#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mws n LYS 28 N 0.00 -0.03 -0.07 -1.24 4.81 -1.26 0.32 118.16 120.69 1mws n LYS 28 Ca 0.00 1.18 -0.12 0.00 -0.87 0.00 0.00 58.31 58.51 1mws n LYS 28 Cb 0.00 -2.36 -0.05 0.00 0.02 0.00 0.00 35.03 32.64 1mws n LYS 28 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 1mws h GLU 29 N 0.00 0.38 0.29 1.64 4.11 -2.00 -0.74 114.58 118.27 1mws h GLU 29 Ca 0.85 -0.13 0.00 0.00 0.07 0.00 0.00 59.36 60.15 1mws h GLU 29 Cb 2.80 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 32.00 1mws h GLU 29 CO -0.40 0.59 -0.29 0.82 0.07 0.00 0.00 179.01 179.79 1mws h ILE 30 N 0.13 0.38 -0.91 -1.06 2.04 -0.49 -0.60 117.51 117.01 1mws h ILE 30 Ca 0.06 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.10 1mws h ILE 30 Cb 0.43 0.38 -0.07 0.00 -0.74 0.00 0.00 36.82 36.82 1mws h ILE 30 CO 0.01 0.00 0.59 0.78 0.00 0.00 0.00 178.15 179.54 1mws h ASN 31 N -0.61 0.52 -0.54 1.72 2.35 -1.47 0.19 115.58 117.74 1mws h ASN 31 Ca -0.01 0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.75 1mws h ASN 31 Cb 0.56 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.86 1mws h ASN 31 CO -0.06 0.22 0.19 0.78 -1.65 0.00 0.00 177.43 176.91 1mws h ASN 32 N 0.53 0.80 -0.02 5.81 -0.26 0.33 0.72 115.58 123.49 1mws h ASN 32 Ca 0.48 -0.12 -0.02 0.00 -0.56 0.00 0.00 56.30 56.08 1mws h ASN 32 Cb 1.01 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 38.07 1mws h ASN 32 CO -0.21 0.75 -0.05 0.74 -1.06 0.00 0.00 177.43 177.59 1mws h THR 33 N 0.84 1.46 -0.94 2.81 2.02 0.56 -1.48 112.91 118.19 1mws h THR 33 Ca 0.19 -1.44 0.03 0.00 0.77 0.00 0.00 66.41 65.96 1mws h THR 33 Cb 0.23 2.38 -0.05 0.00 -1.74 0.00 0.00 68.15 68.97 1mws h THR 33 CO -0.01 0.39 0.62 0.40 0.37 0.00 0.00 175.52 177.28 1mws h ILE 34 N -0.49 1.18 0.00 3.11 2.04 -0.73 0.15 117.51 122.76 1mws h ILE 34 Ca -0.00 -0.41 -0.05 0.00 1.00 0.00 0.00 64.86 65.39 1mws h ILE 34 Cb 0.66 -0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1mws h ILE 34 CO 0.01 0.22 -0.24 0.44 0.00 0.00 0.00 178.15 178.58 1mws h ASP 35 N 1.21 0.00 0.06 1.72 5.19 0.49 -0.40 116.42 124.69 1mws h ASP 35 Ca 0.37 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.71 1mws h ASP 35 Cb -0.03 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 1mws h ASP 35 CO -0.11 0.24 -0.23 0.00 -3.12 0.00 0.00 179.24 176.02 1mws h ALA 36 N 1.76 1.30 -0.14 3.45 0.00 0.37 0.03 119.26 126.04 1mws h ALA 36 Ca -0.00 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1mws h ALA 36 Cb 0.44 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1mws h ALA 36 CO 0.03 0.47 -0.03 0.82 0.00 0.00 0.00 179.25 180.54 1mws h ILE 37 N 0.27 1.28 -0.76 0.00 2.04 -0.15 0.11 117.51 120.29 1mws h ILE 37 Ca 0.05 -0.95 0.11 0.00 1.00 0.00 0.00 64.86 65.07 1mws h ILE 37 Cb 0.56 1.64 -0.08 0.00 -0.74 0.00 0.00 36.82 38.20 1mws h ILE 37 CO 0.04 0.28 0.38 -0.33 0.00 0.00 0.00 178.15 178.51 1mws h GLU 38 N -0.04 0.58 -0.00 2.37 5.08 -0.72 -0.11 114.58 121.74 1mws h GLU 38 Ca 0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1mws h GLU 38 Cb 0.44 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1mws h GLU 38 CO 0.01 0.39 -0.01 -0.25 -1.00 0.00 0.00 179.01 178.15 1mws n ASP 39 N -4.88 0.45 -2.36 1.42 8.00 -0.06 -4.41 116.55 114.72 1mws n ASP 39 Ca 0.13 -1.10 -0.19 0.00 0.71 0.00 0.00 54.79 54.35 1mws n ASP 39 Cb 0.34 -0.01 0.01 0.00 -0.02 0.00 0.00 41.12 41.44 1mws n ASP 39 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1mws n LYS 40 N -0.67 -2.93 -2.51 -1.24 5.02 -0.06 -4.88 118.16 110.89 1mws n LYS 40 Ca 0.22 0.83 -0.43 0.00 -2.02 0.00 0.00 58.31 56.91 1mws n LYS 40 Cb 0.19 -5.39 0.00 0.00 -0.02 0.00 0.00 35.03 29.82 1mws n LYS 40 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1mws n ASN 41 N -1.70 4.91 -0.34 4.39 5.03 0.25 -4.80 115.26 123.01 1mws n ASN 41 Ca -0.15 -2.98 -0.02 0.00 0.87 0.00 0.00 54.58 52.30 1mws n ASN 41 Cb 0.63 -1.60 0.14 0.00 -1.02 0.00 0.00 39.78 37.94 1mws n ASN 41 CO 0.00 0.00 0.00 -0.26 -1.83 0.00 0.00 177.26 175.17 1mws h PHE 42 N 6.65 1.19 -0.72 3.10 0.05 -1.90 0.29 116.94 125.60 1mws h PHE 42 Ca 0.41 0.02 -0.06 0.00 3.82 0.00 0.00 57.97 62.16 1mws h PHE 42 Cb 0.77 -0.40 -0.03 0.00 2.00 0.00 0.00 35.95 38.29 1mws h PHE 42 CO 1.27 0.76 0.22 0.87 -0.18 0.00 0.00 178.31 181.25 1mws h LYS 43 N 1.27 1.11 -0.38 1.51 1.79 -1.91 0.14 116.57 120.11 1mws h LYS 43 Ca 0.34 -0.23 -0.07 0.00 -2.18 0.00 0.00 60.65 58.50 1mws h LYS 43 Cb -0.13 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.35 1mws h LYS 43 CO -0.07 0.95 -0.05 0.37 -1.08 0.00 0.00 179.45 179.57 1mws h GLN 44 N 1.07 0.70 -0.54 3.15 4.15 -1.78 0.15 115.11 122.00 1mws h GLN 44 Ca 0.23 -0.25 -0.02 0.00 0.77 0.00 0.00 58.65 59.39 1mws h GLN 44 Cb 0.30 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.92 1mws h GLN 44 CO -0.01 0.82 0.27 0.28 -1.93 0.00 0.00 178.83 178.27 1mws h VAL 45 N 0.51 1.19 0.25 2.39 2.07 -0.59 -0.85 116.25 121.23 1mws h VAL 45 Ca 0.10 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 67.09 1mws h VAL 45 Cb 0.54 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1mws h VAL 45 CO 0.03 0.22 -0.22 0.22 0.02 0.00 0.00 177.57 177.84 1mws h TYR 46 N 0.72 -0.57 0.00 1.57 3.20 -0.49 -1.98 116.97 119.41 1mws h TYR 46 Ca 0.19 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 1mws h TYR 46 Cb 0.10 0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 1mws h TYR 46 CO -0.01 -0.33 -0.03 0.87 -1.64 0.00 0.00 178.16 177.02 1mws h LYS 47 N -0.49 0.00 -0.31 1.82 1.79 -0.44 -1.04 116.57 117.91 1mws h LYS 47 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1mws h LYS 47 Cb 0.44 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1mws h LYS 47 CO -0.03 0.03 0.00 -0.25 -1.08 0.00 0.00 179.45 178.12 1mws n ASP 48 N -3.71 2.29 -4.89 0.86 8.00 -0.35 -4.92 116.55 113.83 1mws n ASP 48 Ca -0.03 -1.87 -0.29 0.00 0.71 0.00 0.00 54.79 53.31 1mws n ASP 48 Cb 0.12 -0.21 -0.03 0.00 -0.02 0.00 0.00 41.12 40.99 1mws n ASP 48 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1mws s SER 49 N -1.35 6.48 0.87 -2.24 0.01 -0.39 -0.49 113.70 116.59 1mws s SER 49 Ca 0.33 0.89 -0.12 0.00 1.31 0.00 0.00 55.95 58.36 1mws s SER 49 Cb 0.18 -2.22 0.10 0.00 0.21 0.00 0.00 66.02 64.29 1mws s SER 49 CO 0.25 -0.28 1.06 -1.54 0.41 0.00 0.00 173.24 173.15 1mws n SER 50 N -1.07 0.27 -0.23 2.44 3.41 0.15 -4.68 113.62 113.92 1mws n SER 50 Ca 0.00 0.48 -0.05 0.00 -0.26 0.00 0.00 58.87 59.05 1mws n SER 50 Cb 0.54 -1.45 0.06 0.00 -0.26 0.00 0.00 64.21 63.10 1mws n SER 50 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1mws h TYR 51 N -1.41 0.80 -0.20 7.33 5.03 -1.97 -2.13 116.97 124.42 1mws h TYR 51 Ca -0.44 0.02 -0.13 0.00 2.58 0.00 0.00 58.73 60.76 1mws h TYR 51 Cb 1.29 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 39.30 1mws h TYR 51 CO 0.47 0.49 -0.37 0.82 -1.32 0.00 0.00 178.16 178.24 1mws h ILE 52 N 0.85 1.33 -0.43 1.81 2.04 -1.97 -1.93 117.51 119.21 1mws h ILE 52 Ca 0.25 -1.60 -0.07 0.00 1.00 0.00 0.00 64.86 64.44 1mws h ILE 52 Cb -0.05 1.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 1mws h ILE 52 CO -0.07 0.49 -0.04 0.77 0.00 0.00 0.00 178.15 179.31 1mws h SER 53 N 0.28 0.69 -0.41 1.72 4.64 -1.88 0.56 113.55 119.16 1mws h SER 53 Ca 0.01 -0.17 -0.10 0.00 -0.47 0.00 0.00 61.79 61.06 1mws h SER 53 Cb 0.97 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1mws h SER 53 CO 0.08 0.78 -0.13 0.11 -0.87 0.00 0.00 176.83 176.81 1mws h LYS 54 N 0.67 0.82 -0.25 4.77 1.57 -1.37 -2.38 116.57 120.39 1mws h LYS 54 Ca 0.13 -0.33 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1mws h LYS 54 Cb 0.47 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1mws h LYS 54 CO 0.02 0.96 0.16 1.03 -0.57 0.00 0.00 179.45 181.05 1mws h SER 55 N 0.64 0.30 -0.51 0.86 0.87 -0.95 0.71 113.55 115.47 1mws h SER 55 Ca 0.10 -0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.53 1mws h SER 55 Cb 0.67 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.54 1mws h SER 55 CO 0.05 0.25 -0.03 0.44 -0.53 0.00 0.00 176.83 177.01 1mws h ASP 56 N 0.32 0.91 0.30 6.23 3.32 -0.84 -3.34 116.42 123.33 1mws h ASP 56 Ca 0.09 -0.32 -0.33 0.00 0.02 0.00 0.00 57.03 56.49 1mws h ASP 56 Cb 0.00 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 1mws h ASP 56 CO -0.02 1.01 -1.87 0.59 -1.72 0.00 0.00 179.24 177.23 1mws n ASN 57 N -4.28 1.47 0.00 6.45 3.02 -0.90 -5.10 115.26 115.92 1mws n ASN 57 Ca 0.01 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.86 1mws n ASN 57 Cb 0.34 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1mws n ASN 57 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mws n GLY 58 N 1.78 -0.37 0.29 7.41 0.00 0.24 -4.33 105.19 110.20 1mws n GLY 58 Ca -0.25 -1.47 0.02 0.00 0.00 0.00 0.00 46.02 44.32 1mws n GLY 58 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1mws h GLU 59 N 0.00 0.56 -0.33 1.61 4.81 -1.95 -2.52 114.58 116.76 1mws h GLU 59 Ca 0.00 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 1mws h GLU 59 Cb 0.00 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1mws h GLU 59 CO 0.00 0.46 0.08 0.28 -0.73 0.00 0.00 179.01 179.10 1mws h VAL 60 N 0.56 1.22 -0.00 0.32 2.07 -1.97 0.46 116.25 118.91 1mws h VAL 60 Ca 0.14 -0.74 -0.10 0.00 0.82 0.00 0.00 66.70 66.81 1mws h VAL 60 Cb 0.11 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1mws h VAL 60 CO -0.01 0.25 -0.49 -0.08 0.02 0.00 0.00 177.57 177.25 1mws h GLU 61 N 0.37 0.01 0.00 1.57 4.57 -1.72 0.11 114.58 119.49 1mws h GLU 61 Ca 0.10 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 