2qlm s ASN 453 CO 0.04 0.03 1.04 -0.83 -2.04 0.00 0.00 177.10 175.35 2qlm s GLY 454 N -0.79 1.76 0.00 0.45 0.00 -1.08 -1.53 107.32 106.13 2qlm s GLY 454 Ca 0.01 -1.72 0.05 0.00 0.00 0.00 0.00 44.72 43.06 2qlm s GLY 454 CO 0.00 -1.11 0.87 3.33 0.00 0.00 0.00 173.10 176.20 2qlm n VAL 455 N -2.95 0.46 -3.52 1.40 0.24 -1.26 -2.11 118.33 110.59 2qlm n VAL 455 Ca 0.16 -0.73 -0.16 0.00 -2.04 0.00 0.00 64.34 61.56 2qlm n VAL 455 Cb 0.61 0.83 -0.05 0.00 -1.47 0.00 0.00 33.84 33.75 2qlm n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qlm s ALA 456 N -0.69 -1.77 0.18 2.33 0.00 -1.26 -0.64 121.76 119.90 2qlm s ALA 456 Ca 0.08 1.26 -0.16 0.00 0.00 0.00 0.00 51.96 53.14 2qlm s ALA 456 Cb 0.05 0.01 0.13 0.00 0.00 0.00 0.00 23.12 23.32 2qlm s ALA 456 CO 0.07 -0.41 1.66 -0.09 0.00 0.00 0.00 175.76 176.99 2qlm h ARG 457 N 2.81 0.01 -0.66 0.00 2.43 -1.90 0.04 114.38 117.11 2qlm h ARG 457 Ca -0.26 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.88 2qlm h ARG 457 Cb 1.16 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.68 2qlm h ARG 457 CO 0.38 0.01 0.32 0.97 -1.51 0.00 0.00 179.97 180.13 2qlm h ILE 458 N 0.01 1.21 -0.09 1.20 2.10 -1.91 -1.95 117.51 118.09 2qlm h ILE 458 Ca 0.22 -0.61 -0.01 0.00 1.08 0.00 0.00 64.86 65.54 2qlm h ILE 458 Cb 0.33 0.37 -0.00 0.00 -1.09 0.00 0.00 36.82 36.43 2qlm h ILE 458 CO -0.46 0.25 0.02 -0.74 -1.08 0.00 0.00 178.15 176.15 2qlm h HIS 459 N 0.94 0.15 -0.66 2.19 2.76 -1.40 -1.67 115.15 117.46 2qlm h HIS 459 Ca 0.23 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.37 2qlm h HIS 459 Cb 0.10 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 28.99 2qlm h HIS 459 CO 0.01 0.32 0.37 0.77 -1.30 0.00 0.00 177.93 178.10 2qlm h SER 460 N -0.06 0.79 -0.29 3.26 0.02 -0.88 -1.36 113.55 115.04 2qlm h SER 460 Ca 0.03 -0.05 -0.12 0.00 -0.84 0.00 0.00 61.79 60.81 2qlm h SER 460 Cb 0.24 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 2qlm h SER 460 CO 0.00 0.63 -0.24 -0.33 -1.14 0.00 0.00 176.83 175.75 2qlm h GLU 461 N 0.91 0.78 -0.48 3.45 4.39 -1.29 -2.82 114.58 119.52 2qlm h GLU 461 Ca 0.23 -0.32 -0.07 0.00 0.34 0.00 0.00 59.36 59.54 2qlm h GLU 461 Cb 0.00 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 2qlm h GLU 461 CO -0.04 0.94 0.03 0.82 -1.16 0.00 0.00 179.01 179.60 2qlm h ILE 462 N 0.68 1.23 -0.48 3.13 2.04 -0.60 -1.61 117.51 121.90 2qlm h ILE 462 Ca 0.09 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2qlm h ILE 462 Cb 0.76 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 2qlm h ILE 462 CO 0.06 0.34 0.32 -0.07 0.00 0.00 0.00 178.15 178.79 2qlm h LEU 463 N 0.73 0.55 -0.97 1.44 3.38 -1.16 0.75 115.31 120.04 2qlm h LEU 463 Ca 0.15 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2qlm h LEU 463 Cb 0.41 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2qlm h LEU 463 CO 0.01 0.40 -0.40 0.11 0.09 0.00 0.00 178.44 178.65 2qlm h LYS 464 N 0.65 0.22 0.00 1.13 1.57 -1.23 -1.67 116.57 117.23 2qlm h LYS 464 Ca 0.18 -0.10 -0.21 0.00 -1.87 0.00 0.00 60.65 58.64 2qlm h LYS 464 Cb -0.07 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 2qlm h LYS 464 CO -0.04 0.59 -1.51 0.87 -0.57 0.00 0.00 179.45 178.79 2qlm h LYS 465 N 0.18 0.00 0.00 3.15 1.57 -1.13 -3.32 116.57 117.02 2qlm h LYS 465 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2qlm h LYS 465 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 2qlm h LYS 465 CO 0.06 0.37 0.00 0.25 -0.57 0.00 0.00 179.45 179.56 2qlm n THR 466 N -2.96 0.00 0.21 -0.16 -2.24 0.24 -4.73 114.28 104.65 2qlm n THR 466 Ca -0.12 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.72 2qlm n THR 466 Cb 0.92 -0.03 0.48 0.00 -2.10 0.00 0.00 70.33 69.59 2qlm n THR 466 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 2qlm h ILE 467 N 0.00 0.98 -0.20 2.28 3.07 -1.69 -2.55 117.51 119.41 2qlm h ILE 467 Ca 0.00 -1.01 -0.01 0.00 1.55 0.00 0.00 64.86 65.38 2qlm h ILE 467 Cb 0.00 1.58 -0.01 0.00 -0.27 0.00 0.00 36.82 38.12 2qlm h ILE 467 CO 0.00 0.27 -0.01 0.49 -1.05 0.00 0.00 178.15 177.85 2qlm n PHE 468 N -3.90 0.71 -0.12 0.16 0.99 -0.63 -4.78 117.46 109.88 2qlm n PHE 468 Ca -0.02 -0.97 -0.05 0.00 -0.00 0.00 0.00 57.45 56.42 2qlm n PHE 468 Cb 0.35 -0.29 0.02 0.00 -1.00 0.00 0.00 39.48 38.56 2qlm n PHE 468 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 2qlm h LYS 469 N 1.27 -0.02 -0.66 -1.08 3.64 -1.42 -0.15 116.57 118.14 2qlm h LYS 469 Ca 0.02 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.46 2qlm h LYS 469 Cb 1.35 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 33.11 2qlm h LYS 469 CO 0.18 -0.02 0.36 -0.44 -2.27 0.00 0.00 179.45 177.26 2qlm h ASP 470 N -0.02 0.51 -0.47 4.20 3.32 -1.86 -0.83 116.42 121.27 2qlm h ASP 470 Ca 0.20 0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.17 2qlm h ASP 470 Cb 0.33 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 2qlm h ASP 470 CO -0.44 0.32 -0.16 -0.26 -1.72 0.00 0.00 179.24 176.99 2qlm h PHE 471 N 0.65 1.09 -0.71 4.55 0.04 -1.78 -2.16 116.94 118.63 2qlm h PHE 471 Ca 0.30 -0.24 -0.02 0.00 2.80 0.00 0.00 57.97 60.82 2qlm h PHE 471 Cb 0.22 -0.26 -0.03 0.00 2.20 0.00 0.00 35.95 38.08 2qlm h PHE 471 CO -0.09 1.04 0.37 -0.92 -0.60 0.00 0.00 178.31 178.11 2qlm h TYR 472 N 0.85 0.99 -0.24 -0.55 3.20 -0.62 0.73 116.97 121.33 2qlm h TYR 472 Ca 0.12 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.90 2qlm h TYR 472 Cb 0.71 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 2qlm h TYR 472 CO 0.05 0.71 -0.11 0.93 -1.64 0.00 0.00 178.16 178.10 2qlm h GLU 473 N 0.98 0.38 -0.02 1.82 5.08 -0.97 -1.84 114.58 120.02 2qlm h GLU 473 Ca 0.25 -0.10 -0.05 0.00 -1.00 0.00 0.00 59.36 58.46 2qlm h GLU 473 Cb 0.07 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2qlm h GLU 473 CO -0.04 0.50 -0.17 1.25 -1.00 0.00 0.00 179.01 179.55 2qlm h LEU 474 N 0.36 0.18 -6.32 1.33 5.85 -1.14 -3.42 115.31 112.15 2qlm h LEU 474 Ca 0.07 -0.72 -0.59 0.00 0.84 0.00 0.00 57.88 57.48 2qlm h LEU 474 Cb 0.42 -0.05 -0.39 0.00 0.37 0.00 0.00 40.66 41.00 2qlm h LEU 474 CO 0.02 0.87 -0.92 -0.62 -0.34 0.00 0.00 178.44 177.45 2qlm n GLU 475 N -4.58 0.86 0.09 1.25 1.02 0.23 -4.98 120.64 114.52 2qlm n GLU 475 Ca -0.09 -3.54 0.03 0.00 -0.02 0.00 0.00 57.16 53.53 2qlm n GLU 475 Cb 0.44 -1.67 0.41 0.00 -0.02 0.00 0.00 31.44 30.60 2qlm n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2qlm h PRO 476 N 4.89 0.32 0.00 3.49 0.13 -1.56 -2.69 132.00 136.59 2qlm h PRO 476 Ca 0.18 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2qlm h PRO 476 Cb 0.85 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.92 2qlm h PRO 476 CO 0.50 0.36 -0.02 1.12 -0.23 0.00 0.00 178.00 179.74 2qlm h HIS 477 N 0.32 0.00 0.00 1.56 2.07 -1.94 -2.81 115.15 114.35 2qlm h HIS 477 Ca 0.07 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.51 2qlm h HIS 477 Cb 0.24 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.21 2qlm h HIS 477 CO 0.01 0.02 -0.40 -0.22 -3.07 0.00 0.00 177.93 174.26 2qlm h LYS 478 N 0.00 0.00 -5.58 5.12 3.64 -1.71 -3.45 116.57 114.58 2qlm h LYS 478 Ca -0.00 0.00 -0.59 0.00 -1.27 0.00 0.00 60.65 58.79 2qlm h LYS 478 Cb 0.06 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 31.79 2qlm h LYS 478 CO 0.00 0.40 -0.14 -0.06 -2.27 0.00 0.00 179.45 177.39 2qlm s PHE 479 N -3.54 3.43 0.24 1.91 0.08 -1.06 -0.24 117.98 118.80 2qlm s PHE 479 Ca 0.00 0.76 0.01 0.00 0.12 0.00 0.00 56.93 57.83 2qlm s PHE 479 Cb 0.11 -2.56 -0.05 0.00 -0.57 0.00 0.00 43.02 39.94 2qlm s PHE 479 CO 0.70 0.05 0.09 -0.65 -0.10 0.00 0.00 175.22 175.31 2qlm s GLN 480 N 1.08 1.33 -0.06 0.44 -0.21 0.91 -4.96 119.66 118.20 2qlm s GLN 480 Ca 0.23 -1.71 0.05 0.00 0.02 0.00 0.00 55.36 53.95 2qlm s GLN 480 Cb -0.15 -0.14 -0.02 0.00 1.00 0.00 0.00 33.01 33.70 2qlm s GLN 480 CO 0.09 -0.30 -0.19 1.21 -2.12 0.00 0.00 175.29 173.98 2qlm s ASN 481 N -3.26 3.59 -0.36 5.90 3.84 -1.26 -2.64 114.94 120.74 2qlm s ASN 481 Ca 0.37 -0.35 -0.00 0.00 0.21 0.00 0.00 52.86 53.08 2qlm s ASN 481 Cb 0.07 -0.85 0.13 0.00 -0.55 0.00 0.00 41.25 40.05 2qlm s ASN 481 CO 0.12 0.29 0.19 -0.54 -2.79 0.00 0.00 177.10 174.37 2qlm s LYS 482 N -0.41 0.69 0.21 0.43 -0.14 -0.90 -4.96 119.74 114.67 2qlm s LYS 482 Ca 0.04 -1.33 -0.32 0.00 -1.36 0.00 0.00 55.97 53.00 2qlm s LYS 482 Cb -0.12 -1.62 -0.12 0.00 -1.68 0.00 0.00 37.83 34.29 2qlm s LYS 482 CO 0.02 -1.14 1.71 0.99 -0.76 0.00 0.00 175.35 176.17 2qlm s THR 483 N 1.13 2.04 1.03 2.17 2.01 -1.26 -4.18 115.64 118.59 2qlm s THR 483 Ca 0.15 0.03 -0.12 0.00 0.31 0.00 0.00 61.69 62.06 2qlm s THR 483 Cb -0.22 -3.02 0.17 0.00 0.01 0.00 0.00 72.50 69.44 2qlm s THR 483 CO -0.09 0.00 0.86 0.59 -0.69 0.00 0.00 174.62 175.30 2qlm n ASN 484 N 3.87 -1.00 -3.54 3.53 5.03 0.19 -4.65 115.26 118.68 2qlm n ASN 484 Ca 0.15 0.17 -0.10 0.00 0.87 0.00 0.00 54.58 55.67 2qlm n ASN 484 Cb 0.35 -1.31 -0.03 0.00 -1.02 0.00 0.00 39.78 37.77 2qlm n ASN 484 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 2qlm s GLY 485 N -2.37 0.72 0.13 7.41 0.00 -1.26 -4.81 107.32 107.13 2qlm s GLY 485 Ca 0.65 -0.98 0.07 0.00 0.00 0.00 0.00 44.72 44.45 2qlm s GLY 485 CO 0.63 -0.62 -0.16 -0.26 0.00 0.00 0.00 173.10 172.69 2qlm s ILE 486 N -3.37 1.48 -0.11 0.90 -4.36 -0.02 -4.48 121.20 111.23 2qlm s ILE 486 Ca 0.22 -1.72 -0.30 0.00 -0.26 0.00 0.00 60.65 58.60 2qlm s ILE 486 Cb -0.02 -1.58 -0.01 0.00 1.25 0.00 0.00 42.46 42.09 2qlm s ILE 486 CO 0.13 -0.34 1.06 0.28 0.24 0.00 0.00 174.94 176.31 2qlm s THR 487 N -1.95 4.65 -0.99 8.37 -1.32 -1.26 -0.81 115.64 122.33 2qlm s THR 487 Ca 0.10 1.94 0.17 0.00 -1.21 0.00 0.00 61.69 62.68 2qlm s THR 487 Cb -0.06 -4.25 0.14 0.00 -1.51 0.00 0.00 72.50 66.82 2qlm s THR 487 CO 0.04 -0.03 1.53 -0.81 -2.21 0.00 0.00 174.62 173.15 2qlm n PRO 488 N 5.28 0.01 0.18 7.08 -0.04 -1.26 -1.89 135.00 144.35 2qlm n PRO 488 Ca 0.10 0.22 -0.07 0.00 -0.04 0.00 0.00 63.50 63.71 2qlm n PRO 488 Cb 0.48 -1.51 -0.04 0.00 -0.04 0.00 0.00 33.50 32.39 2qlm n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qlm h ARG 489 N 0.00 -0.46 -0.74 0.54 -0.00 -1.91 -2.18 114.38 109.63 2qlm h ARG 489 Ca 0.00 0.03 -0.04 0.00 -0.50 0.00 0.00 59.98 59.47 2qlm h ARG 489 Cb 0.29 0.11 -0.03 0.00 0.00 0.00 0.00 29.97 30.33 2qlm h ARG 489 CO 0.00 -0.31 0.30 -0.09 0.00 0.00 0.00 179.97 179.87 2qlm h ARG 490 N -0.72 1.10 -0.28 0.04 2.43 -1.97 -0.04 114.38 114.94 2qlm h ARG 490 Ca -0.05 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2qlm h ARG 490 Cb 0.37 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2qlm h ARG 490 CO 0.08 0.90 0.00 0.91 -1.51 0.00 0.00 179.97 180.35 2qlm n TRP 491 N -4.34 0.36 0.04 2.20 7.02 -0.79 -2.82 117.44 119.10 2qlm n TRP 491 Ca 0.06 -0.18 0.00 0.00 -1.02 0.00 0.00 57.50 56.36 2qlm n TRP 491 Cb 0.18 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.07 2qlm n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2qlm n LEU 492 N 0.90 0.02 -0.11 -0.99 7.94 -0.85 -4.76 117.00 119.15 2qlm n LEU 492 Ca 0.17 0.13 -0.07 0.00 -1.11 0.00 0.00 56.01 55.14 2qlm n LEU 492 Cb 0.46 0.08 0.01 0.00 0.53 0.00 0.00 43.42 44.51 2qlm n LEU 492 CO 0.14 -0.59 0.98 0.58 -1.11 0.00 0.00 177.39 177.40 2qlm h VAL 493 N 0.00 0.98 0.17 1.96 2.07 -1.20 0.30 116.25 120.52 2qlm h VAL 493 Ca 0.00 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 2qlm h VAL 493 Cb 0.00 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2qlm h VAL 493 CO 0.00 0.07 -0.08 0.25 0.02 0.00 0.00 177.57 177.83 2qlm h LEU 494 N 0.38 -0.19 0.00 2.57 6.46 -1.14 -3.24 115.31 120.15 2qlm h LEU 494 Ca 0.16 -0.34 -0.03 0.00 -0.12 0.00 0.00 57.88 57.55 2qlm h LEU 494 Cb 0.07 0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 40.05 2qlm h LEU 494 CO -0.11 0.30 -0.65 0.00 -0.62 0.00 0.00 178.44 177.35 2qlm n ASN 496 N -2.90 0.80 -0.07 0.00 2.85 0.10 -4.88 115.26 111.16 2qlm n ASN 496 Ca 0.01 -2.88 -0.02 0.00 -0.11 0.00 0.00 54.58 51.58 2qlm n ASN 496 Cb 0.59 -0.63 0.23 0.00 1.24 0.00 0.00 39.78 41.21 2qlm n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2qlm h PRO 497 N 3.68 0.70 -0.44 1.20 0.13 -1.66 -2.04 132.00 133.56 2qlm h PRO 497 Ca 0.09 -0.15 0.08 0.00 -0.87 0.00 0.00 66.00 65.15 2qlm h PRO 497 Cb 0.88 -0.10 -0.07 0.00 0.13 0.00 0.00 31.00 31.83 2qlm h PRO 497 CO 0.51 0.67 0.02 0.78 -0.23 0.00 0.00 178.00 179.76 2qlm h GLY 498 N 0.91 0.47 0.80 1.56 0.00 -1.91 0.65 103.07 105.55 2qlm h GLY 498 Ca 0.15 0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.46 2qlm h GLY 498 CO 0.01 -0.10 -0.07 -2.00 0.00 0.00 0.00 176.54 174.38 2qlm h LEU 499 N 0.14 0.41 -0.91 3.11 5.85 -1.88 -2.72 115.31 119.29 2qlm h LEU 499 Ca 0.22 -0.39 0.15 0.00 0.84 0.00 0.00 57.88 58.70 2qlm h LEU 499 Cb 0.31 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 41.14 2qlm h LEU 499 CO -0.35 0.70 0.52 0.00 -0.34 0.00 0.00 178.44 178.97 2qlm h ALA 500 N 0.72 1.41 -0.24 1.25 0.00 -1.04 -2.21 119.26 119.15 2qlm h ALA 500 Ca 0.05 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2qlm h ALA 500 Cb 0.53 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2qlm h ALA 500 CO 0.02 -0.02 -0.20 1.49 0.00 0.00 0.00 179.25 180.54 2qlm h GLU 501 N 0.73 0.55 0.00 0.00 4.57 -0.80 -1.16 114.58 118.47 2qlm h GLU 501 Ca 0.50 -0.28 -0.08 0.00 -1.18 0.00 0.00 59.36 58.32 2qlm h GLU 501 Cb 0.67 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.26 2qlm h GLU 501 CO -0.35 0.86 -0.38 -0.84 -1.18 0.00 0.00 179.01 177.13 2qlm h ILE 502 N 0.25 1.23 -0.17 2.32 3.07 -1.26 -0.47 117.51 122.49 2qlm h ILE 502 Ca 0.04 -1.31 -0.09 0.00 1.55 0.00 0.00 64.86 65.06 2qlm h ILE 502 Cb 0.74 1.71 -0.00 0.00 -0.27 0.00 0.00 36.82 39.00 2qlm h ILE 502 CO 0.05 0.37 -0.24 0.40 -1.05 0.00 0.00 178.15 177.68 2qlm h ILE 503 N 0.00 1.35 -0.56 0.16 2.04 -1.34 -3.22 117.51 115.94 2qlm h ILE 503 Ca -0.00 -1.45 -0.00 0.00 1.00 0.00 0.00 64.86 64.40 2qlm h ILE 503 Cb 0.68 1.89 -0.03 0.00 -0.74 0.00 0.00 36.82 38.62 2qlm h ILE 503 CO 0.05 0.44 0.33 0.00 0.00 0.00 0.00 178.15 178.97 2qlm h ALA 504 N 0.60 1.53 -0.80 1.87 0.00 -0.83 -1.15 119.26 120.48 2qlm h ALA 504 Ca 0.02 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.95 2qlm h ALA 504 Cb 0.81 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.30 2qlm h ALA 504 CO 0.06 0.41 0.46 0.93 0.00 0.00 0.00 179.25 181.10 2qlm h GLU 505 N 0.77 0.77 0.00 0.00 5.08 -1.10 0.64 114.58 120.73 2qlm h GLU 505 Ca 0.20 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 2qlm h GLU 505 Cb -0.02 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 2qlm h GLU 505 CO -0.04 0.51 -0.13 0.00 -1.00 0.00 0.00 179.01 178.35 2qlm h ARG 506 N 0.79 0.00 -0.13 2.33 2.47 -1.43 -3.41 114.38 115.00 2qlm h ARG 506 Ca 0.38 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.10 2qlm h ARG 506 Cb 0.32 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.64 2qlm h ARG 506 CO -0.23 0.95 0.00 0.44 0.56 0.00 0.00 179.97 181.69 2qlm n ILE 507 N -4.60 0.60 -3.71 2.04 -5.35 -0.49 -5.11 119.36 102.74 2qlm n ILE 507 Ca -0.12 -0.80 0.00 0.00 -0.27 0.00 0.00 62.75 61.56 2qlm n ILE 507 Cb 0.48 0.76 0.00 0.00 -1.74 0.00 0.00 39.64 39.13 2qlm n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qlm n GLY 508 N 0.22 -1.88 0.00 3.28 0.00 0.21 -4.68 105.19 102.35 2qlm n GLY 508 Ca 0.06 -1.43 0.07 0.00 0.00 0.00 0.00 46.02 44.72 2qlm n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qlm n GLU 509 N 0.00 1.70 0.23 1.61 1.02 -1.26 -4.10 120.64 119.85 2qlm n GLU 509 Ca 0.00 -0.02 0.16 0.00 -0.02 0.00 0.00 57.16 57.29 2qlm n GLU 509 Cb 0.00 -1.25 0.76 0.00 -0.02 0.00 0.00 31.44 30.93 2qlm n GLU 509 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2qlm h GLU 510 N 0.00 0.00 0.00 3.49 4.22 -1.96 -2.83 114.58 117.51 2qlm h GLU 510 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 2qlm h GLU 510 Cb 0.41 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 2qlm h GLU 510 CO 0.00 0.00 -0.10 0.10 -2.18 0.00 0.00 179.01 176.83 2qlm h TYR 511 N 0.00 0.00 -0.05 0.92 -0.00 -1.81 -2.50 116.97 113.53 2qlm h TYR 511 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.71 2qlm h TYR 511 Cb 0.23 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.96 2qlm h TYR 511 CO 0.00 0.10 -0.06 0.82 -0.00 0.00 0.00 178.16 179.01 2qlm h ILE 512 N 0.00 1.08 -0.05 -0.90 2.04 -1.86 -1.61 117.51 116.21 2qlm h ILE 512 Ca -0.00 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.51 2qlm h ILE 512 Cb 0.40 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 2qlm h ILE 512 CO 0.01 0.11 0.00 -1.54 0.00 0.00 0.00 178.15 176.73 2qlm n SER 513 N -4.42 2.43 -2.92 1.72 3.41 -1.14 -4.65 113.62 108.05 2qlm n SER 513 Ca -0.02 -2.65 -0.14 0.00 -0.26 0.00 0.00 58.87 55.81 2qlm n SER 513 Cb 0.17 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 2qlm n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qlm n ASP 514 N -0.90 -1.86 0.31 4.04 4.64 -0.70 -5.04 116.55 117.04 2qlm n ASP 514 Ca 0.11 -3.04 0.20 0.00 -1.38 0.00 0.00 54.79 50.68 2qlm n ASP 514 Cb 0.52 0.93 0.99 0.00 -1.04 0.00 0.00 41.12 42.52 2qlm n ASP 514 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 2qlm h LEU 515 N 4.15 0.00 -2.51 -2.67 5.85 -1.61 -2.02 115.31 116.50 2qlm h LEU 515 Ca -0.04 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.69 2qlm h LEU 515 Cb 0.98 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.01 2qlm h LEU 515 CO 0.35 0.00 0.09 0.44 -0.34 0.00 0.00 178.44 178.98 2qlm h ASP 516 N 0.00 0.00 0.26 1.25 3.32 -1.85 -1.80 116.42 117.60 2qlm h ASP 516 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qlm h ASP 516 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2qlm h ASP 516 CO 0.00 0.00 0.00 1.56 -1.72 0.00 0.00 179.24 179.08 2qlm h GLN 517 N 0.00 0.00 -0.02 3.56 4.20 -1.69 -2.36 115.11 118.80 2qlm h GLN 517 Ca 0.03 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.74 2qlm h GLN 517 Cb 0.21 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 2qlm h GLN 517 CO -0.00 0.00 0.06 -0.07 -0.67 0.00 0.00 178.83 178.15 2qlm h LEU 518 N 0.00 0.00 -1.79 1.46 3.38 -1.56 -1.80 115.31 115.00 2qlm h LEU 518 Ca 0.00 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.13 2qlm h LEU 518 Cb 0.13 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2qlm h LEU 518 CO 0.00 0.00 0.46 0.03 0.09 0.00 0.00 178.44 179.02 2qlm h ARG 519 N 0.00 0.20 0.00 1.13 3.08 -0.85 -0.17 114.38 117.77 2qlm h ARG 519 Ca 0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qlm h ARG 519 Cb 0.13 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2qlm h ARG 519 CO -0.00 0.13 0.17 0.87 -1.07 0.00 0.00 179.97 180.08 2qlm h LYS 520 N 0.21 0.00 0.00 0.04 1.57 -1.57 -0.80 116.57 116.01 2qlm h LYS 520 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 2qlm h LYS 520 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 2qlm h LYS 520 CO -0.06 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.10 2qlm n LEU 521 N -2.91 0.59 0.25 2.94 4.77 -0.08 -3.04 117.00 119.52 2qlm n LEU 521 Ca -0.02 0.60 0.08 0.00 -0.03 0.00 0.00 56.01 56.64 2qlm n LEU 521 Cb 0.23 -0.47 0.61 0.00 -2.33 0.00 0.00 43.42 41.45 2qlm n LEU 521 CO 0.16 -0.35 1.00 -0.07 -1.33 0.00 0.00 177.39 176.79 2qlm h LEU 522 N 0.00 0.00 0.00 2.23 4.07 -1.32 -1.75 115.31 118.54 2qlm h LEU 522 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2qlm h LEU 522 Cb 0.49 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.23 2qlm h LEU 522 CO 0.00 0.09 0.00 -1.54 -1.08 0.00 0.00 178.44 175.91 2qlm n SER 523 N -4.34 0.00 -0.33 -0.43 3.41 -1.17 -2.98 113.62 107.78 2qlm n SER 523 Ca -0.03 -1.27 0.03 0.00 -0.26 0.00 0.00 58.87 57.34 2qlm n SER 523 Cb 0.16 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.20 2qlm n SER 523 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2qlm n TYR 524 N -0.78 0.25 0.25 7.33 4.01 -0.66 -4.72 117.16 122.83 2qlm n TYR 524 Ca 0.12 -0.53 0.11 0.00 -0.16 0.00 0.00 57.90 57.44 2qlm n TYR 524 Cb 0.06 -0.05 0.63 0.00 -0.31 0.00 0.00 39.34 39.67 2qlm n TYR 524 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 2qlm h VAL 525 N 1.00 0.65 -0.36 -0.72 3.04 -1.61 -1.84 116.25 116.41 2qlm h VAL 525 Ca 0.00 -0.73 0.00 0.00 -1.01 0.00 0.00 66.70 64.96 2qlm h VAL 525 Cb 0.65 1.46 0.00 0.00 -2.01 0.00 0.00 31.29 31.39 2qlm h VAL 525 CO 0.01 0.17 0.00 0.47 -1.01 0.00 0.00 177.57 177.20 2qlm n ASP 526 N -3.66 3.67 -4.57 3.17 10.43 -1.26 -4.86 116.55 119.47 2qlm n ASP 526 Ca -0.01 -2.52 -0.43 0.00 2.57 0.00 0.00 54.79 54.40 2qlm n ASP 526 Cb 0.29 -0.43 -0.05 0.00 1.84 0.00 0.00 41.12 42.78 2qlm n ASP 526 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2qlm s ASP 527 N -1.37 6.52 0.35 -2.24 2.15 -0.69 -4.93 116.67 116.45 2qlm s ASP 527 Ca 0.36 0.20 0.03 0.00 0.43 0.00 0.00 52.55 53.57 2qlm s ASP 527 Cb 0.25 -2.43 0.66 0.00 -0.30 0.00 0.00 42.92 41.10 2qlm s ASP 527 CO 0.14 -0.92 1.98 -0.08 -0.17 0.00 0.00 175.17 176.12 2qlm h GLU 528 N 8.83 0.71 -0.26 4.34 4.57 -1.92 -0.85 114.58 130.00 2qlm h GLU 528 Ca -0.24 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 57.80 2qlm h GLU 528 Cb 1.08 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.52 2qlm h GLU 528 CO 0.98 0.53 -0.11 0.00 -1.18 0.00 0.00 179.01 179.23 2qlm h ALA 529 N 1.59 0.36 -0.21 2.92 0.00 -1.96 -2.46 119.26 119.50 2qlm h ALA 529 Ca 0.18 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2qlm h ALA 529 Cb 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2qlm h ALA 529 CO -0.03 0.22 0.05 0.35 0.00 0.00 0.00 179.25 179.84 2qlm h PHE 530 N 0.26 0.35 -0.52 0.00 -0.00 -1.76 -0.57 116.94 114.70 2qlm h PHE 530 Ca 0.06 -0.04 0.11 0.00 -0.00 0.00 0.00 57.97 58.09 2qlm h PHE 530 Cb 0.61 -0.10 -0.09 0.00 -0.00 0.00 0.00 35.95 36.37 2qlm h PHE 530 CO 0.06 0.45 -0.06 0.82 -0.00 0.00 0.00 178.31 179.57 2qlm h ILE 531 N 0.16 0.53 -0.70 1.41 2.04 -1.22 0.24 117.51 119.97 2qlm h ILE 531 Ca 0.07 -0.02 -0.04 0.00 1.00 0.00 0.00 64.86 65.86 2qlm h ILE 531 Cb 0.27 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 2qlm h ILE 531 CO 0.00 0.01 0.27 -0.09 0.00 0.00 0.00 178.15 178.34 2qlm h ARG 532 N 0.06 1.05 -0.31 2.37 2.43 -1.27 -2.25 114.38 116.45 2qlm h ARG 532 Ca 0.26 -0.20 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 2qlm h ARG 532 Cb 0.40 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 2qlm h ARG 532 CO -0.49 0.88 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.24 2qlm h ASP 533 N 1.00 0.68 -0.18 -3.80 3.32 -0.32 -1.43 116.42 115.69 2qlm h ASP 533 Ca 0.23 -0.41 0.02 0.00 0.02 0.00 0.00 57.03 56.89 2qlm h ASP 533 Cb 0.23 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 2qlm h ASP 533 CO -0.02 0.95 0.04 0.58 -1.72 0.00 0.00 179.24 179.07 2qlm h VAL 534 N 0.42 0.92 -0.43 -1.35 2.07 -0.48 -1.42 116.25 115.99 2qlm h VAL 534 Ca 0.07 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.50 2qlm h VAL 534 Cb 0.69 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 2qlm h VAL 534 CO 0.05 0.02 0.07 0.00 0.02 0.00 0.00 177.57 177.73 2qlm h ALA 535 N 1.13 1.32 -0.37 1.67 0.00 -1.41 -2.73 119.26 118.87 2qlm h ALA 535 Ca 0.08 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2qlm h ALA 535 Cb 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2qlm h ALA 535 CO -0.10 0.47 0.03 -0.22 0.00 0.00 0.00 179.25 179.43 2qlm h LYS 536 N 0.63 0.63 -0.66 0.00 3.64 -0.88 -2.07 116.57 117.85 2qlm h LYS 536 Ca 0.14 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2qlm h LYS 536 Cb 0.29 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 2qlm h LYS 536 CO 0.00 0.71 0.40 0.28 -2.27 0.00 0.00 179.45 178.58 2qlm h VAL 537 N 0.46 1.19 -0.55 2.00 2.07 -1.12 -1.62 116.25 118.67 2qlm h VAL 537 Ca 0.11 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 2qlm h VAL 537 Cb 0.41 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 2qlm h VAL 537 CO 0.01 0.20 0.32 0.50 0.02 0.00 0.00 177.57 178.62 2qlm h LYS 538 N 0.90 0.76 -0.69 1.57 1.63 -1.43 -1.64 116.57 117.67 2qlm h LYS 538 Ca 0.24 -0.08 -0.05 0.00 -0.85 0.00 0.00 60.65 59.92 2qlm h LYS 538 Cb -0.03 -0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.42 2qlm h LYS 538 CO -0.04 0.56 0.25 0.37 -3.45 0.00 0.00 179.45 177.14 2qlm h GLN 539 N 0.74 1.05 -0.62 1.90 5.75 -1.00 -0.99 115.11 121.95 2qlm h GLN 539 Ca 0.20 -0.20 -0.04 0.00 -0.15 0.00 0.00 58.65 58.45 2qlm h GLN 539 Cb 0.01 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.37 2qlm h GLN 539 CO -0.03 0.88 0.21 0.93 -2.65 0.00 0.00 178.83 178.17 2qlm h GLU 540 N 1.00 0.95 -0.62 1.69 5.08 -1.20 -1.07 114.58 120.40 2qlm h GLU 540 Ca 0.23 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 2qlm h GLU 540 Cb 0.24 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 2qlm h GLU 540 CO -0.01 0.83 0.27 -0.91 -1.00 0.00 0.00 179.01 178.18 2qlm h ASN 541 N 0.88 0.80 -0.30 1.42 2.35 -0.95 -0.70 115.58 119.08 2qlm h ASN 541 Ca 0.20 -0.10 -0.17 0.00 -0.55 0.00 0.00 56.30 55.69 2qlm h ASN 541 Cb 0.26 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 2qlm h ASN 541 CO -0.01 0.71 -0.47 0.11 -1.65 0.00 0.00 177.43 176.12 2qlm h LYS 542 N 0.88 0.84 -0.30 0.81 1.57 -0.96 -1.89 116.57 117.52 2qlm h LYS 542 Ca 0.21 -0.51 -0.02 0.00 -1.87 0.00 0.00 60.65 58.46 2qlm h LYS 542 Cb 0.14 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2qlm h LYS 542 CO -0.02 1.15 0.10 -0.07 -0.57 0.00 0.00 179.45 180.03 2qlm h LEU 543 N 0.62 0.43 -0.97 2.94 3.38 -0.97 0.88 115.31 121.61 2qlm h LEU 543 Ca 0.02 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.82 2qlm h LEU 543 Cb 1.08 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.66 2qlm h LEU 543 CO 0.11 0.51 0.64 0.50 0.09 0.00 0.00 178.44 180.29 2qlm h LYS 544 N 0.33 1.23 -0.01 1.13 3.64 -1.14 -1.13 116.57 120.63 2qlm h LYS 544 Ca 0.10 -0.07 -0.23 0.00 -1.27 0.00 0.00 60.65 59.17 2qlm h LYS 544 Cb 0.23 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 2qlm h LYS 544 CO -0.00 0.82 -0.95 0.35 -2.27 0.00 0.00 179.45 177.40 2qlm h PHE 545 N 1.27 0.68 -0.37 1.91 3.57 -1.18 -1.90 116.94 120.92 2qlm h PHE 545 Ca 0.37 -0.36 0.02 0.00 3.53 0.00 0.00 57.97 61.53 2qlm h PHE 545 Cb -0.07 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.57 2qlm h PHE 545 CO -0.00 1.19 0.25 0.00 -2.23 0.00 0.00 178.31 177.51 2qlm h ALA 546 N 0.70 1.83 0.00 2.41 0.00 -0.58 -1.70 119.26 121.92 2qlm h ALA 546 Ca -0.08 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 2qlm h ALA 546 Cb 1.58 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 2qlm h ALA 546 CO 0.17 0.13 -0.88 0.00 0.00 0.00 0.00 179.25 178.67 2qlm h ALA 547 N 1.78 0.52 -0.52 0.00 0.00 -1.08 -3.11 119.26 116.85 2qlm h ALA 547 Ca 0.15 -0.80 -0.11 0.00 0.00 0.00 0.00 54.91 54.15 2qlm h ALA 547 Cb 0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2qlm h ALA 547 CO -0.03 1.10 -0.09 -0.92 0.00 0.00 0.00 179.25 179.30 2qlm h TYR 548 N 0.00 1.07 -0.61 0.00 5.03 -0.63 -2.28 116.97 119.54 2qlm h TYR 548 Ca -0.01 -0.21 -0.07 0.00 2.58 0.00 0.00 58.73 61.03 2qlm h TYR 548 Cb 1.58 