1mws h GLU 61 Cb 0.30 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1mws h GLU 61 CO 0.00 0.50 -0.84 0.52 -1.18 0.00 0.00 179.01 178.01 1mws h MET 62 N 0.01 0.00 0.00 1.92 2.86 -1.27 -3.37 114.93 115.08 1mws h MET 62 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1mws h MET 62 Cb 0.88 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.54 1mws h MET 62 CO 0.06 0.06 -0.62 0.25 1.06 0.00 0.00 176.91 177.73 1mws n THR 63 N -2.81 0.00 -0.09 2.22 -2.24 0.14 -4.68 114.28 106.81 1mws n THR 63 Ca -0.00 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.58 1mws n THR 63 Cb 0.59 0.12 -0.12 0.00 -2.10 0.00 0.00 70.33 68.82 1mws n THR 63 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1mws n GLU 64 N -1.03 0.67 -0.13 -0.78 1.02 0.30 -4.28 120.64 116.43 1mws n GLU 64 Ca 0.00 0.19 -0.08 0.00 -0.02 0.00 0.00 57.16 57.25 1mws n GLU 64 Cb 0.06 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 1mws n GLU 64 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1mws h ARG 65 N -0.05 0.52 -0.98 3.49 2.43 -1.52 -2.47 114.38 115.80 1mws h ARG 65 Ca -0.54 -0.03 0.18 0.00 -0.81 0.00 0.00 59.98 58.78 1mws h ARG 65 Cb 1.91 -0.12 -0.09 0.00 -0.42 0.00 0.00 29.97 31.25 1mws h ARG 65 CO -0.06 0.34 0.61 -1.35 -1.51 0.00 0.00 179.97 178.00 1mws h PRO 66 N 0.53 0.70 -0.28 0.20 0.11 -1.78 -1.27 132.00 130.21 1mws h PRO 66 Ca 0.15 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.23 1mws h PRO 66 Cb -0.05 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 30.88 1mws h PRO 66 CO -0.04 0.46 0.15 0.82 -0.21 0.00 0.00 178.00 179.19 1mws h ILE 67 N 0.72 1.02 -0.56 4.15 2.04 -1.62 -1.22 117.51 122.03 1mws h ILE 67 Ca 0.54 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 66.24 1mws h ILE 67 Cb 0.90 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 1mws h ILE 67 CO -0.32 0.06 0.11 0.11 0.00 0.00 0.00 178.15 178.11 1mws h LYS 68 N 0.32 0.88 -0.21 2.37 1.57 -1.20 -0.96 116.57 119.33 1mws h LYS 68 Ca 0.11 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 1mws h LYS 68 Cb 0.01 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 1mws h LYS 68 CO -0.06 0.81 -0.15 0.82 -0.57 0.00 0.00 179.45 180.30 1mws h ILE 69 N 0.84 1.32 -0.51 1.86 2.04 -1.16 -2.06 117.51 119.84 1mws h ILE 69 Ca 0.18 -1.26 -0.09 0.00 1.00 0.00 0.00 64.86 64.69 1mws h ILE 69 Cb 0.34 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 1mws h ILE 69 CO 0.00 0.39 -0.03 1.88 0.00 0.00 0.00 178.15 180.39 1mws h TYR 70 N 0.17 0.96 -0.54 1.37 0.99 -1.12 -2.40 116.97 116.39 1mws h TYR 70 Ca 0.04 -0.16 -0.11 0.00 2.00 0.00 0.00 58.73 60.51 1mws h TYR 70 Cb 0.67 -0.25 -0.02 0.00 1.00 0.00 0.00 36.73 38.12 1mws h TYR 70 CO 0.07 0.89 -0.08 -0.91 -0.00 0.00 0.00 178.16 178.13 1mws h ASN 71 N 0.81 0.99 0.40 3.88 2.35 -1.15 -0.08 115.58 122.79 1mws h ASN 71 Ca 0.15 -0.31 -0.07 0.00 -0.55 0.00 0.00 56.30 55.51 1mws h ASN 71 Cb 0.53 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1mws h ASN 71 CO 0.03 1.08 -0.36 0.77 -1.65 0.00 0.00 177.43 177.31 1mws h SER 72 N 0.90 0.00 0.41 5.81 4.64 -1.16 -2.65 113.55 121.50 1mws h SER 72 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1mws h SER 72 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1mws h SER 72 CO 0.04 0.36 -0.67 0.18 -0.87 0.00 0.00 176.83 175.87 1mws n LEU 73 N -4.03 0.62 -2.21 5.97 4.77 -0.92 -4.96 117.00 116.24 1mws n LEU 73 Ca -0.02 -0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 55.77 1mws n LEU 73 Cb 0.40 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.36 1mws n LEU 73 CO 0.38 0.13 0.09 0.61 -1.33 0.00 0.00 177.39 177.27 1mws n GLY 74 N 1.47 0.08 3.78 -0.72 0.00 -0.19 -1.69 105.19 107.93 1mws n GLY 74 Ca 0.05 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 1mws n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mws s VAL 75 N -3.18 2.09 0.00 1.61 1.01 -0.36 -3.05 120.40 118.52 1mws s VAL 75 Ca 0.12 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1mws s VAL 75 Cb -0.05 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.27 1mws s VAL 75 CO 0.38 0.02 0.00 0.29 0.00 0.00 0.00 175.10 175.79 1mws n LYS 76 N 0.50 0.00 -4.47 2.72 5.02 0.11 -4.97 118.16 117.07 1mws n LYS 76 Ca 0.01 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.98 1mws n LYS 76 Cb 0.39 -0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.29 1mws n LYS 76 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1mws s ASP 77 N 0.30 4.45 -0.09 4.39 2.15 -1.26 -4.95 116.67 121.66 1mws s ASP 77 Ca 0.00 -0.22 0.04 0.00 0.43 0.00 0.00 52.55 52.80 1mws s ASP 77 Cb 0.00 -0.97 0.00 0.00 -0.30 0.00 0.00 42.92 41.65 1mws s ASP 77 CO 0.00 0.27 -0.21 -0.63 -0.17 0.00 0.00 175.17 174.42 1mws s ILE 78 N -1.01 1.87 -0.24 4.11 1.01 -1.26 -1.18 121.20 124.50 1mws s ILE 78 Ca 0.17 -0.90 -0.00 0.00 0.00 0.00 0.00 60.65 59.91 1mws s ILE 78 Cb -0.11 -1.63 0.07 0.00 0.01 0.00 0.00 42.46 40.81 1mws s ILE 78 CO 0.08 0.52 0.01 0.20 0.00 0.00 0.00 174.94 175.75 1mws s ASN 79 N 0.43 3.66 -0.41 3.58 0.01 0.17 -4.81 114.94 117.56 1mws s ASN 79 Ca -0.18 -1.22 -0.14 0.00 -0.71 0.00 0.00 52.86 50.61 1mws s ASN 79 Cb -0.17 -0.96 0.03 0.00 0.41 0.00 0.00 41.25 40.55 1mws s ASN 79 CO 0.08 -0.30 0.30 -0.63 -1.51 0.00 0.00 177.10 175.03 1mws s ILE 80 N 1.55 5.15 0.40 0.60 1.01 -1.26 -0.63 121.20 128.03 1mws s ILE 80 Ca -0.00 -0.74 0.05 0.00 0.00 0.00 0.00 60.65 59.96 1mws s ILE 80 Cb -0.18 -3.90 -0.06 0.00 0.01 0.00 0.00 42.46 38.33 1mws s ILE 80 CO -0.11 -0.33 0.03 -1.10 0.00 0.00 0.00 174.94 173.43 1mws s GLN 81 N 1.66 1.92 -1.24 2.79 -0.21 -0.44 -4.80 119.66 119.33 1mws s GLN 81 Ca 0.04 -2.11 -0.12 0.00 0.02 0.00 0.00 55.36 53.19 1mws s GLN 81 Cb -0.20 -1.35 -0.01 0.00 1.00 0.00 0.00 33.01 32.46 1mws s GLN 81 CO 0.09 -0.17 0.67 -3.47 -2.12 0.00 0.00 175.29 170.29 1mws n ASP 82 N -0.97 -3.32 -4.63 5.90 -0.08 -1.26 -0.18 116.55 112.01 1mws n ASP 82 Ca -0.07 -0.99 -0.43 0.00 -1.51 0.00 0.00 54.79 51.79 1mws n ASP 82 Cb 0.67 -3.34 -0.02 0.00 2.34 0.00 0.00 41.12 40.76 1mws n ASP 82 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1mws s ARG 83 N -6.16 3.94 -0.97 -0.67 0.52 -1.26 -4.17 118.95 110.17 1mws s ARG 83 Ca 0.28 1.38 -0.06 0.00 -0.52 0.00 0.00 55.73 56.82 1mws s ARG 83 Cb -0.10 -3.89 0.24 0.00 0.52 0.00 0.00 34.95 31.72 1mws s ARG 83 CO 0.86 -1.09 0.91 0.15 0.02 0.00 0.00 175.30 176.15 1mws s LYS 84 N 4.17 3.66 -0.42 3.54 1.02 0.98 -4.90 119.74 127.79 1mws s LYS 84 Ca 0.59 -3.17 -0.28 0.00 0.02 0.00 0.00 55.97 53.13 1mws s LYS 84 Cb -0.19 -4.23 -0.01 0.00 -0.52 0.00 0.00 37.83 32.88 1mws s LYS 84 CO 0.23 -1.25 1.66 0.42 -0.92 0.00 0.00 175.35 175.49 1mws s ILE 85 N -1.16 3.61 0.00 2.17 1.01 -1.26 -2.35 121.20 123.22 1mws s ILE 85 Ca 0.28 0.58 0.00 0.00 0.00 0.00 0.00 60.65 61.51 1mws s ILE 85 Cb -0.09 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.45 1mws s ILE 85 CO -0.10 -0.66 0.00 1.17 0.00 0.00 0.00 174.94 175.35 1mws n LYS 86 N 8.47 3.67 -3.86 2.79 4.81 -0.14 -4.92 118.16 128.97 1mws n LYS 86 Ca 0.20 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.55 1mws n LYS 86 Cb 0.48 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.53 1mws n LYS 86 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1mws s LYS 87 N 3.08 1.99 0.00 1.64 -0.14 -1.26 -3.93 119.74 121.12 1mws s LYS 87 Ca 0.00 -1.25 0.00 0.00 -1.36 0.00 0.00 55.97 53.36 1mws s LYS 87 Cb 0.00 0.60 0.00 0.00 -1.68 0.00 0.00 37.83 36.75 1mws s LYS 87 CO 0.00 -0.91 0.00 1.33 -0.76 0.00 0.00 175.35 175.01 1mws n VAL 88 N -0.49 0.00 -2.17 3.17 0.24 -1.26 -4.82 118.33 113.00 1mws n VAL 88 Ca -0.06 0.00 -0.02 0.00 -2.04 0.00 0.00 64.34 62.22 1mws n VAL 88 Cb 0.60 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.95 1mws n VAL 88 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1mws n LYS 92 N 0.00 -3.59 -1.01 7.34 5.02 -1.26 -5.16 118.16 119.49 1mws n LYS 92 Ca 0.00 2.79 0.00 0.00 -2.02 0.00 0.00 58.31 59.08 1mws n LYS 92 Cb 0.00 -3.84 0.00 0.00 -0.02 0.00 0.00 35.03 31.17 1mws n LYS 92 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1mws n LYS 93 N 1.30 1.49 -3.17 1.97 5.02 -1.21 -5.01 118.16 118.54 1mws n LYS 93 Ca -0.18 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.16 1mws n LYS 93 Cb 0.28 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.27 1mws n LYS 93 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1mws s ARG 94 N -1.31 0.07 -0.07 1.97 3.52 -1.25 -3.52 118.95 118.35 1mws s ARG 94 Ca 0.00 0.14 -0.15 0.00 -0.13 0.00 0.00 55.73 55.59 1mws s ARG 94 Cb 0.00 0.08 -0.05 0.00 -1.56 0.00 0.00 34.95 33.42 1mws s ARG 94 CO 0.00 -0.06 0.38 0.08 -0.81 0.00 0.00 175.30 174.89 1mws s VAL 95 N 2.74 5.16 -0.24 7.11 1.01 -0.50 -0.97 120.40 134.70 1mws s VAL 95 Ca -0.06 0.75 0.02 0.00 0.00 0.00 0.00 61.98 62.70 1mws s VAL 95 Cb -0.07 -3.69 0.05 0.00 0.00 0.00 0.00 36.38 32.67 1mws s VAL 95 CO -0.10 0.49 -0.12 -1.81 0.00 0.00 0.00 175.10 173.56 1mws s ASP 96 N -0.39 4.10 0.23 3.32 1.01 -0.99 -1.25 116.67 122.70 1mws s ASP 96 Ca 0.22 -1.22 0.02 0.00 0.71 0.00 0.00 52.55 52.29 1mws s ASP 96 Cb -0.15 -1.49 -0.01 0.00 1.01 0.00 0.00 42.92 42.28 1mws s ASP 96 CO 0.10 -0.16 0.09 0.00 0.21 0.00 0.00 175.17 175.41 1mws n ALA 97 N 4.50 0.33 -3.64 5.23 0.00 -0.87 -0.02 120.51 126.05 1mws n ALA 97 Ca -0.15 -1.18 -0.35 0.00 0.00 0.00 0.00 53.44 51.76 1mws n ALA 97 Cb 0.44 0.81 -0.14 0.00 0.00 0.00 0.00 19.45 20.56 1mws n ALA 97 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1mws s GLN 98 N -2.88 2.42 -0.57 0.00 2.00 0.75 -1.60 119.66 119.78 1mws s GLN 98 Ca 0.13 -1.28 -0.23 