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 39.56 2qlm h TYR 548 CO 0.00 1.00 0.13 -0.07 -1.32 0.00 0.00 178.16 177.89 2qlm h LEU 549 N 0.87 0.95 0.01 2.82 3.38 -1.34 -2.14 115.31 119.86 2qlm h LEU 549 Ca 0.14 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 2qlm h LEU 549 Cb 0.64 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2qlm h LEU 549 CO 0.04 0.95 -0.01 -0.33 0.09 0.00 0.00 178.44 179.19 2qlm h GLU 550 N 0.91 -0.01 -0.53 1.13 5.08 -1.47 -1.60 114.58 118.08 2qlm h GLU 550 Ca 0.19 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2qlm h GLU 550 Cb 0.39 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.62 2qlm h GLU 550 CO 0.01 0.48 0.30 0.00 -1.00 0.00 0.00 179.01 178.79 2qlm h ARG 551 N -0.51 0.73 0.00 2.33 3.08 -1.40 -0.02 114.38 118.59 2qlm h ARG 551 Ca -0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2qlm h ARG 551 Cb 0.50 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2qlm h ARG 551 CO 0.00 0.56 -1.26 0.39 -1.07 0.00 0.00 179.97 178.59 2qlm n GLU 552 N -4.64 0.44 0.00 0.04 4.71 -0.81 -4.64 120.64 115.74 2qlm n GLU 552 Ca 0.03 -0.06 0.00 0.00 -0.01 0.00 0.00 57.16 57.12 2qlm n GLU 552 Cb 0.08 -1.46 0.00 0.00 -1.01 0.00 0.00 31.44 29.04 2qlm n GLU 552 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 2qlm n TYR 553 N -1.70 0.00 -2.68 -0.32 4.01 -0.82 -5.04 117.16 110.60 2qlm n TYR 553 Ca 0.01 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.57 2qlm n TYR 553 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 2qlm n TYR 553 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2qlm n LYS 554 N -0.05 -2.82 -4.17 -0.72 4.76 -0.02 -4.94 118.16 110.21 2qlm n LYS 554 Ca 0.00 0.79 -0.36 0.00 -2.87 0.00 0.00 58.31 55.87 2qlm n LYS 554 Cb 0.11 -5.49 -0.08 0.00 -1.84 0.00 0.00 35.03 27.73 2qlm n LYS 554 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2qlm s VAL 555 N -2.93 4.78 -0.16 -0.18 -7.23 -1.10 -4.93 120.40 108.66 2qlm s VAL 555 Ca 0.12 -0.07 -0.02 0.00 -1.81 0.00 0.00 61.98 60.20 2qlm s VAL 555 Cb -0.06 -3.05 -0.02 0.00 0.56 0.00 0.00 36.38 33.81 2qlm s VAL 555 CO 0.15 0.60 -0.07 -1.00 -0.31 0.00 0.00 175.10 174.47 2qlm s HIS 556 N -0.86 2.93 0.06 2.82 0.09 -1.26 -3.08 115.29 115.98 2qlm s HIS 556 Ca 0.13 -0.56 0.04 0.00 -0.00 0.00 0.00 55.06 54.67 2qlm s HIS 556 Cb -0.12 -1.95 -0.03 0.00 -0.00 0.00 0.00 32.58 30.49 2qlm s HIS 556 CO 0.03 -0.21 -0.12 0.96 -0.00 0.00 0.00 174.74 175.39 2qlm s ILE 557 N 0.60 0.95 -0.37 0.60 -4.36 -1.26 -5.12 121.20 112.24 2qlm s ILE 557 Ca -0.05 -1.20 -0.28 0.00 -0.26 0.00 0.00 60.65 58.87 2qlm s ILE 557 Cb -0.15 -0.93 0.02 0.00 1.25 0.00 0.00 42.46 42.65 2qlm s ILE 557 CO 0.03 -0.24 1.04 0.21 0.24 0.00 0.00 174.94 176.22 2qlm s ASN 558 N -1.61 6.77 0.00 4.36 2.47 -1.26 -4.94 114.94 120.74 2qlm s ASN 558 Ca -0.04 0.75 0.22 0.00 0.42 0.00 0.00 52.86 54.21 2qlm s ASN 558 Cb -0.10 -2.52 1.06 0.00 -1.45 0.00 0.00 41.25 38.25 2qlm s ASN 558 CO 0.02 -0.96 1.70 -2.65 -3.72 0.00 0.00 177.10 171.49 2qlm n PRO 559 N 7.08 0.23 0.01 0.43 -0.02 -1.26 -2.54 135.00 138.92 2qlm n PRO 559 Ca 0.10 0.09 0.12 0.00 -2.02 0.00 0.00 63.50 61.80 2qlm n PRO 559 Cb 0.48 -1.50 0.31 0.00 -0.02 0.00 0.00 33.50 32.77 2qlm n PRO 559 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2qlm n ASN 560 N -1.34 0.43 -4.80 2.55 4.13 -1.26 -4.89 115.26 110.07 2qlm n ASN 560 Ca 0.09 -0.07 -0.31 0.00 1.68 0.00 0.00 54.58 55.98 2qlm n ASN 560 Cb 0.19 0.09 0.07 0.00 -1.54 0.00 0.00 39.78 38.59 2qlm n ASN 560 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2qlm s SER 561 N -3.13 5.04 -0.04 6.41 1.04 -1.05 -4.96 113.70 117.00 2qlm s SER 561 Ca 0.11 1.62 -0.30 0.00 0.48 0.00 0.00 55.95 57.86 2qlm s SER 561 Cb 0.17 -2.43 -0.04 0.00 0.10 0.00 0.00 66.02 63.82 2qlm s SER 561 CO 0.67 -1.66 1.35 -0.22 0.98 0.00 0.00 173.24 174.35 2qlm s LEU 562 N -5.67 4.29 -0.70 2.42 0.20 -0.28 -4.76 118.68 114.18 2qlm s LEU 562 Ca 0.59 1.98 -0.24 0.00 0.69 0.00 0.00 54.13 57.15 2qlm s LEU 562 Cb -0.15 -3.55 0.06 0.00 -0.43 0.00 0.00 46.19 42.12 2qlm s LEU 562 CO 0.55 -0.71 1.08 -0.36 -0.29 0.00 0.00 176.35 176.63 2qlm s PHE 563 N 2.64 2.55 -0.46 5.38 2.99 -1.26 -0.74 117.98 129.08 2qlm s PHE 563 Ca 0.61 -0.41 -0.17 0.00 0.00 0.00 0.00 56.93 56.97 2qlm s PHE 563 Cb -0.28 -4.41 0.05 0.00 0.00 0.00 0.00 43.02 38.37 2qlm s PHE 563 CO 0.24 -1.80 0.45 0.34 -0.00 0.00 0.00 175.22 174.45 2qlm s ASP 564 N 3.73 6.17 -0.06 1.36 3.68 0.47 -1.70 116.67 130.32 2qlm s ASP 564 Ca 0.27 -1.00 0.03 0.00 2.13 0.00 0.00 52.55 53.98 2qlm s ASP 564 Cb -0.13 -2.22 0.01 0.00 -1.45 0.00 0.00 42.92 39.13 2qlm s ASP 564 CO 0.11 -0.66 -0.15 0.54 0.13 0.00 0.00 175.17 175.14 2qlm s VAL 565 N 2.00 1.30 -0.33 1.11 0.11 -0.59 0.30 120.40 124.29 2qlm s VAL 565 Ca 0.09 -0.60 0.02 0.00 -2.93 0.00 0.00 61.98 58.56 2qlm s VAL 565 Cb -0.20 -1.15 0.10 0.00 -1.53 0.00 0.00 36.38 33.59 2qlm s VAL 565 CO 0.10 0.39 0.07 -1.58 -3.33 0.00 0.00 175.10 170.74 2qlm s GLN 566 N 0.40 1.20 -0.13 1.54 0.74 -0.20 -2.00 119.66 121.21 2qlm s GLN 566 Ca -0.11 -1.56 0.03 0.00 0.05 0.00 0.00 55.36 53.77 2qlm s GLN 566 Cb -0.14 -2.74 0.01 0.00 1.10 0.00 0.00 33.01 31.23 2qlm s GLN 566 CO 0.04 -0.95 -0.22 0.14 -0.55 0.00 0.00 175.29 173.75 2qlm s VAL 567 N 1.18 2.11 0.00 1.34 -7.23 -1.26 -2.01 120.40 114.53 2qlm s VAL 567 Ca 0.10 -0.97 0.00 0.00 -1.81 0.00 0.00 61.98 59.30 2qlm s VAL 567 Cb -0.18 -1.83 0.00 0.00 0.56 0.00 0.00 36.38 34.92 2qlm s VAL 567 CO -0.14 0.55 0.00 2.29 -0.31 0.00 0.00 175.10 177.49 2qlm n LYS 568 N 3.90 0.00 -1.68 4.82 2.85 -0.94 -4.98 118.16 122.13 2qlm n LYS 568 Ca -0.20 0.00 -0.39 0.00 -1.05 0.00 0.00 58.31 56.68 2qlm n LYS 568 Cb 0.52 0.00 0.04 0.00 -0.65 0.00 0.00 35.03 34.94 2qlm n LYS 568 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2qlm n ARG 569 N -0.43 1.36 -2.58 -1.58 5.12 -1.26 -3.93 116.66 113.36 2qlm n ARG 569 Ca 0.00 0.51 -0.43 0.00 -1.93 0.00 0.00 57.85 56.00 2qlm n ARG 569 Cb 0.00 -2.35 -0.02 0.00 -1.16 0.00 0.00 32.46 28.93 2qlm n ARG 569 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2qlm s ILE 570 N -1.36 4.31 0.01 0.55 -1.09 -0.51 -4.90 121.20 118.20 2qlm s ILE 570 Ca 0.72 1.43 -0.01 0.00 -2.23 0.00 0.00 60.65 60.56 2qlm s ILE 570 Cb -0.44 -4.46 -0.01 0.00 -1.58 0.00 0.00 42.46 35.97 2qlm s ILE 570 CO 0.49 -0.72 0.00 -1.00 -1.23 0.00 0.00 174.94 172.48 2qlm s HIS 571 N 4.17 0.14 0.24 3.97 3.76 -1.26 -4.67 115.29 121.64 2qlm s HIS 571 Ca 0.48 -0.29 -0.06 0.00 -0.15 0.00 0.00 55.06 55.05 2qlm s HIS 571 Cb -0.11 -0.11 0.32 0.00 1.11 0.00 0.00 32.58 33.80 2qlm s HIS 571 CO 0.24 -0.13 1.85 0.93 -0.85 0.00 0.00 174.74 176.78 2qlm h GLU 572 N 5.14 0.93 0.00 1.40 5.08 -1.96 -2.71 114.58 122.45 2qlm h GLU 572 Ca -0.29 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 57.98 2qlm h GLU 572 Cb 1.21 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 2qlm h GLU 572 CO 0.44 0.62 -0.16 0.10 -1.00 0.00 0.00 179.01 179.01 2qlm h TYR 573 N 0.96 0.00 0.00 4.33 -0.00 -1.97 -1.78 116.97 118.51 2qlm h TYR 573 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.10 2qlm h TYR 573 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.89 2qlm h TYR 573 CO -0.03 0.16 -0.07 1.63 -0.00 0.00 0.00 178.16 179.85 2qlm n LYS 574 N -3.66 0.08 -3.76 0.10 5.02 -1.03 -2.84 118.16 112.07 2qlm n LYS 574 Ca -0.01 0.06 -0.25 0.00 -2.02 0.00 0.00 58.31 56.08 2qlm n LYS 574 Cb 0.28 -1.58 0.04 0.00 -0.02 0.00 0.00 35.03 33.75 2qlm n LYS 574 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qlm n ARG 575 N -1.71 -5.58 -0.23 1.97 1.74 -0.67 -4.02 116.66 108.17 2qlm n ARG 575 Ca 0.06 0.65 0.26 0.00 -0.77 0.00 0.00 57.85 58.05 2qlm n ARG 575 Cb 0.37 -5.41 0.64 0.00 -1.02 0.00 0.00 32.46 27.03 2qlm n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2qlm h GLN 576 N -2.05 0.16 -0.73 5.56 7.50 -1.84 -1.73 115.11 121.99 2qlm h GLN 576 Ca -0.59 -0.01 -0.01 0.00 0.50 0.00 0.00 58.65 58.54 2qlm h GLN 576 Cb 1.37 -0.04 -0.04 0.00 0.05 0.00 0.00 27.48 28.82 2qlm h GLN 576 CO 0.60 0.11 0.43 -0.07 -1.50 0.00 0.00 178.83 178.39 2qlm h LEU 577 N 0.16 0.88 -0.54 1.46 3.38 -1.90 -0.81 115.31 117.95 2qlm h LEU 577 Ca 0.47 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.36 2qlm h LEU 577 Cb 1.57 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.08 2qlm h LEU 577 CO -0.09 0.69 0.23 0.25 0.09 0.00 0.00 178.44 179.61 2qlm h LEU 578 N 1.01 0.73 -0.34 1.67 5.85 -1.69 -1.49 115.31 121.06 2qlm h LEU 578 Ca 0.26 -0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.89 2qlm h LEU 578 Cb -0.02 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.76 2qlm h LEU 578 CO -0.05 0.69 -0.07 -1.13 -0.34 0.00 0.00 178.44 177.54 2qlm h ASN 579 N 0.73 -0.28 -0.83 1.25 -0.00 -1.36 -2.19 115.58 112.90 2qlm h ASN 579 Ca 0.18 0.10 0.11 0.00 -0.00 0.00 0.00 56.30 56.69 2qlm h ASN 579 Cb 0.17 0.20 -0.08 0.00 -0.00 0.00 0.00 38.32 38.61 2qlm h ASN 579 CO -0.02 -0.10 0.46 0.00 -0.00 0.00 0.00 177.43 177.78 2qlm h LEU 581 N 0.74 1.05 -0.17 0.00 3.38 -0.89 -1.95 115.31 117.47 2qlm h LEU 581 Ca 0.42 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 2qlm h LEU 581 Cb 0.45 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2qlm h LEU 581 CO -0.28 0.97 0.08 -0.74 0.09 0.00 0.00 178.44 178.56 2qlm h HIS 582 N 1.07 0.25 -0.47 1.13 2.76 -0.78 -1.52 115.15 117.59 2qlm h HIS 582 Ca 0.24 -0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.49 2qlm h HIS 582 Cb 0.29 -0.08 -0.08 0.00 1.55 0.00 0.00 27.41 29.09 2qlm h HIS 582 CO 0.02 0.28 -0.02 0.28 -1.30 0.00 0.00 177.93 177.19 2qlm h VAL 583 N 0.15 0.62 -0.67 5.26 2.07 -1.00 -1.00 116.25 121.67 2qlm h VAL 583 Ca 0.06 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.50 2qlm h VAL 583 Cb 0.12 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.38 2qlm h VAL 583 CO -0.01 0.02 0.21 0.40 0.02 0.00 0.00 177.57 178.21 2qlm h ILE 584 N 0.09 1.24 -0.38 4.57 2.04 -1.28 -2.01 117.51 121.79 2qlm h ILE 584 Ca 0.24 -0.83 0.02 0.00 1.00 0.00 0.00 64.86 65.28 2qlm h ILE 584 Cb 0.35 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 2qlm h ILE 584 CO -0.41 0.33 0.20 0.74 0.00 0.00 0.00 178.15 179.01 2qlm h THR 585 N 0.98 1.01 -0.41 -0.27 2.02 -0.43 -0.12 112.91 115.69 2qlm h THR 585 Ca 0.22 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 67.27 2qlm h THR 585 Cb 0.27 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 2qlm h THR 585 CO -0.01 0.08 0.25 -0.07 0.37 0.00 0.00 175.52 176.14 2qlm h LEU 586 N 0.41 0.42 -0.34 2.58 4.07 -0.94 -0.46 115.31 121.05 2qlm h LEU 586 Ca 0.15 -0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.12 2qlm h LEU 586 Cb 0.04 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 2qlm h LEU 586 CO -0.09 0.30 0.21 0.22 -1.08 0.00 0.00 178.44 178.01 2qlm h TYR 587 N 0.51 0.40 -0.73 1.13 5.03 -1.10 -1.39 116.97 120.83 2qlm h TYR 587 Ca 0.16 0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.42 2qlm h TYR 587 Cb -0.02 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.10 2qlm h TYR 587 CO -0.06 0.25 0.21 -0.91 -1.32 0.00 0.00 178.16 176.33 2qlm h ASN 588 N 0.44 1.07 -0.61 -2.11 2.35 -0.75 -0.86 115.58 115.11 2qlm h ASN 588 Ca 0.13 -0.22 -0.07 0.00 -0.55 0.00 0.00 56.30 55.60 2qlm h ASN 588 Cb -0.03 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.03 2qlm h ASN 588 CO -0.04 1.00 0.13 0.03 -1.65 0.00 0.00 177.43 176.90 2qlm h ARG 589 N 1.08 1.01 -0.22 0.81 3.08 -0.94 -1.10 114.38 118.10 2qlm h ARG 589 Ca 0.23 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2qlm h ARG 589 Cb 0.33 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2qlm h ARG 589 CO -0.00 0.91 0.09 0.82 -1.07 0.00 0.00 179.97 180.72 2qlm h ILE 590 N 0.96 1.16 -0.02 2.04 2.04 -0.96 -2.05 117.51 120.67 2qlm h ILE 590 Ca 0.20 -0.48 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 2qlm h ILE 590 Cb 0.37 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 2qlm h ILE 590 CO 0.00 0.16 -0.18 0.11 0.00 0.00 0.00 178.15 178.24 2qlm h LYS 591 N 0.20 0.03 -0.15 2.37 1.79 -0.98 -1.48 116.57 118.36 2qlm h LYS 591 Ca 0.07 -0.01 -0.23 0.00 -2.18 0.00 0.00 60.65 58.31 2qlm h LYS 591 Cb 0.16 -0.01 0.01 0.00 -1.58 0.00 0.00 32.23 30.82 2qlm h LYS 591 CO -0.01 0.22 -0.80 -0.22 -1.08 0.00 0.00 179.45 177.57 2qlm h LYS 592 N 0.03 0.80 -2.49 3.15 3.64 -1.08 -3.39 116.57 117.23 2qlm h LYS 592 Ca 0.01 -0.66 -0.59 0.00 -1.27 0.00 0.00 60.65 58.13 2qlm h LYS 592 Cb 0.35 0.14 -0.40 0.00 -0.41 0.00 0.00 32.23 31.91 2qlm h LYS 592 CO 0.02 1.27 -0.84 0.39 -2.27 0.00 0.00 179.45 178.02 2qlm n GLU 593 N -3.93 0.99 0.09 1.90 1.02 -0.78 -5.00 120.64 114.92 2qlm n GLU 593 Ca -0.08 -3.71 0.04 0.00 -0.02 0.00 0.00 57.16 53.39 2qlm n GLU 593 Cb 0.76 -1.83 0.46 0.00 -0.02 0.00 0.00 31.44 30.80 2qlm n GLU 593 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2qlm h PRO 594 N 5.14 0.35 -0.54 3.49 0.11 -1.49 -2.83 132.00 136.23 2qlm h PRO 594 Ca 0.20 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2qlm h PRO 594 Cb 0.83 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2qlm h PRO 594 CO 0.53 0.29 0.00 0.09 -0.21 0.00 0.00 178.00 178.71 2qlm n ASN 595 N -4.43 3.10 -4.81 -2.05 5.03 -1.26 -4.88 115.26 105.96 2qlm n ASN 595 Ca 0.01 -1.98 -0.37 0.00 0.87 0.00 0.00 54.58 53.11 2qlm n ASN 595 Cb 0.13 -0.36 -0.06 0.00 -1.02 0.00 0.00 39.78 38.47 2qlm n ASN 595 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 2qlm s LYS 596 N -1.28 4.27 0.08 3.52 2.36 -1.07 -5.04 119.74 122.57 2qlm s LYS 596 Ca 0.39 0.87 -0.30 0.00 -2.55 0.00 0.00 55.97 54.38 2qlm s LYS 596 Cb 0.21 -2.98 -0.05 0.00 -1.05 0.00 0.00 37.83 33.96 2qlm s LYS 596 CO 0.27 0.45 1.02 0.12 1.55 0.00 0.00 175.35 178.77 2qlm s PHE 597 N -1.42 3.68 0.05 4.03 5.36 -1.26 -5.05 117.98 123.37 2qlm s PHE 597 Ca 0.40 1.67 0.05 0.00 -0.96 0.00 0.00 56.93 58.09 2qlm s PHE 597 Cb -0.18 -3.16 -0.02 0.00 -0.34 0.00 0.00 43.02 39.32 2qlm s PHE 597 CO 0.21 -0.19 -0.14 0.14 -1.46 0.00 0.00 175.22 173.79 2qlm s VAL 598 N 0.45 1.07 -0.02 3.12 -7.23 -1.26 -5.11 120.40 111.42 2qlm s VAL 598 Ca 0.51 -1.13 -0.30 0.00 -1.81 0.00 0.00 61.98 59.25 2qlm s VAL 598 Cb -0.24 -1.00 -0.07 0.00 0.56 0.00 0.00 36.38 35.63 2qlm s VAL 598 CO 0.30 -0.12 1.73 -0.69 -0.31 0.00 0.00 175.10 176.01 2qlm s VAL 599 N -1.06 3.39 0.33 1.32 1.01 -1.26 -4.95 120.40 119.17 2qlm s VAL 599 Ca -0.01 0.51 -0.29 0.00 0.00 0.00 0.00 61.98 62.20 2qlm s VAL 599 Cb -0.09 -3.33 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 2qlm s VAL 599 CO 0.02 -0.04 1.39 -2.84 0.00 0.00 0.00 175.10 173.62 2qlm s PRO 600 N 3.99 4.27 0.01 2.72 0.02 -1.26 -4.93 135.00 139.81 2qlm s PRO 600 Ca 0.77 2.34 0.04 0.00 0.02 0.00 0.00 61.00 64.17 2qlm s PRO 600 Cb -0.36 -3.05 -0.01 0.00 0.02 0.00 0.00 34.50 31.09 2qlm s PRO 600 CO 0.33 -0.34 -0.14 1.03 -0.33 0.00 0.00 177.00 177.55 2qlm s ARG 601 N -1.56 1.04 -0.32 5.54 0.52 -0.29 -1.12 118.95 122.76 2qlm s ARG 601 Ca 0.52 -0.59 -0.06 0.00 -0.52 0.00 0.00 55.73 55.08 2qlm s ARG 601 Cb -0.42 -1.02 0.03 0.00 0.52 0.00 0.00 34.95 34.05 2qlm s ARG 601 CO 0.54 0.27 0.09 0.99 0.02 0.00 0.00 175.30 177.20 2qlm s THR 602 N -0.52 3.78 -0.35 0.02 2.01 0.08 -1.95 115.64 118.71 2qlm s THR 602 Ca 0.04 -0.99 -0.15 0.00 0.31 0.00 0.00 61.69 60.90 2qlm s THR 602 Cb -0.06 -3.07 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 2qlm s THR 602 CO 0.00 -0.07 0.37 -0.69 -0.69 0.00 0.00 174.62 173.54 2qlm s VAL 603 N 1.43 5.16 -0.19 3.82 1.01 0.74 -0.39 120.40 131.97 2qlm s VAL 603 Ca -0.00 0.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.97 2qlm s VAL 603 Cb -0.19 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 2qlm s VAL 603 CO 0.02 -0.13 -0.09 -0.04 0.00 0.00 0.00 175.10 174.86 2qlm s MET 604 N 2.04 3.32 -0.07 2.72 -1.94 0.15 -1.06 119.30 124.46 2qlm s MET 604 Ca 0.12 -0.67 0.04 0.00 -1.71 0.00 0.00 55.69 53.47 2qlm s MET 604 Cb -0.17 -2.85 0.00 0.00 2.01 0.00 0.00 34.83 33.83 2qlm s MET 604 CO 0.12 -0.10 -0.19 0.42 -0.01 0.00 0.00 175.02 175.26 2qlm s ILE 605 N 1.17 1.65 0.05 2.53 1.01 -0.55 -1.04 121.20 126.02 2qlm s ILE 605 Ca 0.02 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.74 2qlm s ILE 605 Cb -0.14 -1.43 0.01 0.00 0.01 0.00 0.00 42.46 40.91 2qlm s ILE 605 CO -0.03 0.47 0.26 -0.83 0.00 0.00 0.00 174.94 174.81 2qlm s GLY 606 N 0.24 -0.05 0.00 6.18 0.00 -0.85 -0.31 107.32 112.53 2qlm s GLY 606 Ca -0.11 -0.19 0.00 0.00 0.00 0.00 0.00 44.72 44.42 2qlm s GLY 606 CO 0.05 -0.39 0.00 0.61 0.00 0.00 0.00 173.10 173.37 2qlm n GLY 607 N 0.46 3.87 3.87 0.20 0.00 -1.25 -2.22 105.19 110.12 2qlm n GLY 607 Ca -0.18 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.54 2qlm n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qlm s LYS 608 N -2.63 3.77 -0.12 1.61 1.02 -1.26 -4.68 119.74 117.45 2qlm s LYS 608 Ca 0.00 0.18 -0.05 0.00 0.02 0.00 0.00 55.97 56.12 2qlm s LYS 608 Cb 0.00 -2.96 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 2qlm s LYS 608 CO 0.00 0.53 0.08 0.00 -0.92 0.00 0.00 175.35 175.05 2qlm s ALA 609 N -1.45 3.61 0.22 5.17 0.00 -1.26 -1.43 121.76 126.63 2qlm s ALA 609 Ca 0.35 -0.71 -0.32 0.00 0.00 0.00 0.00 51.96 51.28 2qlm s ALA 609 Cb -0.14 -1.80 -0.13 0.00 0.00 0.00 0.00 23.12 21.05 2qlm s ALA 609 CO 0.19 0.54 1.60 0.00 0.00 0.00 0.00 175.76 178.09 2qlm n ALA 610 N 2.29 2.09 0.18 0.00 0.00 -1.26 -4.86 120.51 118.95 2qlm n ALA 610 Ca -0.19 0.41 0.19 0.00 0.00 0.00 0.00 53.44 53.84 2qlm n ALA 610 Cb 0.54 -2.42 0.80 0.00 0.00 0.00 0.00 19.45 18.37 2qlm n ALA 610 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2qlm h PRO 611 N 5.63 0.00 -0.08 0.00 0.11 -1.98 -0.68 132.00 135.00 2qlm h PRO 611 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2qlm h PRO 611 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2qlm h PRO 611 CO 0.87 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.07 2qlm n GLY 612 N -1.40 1.10 3.45 -0.55 0.00 -1.26 -4.84 105.19 101.67 2qlm n GLY 612 Ca 0.04 -0.70 -0.44 0.00 0.00 0.00 0.00 46.02 44.92 2qlm n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2qlm s TYR 613 N -1.93 3.07 0.14 1.61 6.04 -0.26 -4.90 117.35 121.11 2qlm s TYR 613 Ca 0.30 -1.28 -0.17 0.00 0.04 0.00 0.00 57.07 55.95 2qlm s TYR 613 Cb 0.20 -4.27 -0.02 0.00 -1.04 0.00 0.00 41.96 36.84 2qlm s TYR 613 CO 0.30 -1.50 1.79 1.25 -1.54 0.00 0.00 175.55 175.85 2qlm h HIS 614 N 8.93 0.43 -0.94 4.97 -0.00 -1.88 -2.29 115.15 124.37 2qlm h HIS 614 Ca 0.09 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.46 2qlm h HIS 614 Cb 1.03 -0.14 -0.04 0.00 -0.00 0.00 0.00 27.41 28.25 2qlm h HIS 614 CO 1.13 0.28 0.55 1.98 -0.00 0.00 0.00 177.93 181.88 2qlm h MET 615 N 0.44 1.28 -0.34 5.26 1.85 -1.98 -1.02 114.93 120.42 2qlm h MET 615 Ca 0.12 -0.12 -0.07 0.00 -0.61 0.00 0.00 59.70 59.02 2qlm h MET 615 Cb -0.03 -0.26 -0.02 0.00 0.43 0.00 0.00 31.60 31.72 2qlm h MET 615 CO -0.02 0.90 -0.07 0.00 -0.40 0.00 0.00 176.91 177.32 2qlm h ALA 616 N 1.30 1.24 -0.10 0.39 0.00 -1.83 -1.13 119.26 119.13 2qlm h ALA 616 Ca 0.33 -0.25 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 2qlm h ALA 616 Cb -0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2qlm h ALA 616 CO -0.06 0.50 -0.58 0.87 0.00 0.00 0.00 179.25 179.98 2qlm h LYS 617 N 0.53 0.33 -0.30 0.00 1.57 -0.90 -2.65 116.57 115.15 2qlm h LYS 617 Ca 0.10 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.58 2qlm h LYS 617 Cb 0.45 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 2qlm h LYS 617 CO 0.02 0.82 -0.19 0.52 -0.57 0.00 0.00 179.45 180.05 2qlm h MET 618 N 0.25 0.54 -0.53 3.15 2.86 -0.81 -2.58 114.93 117.80 2qlm h MET 618 Ca -0.00 -0.18 -0.07 0.00 -2.06 0.00 0.00 59.70 57.38 2qlm h MET 618 Cb 1.09 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.68 2qlm h MET 618 CO 0.10 0.70 0.05 0.82 1.06 0.00 0.00 176.91 179.64 2qlm h ILE 619 N 0.49 1.26 -0.20 -1.22 2.04 -1.05 -0.57 117.51 118.25 2qlm h ILE 619 Ca 0.08 -1.02 0.01 0.00 1.00 0.00 0.00 64.86 64.93 2qlm h ILE 619 Cb 0.60 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 2qlm h ILE 619 CO 0.04 0.37 0.11 0.40 0.00 0.00 0.00 178.15 179.06 2qlm h ILE 620 N 0.79 1.01 -0.83 -0.67 2.04 -1.39 -1.93 117.51 116.53 2qlm h ILE 620 Ca 0.16 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.96 2qlm h ILE 620 Cb 0.46 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 2qlm h ILE 620 CO 0.02 0.04 0.54 0.50 0.00 0.00 0.00 178.15 179.25 2qlm h LYS 621 N 0.23 1.06 -0.41 2.37 1.63 -1.25 -2.07 116.57 118.13 2qlm h LYS 621 Ca 0.08 -0.06 0.04 0.00 -0.85 0.00 0.00 60.65 59.86 2qlm h LYS 621 Cb 0.01 -0.24 -0.04 0.00 -0.60 0.00 0.00 32.23 31.36 2qlm h LYS 621 CO -0.05 0.70 0.17 1.25 -3.45 0.00 0.00 179.45 178.07 2qlm h LEU 622 N 1.09 0.21 -0.22 5.20 6.46 -0.86 0.09 115.31 127.28 2qlm h LEU 622 Ca 0.31 0.04 0.01 0.00 -0.12 0.00 0.00 57.88 58.12 2qlm h LEU 622 Cb -0.08 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 2qlm h LEU 622 CO -0.08 0.16 0.11 0.40 -0.62 0.00 0.00 178.44 178.40 2qlm h ILE 623 N 0.35 1.00 -0.55 4.05 2.04 -0.82 0.77 117.51 124.36 2qlm h ILE 623 Ca 0.18 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.90 2qlm h ILE 623 Cb 0.14 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2qlm h ILE 623 CO -0.17 0.04 0.09 0.71 0.00 0.00 0.00 178.15 178.82 2qlm h THR 624 N 0.24 1.24 -0.77 -0.27 1.35 -1.23 -1.76 112.91 111.70 2qlm h THR 624 Ca 0.09 -0.92 -0.06 0.00 -0.55 0.00 0.00 66.41 64.97 2qlm h THR 624 Cb 0.01 0.73 -0.03 0.00 -1.73 0.00 0.00 68.15 67.13 2qlm h THR 624 CO -0.05 0.34 0.26 0.00 -0.25 0.00 0.00 175.52 175.81 2qlm h ALA 625 N 1.26 1.00 -0.10 6.62 0.00 -0.40 -0.09 119.26 127.55 2qlm h ALA 625 Ca 0.17 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2qlm h ALA 625 Cb 0.37 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2qlm h ALA 625 CO 0.01 0.67 0.03 0.82 0.00 0.00 0.00 179.25 180.78 2qlm h ILE 626 N 1.13 1.16 -0.58 0.00 2.04 -0.64 -2.94 117.51 117.69 2qlm h ILE 626 Ca 0.25 -0.49 0.10 0.00 1.00 0.00 0.00 64.86 65.72 2qlm h ILE 626 Cb 0.28 1.31 -0.08 0.00 -0.74 0.00 0.00 36.82 37.59 2qlm h ILE 626 CO -0.01 0.14 0.15 1.23 0.00 0.00 0.00 178.15 179.66 2qlm h GLY 627 N -0.02 0.75 0.86 5.37 0.00 -1.05 0.83 103.07 109.82 2qlm h GLY 627 Ca 0.03 -0.05 0.11 0.00 0.00 0.00 0.00 47.33 47.42 2qlm h GLY 627 CO -0.00 -0.08 0.49 -0.55 0.00 0.00 0.00 176.54 176.40 2qlm h ASP 628 N 0.29 0.54 0.00 0.19 3.45 -0.92 0.13 116.42 120.11 2qlm h ASP 628 Ca 0.30 0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.75 2qlm h ASP 628 Cb 0.41 -0.10 -0.00 0.00 -0.56 0.00 0.00 39.33 39.08 2qlm h ASP 628 CO -0.36 0.32 -0.15 0.58 -1.57 0.00 0.00 179.24 178.06 2qlm h VAL 629 N 0.60 1.65 -0.28 -1.35 2.07 -1.21 -3.36 116.25 114.35 2qlm h VAL 629 Ca 0.35 -2.29 -0.08 0.00 0.82 0.00 0.00 66.70 65.49 2qlm h VAL 629 Cb 0.54 3.17 -0.01 0.00 -1.52 0.00 0.00 31.29 33.46 2qlm h VAL 629 CO -0.12 0.56 -0.13 0.58 0.02 0.00 0.00 177.57 178.47 2qlm h VAL 630 N -1.00 1.29 0.00 2.57 2.07 -0.65 -3.04 116.25 117.50 2qlm h VAL 630 Ca -0.04 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.26 2qlm h VAL 630 Cb 1.01 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 2qlm h VAL 630 CO -0.03 0.39 0.00 0.59 0.02 0.00 0.00 177.57 178.54 2qlm n ASN 631 N -4.43 0.31 -0.15 0.57 3.02 0.45 -3.06 115.26 111.97 2qlm n ASN 631 Ca -0.03 0.57 0.02 0.00 -0.03 0.00 0.00 54.58 55.10 2qlm n ASN 631 Cb 0.36 -0.64 0.03 0.00 -0.61 0.00 0.00 39.78 38.92 2qlm n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2qlm n HIS 632 N -1.84 0.06 -2.78 3.10 8.25 -1.19 -4.97 115.22 115.85 2qlm n HIS 632 Ca 0.03 -0.24 -0.42 0.00 -0.26 0.00 0.00 57.72 56.83 2qlm n HIS 632 Cb 0.21 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.26 2qlm n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2qlm s ASP 633 N -0.61 6.83 0.42 0.41 -1.08 -1.15 -4.94 116.67 116.54 2qlm s ASP 633 Ca 0.05 0.92 0.10 0.00 -0.52 0.00 0.00 52.55 53.10 2qlm s ASP 633 Cb 0.03 -2.48 0.90 0.00 -1.46 0.00 0.00 42.92 39.90 2qlm s ASP 633 CO 0.04 -0.73 2.00 -0.65 0.52 0.00 0.00 175.17 176.35 2qlm h PRO 634 N 8.01 0.28 -0.17 4.34 0.11 -1.93 -2.60 132.00 140.04 2qlm h PRO 634 Ca -0.22 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.75 2qlm h PRO 634 Cb 1.08 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 2qlm h PRO 634 CO 0.96 0.30 -0.32 0.28 -0.21 0.00 0.00 178.00 179.01 2qlm h VAL 635 N 0.28 1.28 -0.14 3.15 2.07 -1.97 -3.11 116.25 117.81 2qlm h VAL 635 Ca 0.07 -1.35 -0.02 0.00 0.82 0.00 0.00 66.70 66.22 2qlm h VAL 635 Cb 0.18 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 2qlm h VAL 635 CO 0.00 0.42 0.01 0.58 0.02 0.00 0.00 177.57 178.60 2qlm h VAL 636 N 0.30 1.23 0.00 2.57 2.07 -1.81 -3.49 116.25 117.13 2qlm h VAL 636 Ca 0.04 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.81 2qlm h VAL 636 Cb 0.72 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 2qlm h VAL 636 CO 0.05 0.22 0.00 0.61 0.02 0.00 0.00 177.57 178.48 2qlm n GLY 637 N -0.37 1.67 1.43 2.17 0.00 -1.18 -2.86 105.19 106.05 2qlm n GLY 637 Ca -0.05 -0.64 0.06 0.00 0.00 0.00 0.00 46.02 45.39 2qlm n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qlm n ASP 638 N 2.80 4.20 0.14 1.61 5.75 -1.26 -4.33 116.55 125.46 2qlm n ASP 638 Ca 0.00 -2.52 0.04 0.00 -0.01 0.00 0.00 54.79 52.30 2qlm n ASP 638 Cb 0.00 -0.57 0.03 0.00 -1.03 0.00 0.00 41.12 39.55 2qlm n ASP 638 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2qlm h ARG 639 N 3.13 0.00 -2.85 0.11 3.08 -1.87 -3.43 114.38 112.56 2qlm h ARG 639 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 2qlm h ARG 639 Cb 1.40 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 31.15 2qlm h ARG 639 CO 0.28 0.42 -0.44 -1.17 -1.07 0.00 0.00 179.97 177.99 2qlm s LEU 640 N -6.37 0.03 -0.02 3.04 2.96 -1.26 -1.13 118.68 115.93 2qlm s LEU 640 Ca 0.04 0.67 0.02 0.00 -0.22 0.00 0.00 54.13 54.63 2qlm s LEU 640 Cb 0.07 0.92 0.00 0.00 0.50 0.00 0.00 46.19 47.69 2qlm s LEU 640 CO 0.74 -0.20 -0.07 -0.13 -1.32 0.00 0.00 176.35 175.38 2qlm s ARG 641 N 1.70 0.69 -0.20 1.98 1.81 -0.82 -4.68 118.95 119.43 2qlm s ARG 641 Ca -0.06 -0.22 0.01 0.00 -1.72 0.00 0.00 55.73 53.74 2qlm s ARG 641 Cb -0.10 -0.67 0.03 0.00 -0.45 0.00 0.00 34.95 33.76 2qlm s ARG 641 CO -0.10 0.09 -0.14 0.08 -0.68 0.00 0.00 175.30 174.55 2qlm s VAL 642 N 0.15 1.86 -0.08 3.52 1.01 -1.26 -0.18 120.40 125.42 2qlm s VAL 642 Ca -0.02 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.96 2qlm s VAL 642 Cb -0.07 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.50 2qlm s VAL 642 CO -0.00 0.30 -0.17 -0.63 0.00 0.00 0.00 175.10 174.61 2qlm s ILE 643 N 1.32 1.48 -0.28 2.22 1.09 -0.22 -4.54 121.20 122.27 2qlm s ILE 643 Ca 0.00 -0.68 -0.20 0.00 -1.10 0.00 0.00 60.65 58.67 2qlm s ILE 643 Cb -0.15 -1.32 -0.01 0.00 -1.06 0.00 0.00 42.46 39.91 2qlm s ILE 643 CO -0.10 0.43 0.62 0.12 -0.10 0.00 0.00 174.94 175.91 2qlm s PHE 644 N 0.57 3.25 -0.58 3.97 2.19 -1.26 -1.48 117.98 124.63 2qlm s PHE 644 Ca -0.16 0.68 -0.28 0.00 0.33 0.00 0.00 56.93 57.50 2qlm s PHE 644 Cb -0.17 -2.90 0.02 0.00 -1.31 0.00 0.00 43.02 38.66 2qlm s PHE 644 CO 0.05 -0.40 1.30 -0.51 1.83 0.00 0.00 175.22 177.50 2qlm s LEU 645 N 2.54 3.41 0.28 6.12 1.02 0.57 -4.96 118.68 127.66 2qlm s LEU 645 Ca 0.25 0.16 -0.29 0.00 0.02 0.00 0.00 54.13 54.27 2qlm s LEU 645 Cb -0.15 -3.08 -0.10 0.00 0.02 0.00 0.00 46.19 42.88 2qlm s LEU 645 CO 0.10 -1.61 1.17 -0.70 0.02 0.00 0.00 176.35 175.34 2qlm s GLU 646 N 5.25 4.54 -1.27 1.70 2.12 -1.26 -3.88 118.70 125.91 2qlm s GLU 646 Ca 0.47 1.92 -0.04 0.00 0.36 0.00 0.00 54.97 57.68 2qlm s GLU 646 Cb -0.09 -3.17 0.00 0.00 0.26 0.00 0.00 34.13 31.14 2qlm s GLU 646 CO 0.25 0.06 1.07 -1.71 -0.54 0.00 0.00 175.26 174.39 2qlm n ASN 647 N 1.30 -3.82 -4.71 -1.70 5.15 -1.25 -4.92 115.26 105.31 2qlm n ASN 647 Ca 0.00 -0.59 -0.42 0.00 -0.60 0.00 0.00 54.58 52.97 2qlm n ASN 647 Cb 0.44 -5.07 -0.03 0.00 -0.53 0.00 0.00 39.78 34.59 2qlm n ASN 647 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qlm n TYR 648 N -4.50 2.70 -3.84 1.20 9.36 -1.26 -4.86 117.16 115.97 2qlm n TYR 648 Ca -0.17 -0.03 -0.09 0.00 3.32 0.00 0.00 57.90 60.93 2qlm n TYR 648 Cb 0.62 -2.69 0.01 0.00 -0.63 0.00 0.00 39.34 36.65 2qlm n TYR 648 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 2qlm s ARG 649 N 1.74 2.17 0.17 2.98 1.70 -1.26 -4.71 118.95 121.73 2qlm s ARG 649 Ca 0.78 -1.42 -0.14 0.00 -0.47 0.00 0.00 55.73 54.47 2qlm s ARG 649 Cb -0.50 0.61 0.10 0.00 -0.57 0.00 0.00 34.95 34.59 2qlm s ARG 649 CO 0.34 -1.01 1.78 0.28 -1.08 0.00 0.00 175.30 175.62 2qlm h VAL 650 N 2.01 0.97 -0.17 4.99 2.07 -1.95 -1.15 116.25 123.02 2qlm h VAL 650 Ca -0.31 -0.16 -0.08 0.00 0.82 0.00 0.00 66.70 66.98 2qlm h VAL 650 Cb 1.25 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 2qlm h VAL 650 CO 0.39 0.08 -0.26 0.77 0.02 0.00 0.00 177.57 178.58 2qlm h SER 651 N 0.46 0.30 0.03 0.57 4.64 -1.97 -2.05 113.55 115.52 2qlm h SER 651 Ca 0.20 -0.09 -0.14 0.00 -0.47 0.00 0.00 61.79 61.28 2qlm h SER 651 Cb 0.10 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 2qlm h SER 651 CO -0.14 0.56 -0.48 0.25 -0.87 0.00 0.00 176.83 176.16 2qlm h LEU 652 N 0.27 0.57 -0.81 5.97 5.85 -1.78 -3.18 115.31 122.20 2qlm h LEU 652 Ca 0.04 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.49 2qlm h LEU 652 Cb 0.60 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 2qlm h LEU 652 CO 0.04 0.96 0.53 0.00 -0.34 0.00 0.00 178.44 179.63 2qlm h ALA 653 N 1.06 1.02 -0.01 1.25 0.00 -0.67 -0.99 119.26 120.93 2qlm h ALA 653 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qlm h ALA 653 Cb 0.99 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2qlm h ALA 653 CO 0.09 0.44 0.01 0.93 0.00 0.00 0.00 179.25 180.72 2qlm h GLU 654 N 1.09 0.00 0.00 0.00 5.08 -1.37 -1.96 114.58 117.42 2qlm h GLU 654 Ca 0.29 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.43 2qlm h GLU 654 Cb -0.11 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 2qlm h GLU 654 CO -0.06 0.00 -1.29 1.63 -1.00 0.00 0.00 179.01 178.29 2qlm n LYS 655 N -3.53 0.56 0.06 2.33 5.02 -0.74 -4.53 118.16 117.32 2qlm n LYS 655 Ca -0.03 0.55 -0.16 0.00 -2.02 0.00 0.00 58.31 56.66 2qlm n LYS 655 Cb 0.09 -1.73 -0.06 0.00 -0.02 0.00 0.00 35.03 33.31 2qlm n LYS 655 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 2qlm h VAL 656 N -1.00 1.36 -0.12 -0.18 3.04 -1.13 -3.33 116.25 114.89 2qlm h VAL 656 Ca -0.35 -2.38 0.02 0.00 -1.01 0.00 0.00 66.70 62.98 2qlm h VAL 656 Cb 1.26 2.40 -0.02 0.00 -2.01 0.00 0.00 31.29 32.93 2qlm h VAL 656 CO -0.21 0.72 0.02 0.40 -1.01 0.00 0.00 177.57 177.48 2qlm h ILE 657 N 0.29 0.94 -0.03 3.17 2.04 -1.60 -1.56 117.51 120.76 2qlm h ILE 657 Ca -0.10 -0.02 0.01 0.00 1.00 0.00 0.00 64.86 65.75 2qlm h ILE 657 Cb 1.61 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 38.57 2qlm h ILE 657 CO 0.18 0.01 0.09 -0.65 0.00 0.00 0.00 178.15 177.78 2qlm h PRO 658 N 0.06 0.00 -0.00 2.37 0.11 -1.80 -2.24 132.00 130.50 2qlm h PRO 658 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 2qlm h PRO 658 Cb 0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.16 2qlm h PRO 658 CO -0.08 0.00 -0.40 0.00 -0.21 0.00 0.00 178.00 177.31 2qlm n ALA 659 N -2.13 3.38 -1.89 -0.75 0.00 -0.62 -4.74 120.51 113.75 2qlm n ALA 659 Ca -0.02 -0.41 -0.38 0.00 0.00 0.00 0.00 53.44 52.63 2qlm n ALA 659 Cb 0.17 -1.09 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 2qlm n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qlm s ALA 660 N -2.71 3.32 -0.23 0.00 0.00 -0.84 -4.63 121.76 116.66 2qlm s ALA 660 Ca 0.18 0.42 0.06 0.00 0.00 0.00 0.00 51.96 52.62 2qlm s ALA 660 Cb 0.18 -3.06 -0.18 0.00 0.00 0.00 0.00 23.12 20.07 2qlm s ALA 660 CO 0.61 0.24 -0.15 -0.25 0.00 0.00 0.00 175.76 176.21 2qlm n ASP 661 N 0.93 1.61 -3.99 0.00 8.00 -0.70 -4.09 116.55 118.31 2qlm n ASP 661 Ca -0.01 -0.10 -0.27 0.00 0.71 0.00 0.00 54.79 55.12 2qlm n ASP 661 Cb 0.50 -0.04 -0.17 0.00 -0.02 0.00 0.00 41.12 41.39 2qlm n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2qlm s LEU 662 N -6.19 1.51 -0.28 0.64 0.20 -0.69 -0.61 118.68 113.27 2qlm s LEU 662 Ca -0.27 -0.37 -0.11 0.00 0.69 0.00 0.00 54.13 54.07 2qlm s LEU 662 Cb 0.08 -0.97 -0.05 0.00 -0.43 0.00 0.00 46.19 44.83 2qlm s LEU 662 CO 0.63 -0.04 0.18 -0.55 -0.29 0.00 0.00 176.35 176.27 2qlm s SER 663 N 1.26 5.92 -0.43 3.68 0.15 0.65 -1.55 113.70 123.38 2qlm s SER 663 Ca -0.02 -0.03 -0.20 0.00 0.70 0.00 0.00 55.95 56.40 2qlm s SER 663 Cb -0.14 -2.10 0.02 0.00 -1.71 0.00 0.00 66.02 62.10 2qlm s SER 663 CO -0.04 -0.05 0.60 -1.61 1.20 0.00 0.00 173.24 173.34 2qlm s GLU 664 N 1.73 3.24 -0.58 5.44 0.41 -0.85 -1.58 118.70 126.51 2qlm s GLU 664 Ca 0.07 -0.46 0.05 0.00 -0.41 0.00 0.00 54.97 54.22 2qlm s GLU 664 Cb -0.16 -3.96 0.19 0.00 -1.78 0.00 0.00 34.13 28.43 2qlm s GLU 664 CO 0.10 -0.98 0.50 1.04 -0.49 0.00 0.00 175.26 175.43 2qlm n GLN 665 N 6.12 1.38 -1.05 1.61 1.13 -0.47 -4.77 117.38 121.32 2qlm n GLN 665 Ca -0.03 -4.03 -0.01 0.00 -1.94 0.00 0.00 57.00 50.99 2qlm n GLN 665 Cb 0.48 -2.01 0.15 0.00 0.11 0.00 0.00 30.24 28.96 2qlm n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2qlm n ILE 666 N 1.97 2.04 -1.86 5.09 -5.35 -1.26 -2.42 119.36 117.58 2qlm n ILE 666 Ca 0.24 -3.23 -0.36 0.00 -0.27 0.00 0.00 62.75 59.14 2qlm n ILE 666 Cb 0.41 -0.26 0.05 0.00 -1.74 0.00 0.00 39.64 38.10 2qlm n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2qlm s SER 667 N -3.21 4.90 0.22 7.28 1.04 -1.26 -4.59 113.70 118.07 2qlm s SER 667 Ca 0.40 2.44 -0.32 0.00 0.48 0.00 0.00 55.95 58.96 2qlm s SER 667 Cb 0.38 -2.60 -0.12 0.00 0.10 0.00 0.00 66.02 63.78 2qlm s SER 667 CO -0.06 -1.80 1.70 -0.89 0.98 0.00 0.00 173.24 173.18 2qlm s THR 668 N -1.60 2.05 0.09 2.02 2.01 -1.13 -4.67 115.64 114.41 2qlm s THR 668 Ca 0.78 0.03 -0.36 0.00 0.31 0.00 0.00 61.69 62.46 2qlm s THR 668 Cb -0.32 -3.02 -0.15 0.00 0.01 0.00 0.00 72.50 69.01 2qlm s THR 668 CO 0.37 0.00 1.46 0.00 -0.69 0.00 0.00 174.62 175.76 2qlm n ALA 669 N 3.76 0.01 -0.12 7.40 0.00 -1.26 -1.79 120.51 128.52 2qlm n ALA 669 Ca 0.15 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.07 2qlm n ALA 669 Cb 0.36 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.60 2qlm n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qlm n GLY 670 N 2.99 0.54 0.07 0.00 0.00 -1.26 -4.66 105.19 102.87 2qlm n GLY 670 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 2qlm n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qlm n THR 671 N -2.00 0.87 -2.94 2.61 -2.24 -0.74 -4.87 114.28 104.98 2qlm n THR 671 Ca 0.00 -0.39 -0.43 0.00 -2.27 0.00 0.00 64.05 60.96 2qlm n THR 671 Cb 0.00 -0.94 -0.05 0.00 -2.10 0.00 0.00 70.33 67.24 2qlm n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2qlm s GLU 672 N -2.31 3.33 0.18 -0.78 2.56 -1.26 -4.74 118.70 115.68 2qlm s GLU 672 Ca -0.16 -0.29 -0.19 0.00 0.00 0.00 0.00 54.97 54.32 2qlm s GLU 672 Cb 0.05 -4.01 0.12 0.00 2.00 0.00 0.00 34.13 32.28 2qlm s GLU 672 CO 0.40 -1.30 1.61 0.00 -0.56 0.00 0.00 175.26 175.42 2qlm h ALA 673 N 9.13 0.06 0.00 6.30 0.00 -1.90 -2.90 119.26 129.95 2qlm h ALA 673 Ca -0.26 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2qlm h ALA 673 Cb 1.08 0.59 0.00 0.00 0.00 0.00 0.00 17.79 19.46 2qlm h ALA 673 CO 1.02 -0.60 -0.01 0.45 0.00 0.00 0.00 179.25 180.10 2qlm n SER 674 N -5.41 -0.07 0.00 0.00 2.88 -1.26 -4.21 113.62 105.55 2qlm n SER 674 Ca 0.03 0.38 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 2qlm n SER 674 Cb 0.32 0.30 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 2qlm n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qlm n GLY 675 N 1.64 -2.07 0.00 0.46 0.00 -1.26 -1.02 105.19 102.93 2qlm n GLY 675 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.68 2qlm n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qlm n THR 676 N -0.90 0.00 -0.28 2.61 -2.24 -1.26 -4.75 114.28 107.47 2qlm n THR 676 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 2qlm n THR 676 Cb 0.00 -0.02 0.28 0.00 -2.10 0.00 0.00 70.33 68.48 2qlm n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2qlm h GLY 677 N 0.00 1.25 0.24 3.38 0.00 -1.95 -2.16 103.07 103.82 2qlm h GLY 677 Ca 0.00 -0.38 0.12 0.00 0.00 0.00 0.00 47.33 47.07 2qlm h GLY 677 CO 0.00 0.26 0.23 3.45 0.00 0.00 0.00 176.54 180.48 2qlm h ASN 678 N 0.94 0.19 0.00 0.19 -0.00 -1.94 -2.19 115.58 112.77 2qlm h ASN 678 Ca 0.38 0.10 0.00 0.00 -0.00 0.00 0.00 56.30 56.78 2qlm h ASN 678 Cb 0.27 0.09 0.00 0.00 -0.00 0.00 0.00 38.32 38.68 2qlm h ASN 678 CO -0.15 0.09 0.00 0.23 -0.00 0.00 0.00 177.43 177.61 2qlm n MET 679 N -5.03 0.32 0.00 4.14 2.81 -0.81 -2.14 117.12 116.40 2qlm n MET 679 Ca 0.11 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.00 2qlm n MET 679 Cb 0.34 -1.34 0.00 0.00 -0.71 0.00 0.00 33.22 31.51 2qlm n MET 679 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2qlm n PHE 681 N 0.88 0.00 -0.35 2.03 3.72 -0.83 -1.76 117.46 121.16 2qlm n PHE 681 Ca 0.00 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.37 2qlm n PHE 681 Cb 0.16 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.80 2qlm n PHE 681 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 2qlm h MET 682 N 0.00 1.25 0.00 -1.08 4.05 -1.63 -2.22 114.93 115.29 2qlm h MET 682 Ca 0.00 -0.07 -0.07 0.00 -0.28 0.00 0.00 59.70 59.27 2qlm h MET 682 Cb 0.00 -0.28 -0.01 0.00 -0.80 0.00 0.00 31.60 30.51 2qlm h MET 682 CO 0.00 0.82 -0.35 1.25 0.23 0.00 0.00 176.91 178.87 2qlm h LEU 683 N 1.28 0.00 -2.85 3.39 5.85 -1.63 -3.24 115.31 118.11 2qlm h LEU 683 Ca 0.35 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2qlm h LEU 683 Cb -0.15 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.88 2qlm h LEU 683 CO -0.08 0.35 0.00 0.59 -0.34 0.00 0.00 178.44 178.96 2qlm n ASN 684 N -3.77 3.85 0.00 1.25 3.02 -0.94 -4.91 115.26 113.76 2qlm n ASN 684 Ca -0.01 -2.08 0.00 0.00 -0.03 0.00 0.00 54.58 52.46 2qlm n ASN 684 Cb 0.43 -0.45 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 2qlm n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qlm n GLY 685 N 1.29 1.15 3.81 7.41 0.00 -1.04 -4.77 105.19 113.02 2qlm n GLY 685 Ca 0.22 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.47 2qlm n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qlm s ALA 686 N -2.00 3.66 0.40 4.61 0.00 -0.88 -4.79 121.76 122.75 2qlm s ALA 686 Ca 0.00 -0.91 -0.09 0.00 0.00 0.00 0.00 51.96 50.96 2qlm s ALA 686 Cb 0.00 -1.58 -0.06 0.00 0.00 0.00 0.00 23.12 21.48 2qlm s ALA 686 CO 0.00 0.73 0.75 -0.51 0.00 0.00 0.00 175.76 176.73 2qlm s LEU 687 N -2.07 3.83 -0.17 0.00 1.43 0.21 -4.39 118.68 117.52 2qlm s LEU 687 Ca 0.27 1.06 -0.02 0.00 -1.03 0.00 0.00 54.13 54.41 2qlm s LEU 687 Cb -0.12 -3.94 -0.01 0.00 0.03 0.00 0.00 46.19 42.15 2qlm s LEU 687 CO 0.19 -0.40 -0.09 -0.89 0.23 0.00 0.00 176.35 175.39 2qlm s THR 688 N -2.38 3.15 -0.26 5.49 2.01 -1.26 -0.25 115.64 122.14 2qlm s THR 688 Ca 0.50 -0.60 -0.10 0.00 0.31 0.00 0.00 61.69 61.81 2qlm s THR 688 Cb -0.10 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.99 2qlm s THR 688 CO 0.33 0.48 0.14 -0.51 -0.69 0.00 0.00 174.62 174.37 2qlm s ILE 689 N 0.91 5.01 0.21 1.82 2.07 -0.61 -1.08 121.20 129.52 2qlm s ILE 689 Ca -0.02 0.06 -0.23 0.00 -1.41 0.00 0.00 60.65 59.06 2qlm s ILE 689 Cb -0.15 -3.36 0.05 0.00 0.13 0.00 0.00 42.46 39.13 2qlm s ILE 689 CO 0.00 0.31 0.74 -0.83 -1.91 0.00 0.00 174.94 173.24 2qlm s GLY 690 N 1.50 -0.28 0.52 1.50 0.00 -0.48 -1.37 107.32 108.70 2qlm s GLY 690 Ca 0.07 0.07 -0.05 0.00 0.00 0.00 0.00 44.72 44.81 2qlm s GLY 690 CO 0.07 0.02 0.82 -0.51 0.00 0.00 0.00 173.10 173.51 2qlm s THR 691 N -3.71 4.32 -1.26 0.90 -4.23 -1.01 -2.14 115.64 108.51 2qlm s THR 691 Ca 0.08 0.06 -0.18 0.00 -1.18 0.00 0.00 61.69 60.47 2qlm s THR 691 Cb -0.04 -3.67 0.01 0.00 1.34 0.00 0.00 72.50 70.15 2qlm s THR 691 CO -0.00 -0.65 1.91 0.23 -0.54 0.00 0.00 174.62 175.57 2qlm n MET 692 N -2.38 2.63 -4.09 3.99 2.81 -1.26 -4.68 117.12 114.14 2qlm n MET 692 Ca 0.02 -2.81 -0.14 0.00 -1.81 0.00 0.00 57.70 52.96 2qlm n MET 692 Cb 0.56 -3.43 -0.12 0.00 -0.71 0.00 0.00 33.22 29.52 2qlm n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2qlm s ASP 693 N 4.50 0.79 0.60 7.83 3.68 -1.26 -4.61 116.67 128.20 2qlm s ASP 693 Ca 0.56 -0.42 0.00 0.00 2.13 0.00 0.00 52.55 54.82 2qlm s ASP 693 Cb 0.07 0.00 0.00 0.00 -1.45 0.00 0.00 42.92 41.54 2qlm s ASP 693 CO 0.06 -0.12 0.00 0.61 0.13 0.00 0.00 175.17 175.84 2qlm n GLY 694 N 1.90 2.39 0.03 2.66 0.00 -1.10 -1.74 105.19 109.33 2qlm n GLY 694 Ca -0.20 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 45.73 2qlm n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qlm n ALA 695 N 7.67 2.07 -0.32 4.61 0.00 -0.19 -3.14 120.51 131.22 2qlm n ALA 695 Ca 0.00 -0.05 0.17 0.00 0.00 0.00 0.00 53.44 53.56 2qlm n ALA 695 Cb 0.00 -1.40 0.42 0.00 0.00 0.00 0.00 19.45 18.47 2qlm n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2qlm h ASN 696 N 0.00 0.59 -0.28 0.00 2.35 -1.53 -0.63 115.58 116.07 2qlm h ASN 696 Ca 0.00 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2qlm h ASN 696 Cb 0.46 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 2qlm h ASN 696 CO 0.00 0.19 0.19 0.58 -1.65 0.00 0.00 177.43 176.74 2qlm h VAL 697 N 0.57 1.08 -0.06 2.81 2.07 -1.65 -1.15 116.25 119.92 2qlm h VAL 697 Ca 0.56 -0.15 -0.18 0.00 0.82 0.00 0.00 66.70 67.74 2qlm h VAL 697 Cb 1.15 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2qlm h VAL 697 CO -0.31 0.08 -0.75 -0.33 0.02 0.00 0.00 177.57 176.27 2qlm h GLU 698 N 0.38 0.35 -0.27 1.57 5.08 -1.58 -1.67 114.58 118.43 2qlm h GLU 698 Ca 0.10 -0.30 0.01 0.00 -1.00 0.00 0.00 59.36 58.17 2qlm h GLU 698 Cb -0.04 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2qlm h GLU 698 CO -0.02 0.95 0.16 0.52 -1.00 0.00 0.00 179.01 179.62 2qlm h MET 699 N 0.23 0.33 -0.50 2.33 2.86 -0.99 0.67 114.93 119.86 2qlm h MET 699 Ca -0.03 -0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 2qlm h MET 699 Cb 1.33 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.90 2qlm h MET 699 CO 0.13 0.22 0.05 0.00 1.06 0.00 0.00 176.91 178.36 2qlm h ALA 700 N 1.11 1.15 -0.57 6.32 0.00 -1.14 -0.86 119.26 125.26 2qlm h ALA 700 Ca 0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2qlm h ALA 700 Cb -0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2qlm h ALA 700 CO -0.04 0.56 0.22 1.49 0.00 0.00 0.00 179.25 181.47 2qlm h GLU 701 N 0.76 0.86 -0.10 0.00 4.81 -0.99 0.18 114.58 120.11 2qlm h GLU 701 Ca 0.16 -0.16 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2qlm h GLU 701 Cb 0.39 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 2qlm h GLU 701 CO 0.01 0.75 -0.08 0.93 -0.73 0.00 0.00 179.01 179.89 2qlm h GLU 702 N 0.79 0.23 0.00 1.92 4.39 -0.59 -3.32 114.58 118.00 2qlm h GLU 702 Ca 0.19 -0.12 -0.14 0.00 0.34 0.00 0.00 59.36 59.63 2qlm h GLU 702 Cb 0.22 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 2qlm h GLU 702 CO -0.01 0.63 -0.67 0.00 -1.16 0.00 0.00 179.01 177.80 2qlm h ALA 703 N 0.59 0.58 0.00 3.43 0.00 -1.19 -3.47 119.26 119.21 2qlm h ALA 703 Ca 0.02 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2qlm h ALA 703 Cb 0.58 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2qlm h ALA 703 CO 0.02 0.84 0.00 0.41 0.00 0.00 0.00 179.25 180.52 2qlm n GLY 704 N 1.20 1.95 0.27 0.00 0.00 0.62 -4.65 105.19 104.58 2qlm n GLY 704 Ca 0.01 -1.49 0.12 0.00 0.00 0.00 0.00 46.02 44.66 2qlm n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qlm h GLU 705 N 0.00 0.00 0.00 1.61 5.08 -1.88 -0.85 114.58 118.54 2qlm h GLU 705 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2qlm h GLU 705 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2qlm h GLU 705 CO 0.00 0.09 0.00 0.93 -1.00 0.00 0.00 179.01 179.03 2qlm h GLU 706 N 0.00 0.00 -0.40 2.33 3.07 -1.90 -2.92 114.58 114.75 2qlm h GLU 706 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2qlm h GLU 706 Cb 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 2qlm h GLU 706 CO 0.01 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.71 2qlm n ASN 707 N -2.73 3.91 -4.05 1.42 3.02 -0.33 -4.94 115.26 111.56 2qlm n ASN 707 Ca 0.01 -2.55 -0.16 0.00 -0.03 0.00 0.00 54.58 51.85 2qlm n ASN 707 Cb 0.24 -0.46 -0.13 0.00 -0.61 0.00 0.00 39.78 38.82 2qlm n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2qlm s PHE 708 N -2.00 0.79 -1.07 3.10 5.36 -1.10 -4.80 117.98 118.25 2qlm s PHE 708 Ca 0.39 -0.32 -0.11 0.00 -0.96 0.00 0.00 56.93 55.94 2qlm s PHE 708 Cb 0.27 -0.48 0.25 0.00 -0.34 0.00 0.00 43.02 42.72 2qlm s PHE 708 CO 0.15 -0.02 1.10 -0.06 -1.46 0.00 0.00 175.22 174.93 2qlm s PHE 709 N -0.79 4.04 0.05 10.12 0.08 -0.24 -4.94 117.98 126.30 2qlm s PHE 709 Ca -0.02 -2.46 -0.21 0.00 0.12 0.00 0.00 56.93 54.36 2qlm s PHE 709 Cb -0.07 -3.92 -0.06 0.00 -0.57 0.00 0.00 43.02 38.40 2qlm s PHE 709 CO 0.00 -1.04 0.62 0.42 -0.10 0.00 0.00 175.22 175.12 2qlm s ILE 710 N -0.49 4.76 0.18 0.64 1.01 -1.26 -1.39 121.20 124.65 2qlm s ILE 710 Ca 0.30 1.31 -0.11 0.00 0.00 0.00 0.00 60.65 62.16 2qlm s ILE 710 Cb -0.09 -3.95 -0.00 0.00 0.01 0.00 0.00 42.46 38.43 2qlm s ILE 710 CO -0.07 0.49 0.35 0.72 0.00 0.00 0.00 174.94 176.43 2qlm s PHE 711 N -0.70 0.30 0.00 3.97 -0.71 -0.91 -4.96 117.98 114.97 2qlm s PHE 711 Ca 0.31 -0.66 0.00 0.00 -1.04 0.00 0.00 56.93 55.54 2qlm s PHE 711 Cb -0.19 0.05 0.00 0.00 -1.21 0.00 0.00 43.02 41.67 2qlm s PHE 711 CO 0.19 -0.79 0.00 0.41 -1.34 0.00 0.00 175.22 173.70 2qlm n GLY 712 N -0.26 -2.86 3.77 1.99 0.00 -1.26 -4.27 105.19 102.30 2qlm n GLY 712 Ca -0.07 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 2qlm n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qlm s MET 713 N -0.79 4.17 0.70 1.61 -1.94 -1.26 -4.91 119.30 116.87 2qlm s MET 713 Ca 0.00 2.49 -0.07 0.00 -1.71 0.00 0.00 55.69 56.40 2qlm s MET 713 Cb 0.00 -3.01 0.06 0.00 2.01 0.00 0.00 34.83 33.89 2qlm s MET 713 CO 0.00 -0.48 1.01 1.03 -0.01 0.00 0.00 175.02 176.57 2qlm s ARG 714 N -1.61 2.25 0.31 2.03 1.81 -1.26 -4.49 118.95 117.98 2qlm s ARG 714 Ca 0.55 -0.21 0.07 0.00 -1.72 0.00 0.00 55.73 54.41 2qlm s ARG 714 Cb -0.45 -2.17 0.81 0.00 -0.45 0.00 0.00 34.95 32.69 2qlm s ARG 714 CO 0.57 -1.21 1.72 0.28 -0.68 0.00 0.00 175.30 175.98 2qlm h VAL 715 N -0.59 0.53 -0.45 3.52 2.07 -1.83 -1.17 116.25 118.33 2qlm h VAL 715 Ca -0.45 -0.18 -0.07 0.00 0.82 0.00 0.00 66.70 66.82 2qlm h VAL 715 Cb 1.31 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2qlm h VAL 715 CO 0.61 0.10 -0.01 -0.33 0.02 0.00 0.00 177.57 177.96 2qlm h GLU 716 N 0.53 0.74 -0.22 1.57 3.07 -1.95 -2.20 114.58 116.12 2qlm h GLU 716 Ca 0.61 -0.20 -0.13 0.00 -0.50 0.00 0.00 59.36 59.14 2qlm h GLU 716 Cb 1.13 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.94 2qlm h GLU 716 CO -0.48 0.76 -0.41 -0.44 -1.40 0.00 0.00 179.01 177.03 2qlm h ASP 717 N 0.70 0.55 -0.11 1.42 3.45 -1.60 -1.72 116.42 119.11 2qlm h ASP 717 Ca 0.14 -0.25 -0.01 0.00 0.43 0.00 0.00 57.03 57.34 2qlm h ASP 717 Cb 0.44 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 39.05 2qlm h ASP 717 CO 0.02 0.90 0.03 0.58 -1.57 0.00 0.00 179.24 179.19 2qlm h VAL 718 N 0.43 1.20 -0.51 -1.35 2.07 -1.23 -2.07 116.25 114.78 2qlm h VAL 718 Ca 0.04 -0.61 0.08 0.00 0.82 0.00 0.00 66.70 67.03 2qlm h VAL 718 Cb 0.90 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 32.01 2qlm h VAL 718 CO 0.08 0.18 0.16 0.44 0.02 0.00 0.00 177.57 178.44 2qlm h ASP 719 N -0.03 0.12 -0.96 0.57 3.32 -1.29 -0.69 116.42 117.45 2qlm h ASP 719 Ca 0.03 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2qlm h ASP 719 Cb 0.25 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.83 2qlm h ASP 719 CO 0.00 0.09 0.61 0.03 -1.72 0.00 0.00 179.24 178.25 2qlm h ARG 720 N 0.32 1.29 -0.31 3.56 3.08 -1.26 -2.07 114.38 118.99 2qlm h ARG 720 Ca 0.25 -0.10 -0.12 0.00 0.07 0.00 0.00 59.98 60.09 2qlm h ARG 720 Cb 0.30 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2qlm h ARG 720 CO -0.28 0.88 -0.30 1.25 -1.07 0.00 0.00 179.97 180.44 2qlm h LEU 721 N 1.32 0.68 -0.60 3.04 6.46 -0.75 -2.59 115.31 122.85 2qlm h LEU 721 Ca 0.35 -0.27 -0.10 0.00 -0.12 0.00 0.00 57.88 57.75 2qlm h LEU 721 Cb -0.11 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.62 2qlm h LEU 721 CO -0.07 0.94 -0.00 0.44 -0.62 0.00 0.00 178.44 179.13 2qlm h ASP 722 N 0.56 1.04 -0.77 1.25 3.32 -0.89 0.28 116.42 121.21 2qlm h ASP 722 Ca 0.07 -0.31 -0.04 0.00 0.02 0.00 0.00 57.03 56.77 2qlm h ASP 722 Cb 0.80 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 2qlm h ASP 722 CO 0.07 1.10 0.32 1.56 -1.72 0.00 0.00 179.24 180.56 2qlm h GLN 723 N 0.96 1.15 0.07 3.56 4.20 -1.27 -2.84 115.11 120.93 2qlm h GLN 723 Ca 0.17 -0.20 -0.24 0.00 0.06 0.00 0.00 58.65 58.44 2qlm h GLN 723 Cb 0.56 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 2qlm h GLN 723 CO 0.03 0.92 -1.10 -0.09 -0.67 0.00 0.00 178.83 177.93 2qlm h ARG 724 N 1.12 0.25 0.00 1.46 2.43 -1.35 -3.50 114.38 114.79 2qlm h ARG 724 Ca 0.26 -0.36 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2qlm h ARG 724 Cb 0.19 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2qlm h ARG 724 CO -0.02 1.13 0.00 0.41 -1.51 0.00 0.00 179.97 179.97 2qlm n GLY 725 N 1.29 1.65 3.62 2.80 0.00 0.96 -5.01 105.19 110.49 2qlm n GLY 725 Ca -0.06 -1.28 -0.43 0.00 0.00 0.00 0.00 46.02 44.25 2qlm n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2qlm s TYR 726 N 0.00 3.10 -0.37 1.61 5.04 -1.19 -4.85 117.35 120.69 2qlm s TYR 726 Ca 0.00 0.94 -0.03 0.00 -2.44 0.00 0.00 57.07 55.53 2qlm s TYR 726 Cb 0.00 -3.69 0.08 0.00 0.35 0.00 0.00 41.96 38.70 2qlm s TYR 726 CO 0.00 -0.81 0.13 1.21 -1.34 0.00 0.00 175.55 174.74 2qlm s ASN 727 N 1.81 5.18 0.37 4.32 2.47 -1.26 -4.98 114.94 122.85 2qlm s ASN 727 Ca 0.41 -1.66 0.11 0.00 0.42 0.00 0.00 52.86 52.14 2qlm s ASN 727 Cb -0.12 -1.81 0.71 0.00 -1.45 0.00 0.00 41.25 38.59 2qlm s ASN 727 CO 0.18 -0.43 1.85 0.00 -3.72 0.00 0.00 177.10 174.97 2qlm h ALA 728 N 8.08 1.40 -0.93 1.71 0.00 -1.87 -2.94 119.26 124.71 2qlm h ALA 728 Ca -0.17 -0.29 0.14 0.00 0.00 0.00 0.00 54.91 54.58 2qlm h ALA 728 Cb 1.06 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.70 2qlm h ALA 728 CO 0.64 0.43 0.59 0.37 0.00 0.00 0.00 179.25 181.28 2qlm h GLN 729 N 0.12 0.77 -0.62 0.00 5.75 -1.92 -1.64 115.11 117.56 2qlm h GLN 729 Ca 0.02 -0.05 0.10 0.00 -0.15 0.00 0.00 58.65 58.57 2qlm h GLN 729 Cb 0.56 -0.17 -0.08 0.00 1.07 0.00 0.00 27.48 28.86 2qlm h GLN 729 CO 0.04 0.51 0.23 1.49 -2.65 0.00 0.00 178.83 178.45 2qlm h GLU 730 N 0.79 0.39 -0.25 1.69 4.81 -1.94 0.13 114.58 120.20 2qlm h GLU 730 Ca 0.47 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.60 2qlm h GLU 730 Cb 0.66 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2qlm h GLU 730 CO -0.23 0.26 -0.14 1.88 -0.73 0.00 0.00 179.01 180.05 2qlm h TYR 731 N 0.40 0.62 -0.74 0.92 -1.99 -1.47 -2.30 116.97 112.41 2qlm h TYR 731 Ca 0.32 -0.16 0.09 0.00 2.00 0.00 0.00 58.73 60.98 2qlm h TYR 731 Cb 0.41 -0.14 -0.07 0.00 2.00 0.00 0.00 36.73 38.93 2qlm h TYR 731 CO -0.17 0.80 0.40 -0.92 -0.00 0.00 0.00 178.16 178.27 2qlm h TYR 732 N 0.26 0.72 -0.26 4.88 5.03 -1.12 -0.71 116.97 125.76 2qlm h TYR 732 Ca 0.05 0.03 -0.10 0.00 2.58 0.00 0.00 58.73 61.29 2qlm h TYR 732 Cb 0.65 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.70 2qlm h TYR 732 CO 0.06 0.29 -0.25 -0.44 -1.32 0.00 0.00 178.16 176.50 2qlm h ASP 733 N 0.69 0.51 0.00 -2.11 3.32 -0.66 -3.33 116.42 114.84 2qlm h ASP 733 Ca 0.36 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2qlm h ASP 733 Cb 0.33 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2qlm h ASP 733 CO -0.24 0.76 -0.99 0.54 -1.72 0.00 0.00 179.24 177.59 2qlm n ARG 734 N -4.12 0.55 -4.02 3.56 1.74 -0.87 -4.79 116.66 108.71 2qlm n ARG 734 Ca -0.00 -0.01 -0.31 0.00 -0.77 0.00 0.00 57.85 56.75 2qlm n ARG 734 Cb 0.41 -1.43 -0.15 0.00 -1.02 0.00 0.00 32.46 30.28 2qlm n ARG 734 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2qlm s ILE 735 N -2.88 2.25 0.25 0.55 1.01 -0.31 -5.00 121.20 117.05 2qlm s ILE 735 Ca 0.06 -2.28 -0.04 0.00 0.00 0.00 0.00 60.65 58.39 2qlm s ILE 735 Cb 0.15 -2.64 0.23 0.00 0.01 0.00 0.00 42.46 40.21 2qlm s ILE 735 CO 0.80 -0.56 1.85 -0.65 0.00 0.00 0.00 174.94 176.39 2qlm h PRO 736 N 7.63 0.95 -0.32 2.79 0.11 -1.86 -2.00 132.00 139.29 2qlm h PRO 736 Ca -0.05 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.95 2qlm h PRO 736 Cb 1.02 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.90 2qlm h PRO 736 CO 0.51 0.63 -0.00 0.93 -0.21 0.00 0.00 178.00 179.86 2qlm h GLU 737 N 0.98 0.50 -0.10 1.05 5.08 -1.95 -2.24 114.58 117.89 2qlm h GLU 737 Ca 0.40 -0.10 -0.22 0.00 -1.00 0.00 0.00 59.36 58.44 2qlm h GLU 737 Cb 0.23 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.41 2qlm h GLU 737 CO -0.19 0.53 -0.81 1.25 -1.00 0.00 0.00 179.01 178.79 2qlm h LEU 738 N 0.48 0.76 -0.43 1.33 5.85 -1.79 -3.15 115.31 118.36 2qlm h LEU 738 Ca 0.10 -0.52 0.03 0.00 0.84 0.00 0.00 57.88 58.33 2qlm h LEU 738 Cb 0.31 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 2qlm h LEU 738 CO 0.01 1.30 0.23 -0.09 -0.34 0.00 0.00 178.44 179.55 2qlm h ARG 739 N 0.42 0.45 -0.41 1.25 2.43 -1.11 -2.37 114.38 115.04 2qlm h ARG 739 Ca -0.06 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.15 2qlm h ARG 739 Cb 1.42 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 30.81 2qlm h ARG 739 CO 0.15 0.30 0.08 0.37 -1.51 0.00 0.00 179.97 179.36 2qlm h GLN 740 N 0.47 0.20 -0.27 0.20 4.15 -1.45 -1.10 115.11 117.31 2qlm h GLN 740 Ca 0.18 -0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.61 2qlm h GLN 740 Cb 0.05 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 2qlm h GLN 740 CO -0.11 0.13 0.11 0.82 -1.93 0.00 0.00 178.83 177.86 2qlm h ILE 741 N 0.21 0.95 -0.61 2.39 2.04 -1.46 -0.13 117.51 120.90 2qlm h ILE 741 Ca 0.20 -0.08 -0.05 0.00 1.00 0.00 0.00 64.86 