0.00 -2.00 0.00 0.00 55.36 51.97 1mws s GLN 98 Cb 0.01 -3.20 0.05 0.00 0.80 0.00 0.00 33.01 30.66 1mws s GLN 98 CO 0.09 -0.64 0.92 -0.47 -0.50 0.00 0.00 175.29 174.69 1mws s TYR 99 N 1.25 2.79 -0.18 1.67 6.04 0.18 -1.33 117.35 127.77 1mws s TYR 99 Ca -0.05 -0.18 -0.07 0.00 0.04 0.00 0.00 57.07 56.81 1mws s TYR 99 Cb -0.20 -4.07 -0.04 0.00 -1.04 0.00 0.00 41.96 36.61 1mws s TYR 99 CO -0.01 -1.39 0.05 0.15 -1.54 0.00 0.00 175.55 172.80 1mws s LYS 100 N 3.86 3.90 -0.04 4.97 1.02 0.20 -2.07 119.74 131.58 1mws s LYS 100 Ca 0.27 -0.38 0.02 0.00 0.02 0.00 0.00 55.97 55.90 1mws s LYS 100 Cb -0.14 -3.17 0.01 0.00 -0.52 0.00 0.00 37.83 34.01 1mws s LYS 100 CO 0.16 0.24 -0.10 0.42 -0.92 0.00 0.00 175.35 175.15 1mws s ILE 101 N 0.44 0.91 -0.12 2.17 1.01 -0.26 0.41 121.20 125.76 1mws s ILE 101 Ca 0.02 -0.40 -0.04 0.00 0.00 0.00 0.00 60.65 60.23 1mws s ILE 101 Cb -0.13 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.49 1mws s ILE 101 CO 0.01 0.29 0.03 -0.54 0.00 0.00 0.00 174.94 174.73 1mws s LYS 102 N 0.36 3.38 0.26 2.79 3.01 -0.32 -0.87 119.74 128.35 1mws s LYS 102 Ca -0.07 -0.36 0.02 0.00 -1.01 0.00 0.00 55.97 54.55 1mws s LYS 102 Cb -0.11 -2.97 -0.04 0.00 -1.01 0.00 0.00 37.83 33.70 1mws s LYS 102 CO 0.01 0.55 0.18 0.95 0.51 0.00 0.00 175.35 177.55 1mws s THR 103 N -0.45 0.11 -1.10 2.17 -4.23 -0.76 -0.71 115.64 110.67 1mws s THR 103 Ca 0.09 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.75 1mws s THR 103 Cb -0.12 -2.51 0.16 0.00 1.34 0.00 0.00 72.50 71.37 1mws s THR 103 CO 0.02 0.00 1.48 0.59 -0.54 0.00 0.00 174.62 176.17 1mws n ASN 104 N -0.79 0.00 -0.40 3.99 3.02 -0.68 -2.14 115.26 118.25 1mws n ASN 104 Ca 0.03 0.40 0.07 0.00 -0.03 0.00 0.00 54.58 55.05 1mws n ASN 104 Cb 0.65 -0.45 0.02 0.00 -0.61 0.00 0.00 39.78 39.38 1mws n ASN 104 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1mws n TYR 105 N -1.45 0.00 0.00 3.10 4.02 -1.26 -5.09 117.16 116.47 1mws n TYR 105 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1mws n TYR 105 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.49 1mws n TYR 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1mws n GLY 106 N 1.01 0.79 3.87 2.72 0.00 -0.91 -4.94 105.19 107.73 1mws n GLY 106 Ca 0.07 -2.19 -0.36 0.00 0.00 0.00 0.00 46.02 43.54 1mws n GLY 106 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mws s ASN 107 N -1.28 6.53 -0.21 1.61 0.01 -1.26 -1.83 114.94 118.52 1mws s ASN 107 Ca 0.00 0.62 -0.08 0.00 -0.71 0.00 0.00 52.86 52.69 1mws s ASN 107 Cb 0.00 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.51 1mws s ASN 107 CO 0.00 0.29 0.08 -0.63 -1.51 0.00 0.00 177.10 175.33 1mws s ILE 108 N -1.21 4.71 -0.33 0.60 1.01 -0.05 -4.86 121.20 121.06 1mws s ILE 108 Ca 0.25 -0.05 -0.01 0.00 0.00 0.00 0.00 60.65 60.83 1mws s ILE 108 Cb -0.14 -3.16 0.12 0.00 0.01 0.00 0.00 42.46 39.30 1mws s ILE 108 CO 0.13 0.41 0.17 -0.62 0.00 0.00 0.00 174.94 175.03 1mws s ASP 109 N 0.82 3.36 0.27 3.58 3.68 -1.26 -1.10 116.67 126.02 1mws s ASP 109 Ca 0.04 -1.86 0.04 0.00 2.13 0.00 0.00 52.55 52.90 1mws s ASP 109 Cb -0.13 -0.50 -0.06 0.00 -1.45 0.00 0.00 42.92 40.78 1mws s ASP 109 CO 0.02 -0.36 -0.00 -0.13 0.13 0.00 0.00 175.17 174.83 1mws s ARG 110 N 1.41 1.47 -0.01 4.34 0.52 -0.88 -4.98 118.95 120.82 1mws s ARG 110 Ca 0.14 -1.76 -0.16 0.00 -0.52 0.00 0.00 55.73 53.43 1mws s ARG 110 Cb -0.20 -0.81 -0.06 0.00 0.52 0.00 0.00 34.95 34.40 1mws s ARG 110 CO -0.15 -0.08 0.44 1.21 0.02 0.00 0.00 175.30 176.74 1mws s ASN 111 N -3.38 6.83 0.19 0.23 3.84 -1.26 0.49 114.94 121.87 1mws s ASN 111 Ca 0.31 0.98 0.03 0.00 0.21 0.00 0.00 52.86 54.39 1mws s ASN 111 Cb 0.06 -2.27 -0.05 0.00 -0.55 0.00 0.00 41.25 38.44 1mws s ASN 111 CO 0.11 0.26 -0.01 0.68 -2.79 0.00 0.00 177.10 175.35 1mws s VAL 112 N -0.77 0.89 -0.12 -5.21 -7.23 -0.63 -4.78 120.40 102.55 1mws s VAL 112 Ca 0.25 -2.01 0.02 0.00 -1.81 0.00 0.00 61.98 58.42 1mws s VAL 112 Cb -0.17 -2.17 0.01 0.00 0.56 0.00 0.00 36.38 34.61 1mws s VAL 112 CO 0.14 -0.45 -0.16 -1.10 -0.31 0.00 0.00 175.10 173.21 1mws s GLN 113 N -3.87 2.38 -0.29 4.82 -0.21 -1.26 -2.06 119.66 119.17 1mws s GLN 113 Ca 0.25 -0.62 -0.02 0.00 0.02 0.00 0.00 55.36 54.99 1mws s GLN 113 Cb 0.05 -2.02 0.04 0.00 1.00 0.00 0.00 33.01 32.09 1mws s GLN 113 CO 0.05 -0.07 -0.01 -0.06 -2.12 0.00 0.00 175.29 173.08 1mws s PHE 114 N 1.01 3.21 0.10 0.91 2.99 -0.38 -4.97 117.98 120.85 1mws s PHE 114 Ca -0.05 -1.76 -0.17 0.00 0.00 0.00 0.00 56.93 54.95 1mws s PHE 114 Cb -0.15 -2.10 -0.07 0.00 0.00 0.00 0.00 43.02 40.70 1mws s PHE 114 CO -0.03 -0.78 0.54 -0.80 -0.00 0.00 0.00 175.22 174.16 1mws s ASN 115 N 1.28 6.93 0.29 1.36 -0.87 -1.26 -1.42 114.94 121.25 1mws s ASN 115 Ca -0.04 1.15 0.08 0.00 -1.57 0.00 0.00 52.86 52.48 1mws s ASN 115 Cb -0.19 -2.32 -0.06 0.00 -0.02 0.00 0.00 41.25 38.67 1mws s ASN 115 CO -0.02 0.21 -0.09 -0.36 -2.57 0.00 0.00 177.10 174.27 1mws s PHE 116 N -1.26 2.08 -0.17 2.20 0.40 -1.23 -0.49 117.98 119.51 1mws s PHE 116 Ca 0.32 -0.60 -0.13 0.00 -0.60 0.00 0.00 56.93 55.92 1mws s PHE 116 Cb -0.17 -1.14 0.05 0.00 0.51 0.00 0.00 43.02 42.27 1mws s PHE 116 CO 0.18 0.41 0.43 0.14 0.70 0.00 0.00 175.22 177.09 1mws s VAL 117 N -2.86 -0.01 -0.02 -0.44 -7.23 -0.35 -3.36 120.40 106.14 1mws s VAL 117 Ca 0.30 0.03 -0.30 0.00 -1.81 0.00 0.00 61.98 60.20 1mws s VAL 117 Cb 0.02 -0.62 -0.03 0.00 0.56 0.00 0.00 36.38 36.31 1mws s VAL 117 CO 0.13 0.01 1.04 -0.75 -0.31 0.00 0.00 175.10 175.22 1mws s LYS 118 N 0.65 4.49 -0.20 4.82 2.20 -1.26 -0.41 119.74 130.02 1mws s LYS 118 Ca -0.03 1.49 -0.03 0.00 -0.36 0.00 0.00 55.97 57.04 1mws s LYS 118 Cb -0.05 -3.47 0.06 0.00 -1.51 0.00 0.00 37.83 32.87 1mws s LYS 118 CO -0.04 -0.18 0.06 -1.21 -0.36 0.00 0.00 175.35 173.61 1mws s GLU 119 N 1.37 0.50 -0.75 4.03 2.02 -0.58 -4.90 118.70 120.40 1mws s GLU 119 Ca 0.53 -0.39 -0.07 0.00 0.02 0.00 0.00 54.97 55.05 1mws s GLU 119 Cb -0.22 -1.99 0.01 0.00 0.10 0.00 0.00 34.13 32.03 1mws s GLU 119 CO 0.25 -0.69 0.60 -0.25 0.02 0.00 0.00 175.26 175.19 1mws n ASP 120 N 5.10 -4.81 0.00 -0.19 9.92 -1.26 -3.79 116.55 121.52 1mws n ASP 120 Ca -0.08 -0.83 0.00 0.00 -0.53 0.00 0.00 54.79 53.35 1mws n ASP 120 Cb 0.47 -1.56 0.00 0.00 -0.64 0.00 0.00 41.12 39.39 1mws n ASP 120 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1mws n GLY 121 N -1.37 1.44 1.81 0.44 0.00 -1.26 -5.00 105.19 101.24 1mws n GLY 121 Ca -0.28 -0.69 -0.22 0.00 0.00 0.00 0.00 46.02 44.83 1mws n GLY 121 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1mws n MET 122 N 2.91 0.00 -3.19 1.61 2.81 -1.25 -4.81 117.12 115.20 1mws n MET 122 Ca 0.00 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.48 1mws n MET 122 Cb 0.00 -0.56 -0.07 0.00 -0.71 0.00 0.00 33.22 31.88 1mws n MET 122 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1mws s TRP 123 N -1.09 3.21 0.01 2.03 0.52 -1.26 -1.52 118.94 120.83 1mws s TRP 123 Ca 0.32 0.43 -0.00 0.00 0.02 0.00 0.00 56.10 56.87 1mws s TRP 123 Cb -0.29 -2.92 -0.04 0.00 -1.15 0.00 0.00 33.47 29.08 1mws s TRP 123 CO 0.37 -0.47 0.12 0.15 0.02 0.00 0.00 176.95 177.14 1mws s LYS 124 N 2.47 3.16 0.12 4.98 -0.14 0.45 -4.88 119.74 125.90 1mws s LYS 124 Ca 0.22 -0.47 -0.30 0.00 -1.36 0.00 0.00 55.97 54.05 1mws s LYS 124 Cb -0.15 -2.91 -0.07 0.00 -1.68 0.00 0.00 37.83 33.02 1mws s LYS 124 CO 0.12 0.64 1.17 -1.17 -0.76 0.00 0.00 175.35 175.35 1mws s LEU 125 N -1.94 4.42 -1.24 3.17 0.20 0.35 -1.21 118.68 122.44 1mws s LEU 125 Ca 0.26 2.08 -0.13 0.00 0.69 0.00 0.00 54.13 57.03 1mws s LEU 125 Cb -0.12 -3.59 0.16 0.00 -0.43 0.00 0.00 46.19 42.21 1mws s LEU 125 CO 0.17 -0.38 1.59 -0.67 -0.29 0.00 0.00 176.35 176.77 1mws n ASP 126 N 3.20 5.16 -4.60 3.68 2.03 0.36 0.35 116.55 126.72 1mws n ASP 126 Ca 0.06 -3.01 -0.43 0.00 0.52 0.00 0.00 54.79 51.93 1mws n ASP 126 Cb 0.46 -1.55 -0.00 0.00 -0.72 0.00 0.00 41.12 39.30 1mws n ASP 126 CO 0.00 0.00 0.00 1.87 -1.92 0.00 0.00 177.20 177.15 1mws n TRP 127 N 5.22 1.27 -3.72 -0.67 -0.00 -1.26 -4.63 117.44 113.65 1mws n TRP 127 Ca 0.38 0.63 -0.10 0.00 -0.00 0.00 0.00 57.50 58.42 1mws n TRP 127 Cb 0.41 -2.25 -0.04 0.00 -0.00 0.00 0.00 31.31 29.43 1mws n TRP 127 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 177.69 177.85 1mws s ASP 128 N -0.61 -0.28 0.61 5.87 3.84 -1.26 -4.86 116.67 119.98 1mws s ASP 128 Ca 0.60 -0.46 0.31 0.00 -0.00 0.00 0.00 52.55 53.00 1mws s ASP 128 Cb -0.63 0.58 1.68 0.00 -1.38 0.00 0.00 42.92 43.17 1mws s ASP 128 CO 0.59 -1.05 1.93 0.45 -0.00 0.00 0.00 175.17 177.09 1mws h HIS 129 N 2.19 0.00 0.00 2.11 3.86 -1.88 -0.83 115.15 120.60 1mws h HIS 129 Ca -0.29 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.92 1mws h HIS 129 Cb 1.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.73 1mws h HIS 129 CO 0.35 0.00 0.00 0.43 0.86 0.00 0.00 177.93 179.57 1mws n SER 130 N -2.80 0.00 0.18 2.45 7.64 -1.06 -0.70 113.62 119.33 1mws n SER 130 Ca -0.02 0.35 0.06 0.00 1.01 0.00 0.00 58.87 60.27 1mws n SER 130 Cb 0.29 -0.43 0.25 0.00 -1.01 0.00 0.00 64.21 63.31 1mws n SER 130 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1mws h VAL 131 N 0.00 0.76 0.00 0.44 2.07 -1.48 -3.25 116.25 114.79 1mws h VAL 131 Ca 0.00 -1.66 -0.08 0.00 0.82 0.00 0.00 66.70 65.78 1mws h VAL 131 Cb 0.25 2.