65.93 2qlm h ILE 741 Cb 0.24 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2qlm h ILE 741 CO -0.26 0.04 0.19 0.40 0.00 0.00 0.00 178.15 178.52 2qlm h ILE 742 N 0.24 1.23 -0.19 -0.67 1.08 -1.15 -0.17 117.51 117.87 2qlm h ILE 742 Ca 0.12 -0.80 -0.11 0.00 -0.39 0.00 0.00 64.86 63.67 2qlm h ILE 742 Cb 0.07 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 34.37 2qlm h ILE 742 CO -0.11 0.31 -0.36 -0.33 -0.69 0.00 0.00 178.15 176.97 2qlm h GLU 743 N 0.90 0.41 -0.36 2.37 5.08 -0.89 -0.32 114.58 121.77 2qlm h GLU 743 Ca 0.20 -0.19 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2qlm h GLU 743 Cb 0.26 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2qlm h GLU 743 CO -0.01 0.72 -0.09 1.96 -1.00 0.00 0.00 179.01 180.59 2qlm h GLN 744 N 0.35 0.70 -0.11 2.33 4.20 -0.36 -1.59 115.11 120.62 2qlm h GLN 744 Ca 0.04 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 2qlm h GLN 744 Cb 0.80 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.53 2qlm h GLN 744 CO 0.06 0.86 0.04 -0.07 -0.67 0.00 0.00 178.83 179.05 2qlm h LEU 745 N 0.49 0.16 -0.63 1.46 3.38 -0.88 -1.43 115.31 117.86 2qlm h LEU 745 Ca 0.09 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 2qlm h LEU 745 Cb 0.60 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 2qlm h LEU 745 CO 0.04 0.29 0.20 0.28 0.09 0.00 0.00 178.44 179.34 2qlm h SER 746 N 0.02 0.92 1.18 -0.43 0.02 -1.08 -3.21 113.55 110.98 2qlm h SER 746 Ca 0.04 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 2qlm h SER 746 Cb 0.18 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.48 2qlm h SER 746 CO -0.00 0.88 0.00 -1.54 -1.14 0.00 0.00 176.83 175.03 2qlm n SER 747 N -4.37 0.35 0.00 3.07 3.41 -0.60 -4.64 113.62 110.84 2qlm n SER 747 Ca 0.04 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 2qlm n SER 747 Cb 0.21 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 2qlm n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qlm n GLY 748 N 1.36 1.19 0.32 5.00 0.00 -1.14 -4.86 105.19 107.06 2qlm n GLY 748 Ca 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 2qlm n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2qlm h PHE 749 N 0.00 0.84 -0.27 1.61 3.04 -1.52 -2.43 116.94 118.21 2qlm h PHE 749 Ca 0.00 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.93 2qlm h PHE 749 Cb 0.10 -0.27 0.00 0.00 2.56 0.00 0.00 35.95 38.34 2qlm h PHE 749 CO 0.00 0.61 0.00 1.19 -2.02 0.00 0.00 178.31 178.09 2qlm n PHE 750 N -4.36 0.34 -2.96 0.41 3.72 -1.26 -4.52 117.46 108.84 2qlm n PHE 750 Ca 0.05 -0.17 -0.15 0.00 -0.05 0.00 0.00 57.45 57.14 2qlm n PHE 750 Cb 0.13 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.66 2qlm n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2qlm n SER 751 N 1.28 -1.72 0.28 4.37 3.41 -0.99 -4.79 113.62 115.46 2qlm n SER 751 Ca 0.18 -2.97 0.14 0.00 -0.26 0.00 0.00 58.87 55.96 2qlm n SER 751 Cb 0.56 0.78 0.85 0.00 -0.26 0.00 0.00 64.21 66.14 2qlm n SER 751 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2qlm h PRO 752 N 4.26 0.00 0.00 4.33 0.11 -1.68 -2.38 132.00 136.64 2qlm h PRO 752 Ca -0.01 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.03 2qlm h PRO 752 Cb 0.98 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 2qlm h PRO 752 CO 0.34 0.04 -1.41 1.63 -0.21 0.00 0.00 178.00 178.39 2qlm n LYS 753 N -3.79 0.63 -3.68 1.05 5.02 -1.26 -4.48 118.16 111.64 2qlm n LYS 753 Ca -0.03 0.07 -0.28 0.00 -2.02 0.00 0.00 58.31 56.05 2qlm n LYS 753 Cb 0.14 -1.74 -0.12 0.00 -0.02 0.00 0.00 35.03 33.29 2qlm n LYS 753 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2qlm s GLN 754 N -3.24 1.56 0.55 1.97 -0.21 -0.91 -5.02 119.66 114.36 2qlm s GLN 754 Ca -0.03 -2.47 0.23 0.00 0.02 0.00 0.00 55.36 53.11 2qlm s GLN 754 Cb 0.10 -2.42 1.52 0.00 1.00 0.00 0.00 33.01 33.22 2qlm s GLN 754 CO 0.82 -1.27 2.17 -1.35 -2.12 0.00 0.00 175.29 173.55 2qlm h PRO 755 N 5.98 0.00 -0.46 2.91 0.11 -1.74 -2.03 132.00 136.76 2qlm h PRO 755 Ca 0.12 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.17 2qlm h PRO 755 Cb 0.87 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.94 2qlm h PRO 755 CO 0.53 0.00 0.06 -0.40 -0.21 0.00 0.00 178.00 177.97 2qlm n ASP 756 N -4.19 4.47 -0.11 -2.05 3.85 -1.26 -3.07 116.55 114.18 2qlm n ASP 756 Ca -0.01 -3.11 0.04 0.00 -0.71 0.00 0.00 54.79 51.00 2qlm n ASP 756 Cb 0.16 -0.64 0.37 0.00 -1.35 0.00 0.00 41.12 39.66 2qlm n ASP 756 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 2qlm h LEU 757 N 2.50 0.61 -3.63 -2.12 5.85 -1.70 -2.69 115.31 114.13 2qlm h LEU 757 Ca 0.08 -0.01 -0.17 0.00 0.84 0.00 0.00 57.88 58.62 2qlm h LEU 757 Cb 1.81 -0.14 -0.10 0.00 0.37 0.00 0.00 40.66 42.59 2qlm h LEU 757 CO 0.43 0.43 0.19 0.49 -0.34 0.00 0.00 178.44 179.63 2qlm n PHE 758 N -4.46 2.11 -0.03 1.25 0.99 -1.26 -4.59 117.46 111.47 2qlm n PHE 758 Ca 0.07 -1.18 0.01 0.00 -0.00 0.00 0.00 57.45 56.35 2qlm n PHE 758 Cb 0.12 -0.61 0.31 0.00 -1.00 0.00 0.00 39.48 38.30 2qlm n PHE 758 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.76 178.33 2qlm h LYS 759 N 2.44 0.59 -0.69 -1.08 2.10 -1.80 -2.41 116.57 115.73 2qlm h LYS 759 Ca 0.22 -0.09 -0.06 0.00 -2.00 0.00 0.00 60.65 58.72 2qlm h LYS 759 Cb 2.14 -0.10 -0.03 0.00 -0.90 0.00 0.00 32.23 33.34 2qlm h LYS 759 CO 0.63 0.53 0.21 -0.44 -2.00 0.00 0.00 179.45 178.38 2qlm h ASP 760 N 0.58 1.00 -0.02 7.07 3.32 -1.84 -0.54 116.42 125.98 2qlm h ASP 760 Ca 0.14 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 2qlm h ASP 760 Cb 0.20 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.49 2qlm h ASP 760 CO -0.01 0.94 0.01 0.40 -1.72 0.00 0.00 179.24 178.86 2qlm h ILE 761 N 1.00 1.19 -0.28 0.35 2.04 -1.83 -1.66 117.51 118.33 2qlm h ILE 761 Ca 0.22 -0.56 0.02 0.00 1.00 0.00 0.00 64.86 65.54 2qlm h ILE 761 Cb 0.30 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.88 2qlm h ILE 761 CO -0.01 0.15 0.12 0.58 0.00 0.00 0.00 178.15 178.99 2qlm h VAL 762 N -0.19 0.96 -0.49 1.67 2.07 -1.36 -1.41 116.25 117.49 2qlm h VAL 762 Ca 0.01 -0.09 0.03 0.00 0.82 0.00 0.00 66.70 67.47 2qlm h VAL 762 Cb 0.24 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 2qlm h VAL 762 CO 0.00 0.05 0.27 -1.13 0.02 0.00 0.00 177.57 176.78 2qlm h ASN 763 N 0.26 0.41 -0.26 0.57 -1.24 -1.06 -0.70 115.58 113.57 2qlm h ASN 763 Ca 0.12 0.02 -0.01 0.00 0.71 0.00 0.00 56.30 57.14 2qlm h ASN 763 Cb 0.06 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 2qlm h ASN 763 CO -0.10 0.29 0.12 -0.03 -1.29 0.00 0.00 177.43 176.42 2qlm h MET 764 N 0.53 0.37 -0.98 6.67 4.05 -1.09 0.72 114.93 125.21 2qlm h MET 764 Ca 0.21 -0.06 0.01 0.00 -0.28 0.00 0.00 59.70 59.58 2qlm h MET 764 Cb 0.08 -0.07 -0.05 0.00 -0.80 0.00 0.00 31.60 30.76 2qlm h MET 764 CO -0.12 0.38 0.63 -0.07 0.23 0.00 0.00 176.91 177.95 2qlm h LEU 765 N 0.28 1.14 0.08 3.39 4.07 -0.96 -0.55 115.31 122.77 2qlm h LEU 765 Ca 0.09 -0.04 -0.26 0.00 0.08 0.00 0.00 57.88 57.75 2qlm h LEU 765 Cb 0.13 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 41.57 2qlm h LEU 765 CO -0.01 0.84 -1.24 0.24 -1.08 0.00 0.00 178.44 177.19 2qlm h MET 766 N 1.34 0.17 0.00 1.13 2.86 -0.98 -3.42 114.93 116.03 2qlm h MET 766 Ca 0.36 -0.29 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2qlm h MET 766 Cb -0.13 0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2qlm h MET 766 CO -0.07 1.10 -0.83 0.72 1.06 0.00 0.00 176.91 178.88 2qlm n HIS 767 N -3.44 0.00 -2.93 -0.22 8.25 0.23 -4.43 115.22 112.68 2qlm n HIS 767 Ca -0.08 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.25 2qlm n HIS 767 Cb 1.00 0.00 0.01 0.00 1.12 0.00 0.00 29.99 32.12 2qlm n HIS 767 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2qlm n HIS 768 N -1.79 0.36 -3.06 4.41 -0.00 -0.34 -5.04 115.22 109.76 2qlm n HIS 768 Ca 0.00 -3.25 -0.44 0.00 -0.00 0.00 0.00 57.72 54.04 2qlm n HIS 768 Cb 0.42 -0.24 -0.05 0.00 -0.00 0.00 0.00 29.99 30.11 2qlm n HIS 768 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2qlm s ASP 769 N -2.63 6.23 0.56 4.39 2.15 -0.45 -4.82 116.67 122.09 2qlm s ASP 769 Ca 0.33 -0.95 0.36 0.00 0.43 0.00 0.00 52.55 52.72 2qlm s ASP 769 Cb 0.40 -2.33 1.70 0.00 -0.30 0.00 0.00 42.92 42.39 2qlm s ASP 769 CO -0.03 -1.06 2.09 0.03 -0.17 0.00 0.00 175.17 176.03 2qlm h ARG 770 N 9.15 0.00 -0.17 4.34 3.08 -1.97 -3.27 114.38 125.54 2qlm h ARG 770 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2qlm h ARG 770 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.14 2qlm h ARG 770 CO 1.04 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 181.13 2qlm n PHE 771 N -2.99 0.29 -3.77 3.04 3.72 -1.26 -5.01 117.46 111.48 2qlm n PHE 771 Ca -0.01 -0.59 -0.24 0.00 -0.05 0.00 0.00 57.45 56.57 2qlm n PHE 771 Cb 0.21 -0.08 0.03 0.00 -0.94 0.00 0.00 39.48 38.69 2qlm n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2qlm n LYS 772 N -0.18 -4.85 -0.10 -1.08 5.02 -1.23 -4.74 118.16 110.99 2qlm n LYS 772 Ca 0.09 0.59 -0.06 0.00 -2.02 0.00 0.00 58.31 56.91 2qlm n LYS 772 Cb 0.43 -5.17 0.02 0.00 -0.02 0.00 0.00 35.03 30.29 2qlm n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2qlm h VAL 773 N -1.91 0.83 -0.42 -0.18 2.07 -1.94 -2.55 116.25 112.15 2qlm h VAL 773 Ca -0.61 -0.07 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 2qlm h VAL 773 Cb 1.36 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 2qlm h VAL 773 CO 0.59 0.04 0.14 -0.26 0.02 0.00 0.00 177.57 178.10 2qlm h PHE 774 N 0.20 0.60 0.00 1.57 0.05 -1.91 -2.97 116.94 114.48 2qlm h PHE 774 Ca 0.17 -0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.90 2qlm h PHE 774 Cb 0.19 -0.19 -0.00 0.00 2.00 0.00 0.00 35.95 37.95 2qlm h PHE 774 CO -0.18 0.49 -0.12 0.00 -0.18 0.00 0.00 178.31 178.32 2qlm h ALA 775 N 1.56 1.53 -0.02 2.45 0.00 -1.84 -2.36 119.26 120.58 2qlm h ALA 775 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2qlm h ALA 775 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2qlm h ALA 775 CO -0.01 0.15 -0.14 -0.25 0.00 0.00 0.00 179.25 179.00 2qlm n ASP 776 N -4.00 2.53 0.07 0.00 8.00 -1.13 -4.70 116.55 117.33 2qlm n ASP 776 Ca -0.02 -1.77 -0.12 0.00 0.71 0.00 0.00 54.79 53.59 2qlm n ASP 776 Cb 0.21 0.15 -0.06 0.00 -0.02 0.00 0.00 41.12 41.40 2qlm n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2qlm h TYR 777 N 3.65 -0.22 0.04 1.24 5.03 -1.34 -1.78 116.97 123.58 2qlm h TYR 777 Ca 0.00 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.31 2qlm h TYR 777 Cb 0.84 0.09 0.00 0.00 1.55 0.00 0.00 36.73 39.22 2qlm h TYR 777 CO 0.00 -0.13 -0.02 0.93 -1.32 0.00 0.00 178.16 177.62 2qlm h GLU 778 N -0.18 -0.05 -0.32 1.82 5.08 -1.84 -1.75 114.58 117.35 2qlm h GLU 778 Ca 0.02 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.34 2qlm h GLU 778 Cb 0.19 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2qlm h GLU 778 CO -0.05 -0.01 0.04 0.93 -1.00 0.00 0.00 179.01 178.92 2qlm h GLU 779 N -0.07 0.47 -0.04 2.33 5.08 -1.87 -2.29 114.58 118.18 2qlm h GLU 779 Ca -0.01 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2qlm h GLU 779 Cb 0.06 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 2qlm h GLU 779 CO 0.01 0.47 0.00 -0.92 -1.00 0.00 0.00 179.01 177.57 2qlm h TYR 780 N 0.46 0.08 -0.65 4.33 3.20 -1.05 -0.69 116.97 122.65 2qlm h TYR 780 Ca 0.11 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 2qlm h TYR 780 Cb 0.24 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 2qlm h TYR 780 CO 0.01 0.35 0.39 0.28 -1.64 0.00 0.00 178.16 177.55 2qlm h VAL 781 N -0.21 1.19 0.13 1.81 2.07 -1.25 -0.27 116.25 119.71 2qlm h VAL 781 Ca 0.01 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 2qlm h VAL 781 Cb 0.31 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2qlm h VAL 781 CO 0.00 0.20 -0.09 0.50 0.02 0.00 0.00 177.57 178.20 2qlm h LYS 782 N 0.88 -0.21 -0.81 1.57 1.63 -1.39 -2.08 116.57 116.16 2qlm h LYS 782 Ca 0.23 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.05 2qlm h LYS 782 Cb -0.02 0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 31.61 2qlm h LYS 782 CO -0.04 -0.14 0.53 0.00 -3.45 0.00 0.00 179.45 176.35 2qlm h GLN 784 N 1.10 0.13 -0.27 0.00 1.08 -0.71 -2.04 115.11 114.40 2qlm h GLN 784 Ca 0.30 -0.02 -0.13 0.00 -1.45 0.00 0.00 58.65 57.35 2qlm h GLN 784 Cb -0.12 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 2qlm h GLN 784 CO -0.06 0.18 -0.37 0.93 -0.95 0.00 0.00 178.83 178.56 2qlm h GLU 785 N 0.13 0.62 -0.05 1.46 5.08 -0.63 -2.54 114.58 118.65 2qlm h GLU 785 Ca 0.03 -0.30 -0.08 0.00 -1.00 0.00 0.00 59.36 58.01 2qlm h GLU 785 Cb 0.16 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2qlm h GLU 785 CO 0.01 0.89 -0.34 0.00 -1.00 0.00 0.00 179.01 178.57 2qlm h ARG 786 N 0.51 0.10 0.10 2.33 3.08 -1.10 -1.64 114.38 117.76 2qlm h ARG 786 Ca 0.05 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 2qlm h ARG 786 Cb 0.88 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.92 2qlm h ARG 786 CO 0.08 0.43 -0.05 0.28 -1.07 0.00 0.00 179.97 179.63 2qlm h VAL 787 N 0.09 1.06 -0.98 2.04 2.07 -1.22 -2.65 116.25 116.67 2qlm h VAL 787 Ca 0.01 -0.68 0.04 0.00 0.82 0.00 0.00 66.70 66.89 2qlm h VAL 787 Cb 0.65 1.49 -0.06 0.00 -1.52 0.00 0.00 31.29 31.85 2qlm h VAL 787 CO 0.05 0.16 0.64 0.28 0.02 0.00 0.00 177.57 178.72 2qlm h SER 788 N -0.46 1.06 -0.34 0.57 0.02 -1.35 -1.37 113.55 111.69 2qlm h SER 788 Ca -0.01 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2qlm h SER 788 Cb 0.38 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 2qlm h SER 788 CO 0.02 0.72 0.20 0.00 -1.14 0.00 0.00 176.83 176.63 2qlm h ALA 789 N 1.43 0.42 -0.48 3.77 0.00 -1.30 -2.69 119.26 120.42 2qlm h ALA 789 Ca 0.39 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.23 2qlm h ALA 789 Cb 0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2qlm h ALA 789 CO -0.13 -0.16 0.02 1.25 0.00 0.00 0.00 179.25 180.24 2qlm h LEU 790 N 0.40 0.81 -2.01 0.00 6.46 -1.09 -2.93 115.31 116.95 2qlm h LEU 790 Ca 0.13 -0.29 0.07 0.00 -0.12 0.00 0.00 57.88 57.67 2qlm h LEU 790 Cb 0.00 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 39.71 2qlm h LEU 790 CO -0.06 0.91 0.17 0.22 -0.62 0.00 0.00 178.44 179.05 2qlm h TYR 791 N 0.69 0.00 0.00 1.25 3.20 -1.10 0.90 116.97 121.91 2qlm h TYR 791 Ca 0.14 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.01 2qlm h TYR 791 Cb 0.48 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.75 2qlm h TYR 791 CO 0.04 0.00 0.00 0.87 -1.64 0.00 0.00 178.16 177.43 2qlm h LYS 792 N 0.00 0.00 -3.29 1.82 1.57 -1.28 -3.32 116.57 112.07 2qlm h LYS 792 Ca 0.11 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.22 2qlm h LYS 792 Cb 0.44 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 32.37 2qlm h LYS 792 CO -0.00 0.00 -0.37 1.21 -0.57 0.00 0.00 179.45 179.72 2qlm s ASN 793 N -4.52 5.25 0.32 0.86 3.84 0.31 -4.99 114.94 116.01 2qlm s ASN 793 Ca -0.00 -3.52 0.07 0.00 0.21 0.00 0.00 52.86 49.62 2qlm s ASN 793 Cb 0.09 -1.77 0.76 0.00 -0.55 0.00 0.00 41.25 39.78 2qlm s ASN 793 CO 0.34 -0.19 1.80 -0.65 -2.79 0.00 0.00 177.10 175.61 2qlm h PRO 794 N 6.05 0.73 -0.37 0.43 0.11 -1.76 -0.63 132.00 136.56 2qlm h PRO 794 Ca 0.09 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.09 2qlm h PRO 794 Cb 0.83 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.76 2qlm h PRO 794 CO 0.76 0.48 -0.05 -0.09 -0.21 0.00 0.00 178.00 178.90 2qlm h ARG 795 N 0.75 0.68 -0.06 1.05 2.43 -1.93 -1.92 114.38 115.38 2qlm h ARG 795 Ca 0.55 -0.24 -0.18 0.00 -0.81 0.00 0.00 59.98 59.30 2qlm h ARG 795 Cb 0.88 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 2qlm h ARG 795 CO -0.33 0.81 -0.74 0.93 -1.51 0.00 0.00 179.97 179.13 2qlm h GLU 796 N 0.49 0.35 -0.03 0.20 4.39 -1.61 -1.46 114.58 116.91 2qlm h GLU 796 Ca 0.10 -0.30 0.01 0.00 0.34 0.00 0.00 59.36 59.51 2qlm h GLU 796 Cb 0.53 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 2qlm h GLU 796 CO 0.03 0.95 -0.05 2.35 -1.16 0.00 0.00 179.01 181.12 2qlm h TRP 797 N 0.24 -0.12 -0.58 4.33 2.91 -1.14 -2.14 115.95 119.45 2qlm h TRP 797 Ca -0.03 0.01 -0.05 0.00 1.13 0.00 0.00 58.89 59.94 2qlm h TRP 797 Cb 1.32 0.06 -0.03 0.00 -0.51 0.00 0.00 29.16 30.00 2qlm h TRP 797 CO 0.04 -0.08 0.14 1.15 -1.03 0.00 0.00 178.44 178.66 2qlm h THR 798 N -0.07 1.23 -0.67 2.65 2.02 -1.25 -1.58 112.91 115.24 2qlm h THR 798 Ca 0.03 -0.85 -0.06 0.00 0.77 0.00 0.00 66.41 66.30 2qlm h THR 798 Cb 0.12 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 2qlm h THR 798 CO -0.07 0.32 0.18 0.03 0.37 0.00 0.00 175.52 176.35 2qlm h ARG 799 N 0.86 1.05 -0.57 6.66 3.08 -1.16 -0.74 114.38 123.55 2qlm h ARG 799 Ca 0.19 -0.23 -0.09 0.00 0.07 0.00 0.00 59.98 59.92 2qlm h ARG 799 Cb 0.31 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 2qlm h ARG 799 CO -0.00 0.91 0.02 1.98 -1.07 0.00 0.00 179.97 181.81 2qlm h MET 800 N 1.00 0.98 -0.24 0.04 4.05 -0.96 -2.39 114.93 117.41 2qlm h MET 800 Ca 0.22 -0.29 0.03 0.00 -0.28 0.00 0.00 59.70 59.38 2qlm h MET 800 Cb 0.32 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 30.99 2qlm h MET 800 CO -0.00 0.95 0.03 0.28 0.23 0.00 0.00 176.91 178.40 2qlm h VAL 801 N 0.90 0.87 -0.99 -5.77 2.07 -0.82 -1.80 116.25 110.71 2qlm h VAL 801 Ca 0.17 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.70 2qlm h VAL 801 Cb 0.50 0.74 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 2qlm h VAL 801 CO 0.02 0.02 0.65 0.40 0.02 0.00 0.00 177.57 178.68 2qlm h ILE 802 N 0.12 1.14 -0.18 4.57 2.04 -0.94 0.45 117.51 124.71 2qlm h ILE 802 Ca 0.11 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 2qlm h ILE 802 Cb 0.12 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.01 2qlm h ILE 802 CO -0.16 0.22 -0.06 0.03 0.00 0.00 0.00 178.15 178.18 2qlm h ARG 803 N 1.22 0.27 0.07 2.37 3.08 -0.97 -0.81 114.38 119.60 2qlm h ARG 803 Ca 0.41 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.40 2qlm h ARG 803 Cb 0.06 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2qlm h ARG 803 CO -0.14 0.35 -0.03 -0.91 -1.07 0.00 0.00 179.97 178.17 2qlm h ASN 804 N 0.26 -0.08 -0.68 7.04 2.35 -0.24 -3.19 115.58 121.04 2qlm h ASN 804 Ca 0.06 -0.53 0.04 0.00 -0.55 0.00 0.00 56.30 55.31 2qlm h ASN 804 Cb 0.28 0.02 -0.05 0.00 0.05 0.00 0.00 38.32 38.63 2qlm h ASN 804 CO 0.01 0.54 0.41 0.40 -1.65 0.00 0.00 177.43 177.15 2qlm h ILE 805 N -0.75 1.06 0.00 2.81 2.04 -0.90 -2.45 117.51 119.33 2qlm h ILE 805 Ca -0.01 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.58 2qlm h ILE 805 Cb 0.60 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 2qlm h ILE 805 CO 0.01 0.15 0.00 0.00 0.00 0.00 0.00 178.15 178.31 2qlm h ALA 806 N 1.31 1.00 -0.17 1.87 0.00 -1.25 -2.73 119.26 119.28 2qlm h ALA 806 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2qlm h ALA 806 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2qlm h ALA 806 CO -0.12 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.38 2qlm n THR 807 N -2.96 1.53 1.65 0.00 -2.24 -0.95 -2.06 114.28 109.24 2qlm n THR 807 Ca -0.01 -1.49 0.15 0.00 -2.27 0.00 0.00 64.05 60.43 2qlm n THR 807 Cb 0.20 0.15 0.72 0.00 -2.10 0.00 0.00 70.33 69.29 2qlm n THR 807 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qlm n SER 808 N -0.39 0.56 -0.30 3.42 3.41 -1.03 -4.40 113.62 114.89 2qlm n SER 808 Ca 0.12 -0.96 0.09 0.00 -0.26 0.00 0.00 58.87 57.86 2qlm n SER 808 Cb 0.56 -0.03 0.31 0.00 -0.26 0.00 0.00 64.21 64.78 2qlm n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2qlm h GLY 809 N 4.95 1.35 1.37 5.00 0.00 -1.80 -1.94 103.07 112.01 2qlm h GLY 809 Ca 0.00 -0.36 0.08 0.00 0.00 0.00 0.00 47.33 47.05 2qlm h GLY 809 CO 0.00 0.16 0.24 1.70 0.00 0.00 0.00 176.54 178.63 2qlm h LYS 810 N 0.85 0.00 -0.68 4.80 3.64 -1.89 -2.85 116.57 120.44 2qlm h LYS 810 Ca 0.45 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.83 2qlm h LYS 810 Cb 0.53 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2qlm h LYS 810 CO -0.21 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 178.16 2qlm n PHE 811 N -4.14 1.30 -2.60 1.91 3.01 -0.73 -4.73 117.46 111.48 2qlm n PHE 811 Ca 0.04 -0.47 -0.41 0.00 1.01 0.00 0.00 57.45 57.62 2qlm n PHE 811 Cb 0.39 -0.32 -0.04 0.00 -0.01 0.00 0.00 39.48 39.50 2qlm n PHE 811 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2qlm s SER 812 N -0.61 7.36 0.00 4.37 0.15 -1.08 -0.84 113.70 123.05 2qlm s SER 812 Ca 0.37 1.96 0.12 0.00 0.70 0.00 0.00 55.95 59.09 2qlm s SER 812 Cb 0.27 -2.60 0.52 0.00 -1.71 0.00 0.00 66.02 62.50 2qlm s SER 812 CO 0.13 -0.17 1.34 -1.54 1.20 0.00 0.00 173.24 174.20 2qlm n SER 813 N 2.65 0.00 -0.13 5.45 3.41 0.01 -1.62 113.62 123.38 2qlm n SER 813 Ca 0.03 0.38 -0.09 0.00 -0.26 0.00 0.00 58.87 58.93 2qlm n SER 813 Cb 0.47 -0.44 0.05 0.00 -0.26 0.00 0.00 64.21 64.04 2qlm n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2qlm h ASP 814 N 0.00 0.91 -0.20 4.04 3.32 -1.92 -1.28 116.42 121.29 2qlm h ASP 814 Ca 0.00 -0.32 -0.06 0.00 0.02 0.00 0.00 57.03 56.68 2qlm h ASP 814 Cb 0.17 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2qlm h ASP 814 CO 0.00 1.07 -0.09 -0.09 -1.72 0.00 0.00 179.24 178.41 2qlm h ARG 815 N 0.79 0.42 -0.25 3.56 1.12 -1.61 -2.02 114.38 116.39 2qlm h ARG 815 Ca 0.12 -0.18 0.05 0.00 -1.11 0.00 0.00 59.98 58.85 2qlm h ARG 815 Cb 0.71 -0.01 -0.04 0.00 -0.01 0.00 0.00 29.97 30.62 2qlm h ARG 815 CO 0.05 0.70 -0.02 1.15 -3.11 0.00 0.00 179.97 178.74 2qlm h THR 816 N 0.12 0.79 -0.44 0.20 2.02 -1.49 -1.92 112.91 112.19 2qlm h THR 816 Ca 0.05 -0.02 -0.13 0.00 0.77 0.00 0.00 66.41 67.08 2qlm h THR 816 Cb 0.57 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 2qlm h THR 816 CO 0.03 0.01 -0.23 0.40 0.37 0.00 0.00 175.52 176.10 2qlm h ILE 817 N 0.05 1.27 -0.62 3.11 1.08 -1.25 -1.50 117.51 119.66 2qlm h ILE 817 Ca 0.12 -1.38 0.02 0.00 -0.39 0.00 0.00 64.86 63.23 2qlm h ILE 817 Cb 0.17 1.17 -0.03 0.00 -3.07 0.00 0.00 36.82 35.05 2qlm h ILE 817 CO -0.22 0.47 0.41 0.00 -0.69 0.00 0.00 178.15 178.11 2qlm h ALA 818 N 0.96 1.62 -0.14 1.87 0.00 -1.21 0.89 119.26 123.25 2qlm h ALA 818 Ca 0.10 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2qlm h ALA 818 Cb 0.78 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2qlm h ALA 818 CO 0.06 0.33 -0.14 1.96 0.00 0.00 0.00 179.25 181.46 2qlm h GLN 819 N 0.78 0.34 -0.47 0.00 4.20 -0.85 -1.56 115.11 117.54 2qlm h GLN 819 Ca 0.24 -0.18 0.07 0.00 0.06 0.00 0.00 58.65 58.84 2qlm h GLN 819 Cb -0.00 0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.73 2qlm h GLN 819 CO -0.06 0.74 0.13 1.88 -0.67 0.00 0.00 178.83 180.84 2qlm h TYR 820 N -0.04 0.21 -0.12 2.96 0.05 -1.07 -0.19 116.97 118.78 2qlm h TYR 820 Ca 0.02 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.83 2qlm h TYR 820 Cb 0.68 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 2qlm h TYR 820 CO 0.09 0.04 0.08 0.00 -1.05 0.00 0.00 178.16 177.31 2qlm h ALA 821 N 1.35 0.15 0.06 3.88 0.00 -0.78 0.14 119.26 124.06 2qlm h ALA 821 Ca 0.23 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.86 2qlm h ALA 821 Cb 0.28 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.04 2qlm h ALA 821 CO -0.28 -0.36 -1.13 0.00 0.00 0.00 0.00 179.25 177.49 2qlm h ARG 822 N 0.16 0.57 0.00 0.00 3.08 -1.18 0.17 114.38 117.18 2qlm h ARG 822 Ca 0.04 -0.70 0.00 0.00 0.07 0.00 0.00 59.98 59.40 2qlm h ARG 822 Cb -0.01 0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2qlm h ARG 822 CO -0.01 1.29 -1.81 0.39 -1.07 0.00 0.00 179.97 178.76 2qlm n GLU 823 N -3.78 0.54 -0.01 0.04 1.02 -0.09 -4.35 120.64 114.02 2qlm n GLU 823 Ca -0.11 -0.16 -0.02 0.00 -0.02 0.00 0.00 57.16 56.85 2qlm n GLU 823 Cb 0.93 -1.52 -0.01 0.00 -0.02 0.00 0.00 31.44 30.82 2qlm n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2qlm n ILE 824 N -2.13 0.11 0.11 -3.67 5.41 -0.13 -4.87 119.36 114.19 2qlm n ILE 824 Ca -0.03 -0.01 0.09 0.00 1.00 0.00 0.00 62.75 63.80 2qlm n ILE 824 Cb 0.53 -1.52 0.01 0.00 -0.71 0.00 0.00 39.64 37.95 2qlm n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 2qlm h TRP 825 N -0.05 0.00 -2.92 1.39 6.55 -1.06 -3.49 115.95 116.37 2qlm h TRP 825 Ca -0.04 0.00 -0.17 0.00 0.95 0.00 0.00 58.89 59.63 2qlm h TRP 825 Cb 1.01 0.00 0.05 0.00 -0.86 0.00 0.00 29.16 29.36 2qlm h TRP 825 CO -0.01 0.13 -0.29 0.41 -1.05 0.00 0.00 178.44 177.64 2qlm n GLY 826 N 1.21 0.28 3.21 1.49 0.00 0.41 -4.93 105.19 106.86 2qlm n GLY 826 Ca -0.01 -0.30 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 2qlm n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qlm s VAL 827 N -3.07 1.37 -0.23 1.61 -7.23 -0.23 -5.01 120.40 107.59 2qlm s VAL 827 Ca 0.23 -1.29 -0.14 0.00 -1.81 0.00 0.00 61.98 58.97 2qlm s VAL 827 Cb -0.10 -1.25 -0.04 0.00 0.56 0.00 0.00 36.38 35.54 2qlm s VAL 827 CO 0.28 -0.07 0.33 -1.61 -0.31 0.00 0.00 175.10 173.73 2qlm s GLU 828 N -1.58 4.09 0.82 4.82 0.41 -1.26 -3.59 118.70 122.42 2qlm s GLU 828 Ca 0.03 0.02 -0.12 0.00 -0.41 0.00 0.00 54.97 54.49 2qlm s GLU 828 Cb -0.09 -3.58 0.09 0.00 -1.78 0.00 0.00 34.13 28.77 2qlm s GLU 828 CO 0.03 -0.10 1.15 -1.25 -0.49 0.00 0.00 175.26 174.60 2qlm s PRO 829 N 1.51 1.66 -0.05 0.39 0.04 -1.26 -4.96 135.00 132.33 2qlm s PRO 829 Ca 0.15 1.53 -0.02 0.00 0.04 0.00 0.00 61.00 62.70 2qlm s PRO 829 Cb -0.15 -1.80 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2qlm s PRO 829 CO 0.08 -2.15 0.10 0.45 0.04 0.00 0.00 177.00 175.52 2qlm s SER 830 N -2.62 0.31 0.00 6.66 0.15 0.56 -5.02 113.70 113.75 2qlm s SER 830 Ca 0.68 0.19 0.28 0.00 0.70 0.00 0.00 55.95 57.80 2qlm s SER 830 Cb -0.23 0.07 1.13 0.00 -1.71 0.00 0.00 66.02 65.27 2qlm s SER 830 CO 0.53 -0.18 1.79 0.54 1.20 0.00 0.00 173.24 177.12 2qlm n ARG 831 N 4.60 1.59 -2.07 5.44 5.12 -1.26 -3.23 116.66 126.86 2qlm n ARG 831 Ca -0.19 -0.86 -0.41 0.00 -1.93 0.00 0.00 57.85 54.46 2qlm n ARG 831 Cb 0.51 -1.48 -0.02 0.00 -1.16 0.00 0.00 32.46 30.31 2qlm n ARG 831 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2qlm s GLN 832 N -1.99 4.31 0.38 5.56 -0.21 -1.26 -5.00 119.66 121.45 2qlm s GLN 832 Ca 0.39 2.25 -0.26 0.00 0.02 0.00 0.00 55.36 57.76 2qlm s GLN 832 Cb 0.21 -3.10 -0.09 0.00 1.00 0.00 0.00 33.01 31.03 2qlm s GLN 832 CO 0.33 -0.32 1.17 1.03 -2.12 0.00 0.00 175.29 175.38 2qlm s ARG 833 N -0.89 4.14 0.28 2.91 3.00 -1.26 -4.96 118.95 122.17 2qlm s ARG 833 Ca 0.55 1.86 -0.15 0.00 0.00 0.00 0.00 55.73 57.99 2qlm s ARG 833 Cb -0.41 -2.75 -0.08 0.00 0.00 0.00 0.00 34.95 31.71 2qlm s ARG 833 CO 0.47 -0.25 0.70 -0.51 0.00 0.00 0.00 175.30 175.70 2qlm s LEU 834 N -2.35 4.13 0.30 2.53 1.43 -0.46 -5.04 118.68 119.22 2qlm s LEU 834 Ca 0.55 1.23 -0.30 0.00 -1.03 0.00 0.00 54.13 54.59 2qlm s LEU 834 Cb -0.31 -3.91 -0.11 0.00 0.03 0.00 0.00 46.19 41.89 2qlm s LEU 834 CO 0.40 -0.14 1.52 -2.16 0.23 0.00 0.00 176.35 176.21 2qlm s PRO 835 N -2.76 4.16 0.00 1.29 0.04 -1.26 -4.59 135.00 131.88 2qlm s PRO 835 Ca 0.51 2.49 0.21 0.00 0.04 0.00 0.00 61.00 64.25 2qlm s PRO 835 Cb -0.11 -3.04 1.25 0.00 0.04 0.00 0.00 34.50 32.64 2qlm s PRO 835 CO 0.19 -0.54 1.64 0.00 0.04 0.00 0.00 177.00 178.32