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 1mws h VAL 131 CO 0.00 0.37 -0.65 0.40 0.02 0.00 0.00 177.57 177.70 1mws h ILE 132 N 0.00 0.52 -3.26 4.57 2.04 -1.09 -3.47 117.51 116.82 1mws h ILE 132 Ca -0.00 -1.56 -0.42 0.00 1.00 0.00 0.00 64.86 63.87 1mws h ILE 132 Cb 1.04 1.16 -0.39 0.00 -0.74 0.00 0.00 36.82 37.89 1mws h ILE 132 CO 0.05 0.18 -0.76 -0.63 0.00 0.00 0.00 178.15 176.99 1mws s ILE 133 N -2.19 0.19 0.14 -0.67 -1.09 -0.91 -5.08 121.20 111.59 1mws s ILE 133 Ca -0.18 0.18 -0.33 0.00 -2.23 0.00 0.00 60.65 58.08 1mws s ILE 133 Cb 0.03 -0.43 -0.13 0.00 -1.58 0.00 0.00 42.46 40.35 1mws s ILE 133 CO 0.37 0.18 1.65 -0.81 -1.23 0.00 0.00 174.94 175.10 1mws n PRO 134 N 5.20 2.28 0.00 2.79 -0.04 -1.23 -1.57 135.00 142.44 1mws n PRO 134 Ca -0.06 0.82 0.00 0.00 -0.04 0.00 0.00 63.50 64.23 1mws n PRO 134 Cb 0.50 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.34 1mws n PRO 134 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1mws n GLY 135 N 3.66 2.17 3.77 0.55 0.00 -1.26 -4.99 105.19 109.08 1mws n GLY 135 Ca 0.18 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1mws n GLY 135 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1mws s MET 136 N 0.00 3.86 0.16 1.61 0.00 -0.61 -4.94 119.30 119.38 1mws s MET 136 Ca 0.00 2.16 0.02 0.00 0.00 0.00 0.00 55.69 57.87 1mws s MET 136 Cb 0.00 -2.68 -0.01 0.00 0.00 0.00 0.00 34.83 32.14 1mws s MET 136 CO 0.00 -0.59 0.06 1.04 0.00 0.00 0.00 175.02 175.54 1mws n GLN 137 N -0.04 0.72 -1.64 4.11 6.02 -1.26 -2.55 117.38 122.73 1mws n GLN 137 Ca 0.05 -1.34 -0.34 0.00 -0.01 0.00 0.00 57.00 55.36 1mws n GLN 137 Cb 0.44 0.77 0.06 0.00 1.02 0.00 0.00 30.24 32.54 1mws n GLN 137 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1mws s LYS 138 N -2.60 2.54 -1.39 -1.09 3.01 -1.26 -3.77 119.74 115.18 1mws s LYS 138 Ca 0.09 1.57 -0.10 0.00 -1.01 0.00 0.00 55.97 56.52 1mws s LYS 138 Cb 0.00 -1.90 0.03 0.00 -1.01 0.00 0.00 37.83 34.95 1mws s LYS 138 CO 0.06 -1.49 1.13 -0.25 0.51 0.00 0.00 175.35 175.32 1mws n ASP 139 N -2.48 -5.82 -4.25 2.83 8.00 -1.26 -4.95 116.55 108.62 1mws n ASP 139 Ca 0.12 -0.60 -0.14 0.00 0.71 0.00 0.00 54.79 54.88 1mws n ASP 139 Cb 0.51 -4.77 -0.10 0.00 -0.02 0.00 0.00 41.12 36.74 1mws n ASP 139 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1mws s GLN 140 N -6.35 1.22 0.16 -1.24 -0.21 -1.25 -1.31 119.66 110.69 1mws s GLN 140 Ca 0.58 -1.62 -0.04 0.00 0.02 0.00 0.00 55.36 54.29 1mws s GLN 140 Cb -0.26 -0.12 -0.03 0.00 1.00 0.00 0.00 33.01 33.60 1mws s GLN 140 CO 0.75 -0.25 0.16 -1.54 -2.12 0.00 0.00 175.29 172.30 1mws s SER 141 N -3.21 0.17 -0.23 5.90 1.04 -0.33 -4.86 113.70 112.19 1mws s SER 141 Ca 0.32 -1.14 -0.13 0.00 0.48 0.00 0.00 55.95 55.47 1mws s SER 141 Cb 0.07 0.37 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 1mws s SER 141 CO 0.09 -0.83 0.29 -0.63 0.98 0.00 0.00 173.24 173.14 1mws s ILE 142 N -4.05 5.27 -0.01 -1.02 -1.09 -1.26 -0.80 121.20 118.23 1mws s ILE 142 Ca 0.25 0.46 0.01 0.00 -2.23 0.00 0.00 60.65 59.14 1mws s ILE 142 Cb 0.06 -3.62 -0.04 0.00 -1.58 0.00 0.00 42.46 37.28 1mws s ILE 142 CO 0.04 0.28 -0.01 -1.00 -1.23 0.00 0.00 174.94 173.02 1mws s HIS 143 N 1.32 3.06 -0.20 3.97 3.76 0.17 -4.95 115.29 122.43 1mws s HIS 143 Ca 0.13 0.08 -0.01 0.00 -0.15 0.00 0.00 55.06 55.12 1mws s HIS 143 Cb -0.14 -1.68 0.05 0.00 1.11 0.00 0.00 32.58 31.92 1mws s HIS 143 CO 0.07 0.45 -0.02 0.42 -0.85 0.00 0.00 174.74 174.80 1mws s ILE 144 N -1.04 1.07 0.08 0.60 1.01 -1.26 -0.85 121.20 120.81 1mws s ILE 144 Ca 0.18 -0.81 0.09 0.00 0.00 0.00 0.00 60.65 60.11 1mws s ILE 144 Cb -0.11 -1.38 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 1mws s ILE 144 CO 0.09 -0.06 -0.22 -1.61 0.00 0.00 0.00 174.94 173.14 1mws s GLU 145 N 1.62 1.78 0.10 2.79 0.41 -0.17 -4.99 118.70 120.25 1mws s GLU 145 Ca -0.02 -1.15 -0.18 0.00 -0.41 0.00 0.00 54.97 53.21 1mws s GLU 145 Cb -0.17 -2.05 -0.07 0.00 -1.78 0.00 0.00 34.13 30.06 1mws s GLU 145 CO -0.07 0.50 0.58 1.21 -0.49 0.00 0.00 175.26 176.98 1mws s ASN 146 N -1.69 7.01 -0.49 -0.19 2.47 -1.26 -1.61 114.94 119.18 1mws s ASN 146 Ca 0.14 1.23 -0.02 0.00 0.42 0.00 0.00 52.86 54.63 1mws s ASN 146 Cb -0.10 -2.35 0.13 0.00 -1.45 0.00 0.00 41.25 37.48 1mws s ASN 146 CO 0.06 0.21 0.28 -0.76 -3.72 0.00 0.00 177.10 173.18 1mws s LEU 147 N -1.38 5.20 0.19 3.21 1.43 0.24 -4.89 118.68 122.67 1mws s LEU 147 Ca 0.32 -2.36 -0.33 0.00 -1.03 0.00 0.00 54.13 50.74 1mws s LEU 147 Cb -0.18 -1.83 -0.13 0.00 0.03 0.00 0.00 46.19 44.08 1mws s LEU 147 CO 0.19 -0.47 1.62 1.17 0.23 0.00 0.00 176.35 179.10 1mws n LYS 148 N 4.15 2.38 -4.22 1.70 3.00 -1.26 -0.53 118.16 123.37 1mws n LYS 148 Ca 0.02 0.86 -0.25 0.00 -0.00 0.00 0.00 58.31 58.94 1mws n LYS 148 Cb 0.40 -2.65 -0.08 0.00 0.00 0.00 0.00 35.03 32.70 1mws n LYS 148 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1mws s SER 149 N 0.96 4.36 0.02 3.14 1.04 -1.26 -4.89 113.70 117.07 1mws s SER 149 Ca 0.77 -1.01 0.02 0.00 0.48 0.00 0.00 55.95 56.21 1mws s SER 149 Cb -0.61 -0.54 -0.01 0.00 0.10 0.00 0.00 66.02 64.96 1mws s SER 149 CO 0.37 -0.40 -0.08 -1.61 0.98 0.00 0.00 173.24 172.50 1mws s GLU 150 N -3.82 0.56 0.56 4.02 2.02 -1.26 -4.89 118.70 115.88 1mws s GLU 150 Ca 0.38 -0.51 -0.20 0.00 0.02 0.00 0.00 54.97 54.65 1mws s GLU 150 Cb 0.02 -0.46 -0.04 0.00 0.10 0.00 0.00 34.13 33.75 1mws s GLU 150 CO 0.21 0.11 1.25 0.50 0.02 0.00 0.00 175.26 177.35 1mws s ARG 151 N -0.88 3.14 0.75 1.61 3.52 -1.26 0.32 118.95 126.16 1mws s ARG 151 Ca -0.03 1.94 -0.12 0.00 -0.13 0.00 0.00 55.73 57.39 1mws s ARG 151 Cb -0.06 -2.10 0.05 0.00 -1.56 0.00 0.00 34.95 31.28 1mws s ARG 151 CO 0.00 -1.10 1.12 0.20 -0.81 0.00 0.00 175.30 174.71 1mws s GLY 152 N -1.36 1.90 0.49 8.12 0.00 -0.53 -4.61 107.32 111.33 1mws s GLY 152 Ca 0.74 0.48 -0.04 0.00 0.00 0.00 0.00 44.72 45.89 1mws s GLY 152 CO 0.38 0.84 0.78 0.54 0.00 0.00 0.00 173.10 175.64 1mws s LYS 153 N -4.50 3.39 -0.19 2.90 1.02 -1.26 -4.86 119.74 116.24 1mws s LYS 153 Ca 0.65 0.07 -0.01 0.00 0.02 0.00 0.00 55.97 56.70 1mws s LYS 153 Cb -0.20 -2.39 0.00 0.00 -0.52 0.00 0.00 37.83 34.72 1mws s LYS 153 CO 0.51 -0.27 -0.12 0.42 -0.92 0.00 0.00 175.35 174.96 1mws s ILE 154 N -2.74 2.79 0.19 2.17 1.01 -0.80 -0.79 121.20 123.02 1mws s ILE 154 Ca 0.48 -0.70 0.08 0.00 0.00 0.00 0.00 60.65 60.51 1mws s ILE 154 Cb -0.10 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 1mws s ILE 154 CO 0.44 0.48 -0.06 -0.76 0.00 0.00 0.00 174.94 175.04 1mws s LEU 155 N 1.25 3.10 0.85 2.97 1.43 0.61 -0.91 118.68 127.99 1mws s LEU 155 Ca 0.03 -0.53 -0.08 0.00 -1.03 0.00 0.00 54.13 52.53 1mws s LEU 155 Cb -0.14 -1.76 0.18 0.00 0.03 0.00 0.00 46.19 44.50 1mws s LEU 155 CO -0.06 0.09 1.16 1.51 0.23 0.00 0.00 176.35 179.28 1mws s ASP 156 N -2.95 3.65 0.66 2.29 3.84 0.15 -0.04 116.67 124.27 1mws s ASP 156 Ca 0.26 -0.18 0.42 0.00 -0.00 0.00 0.00 52.55 53.06 1mws s ASP 156 Cb -0.09 0.02 2.31 0.00 -1.38 0.00 0.00 42.92 43.78 1mws s ASP 156 CO 0.17 -2.35 2.32 0.08 -0.00 0.00 0.00 175.17 175.38 1mws h ARG 157 N -1.09 0.00 -0.20 2.11 0.11 -0.46 -1.85 114.38 113.00 1mws h ARG 157 Ca -0.39 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.60 1mws h ARG 157 Cb 1.24 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 32.27 1mws h ARG 157 CO 0.36 0.00 -0.21 0.09 0.10 0.00 0.00 179.97 180.31 1mws n ASN 158 N -3.14 2.30 -1.20 0.08 3.02 -1.26 -4.95 115.26 110.11 1mws n ASN 158 Ca -0.03 -3.72 -0.15 0.00 -0.03 0.00 0.00 54.58 50.65 1mws n ASN 158 Cb 0.11 -0.58 -0.06 0.00 -0.61 0.00 0.00 39.78 38.63 1mws n ASN 158 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1mws n ASN 159 N -1.11 -4.84 -4.74 6.41 3.02 -0.70 -4.99 115.26 108.33 1mws n ASN 159 Ca 0.26 0.36 -0.41 0.00 -0.03 0.00 0.00 54.58 54.76 1mws n ASN 159 Cb 0.88 -3.70 -0.04 0.00 -0.61 0.00 0.00 39.78 36.32 1mws n ASN 159 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1mws s VAL 160 N -2.58 3.72 -0.06 2.41 1.01 -1.26 -4.73 120.40 118.92 1mws s VAL 160 Ca 0.00 1.45 -0.30 0.00 0.00 0.00 0.00 61.98 63.13 1mws s VAL 160 Cb 0.00 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1mws s VAL 160 CO 0.00 0.23 1.10 -1.61 0.00 0.00 0.00 175.10 174.82 1mws s GLU 161 N -0.21 4.41 -0.05 2.72 2.02 -1.26 -0.67 118.70 125.66 1mws s GLU 161 Ca 0.52 1.54 0.14 0.00 0.02 0.00 0.00 54.97 57.19 1mws s GLU 161 Cb -0.31 -3.52 -0.21 0.00 0.10 0.00 0.00 34.13 30.19 1mws s GLU 161 CO 0.35 -0.33 0.25 1.28 0.02 0.00 0.00 175.26 176.83 1mws n LEU 162 N 4.86 0.00 -3.68 1.80 4.77 -0.08 -4.52 117.00 120.15 1mws n LEU 162 Ca 0.09 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.98 1mws n LEU 162 Cb 0.48 0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.55 1mws n LEU 162 CO 0.54 0.09 0.05 0.00 -1.33 0.00 0.00 177.39 176.74 1mws s ALA 163 N -2.83 -1.11 0.08 -1.18 0.00 -1.00 -3.96 121.76 111.75 1mws s ALA 163 Ca -0.06 1.55 -0.04 0.00 0.00 0.00 0.00 51.96 53.41 1mws s ALA 163 Cb 0.08 -1.07 0.01 0.00 0.00 0.00 0.00 23.12 22.14 1mws s ALA 163 CO 0.59 -0.43 0.20 0.27 0.00 0.00 0.00 175.76 176.39 1mws n ASN 164 N 4.63 -0.49 -4.65 0.00 0.23 -0.29 -1.91 115.26 112.79 1mws n ASN 164 Ca -0.18 -1.32 -0.41 0.00 -0.53 0.00 0.00 54.58 52.14 1mws n ASN 164 Cb 0.53 0.81 -0.06 0.00 -2.08 0.00 0.00 39.78 38.99 1mws n ASN 164 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1mws s THR 165 N -2.69 4.97 0.00 5.53 2.01 -1.26 0.70 115.64 124.89 1mws s THR 165 Ca 0.04 1.28 0.00 0.00 0.31 0.00 0.00 61.69 63.32 1mws s THR 165 Cb -0.01 -3.99 0.00 0.00 0.01 0.00 0.00 72.50 68.51 1mws s THR 165 CO 0.02 0.05 0.00 0.61 -0.69 0.00 0.00 174.62 174.61 1mws n GLY 166 N 3.87 6.17 3.35 4.40 0.00 -0.11 -4.84 105.19 118.03 1mws n GLY 166 Ca 0.01 -1.68 -0.30 0.00 0.00 0.00 0.00 46.02 44.04 1mws n GLY 166 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mws s THR 167 N 0.66 2.20 0.21 2.61 2.01 -1.26 -1.42 115.64 120.64 1mws s THR 167 Ca 0.00 -1.34 -0.06 0.00 0.31 0.00 0.00 61.69 60.60 1mws s THR 167 Cb 0.00 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.63 1mws s THR 167 CO 0.00 0.39 0.27 0.00 -0.69 0.00 0.00 174.62 174.59 1mws s ALA 168 N -0.80 0.55 -0.05 7.40 0.00 -0.28 -4.86 121.76 123.72 1mws s ALA 168 Ca 0.12 -1.33 0.06 0.00 0.00 0.00 0.00 51.96 50.81 1mws s ALA 168 Cb -0.10 1.22 -0.01 0.00 0.00 0.00 0.00 23.12 24.22 1mws s ALA 168 CO 0.02 -0.69 -0.25 0.71 0.00 0.00 0.00 175.76 175.55 1mws s TYR 169 N -4.09 2.34 -0.20 0.00 1.51 0.85 -0.43 117.35 117.33 1mws s TYR 169 Ca 0.31 -0.62 -0.13 0.00 -1.01 0.00 0.00 57.07 55.61 1mws s TYR 169 Cb 0.04 -1.53 -0.05 0.00 -0.11 0.00 0.00 41.96 40.32 1mws s TYR 169 CO 0.10 -0.16 0.27 -1.21 -1.11 0.00 0.00 175.55 173.44 1mws s GLU 170 N -0.28 4.18 -0.13 -0.62 2.02 0.34 0.37 118.70 124.57 1mws s GLU 170 Ca 0.00 -0.00 -0.03 0.00 0.02 0.00 0.00 54.97 54.96 1mws s GLU 170 Cb -0.12 -3.49 -0.03 0.00 0.10 0.00 0.00 34.13 30.58 1mws s GLU 170 CO 0.02 0.11 -0.01 0.42 0.02 0.00 0.00 175.26 175.82 1mws s ILE 171 N 0.88 4.15 0.00 -1.63 1.01 0.16 -0.09 121.20 125.68 1mws s ILE 171 Ca 0.14 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.51 1mws s ILE 171 Cb -0.13 -2.80 0.00 0.00 0.01 0.00 0.00 42.46 39.54 1mws s ILE 171 CO 0.05 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.13 1mws n GLY 172 N 3.02 2.35 3.12 6.18 0.00 -0.06 -0.40 105.19 119.40 1mws n GLY 172 Ca -0.18 -0.86 -0.23 0.00 0.00 0.00 0.00 46.02 44.75 1mws n GLY 172 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mws s ILE 173 N -2.90 1.22 -0.30 -0.61 1.01 -0.30 -0.34 121.20 118.97 1mws s ILE 173 Ca 0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 59.91 1mws s ILE 173 Cb 0.00 -1.02 -0.01 0.00 0.01 0.00 0.00 42.46 41.44 1mws s ILE 173 CO 0.00 0.35 0.13 -0.69 0.00 0.00 0.00 174.94 174.73 1mws s VAL 174 N -0.29 4.53 0.22 2.92 1.01 -1.26 -0.45 120.40 127.07 1mws s VAL 174 Ca 0.04 -0.39 -0.13 0.00 0.00 0.00 0.00 61.98 61.51 1mws s VAL 174 Cb -0.07 -3.28 0.27 0.00 0.00 0.00 0.00 36.38 33.31 1mws s VAL 174 CO -0.00 0.12 1.37 -2.65 0.00 0.00 0.00 175.10 173.94 1mws n PRO 175 N 4.97 -0.17 0.23 2.72 -0.02 -1.23 -0.42 135.00 141.07 1mws n PRO 175 Ca -0.14 1.37 0.14 0.00 -2.02 0.00 0.00 63.50 62.84 1mws n PRO 175 Cb 0.49 -2.03 0.73 0.00 -0.02 0.00 0.00 33.50 32.68 1mws n PRO 175 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1mws h LYS 176 N 0.00 0.00 0.00 -0.52 2.10 -1.60 -2.47 116.57 114.08 1mws h LYS 176 Ca 0.34 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.96 1mws h LYS 176 Cb 0.56 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.89 1mws h LYS 176 CO -0.89 0.00 -1.96 0.09 -2.00 0.00 0.00 179.45 174.70 1mws n ASN 177 N -2.51 0.07 -4.33 7.07 3.02 0.43 -4.99 115.26 114.03 1mws n ASN 177 Ca -0.02 0.03 -0.32 0.00 -0.03 0.00 0.00 54.58 54.24 1mws n ASN 177 Cb 0.15 1.79 -0.15 0.00 -0.61 0.00 0.00 39.78 40.95 1mws n ASN 177 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1mws s VAL 178 N -3.42 2.61 0.05 2.41 1.01 -0.93 -4.82 120.40 117.31 1mws s VAL 178 Ca -0.08 -0.84 -0.28 0.00 0.00 0.00 0.00 61.98 60.78 1mws s VAL 178 Cb 0.13 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 1mws s VAL 178 CO 0.89 0.55 0.87 -0.44 0.00 0.00 0.00 175.10 176.98 1mws s SER 179 N 0.04 7.32 0.12 3.32 0.01 -1.26 -4.90 113.70 118.34 1mws s SER 179 Ca -0.07 1.58 0.09 0.00 1.31 0.00 0.00 55.95 58.86 1mws s SER 179 Cb -0.15 -2.52 0.47 0.00 0.21 0.00 0.00 66.02 64.02 1mws s SER 179 CO 0.05 -0.09 1.27 0.29 0.41 0.00 0.00 173.24 175.18 1mws n LYS 180 N 3.14 0.05 -0.02 12.44 5.02 -1.26 -0.63 118.16 136.90 1mws n LYS 180 Ca 0.01 0.53 -0.04 0.00 -2.02 0.00 0.00 58.31 56.79 1mws n LYS 180 Cb 0.50 -1.67 0.18 0.00 -0.02 0.00 0.00 35.03 34.03 1mws n LYS 180 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1mws h LYS 181 N 0.00 0.58 0.00 1.97 1.57 -2.05 -2.90 116.57 115.75 1mws h LYS 181 Ca 0.00 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1mws h LYS 181 Cb 0.02 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1mws h LYS 181 CO 0.00 0.74 0.00 -0.25 -0.57 0.00 0.00 179.45 179.37 1mws n ASP 182 N -4.15 0.00 -0.08 0.86 8.00 0.19 -4.15 116.55 117.22 1mws n ASP 182 Ca 0.00 0.08 -0.07 0.00 0.71 0.00 0.00 54.79 55.51 1mws n ASP 182 Cb 0.38 -0.35 -0.00 0.00 -0.02 0.00 0.00 41.12 41.12 1mws n ASP 182 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 1mws h TYR 183 N 0.00 -0.52 -0.36 1.24 -1.99 -1.60 0.69 116.97 114.44 1mws h TYR 183 Ca 0.00 0.04 0.08 0.00 2.00 0.00 0.00 58.73 60.85 1mws h TYR 183 Cb 0.33 0.28 -0.09 0.00 2.00 0.00 0.00 36.73 39.26 1mws h TYR 183 CO 0.00 -0.28 -0.29 0.87 -0.00 0.00 0.00 178.16 178.46 1mws h LYS 184 N -0.17 -0.23 -0.69 4.88 1.57 -1.81 0.28 116.57 120.39 1mws h LYS 184 Ca 0.16 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.93 1mws h LYS 184 Cb 0.42 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 1mws h LYS 184 CO -0.42 -0.16 0.33 0.00 -0.57 0.00 0.00 179.45 178.63 1mws h ALA 185 N 0.81 0.89 -0.12 3.86 0.00 -1.68 -1.91 119.26 121.10 1mws h ALA 185 Ca 0.17 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1mws h ALA 185 Cb 0.51 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1mws h ALA 185 CO -0.50 0.46 0.06 0.82 0.00 0.00 0.00 179.25 180.10 1mws h ILE 186 N 0.96 1.10 -0.21 0.00 2.04 0.56 -1.47 117.51 120.49 1mws h ILE 186 Ca 0.24 -0.28 0.04 0.00 1.00 0.00 0.00 64.86 65.85 1mws h ILE 186 Cb 0.13 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1mws h ILE 186 CO -0.03 0.09 -0.03 0.00 0.00 0.00 0.00 178.15 178.18 1mws h ALA 187 N 0.95 0.16 0.00 1.87 0.00 -0.40 -1.22 119.26 120.62 1mws h ALA 187 Ca 0.04 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1mws h ALA 187 Cb 0.09 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1mws h ALA 187 CO -0.01 -0.45 -0.33 -0.22 0.00 0.00 0.00 179.25 178.24 1mws h LYS 188 N 0.03 -0.47 -0.97 0.00 3.64 -1.20 -0.29 116.57 117.32 1mws h LYS 188 Ca 0.10 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.56 1mws h LYS 188 Cb 0.14 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.01 1mws h LYS 188 CO -0.19 -0.31 0.63 1.49 -2.27 0.00 0.00 179.45 178.79 1mws h GLU 189 N -0.48 1.16 -0.51 1.90 4.57 -0.99 -2.42 114.58 117.80 1mws h GLU 189 Ca 0.06 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1mws h GLU 189 Cb 0.57 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1mws h GLU 189 CO -0.27 0.76 0.00 1.28 -1.18 0.00 0.00 179.01 179.60 1mws n LEU 190 N -4.49 2.52 -4.02 1.64 4.77 -0.48 -4.94 117.00 112.00 1mws n LEU 190 Ca 0.14 -1.27 -0.29 0.00 -0.03 0.00 0.00 56.01 54.55 1mws n LEU 190 Cb 0.13 -0.36 -0.01 0.00 -2.33 0.00 0.00 43.42 40.84 1mws n LEU 190 CO 0.33 0.50 -0.10 -1.20 -1.33 0.00 0.00 177.39 175.59 1mws n SER 191 N 0.55 -2.03 -4.27 -1.43 7.64 -0.20 -4.98 113.62 108.90 1mws n SER 191 Ca 0.14 -0.96 -0.15 0.00 1.01 0.00 0.00 58.87 58.91 1mws n SER 191 Cb 0.46 -3.15 -0.10 0.00 -1.01 0.00 0.00 64.21 60.41 1mws n SER 191 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1mws s ILE 192 N -3.62 0.95 0.36 0.44 -4.36 -0.72 -4.64 121.20 109.61 1mws s ILE 192 Ca 0.34 -2.02 -0.17 0.00 -0.26 0.00 0.00 60.65 58.54 1mws s ILE 192 Cb -0.18 -2.11 -0.10 0.00 1.25 0.00 0.00 42.46 41.32 1mws s ILE 192 CO 0.89 -0.51 0.82 -0.94 0.24 0.00 0.00 174.94 175.43 1mws s SER 193 N -3.22 6.84 0.37 4.36 1.04 -1.26 -4.24 113.70 117.60 1mws s SER 193 Ca 0.23 1.44 0.10 0.00 0.48 0.00 0.00 55.95 58.20 1mws s SER 193 Cb 0.05 -2.44 0.73 0.00 0.10 0.00 0.00 66.02 64.46 1mws s SER 193 CO 0.04 -0.26 1.87 -0.08 0.98 0.00 0.00 173.24 175.79 1mws h GLU 194 N 2.14 0.18 -0.52 4.02 4.81 -1.93 -0.08 114.58 123.21 1mws h GLU 194 Ca -0.48 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.63 1mws h GLU 194 Cb 1.18 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 1mws h GLU 194 CO 0.64 0.40 0.07 -0.44 -0.73 0.00 0.00 179.01 178.95 1mws h ASP 195 N 0.17 0.78 0.36 1.04 5.19 -1.99 -0.50 116.42 121.47 1mws h ASP 195 Ca 0.03 -0.16 -0.02 0.00 -0.62 0.00 0.00 57.03 56.26 1mws h ASP 195 Cb 0.49 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.80 1mws h ASP 195 CO 0.03 0.80 -0.17 0.22 -3.12 0.00 0.00 179.24 177.00 1mws h TYR 196 N 0.78 -0.45 -0.21 4.55 3.20 -1.41 0.40 116.97 123.83 1mws h TYR 196 Ca 0.16 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.07 1mws h TYR 196 Cb 0.36 0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.74 1mws h TYR 196 CO 0.02 -0.27 -0.09 0.82 -1.64 0.00 0.00 178.16 177.00 1mws h ILE 197 N -0.50 0.71 -0.68 1.81 2.04 -1.14 -0.82 117.51 118.94 1mws h ILE 197 Ca -0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.87 1mws h ILE 197 Cb 0.38 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 1mws h ILE 197 CO 0.08 0.00 0.45 0.11 0.00 0.00 0.00 178.15 178.79 1mws h LYS 198 N -0.05 0.68 -0.27 2.37 1.57 -0.80 -2.18 116.57 117.89 1mws h LYS 198 Ca 0.11 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 1mws h LYS 198 Cb 0.22 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1mws h LYS 198 CO -0.25 0.45 -0.10 0.37 -0.57 0.00 0.00 179.45 179.35 1mws h GLN 199 N 0.70 0.54 -0.79 3.15 5.75 0.18 -2.60 115.11 122.04 1mws h GLN 199 Ca 0.29 -0.22 -0.04 0.00 -0.15 0.00 0.00 58.65 58.52 1mws h GLN 199 Cb 0.24 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.73 1mws h GLN 199 CO -0.09 0.77 0.34 1.96 -2.65 0.00 0.00 178.83 179.16 1mws h GLN 200 N 0.28 1.17 0.00 1.69 1.08 -0.72 -2.01 115.11 116.61 1mws h GLN 200 Ca 0.06 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 57.06 1mws h GLN 200 Cb 0.59 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1mws h GLN 200 CO 0.03 0.94 0.00 0.52 -0.95 0.00 0.00 178.83 179.37 1mws h MET 201 N 1.15 0.00 0.00 1.46 2.86 -1.40 -3.11 114.93 115.89 1mws h MET 201 Ca 0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.91 1mws h MET 201 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1mws h MET 201 CO -0.03 0.00 -0.14 0.22 1.06 0.00 0.00 176.91 178.03 1mws h ASP 202 N 0.00 0.00 -1.98 1.22 3.58 -0.95 -3.46 116.42 114.83 1mws h ASP 202 Ca 0.00 -0.02 -0.62 0.00 0.42 0.00 0.00 57.03 56.81 1mws h ASP 202 Cb 0.46 0.00 0.13 0.00 1.72 0.00 0.00 39.33 41.64 1mws h ASP 202 CO 0.00 0.01 -0.36 0.00 -2.88 0.00 0.00 179.24 176.01 1mws n GLN 203 N -2.71 0.56 0.02 0.28 6.02 -1.18 -4.85 117.38 115.52 1mws n GLN 203 Ca 0.04 0.20 0.05 0.00 -0.01 0.00 0.00 57.00 57.28 1mws n GLN 203 Cb 0.49 -1.41 0.45 0.00 1.02 0.00 0.00 30.24 30.79 1mws n GLN 203 CO 0.00 0.00 0.00 -2.95 -1.01 0.00 0.00 177.06 173.10 1mws h ASN 204 N 1.08 0.43 0.54 1.08 7.08 -1.93 -2.50 115.58 121.35 1mws h ASN 204 Ca -0.37 -0.01 0.00 0.00 -3.08 0.00 0.00 56.30 52.84 1mws h ASN 204 Cb 1.40 -0.11 0.00 0.00 -2.08 0.00 0.00 38.32 37.53 1mws h ASN 204 CO 0.55 0.31 0.00 -2.67 -2.08 0.00 0.00 177.43 173.53 1mws n TRP 205 N -4.48 0.00 -2.33 4.14 4.27 -1.26 -4.81 117.44 112.97 1mws n TRP 205 Ca 0.03 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.21 1mws n TRP 205 Cb 0.07 -0.29 -0.02 0.00 -1.36 0.00 0.00 31.31 29.71 1mws n TRP 205 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 1mws s VAL 206 N -2.58 3.98 0.45 -1.67 1.01 -0.95 -5.01 120.40 115.64 1mws s VAL 206 Ca 0.26 1.09 0.07 0.00 0.00 0.00 0.00 61.98 63.41 1mws s VAL 206 Cb 0.19 -4.04 0.02 0.00 0.00 0.00 0.00 36.38 32.55 1mws s VAL 206 CO 0.43 -0.47 0.62 -1.10 0.00 0.00 0.00 175.10 174.58 1mws s GLN 207 N 4.44 2.73 0.55 2.72 -1.52 -1.26 -4.99 119.66 122.33 1mws s GLN 207 Ca 0.61 -1.21 0.22 0.00 -1.95 0.00 0.00 55.36 53.03 1mws s GLN 207 Cb -0.18 -2.71 1.49 0.00 -0.22 0.00 0.00 33.01 31.39 1mws s GLN 207 CO 0.26 -0.40 2.19 0.22 -0.25 0.00 0.00 175.29 177.31 1mws h ASP 208 N 0.51 0.00 -0.34 5.90 3.58 -1.99 -2.27 116.42 121.81 1mws h ASP 208 Ca -0.39 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.06 1mws h ASP 208 Cb 1.28 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.33 1mws h ASP 208 CO 0.46 0.00 0.00 -0.90 -2.88 0.00 0.00 179.24 175.92 1mws n ASP 209 N -4.26 4.30 -4.76 2.28 5.75 -1.26 -1.46 116.55 117.14 1mws n ASP 209 Ca -0.03 -2.96 -0.38 0.00 -0.01 0.00 0.00 54.79 51.41 1mws n ASP 209 Cb 0.10 -0.57 -0.06 0.00 -1.03 0.00 0.00 41.12 39.56 1mws n ASP 209 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1mws s THR 210 N -2.74 5.09 0.03 2.12 2.01 -0.85 -4.97 115.64 116.33 1mws s THR 210 Ca 0.45 0.96 -0.30 0.00 0.31 0.00 0.00 61.69 63.11 1mws s THR 210 Cb 0.35 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 69.02 1mws s THR 210 CO 0.11 0.41 1.06 0.12 -0.69 0.00 0.00 174.62 175.64 1mws s PHE 211 N 0.01 3.58 -0.24 4.92 5.36 -1.26 -3.95 117.98 126.40 1mws s PHE 211 Ca 0.26 1.55 0.01 0.00 -0.96 0.00 0.00 56.93 57.79 1mws s PHE 211 Cb -0.16 -3.23 0.06 0.00 -0.34 0.00 0.00 43.02 39.34 1mws s PHE 211 CO 0.12 -0.50 -0.07 0.08 -1.46 0.00 0.00 175.22 173.39 1mws s VAL 212 N 0.99 1.69 0.35 3.12 1.01 0.40 -4.96 120.40 122.99 1mws s VAL 212 Ca 0.54 -1.30 -0.28 0.00 0.00 0.00 0.00 61.98 60.95 1mws s VAL 212 Cb -0.24 -1.90 -0.10 0.00 0.00 0.00 0.00 36.38 34.14 1mws s VAL 212 CO 0.29 -0.06 1.29 -2.16 0.00 0.00 0.00 175.10 174.46 1mws s PRO 213 N 1.33 4.28 -0.06 2.72 0.04 -1.26 -1.15 135.00 140.90 1mws s PRO 213 Ca -0.06 2.17 0.01 0.00 0.04 0.00 0.00 61.00 63.15 1mws s PRO 213 Cb -0.19 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 1mws s PRO 213 CO -0.06 -0.23 -0.05 1.28 0.04 0.00 0.00 177.00 177.98 1mws n LEU 214 N 0.65 2.88 -3.66 -3.56 4.77 0.46 -4.92 117.00 113.63 1mws n LEU 214 Ca 0.01 -0.03 -0.15 0.00 -0.03 0.00 0.00 56.01 55.80 1mws n LEU 214 Cb 0.42 -0.20 -0.08 0.00 -2.33 0.00 0.00 43.42 41.24 1mws n LEU 214 CO 0.58 0.58 0.20 -0.75 -1.33 0.00 0.00 177.39 176.67 1mws s LYS 215 N -2.12 0.83 -0.10 3.23 2.20 -0.84 -5.01 119.74 117.94 1mws s LYS 215 Ca -0.08 0.03 -0.00 0.00 -0.36 0.00 0.00 55.97 55.56 1mws s LYS 215 Cb 0.02 0.38 -0.03 0.00 -1.51 0.00 0.00 37.83 36.69 1mws s LYS 215 CO 0.14 -0.24 -0.08 0.99 -0.36 0.00 0.00 175.35 175.80 1mws s THR 216 N -1.22 3.60 0.12 3.43 2.01 -1.26 0.38 115.64 122.71 1mws s THR 216 Ca -0.12 -0.50 0.07 0.00 0.31 0.00 0.00 61.69 61.45 1mws s THR 216 Cb -0.03 -2.50 -0.04 0.00 0.01 0.00 0.00 72.50 69.94 1mws s THR 216 CO 0.07 0.56 -0.17 0.68 -0.69 0.00 0.00 174.62 175.07 1mws s VAL 217 N -0.35 1.50 0.00 3.82 -7.23 0.16 -4.82 120.40 113.48 1mws s VAL 217 Ca 0.05 -1.63 -0.25 0.00 -1.81 0.00 0.00 61.98 58.34 1mws s VAL 217 Cb -0.12 -1.52 -0.18 0.00 0.56 0.00 0.00 36.38 35.12 1mws s VAL 217 CO 0.02 -0.25 1.33 0.50 -0.31 0.00 0.00 175.10 176.39 1mws h LYS 218 N 3.77 0.07 -6.26 4.82 1.63 -1.92 0.24 116.57 118.93 1mws h LYS 218 Ca -0.42 -0.03 -0.60 0.00 -0.85 0.00 0.00 60.65 58.74 1mws h LYS 218 Cb 1.19 -0.00 -0.16 0.00 -0.60 0.00 0.00 32.23 32.66 1mws h LYS 218 CO 0.45 0.49 -0.78 0.15 -3.45 0.00 0.00 179.45 176.32 1mws s LYS 219 N -4.45 1.56 -0.90 1.90 1.02 -1.26 -4.29 119.74 113.32 1mws s LYS 219 Ca -0.15 -1.64 -0.03 0.00 0.02 0.00 0.00 55.97 54.17 1mws s LYS 219 Cb 0.03 -1.70 0.22 0.00 -0.52 0.00 0.00 37.83 35.86 1mws s LYS 219 CO 0.69 0.33 0.80 -1.64 -0.92 0.00 0.00 175.35 174.61 1mws s MET 220 N -3.19 3.34 0.74 1.68 -1.94 -1.26 -4.96 119.30 113.71 1mws s MET 220 Ca 0.25 -3.23 -0.13 0.00 -1.71 0.00 0.00 55.69 50.87 1mws s MET 220 Cb -0.06 -4.01 0.04 0.00 2.01 0.00 0.00 34.83 32.81 1mws s MET 220 CO 0.12 -1.26 1.12 0.16 -0.01 0.00 0.00 175.02 175.16 1mws s ASP 221 N 0.08 4.52 0.46 3.03 3.84 -1.26 -4.73 116.67 122.61 1mws s ASP 221 Ca 0.27 2.03 0.21 0.00 -0.00 0.00 0.00 52.55 55.05 1mws s ASP 221 Cb -0.08 -2.55 1.19 0.00 -1.38 0.00 0.00 42.92 40.10 1mws s ASP 221 CO -0.11 -2.03 1.91 1.05 -0.00 0.00 0.00 175.17 175.98 1mws h GLU 222 N -0.60 0.26 0.25 2.11 -0.00 -1.98 -0.07 114.58 114.54 1mws h GLU 222 Ca -0.45 -0.02 -0.01 0.00 -0.00 0.00 0.00 59.36 58.88 1mws h GLU 222 Cb 1.25 -0.06 0.00 0.00 -0.00 0.00 0.00 28.75 29.94 1mws h GLU 222 CO 0.51 0.18 -0.13 1.88 -0.00 0.00 0.00 179.01 181.45 1mws h TYR 223 N 0.27 -0.34 -0.08 2.06 0.05 -2.00 -1.95 116.97 114.98 1mws h TYR 223 Ca 0.39 -0.01 -0.13 0.00 0.05 0.00 0.00 58.73 59.04 1mws h TYR 223 Cb 1.12 0.11 -0.01 0.00 1.01 0.00 0.00 36.73 38.96 1mws h TYR 223 CO -0.00 -0.21 -0.53 1.25 -1.05 0.00 0.00 178.16 177.62 1mws h LEU 224 N -0.35 0.25 -1.24 3.88 5.85 -1.66 -2.76 115.31 119.28 1mws h LEU 224 Ca -0.03 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 1mws h LEU 224 Cb 0.28 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1mws h LEU 224 CO 0.05 0.73 0.32 -1.28 -0.34 0.00 0.00 178.44 177.91 1mws h SER 225 N 0.18 0.75 -0.23 1.25 0.87 -0.84 -1.48 113.55 114.04 1mws h SER 225 Ca 0.00 -0.06 -0.15 0.00 -1.23 0.00 0.00 61.79 60.35 1mws h SER 225 Cb 0.99 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 1mws h SER 225 CO 0.08 0.62 -0.43 0.44 -0.53 0.00 0.00 176.83 177.01 1mws h ASP 226 N 0.85 0.79 -0.87 6.23 3.32 -1.17 -2.34 116.42 123.22 1mws h ASP 226 Ca 0.21 -0.54 0.09 0.00 0.02 0.00 0.00 57.03 56.81 1mws h ASP 226 Cb 0.05 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.30 1mws h ASP 226 CO -0.03 1.18 0.52 0.15 -1.72 0.00 0.00 179.24 179.33 1mws h PHE 227 N 0.43 0.95 -0.43 4.55 3.57 -1.11 -1.36 116.94 123.53 1mws h PHE 227 Ca 0.01 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.45 1mws h PHE 227 Cb 1.03 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 1mws h PHE 227 CO 0.08 0.42 -0.12 0.00 -2.23 0.00 0.00 178.31 176.46 1mws h ALA 228 N 1.45 0.97 -0.00 2.41 0.00 -1.18 -2.19 119.26 120.72 1mws h ALA 228 Ca 0.41 -0.32 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 1mws h ALA 228 Cb 0.31 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1mws h ALA 228 CO -0.22 0.61 -0.72 -0.22 0.00 0.00 0.00 179.25 178.69 1mws h LYS 229 N 0.71 0.03 -0.06 0.00 3.64 -0.84 0.40 116.57 120.45 1mws h LYS 229 Ca 0.12 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.27 1mws h LYS 229 Cb 0.61 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1mws h LYS 229 CO 0.04 0.74 -0.80 0.87 -2.27 0.00 0.00 179.45 178.03 1mws h LYS 230 N 0.02 0.45 -0.34 1.90 1.79 -1.15 -3.26 116.57 115.99 1mws h LYS 230 Ca -0.01 -0.40 0.00 0.00 -2.18 0.00 0.00 60.65 58.06 1mws h LYS 230 Cb 1.28 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 32.02 1mws h LYS 230 CO 0.10 1.05 0.00 1.19 -1.08 0.00 0.00 179.45 180.70 1mws n PHE 231 N -3.82 0.44 -3.12 -1.35 3.72 -0.84 -4.98 117.46 107.50 1mws n PHE 231 Ca -0.05 -0.24 -0.22 0.00 -0.05 0.00 0.00 57.45 56.88 1mws n PHE 231 Cb 0.75 -0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.33 1mws n PHE 231 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1mws n HIS 232 N 1.35 -2.12 -2.24 1.38 8.25 -0.01 -4.78 115.22 117.06 1mws n HIS 232 Ca 0.18 0.62 -0.31 0.00 -0.26 0.00 0.00 57.72 57.94 1mws n HIS 232 Cb 0.57 -4.53 -0.01 0.00 1.12 0.00 0.00 29.99 27.13 1mws n HIS 232 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1mws s LEU 233 N -6.64 3.48 0.02 2.41 1.43 -0.38 -4.66 118.68 114.34 1mws s LEU 233 Ca 0.36 1.39 0.02 0.00 -1.03 0.00 0.00 54.13 54.87 1mws s LEU 233 Cb -0.16 -4.37 -0.04 0.00 0.03 0.00 0.00 46.19 41.65 1mws s LEU 233 CO 0.44 -0.69 0.02 -0.89 0.23 0.00 0.00 176.35 175.46 1mws s THR 234 N -2.85 4.22 -0.05 5.49 2.01 0.54 -4.76 115.64 120.24 1mws s THR 234 Ca 0.55 -0.65 0.05 0.00 0.31 0.00 0.00 61.69 61.95 1mws s THR 234 Cb -0.10 -2.92 -0.02 0.00 0.01 0.00 0.00 72.50 69.46 1mws s THR 234 CO 0.42 0.32 -0.18 0.42 -0.69 0.00 0.00 174.62 174.91 1mws s THR 235 N -1.15 2.69 -0.10 -0.82 -4.23 -1.26 -0.88 115.64 109.89 1mws s THR 235 Ca 0.22 -0.86 -0.01 0.00 -1.18 0.00 0.00 61.69 59.86 1mws s THR 235 Cb -0.12 -2.03 0.03 0.00 1.34 0.00 0.00 72.50 71.73 1mws s THR 235 CO 0.13 0.58 -0.01 0.21 -0.54 0.00 0.00 174.62 174.99 1mws s ASN 236 N -0.57 1.92 0.30 3.99 2.47 0.87 -4.95 114.94 118.98 1mws s ASN 236 Ca 0.08 -0.25 -0.29 0.00 0.42 0.00 0.00 52.86 52.82 1mws s ASN 236 Cb -0.11 -0.54 -0.10 0.00 -1.45 0.00 0.00 41.25 39.04 1mws s ASN 236 CO 0.01 -0.20 1.36 -0.70 -3.72 0.00 0.00 177.10 173.85 1mws s GLU 237 N 1.90 4.31 0.09 0.43 2.12 -1.26 -0.50 118.70 125.79 1mws s GLU 237 Ca 0.04 2.26 -0.05 0.00 0.36 0.00 0.00 54.97 57.58 1mws s GLU 237 Cb -0.13 -3.08 -0.02 0.00 0.26 0.00 0.00 34.13 31.16 1mws s GLU 237 CO -0.06 -0.29 0.11 -0.08 -0.54 0.00 0.00 175.26 174.41 1mws s THR 238 N -0.73 0.15 0.18 -1.70 -1.32 0.43 -4.90 115.64 107.75 1mws s THR 238 Ca 0.53 -1.51 -0.20 0.00 -1.21 0.00 0.00 61.69 59.29 1mws s THR 238 Cb -0.41 -1.57 -0.08 0.00 -1.51 0.00 0.00 72.50 68.94 1mws s THR 238 CO 0.50 -0.69 0.69 -1.61 -2.21 0.00 0.00 174.62 171.31 1mws s GLU 239 N -3.92 4.29 0.03 7.08 2.02 -1.26 -1.13 118.70 125.81 1mws s GLU 239 Ca 0.10 0.88 -0.27 0.00 0.02 0.00 0.00 54.97 55.70 1mws s GLU 239 Cb 0.06 -3.03 0.07 0.00 0.10 0.00 0.00 34.13 31.32 1mws s GLU 239 CO -0.07 0.48 0.62 0.45 0.02 0.00 0.00 175.26 176.76 1mws s SER 240 N -1.45 -0.58 0.12 -0.19 0.15 -0.51 -4.86 113.70 106.38 1mws s SER 240 Ca 0.38 0.40 -0.34 0.00 0.70 0.00 0.00 55.95 57.09 1mws s SER 240 Cb -0.18 0.54 -0.14 0.00 -1.71 0.00 0.00 66.02 64.52 1mws s SER 240 CO 0.22 -0.72 1.57 -1.14 1.20 0.00 0.00 173.24 174.37 1mws n ARG 241 N 0.48 1.99 -4.74 5.44 3.00 -1.26 -0.93 116.66 120.63 1mws n ARG 241 Ca -0.18 0.72 -0.26 0.00 -0.00 0.00 0.00 57.85 58.13 1mws n ARG 241 Cb 0.60 -2.48 -0.14 0.00 0.00 0.00 0.00 32.46 30.44 1mws n ARG 241 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1mws s ASN 242 N 1.16 2.46 -0.32 6.15 2.47 0.22 -4.76 114.94 122.31 1mws s ASN 242 Ca 0.81 -0.48 0.03 0.00 0.42 0.00 0.00 52.86 53.64 1mws s ASN 242 Cb -0.73 -0.22 0.09 0.00 -1.45 0.00 0.00 41.25 38.95 1mws s ASN 242 CO 0.41 0.19 0.03 -0.31 -3.72 0.00 0.00 177.10 173.70 1mws s TYR 243 N -0.71 3.34 0.54 0.43 1.51 -1.26 -1.14 117.35 120.06 1mws s TYR 243 Ca 0.08 -2.68 0.23 0.00 -1.01 0.00 0.00 57.07 53.69 1mws s TYR 243 Cb -0.09 -2.57 1.44 0.00 -0.11 0.00 0.00 41.96 40.64 1mws s TYR 243 CO 0.01 -0.92 2.09 -1.35 -1.11 0.00 0.00 175.55 174.27 1mws h PRO 244 N 7.72 0.00 -0.01 -1.71 0.11 -1.79 -1.74 132.00 134.57 1mws h PRO 244 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1mws h PRO 244 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1mws h PRO 244 CO 0.50 0.00 -0.00 1.28 -0.21 0.00 0.00 178.00 179.57 1mws n LEU 245 N -4.26 1.36 0.00 2.35 4.77 -1.26 -5.01 117.00 114.94 1mws n LEU 245 Ca 0.03 -0.45 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 1mws n LEU 245 Cb 0.33 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1mws n LEU 245 CO 0.33 0.23 0.00 -0.62 -1.33 0.00 0.00 177.39 176.00 1mws n GLU 246 N 0.06 0.00 0.11 3.23 -0.58 -0.66 -1.90 120.64 120.91 1mws n GLU 246 Ca 0.19 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 57.04 1mws n GLU 246 Cb 0.33 0.00 0.47 0.00 -0.57 0.00 0.00 31.44 31.67 1mws n GLU 246 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1mws n LYS 247 N 14.00 0.16 0.20 3.49 5.02 -1.26 -2.72 118.16 137.04 1mws n LYS 247 Ca 0.00 0.44 0.14 0.00 -2.02 0.00 0.00 58.31 56.87 1mws n LYS 247 Cb 0.00 -1.83 0.49 0.00 -0.02 0.00 0.00 35.03 33.67 1mws n LYS 247 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1mws h ALA 248 N 2.25 1.00 0.00 7.82 0.00 -1.75 -3.21 119.26 125.36 1mws h ALA 248 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mws h ALA 248 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1mws h ALA 248 CO 0.00 0.00 -0.05 0.25 0.00 0.00 0.00 179.25 179.45 1mws n THR 249 N -2.74 1.06 -0.07 0.00 -2.24 -1.10 -4.81 114.28 104.38 1mws n THR 249 Ca 0.02 -1.19 -0.07 0.00 -2.27 0.00 0.00 64.05 60.54 1mws n THR 249 Cb 0.35 0.32 -0.01 0.00 -2.10 0.00 0.00 70.33 68.89 1mws n THR 249 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1mws h SER 250 N 0.00 -0.40 -0.43 3.42 0.02 -1.55 -1.76 113.55 112.85 1mws h SER 250 Ca 0.00 0.10 -0.13 0.00 -0.84 0.00 0.00 61.79 60.92 1mws h SER 250 Cb 0.83 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 1mws h SER 250 CO 0.00 -0.15 -0.23 0.45 -1.14 0.00 0.00 176.83 175.76 1mws h HIS 251 N -0.08 1.06 0.37 3.45 3.86 -1.89 -0.82 115.15 121.10 1mws h HIS 251 Ca 0.14 -0.27 -0.02 0.00 -1.16 0.00 0.00 60.37 59.06 1mws h HIS 251 Cb 0.29 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.52 1mws h HIS 251 CO -0.31 1.07 -0.18 1.25 0.86 0.00 0.00 177.93 180.62 1mws h LEU 252 N 0.75 -0.42 0.10 2.43 6.46 -1.82 -3.35 115.31 119.47 1mws h LEU 252 Ca 0.09 -0.08 -0.28 0.00 -0.12 0.00 0.00 57.88 57.50 1mws h LEU 252 Cb 0.80 0.11 0.03 0.00 -0.73 0.00 0.00 40.66 40.87 1mws h LEU 252 CO 0.07 -0.17 -1.15 -0.07 -0.62 0.00 0.00 178.44 176.50 1mws h LEU 253 N -0.66 0.83 0.00 2.25 3.38 -1.39 -0.40 115.31 119.31 1mws h LEU 253 Ca -0.05 -0.82 0.00 0.00 0.09 0.00 0.00 57.88 57.10 1mws h LEU 253 Cb 0.48 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1mws h LEU 253 CO 0.08 1.56 0.00 0.61 0.09 0.00 0.00 178.44 180.79 1mws n GLY 254 N 1.36 0.22 3.75 0.83 0.00 -0.31 -1.51 105.19 109.53 1mws n GLY 254 Ca -0.13 -0.99 -0.03 0.00 0.00 0.00 0.00 46.02 44.86 1mws n GLY 254 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mws s TYR 255 N 0.00 -0.10 0.26 1.61 -0.85 -1.22 -4.95 117.35 112.09 1mws s TYR 255 Ca 0.00 -0.19 0.10 0.00 -0.52 0.00 0.00 57.07 56.47 1mws s TYR 255 Cb 0.00 0.63 -0.05 0.00 0.38 0.00 0.00 41.96 42.93 1mws s TYR 255 CO 0.00 -0.78 -0.09 0.14 -1.52 0.00 0.00 175.55 173.31 1mws s VAL 256 N -3.11 3.06 0.16 -3.49 -7.23 -1.26 0.16 120.40 108.69 1mws s VAL 256 Ca 0.13 -2.04 -0.24 0.00 -1.81 0.00 0.00 61.98 58.01 1mws s VAL 256 Cb -0.01 -2.61 0.06 0.00 0.56 0.00 0.00 36.38 34.38 1mws s VAL 256 CO 0.02 -0.34 0.89 -0.83 -0.31 0.00 0.00 175.10 174.54 1mws s GLY 257 N -3.47 -0.24 0.25 2.32 0.00 -0.11 -4.68 107.32 101.40 1mws s GLY 257 Ca 0.30 0.13 -0.30 0.00 0.00 0.00 0.00 44.72 44.85 1mws s GLY 257 CO 0.17 0.02 1.43 2.56 0.00 0.00 0.00 173.10 177.28 1mws s PRO 258 N -3.41 4.28 0.42 2.90 0.04 -1.26 -1.17 135.00 136.80 1mws s PRO 258 Ca 0.11 2.28 -0.25 0.00 0.04 0.00 0.00 61.00 63.18 1mws s PRO 258 Cb -0.02 -3.11 -0.08 0.00 0.04 0.00 0.00 34.50 31.32 1mws s PRO 258 CO 0.02 -0.40 1.26 -1.50 0.04 0.00 0.00 177.00 176.42 1mws s ILE 259 N -0.04 2.75 0.25 0.56 2.07 -0.48 -4.85 121.20 121.46 1mws s ILE 259 Ca 0.59 0.64 0.03 0.00 -1.41 0.00 0.00 60.65 60.50 1mws s ILE 259 Cb -0.41 -3.37 0.03 0.00 0.13 0.00 0.00 42.46 38.84 1mws s ILE 259 CO 0.43 0.07 0.26 -0.46 -1.91 0.00 0.00 174.94 173.34 1mws n ASN 260 N -0.02 1.35 0.07 4.50 0.23 -1.26 -4.93 115.26 115.20 1mws n ASN 260 Ca 0.05 -1.75 -0.13 0.00 -0.53 0.00 0.00 54.58 52.22 1mws n ASN 260 Cb 0.45 -0.10 -0.08 0.00 -2.08 0.00 0.00 39.78 37.97 1mws n ASN 260 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1mws h SER 261 N 0.17 -0.13 0.27 0.53 4.64 -1.97 -2.73 113.55 114.32 1mws h SER 261 Ca -0.14 -0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1mws h SER 261 Cb 0.55 0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.65 1mws h SER 261 CO 0.20 0.09 -0.36 -0.33 -0.87 0.00 0.00 176.83 175.57 1mws h GLU 262 N -0.34 -0.63 -0.96 4.77 5.08 -2.01 -2.42 114.58 118.06 1mws h GLU 262 Ca -0.02 0.04 0.30 0.00 -1.00 0.00 0.00 59.36 58.69 1mws h GLU 262 Cb 0.28 0.14 -0.16 0.00 0.50 0.00 0.00 28.75 29.52 1mws h GLU 262 CO 0.03 -0.42 0.34 0.93 -1.00 0.00 0.00 179.01 178.89 1mws h GLU 263 N -0.65 0.15 -0.02 2.33 5.08 -1.98 0.49 114.58 119.98 1mws h GLU 263 Ca -0.03 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1mws h GLU 263 Cb 0.58 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1mws h GLU 263 CO -0.09 0.10 0.03 -0.07 -1.00 0.00 0.00 179.01 177.98 1mws h LEU 264 N 0.15 0.00 -0.02 1.33 3.38 -1.11 -2.34 115.31 116.70 1mws h LEU 264 Ca 0.67 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.41 1mws h LEU 264 Cb 1.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.26 1mws h LEU 264 CO -0.72 0.00 -1.06 0.11 0.09 0.00 0.00 178.44 176.86 1mws h LYS 265 N 0.00 0.15 -7.12 1.13 1.57 0.09 -3.42 116.57 108.98 1mws h LYS 265 Ca 0.01 -0.24 -0.54 0.00 -1.87 0.00 0.00 60.65 58.02 1mws h LYS 265 Cb 0.07 0.08 0.13 0.00 0.08 0.00 0.00 32.23 32.60 1mws h LYS 265 CO -0.00 1.07 0.47 -0.65 -0.57 0.00 0.00 179.45 179.77 1mws s GLN 266 N -2.82 2.69 0.15 3.15 -0.21 -0.88 -4.90 119.66 116.85 1mws s GLN 266 Ca -0.02 1.88 0.18 0.00 0.02 0.00 0.00 55.36 57.42 1mws s GLN 266 Cb 0.09 -1.89 0.78 0.00 1.00 0.00 0.00 33.01 32.99 1mws s GLN 266 CO 0.85 -1.44 1.55 0.36 -2.12 0.00 0.00 175.29 174.48 1mws n LYS 267 N -1.90 0.10 -0.07 2.91 0.00 -1.26 -2.44 118.16 115.49 1mws n LYS 267 Ca 0.14 0.40 -0.13 0.00 -0.00 0.00 0.00 58.31 58.72 1mws n LYS 267 Cb 0.49 -1.72 -0.06 0.00 -0.00 0.00 0.00 35.03 33.75 1mws n LYS 267 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1mws h GLU 268 N 0.00 0.48 -0.55 -1.58 5.08 -1.90 -3.24 114.58 112.87 1mws h GLU 268 Ca 0.00 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1mws h GLU 268 Cb 0.25 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1mws h GLU 268 CO 0.00 0.80 0.00 0.66 -1.00 0.00 0.00 179.01 179.47 1mws n TYR 269 N -4.47 1.82 -2.02 4.33 4.02 -1.02 -4.92 117.16 114.90 1mws n TYR 269 Ca -0.05 -0.72 -0.43 0.00 -0.01 0.00 0.00 57.90 56.69 1mws n TYR 269 Cb 0.38 -0.43 -0.03 0.00 -0.02 0.00 0.00 39.34 39.24 1mws n TYR 269 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1mws s LYS 270 N -2.57 3.69 0.00 -0.72 1.02 -1.12 -1.11 119.74 118.93 1mws s LYS 270 Ca 0.52 1.73 0.00 0.00 0.02 0.00 0.00 55.97 58.24 1mws s LYS 270 Cb 0.39 -4.10 0.00 0.00 -0.52 0.00 0.00 37.83 33.60 1mws s LYS 270 CO 0.17 -1.43 0.00 0.41 -0.92 0.00 0.00 175.35 173.58 1mws n GLY 271 N 4.87 1.91 3.82 -3.33 0.00 -1.26 -5.07 105.19 106.13 1mws n GLY 271 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1mws n GLY 271 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mws s TYR 272 N -2.09 3.13 0.68 1.61 1.51 -0.27 -5.06 117.35 116.87 1mws s TYR 272 Ca 0.00 1.45 -0.07 0.00 -1.01 0.00 0.00 57.07 57.44 1mws s TYR 272 Cb 0.00 -2.91 0.04 0.00 -0.11 0.00 0.00 41.96 38.98 1mws s TYR 272 CO 0.00 -1.09 1.00 0.15 -1.11 0.00 0.00 175.55 174.51 1mws s LYS 273 N -4.63 2.46 0.19 -0.62 -0.14 -1.26 -5.00 119.74 110.74 1mws s LYS 273 Ca 0.60 -0.07 0.24 0.00 -1.36 0.00 0.00 55.97 55.37 1mws s LYS 273 Cb -0.14 -2.16 0.24 0.00 -1.68 0.00 0.00 37.83 34.09 1mws s LYS 273 CO 0.47 -1.09 1.27 -0.44 -0.76 0.00 0.00 175.35 174.80 1mws h ASP 274 N -0.52 0.00 0.31 2.83 3.32 -1.97 -3.19 116.42 117.20 1mws h ASP 274 Ca -0.45 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.49 1mws h ASP 274 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1mws h ASP 274 CO 0.61 0.05 -0.37 -0.90 -1.72 0.00 0.00 179.24 176.92 1mws n ASP 275 N -2.42 0.88 -4.60 6.45 5.75 -1.26 -4.70 116.55 116.66 1mws n ASP 275 Ca 0.02 -0.70 -0.41 0.00 -0.01 0.00 0.00 54.79 53.69 1mws n ASP 275 Cb 0.49 0.21 0.01 0.00 -1.03 0.00 0.00 41.12 40.80 1mws n ASP 275 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1mws n ALA 276 N -0.95 0.04 -3.62 2.12 0.00 -1.21 -4.81 120.51 112.08 1mws n ALA 276 Ca 0.10 0.22 -0.35 0.00 0.00 0.00 0.00 53.44 53.41 1mws n ALA 276 Cb 0.35 -2.06 -0.14 0.00 0.00 0.00 0.00 19.45 17.60 1mws n ALA 276 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1mws s VAL 277 N -1.30 3.11 0.31 0.00 1.01 -1.26 -1.38 120.40 120.88 1mws s VAL 277 Ca 0.64 -0.67 0.10 0.00 0.00 0.00 0.00 61.98 62.05 1mws s VAL 277 Cb -0.56 -2.44 -0.06 0.00 0.00 0.00 0.00 36.38 33.32 1mws s VAL 277 CO 0.56 0.39 -0.12 0.27 0.00 0.00 0.00 175.10 176.20 1mws s ILE 278 N 1.42 2.20 0.28 2.22 -4.36 -0.32 -4.85 121.20 117.79 1mws s ILE 278 Ca 0.05 -2.25 -0.29 0.00 -0.26 0.00 0.00 60.65 57.89 1mws s ILE 278 Cb -0.15 -2.49 -0.10 0.00 1.25 0.00 0.00 42.46 40.98 1mws s ILE 278 CO -0.05 -0.29 1.29 -0.83 0.24 0.00 0.00 174.94 175.29 1mws s GLY 279 N -3.54 2.79 -0.10 6.27 0.00 -1.24 -0.93 107.32 110.56 1mws s GLY 279 Ca 0.31 1.16 0.18 0.00 0.00 0.00 0.00 44.72 46.37 1mws s GLY 279 CO 0.15 1.93 0.24 0.28 0.00 0.00 0.00 173.10 175.70 1mws n LYS 280 N 1.54 0.83 -3.83 2.90 4.76 0.12 -4.32 118.16 120.16 1mws n LYS 280 Ca 0.02 -0.09 -0.09 0.00 -2.87 0.00 0.00 58.31 55.28 1mws n LYS 280 Cb 0.42 -1.46 -0.04 0.00 -1.84 0.00 0.00 35.03 32.11 1mws n LYS 280 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1mws s LYS 281 N -2.88 1.40 3.16 1.97 1.02 -1.23 -4.91 119.74 118.26 1mws s LYS 281 Ca -0.08 -0.99 0.00 0.00 0.02 0.00 0.00 55.97 54.92 1mws s LYS 281 Cb 0.09 0.49 0.00 0.00 -0.52 0.00 0.00 37.83 37.89 1mws s LYS 281 CO 0.77 -0.58 0.00 0.41 -0.92 0.00 0.00 175.35 175.03 1mws n GLY 282 N -0.33 0.85 0.28 -3.33 0.00 -1.26 -2.72 105.19 98.68 1mws n GLY 282 Ca -0.08 -0.81 0.04 0.00 0.00 0.00 0.00 46.02 45.18 1mws n GLY 282 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1mws h LEU 283 N 0.00 0.33 -1.23 0.99 3.38 -0.83 0.15 115.31 118.09 1mws h LEU 283 Ca 0.00 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.04 1mws h LEU 283 Cb 0.00 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.61 1mws h LEU 283 CO 0.00 0.28 0.56 -0.33 0.09 0.00 0.00 178.44 179.04 1mws h GLU 284 N 0.37 0.84 0.10 1.13 4.39 -1.29 -0.52 114.58 119.60 1mws h GLU 284 Ca 0.10 -0.05 -0.25 0.00 0.34 0.00 0.00 59.36 59.50 1mws h GLU 284 Cb 0.04 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.50 1mws h GLU 284 CO -0.01 0.55 -1.24 -0.22 -1.16 0.00 0.00 179.01 176.93 1mws h LYS 285 N 0.86 0.22 -0.62 2.33 3.64 -1.01 -2.72 116.57 119.27 1mws h LYS 285 Ca 0.40 -0.37 0.07 0.00 -1.27 0.00 0.00 60.65 59.48 1mws h LYS 285 Cb 0.39 0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.29 1mws h LYS 285 CO -0.16 1.18 0.29 1.25 -2.27 0.00 0.00 179.45 179.74 1mws h LEU 286 N -0.41 0.38 -3.40 5.20 5.85 -0.53 -2.83 115.31 119.57 1mws h LEU 286 Ca -0.27 0.05 -0.25 0.00 0.84 0.00 0.00 57.88 58.25 1mws h LEU 286 Cb 1.67 -0.01 -0.16 0.00 0.37 0.00 0.00 40.66 42.52 1mws h LEU 286 CO 0.05 0.24 -0.23 -1.22 -0.34 0.00 0.00 178.44 176.94 1mws n TYR 287 N -4.89 1.34 -0.26 1.25 4.02 -0.22 -4.74 117.16 113.65 1mws n TYR 287 Ca 0.08 -1.80 0.04 0.00 -0.01 0.00 0.00 57.90 56.20 1mws n TYR 287 Cb 0.22 -0.49 0.17 0.00 -0.02 0.00 0.00 39.34 39.22 1mws n TYR 287 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 176.86 176.07 1mws h ASP 288 N 1.28 0.45 -0.39 7.72 3.58 -1.22 -2.47 116.42 125.38 1mws h ASP 288 Ca 0.24 0.08 0.08 0.00 0.42 0.00 0.00 57.03 57.85 1mws h ASP 288 Cb 1.47 0.01 -0.08 0.00 1.72 0.00 0.00 39.33 42.44 1mws h ASP 288 CO 0.47 0.23 -0.16 0.50 -2.88 0.00 0.00 179.24 177.40 1mws h LYS 289 N 0.58 -0.08 0.00 0.28 3.64 -1.85 0.18 116.57 119.33 1mws h LYS 289 Ca 0.39 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.76 1mws h LYS 289 Cb 0.49 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1mws h LYS 289 CO -0.32 -0.05 -0.09 0.87 -2.27 0.00 0.00 179.45 177.59 1mws h LYS 290 N -0.08 0.00 0.00 1.90 1.57 -1.82 -3.08 116.57 115.06 1mws h LYS 290 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1mws h LYS 290 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1mws h LYS 290 CO -0.45 0.09 -0.93 1.28 -0.57 0.00 0.00 179.45 178.88 1mws n LEU 291 N -3.25 0.66 -4.65 2.94 4.77 -0.47 -2.86 117.00 114.14 1mws n LEU 291 Ca 0.00 0.13 -0.34 0.00 -0.03 0.00 0.00 56.01 55.77 1mws n LEU 291 Cb 0.34 -0.11 0.11 0.00 -2.33 0.00 0.00 43.42 41.42 1mws n LEU 291 CO 0.29 -0.04 0.63 0.00 -1.33 0.00 0.00 177.39 176.95 1mws n GLN 292 N -2.16 0.26 -4.08 3.23 1.13 0.50 -1.46 117.38 114.81 1mws n GLN 292 Ca 0.02 0.16 -0.12 0.00 -1.94 0.00 0.00 57.00 55.12 1mws n GLN 292 Cb 0.46 -2.32 -0.06 0.00 0.11 0.00 0.00 30.24 28.43 1mws n GLN 292 CO 0.00 0.00 0.00 -3.38 -1.44 0.00 0.00 177.06 172.24 1mws s HIS 293 N -2.04 0.78 -0.24 1.08 -3.43 -1.26 -3.56 115.29 106.62 1mws s HIS 293 Ca 0.72 -1.06 -0.13 0.00 -0.80 0.00 0.00 55.06 53.80 1mws s HIS 293 Cb -0.30 -0.07 0.08 0.00 -1.43 0.00 0.00 32.58 30.85 1mws s HIS 293 CO 0.52 -0.96 0.57 -2.00 -2.00 0.00 0.00 174.74 170.87 1mws s GLU 294 N -3.74 0.56 0.71 -0.38 2.12 -0.04 -4.98 118.70 112.95 1mws s GLU 294 Ca 0.29 1.07 -0.15 0.00 0.36 0.00 0.00 54.97 56.54 1mws s GLU 294 Cb 0.01 0.14 0.03 0.00 0.26 0.00 0.00 34.13 34.57 1mws s GLU 294 CO 0.13 -0.16 1.18 -0.51 -0.54 0.00 0.00 175.26 175.36 1mws s ASP 295 N 1.70 4.44 0.05 -1.70 1.01 -1.26 -0.83 116.67 120.07 1mws s ASP 295 Ca -0.09 2.24 0.00 0.00 0.71 0.00 0.00 52.55 55.42 1mws s ASP 295 Cb -0.07 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.29 1mws s ASP 295 CO -0.17 -2.09 0.04 0.61 0.21 0.00 0.00 175.17 173.77 1mws n GLY 296 N 0.11 2.96 3.53 0.21 0.00 0.31 -4.73 105.19 107.57 1mws n GLY 296 Ca 0.12 -2.18 -0.10 0.00 0.00 0.00 0.00 46.02 43.87 1mws n GLY 296 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mws s TYR 297 N -0.20 -0.42 -0.07 1.61 -0.85 -0.39 -0.59 117.35 116.45 1mws s TYR 297 Ca 0.03 0.18 -0.06 0.00 -0.52 0.00 0.00 57.07 56.70 1mws s TYR 297 Cb -0.00 0.58 0.02 0.00 0.38 0.00 0.00 41.96 42.94 1mws s TYR 297 CO 0.02 -0.84 0.17 0.50 -1.52 0.00 0.00 175.55 173.89 1mws s ARG 298 N -3.60 0.20 -0.16 -3.49 3.52 -0.63 -0.78 118.95 114.00 1mws s ARG 298 Ca 0.04 0.25 -0.01 0.00 -0.13 0.00 0.00 55.73 55.88 1mws s ARG 298 Cb -0.02 0.08 -0.01 0.00 -1.56 0.00 0.00 34.95 33.45 1mws s ARG 298 CO -0.08 -0.03 -0.12 0.08 -0.81 0.00 0.00 175.30 174.33 1mws s VAL 299 N 0.15 2.92 0.19 7.11 1.01 0.06 -1.00 120.40 130.83 1mws s VAL 299 Ca -0.00 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.30 1mws s VAL 299 Cb -0.02 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.07 1mws s VAL 299 CO -0.00 0.50 0.04 0.42 0.00 0.00 0.00 175.10 176.06 1mws s THR 300 N 0.83 0.51 -0.20 3.92 -4.23 -0.03 -0.40 115.64 116.04 1mws s THR 300 Ca -0.04 -1.97 -0.05 0.00 -1.18 0.00 0.00 61.69 58.45 1mws s THR 300 Cb -0.15 -2.24 -0.02 0.00 1.34 0.00 0.00 72.50 71.43 1mws s THR 300 CO 0.00 -0.34 -0.01 -0.63 -0.54 0.00 0.00 174.62 173.10 1mws s ILE 301 N -3.77 3.92 -0.02 2.99 1.01 0.23 -0.66 121.20 124.90 1mws s ILE 301 Ca 0.28 -0.33 0.06 0.00 0.00 0.00 0.00 60.65 60.66 1mws s ILE 301 Cb 0.07 -2.77 -0.01 0.00 0.01 0.00 0.00 42.46 39.76 1mws s ILE 301 CO 0.06 0.43 -0.20 -0.69 0.00 0.00 0.00 174.94 174.54 1mws s VAL 302 N 0.96 1.62 0.23 2.92 1.01 0.02 -0.66 120.40 126.49 1mws s VAL 302 Ca 0.01 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 1mws s VAL 302 Cb -0.14 -1.35 -0.09 0.00 0.00 0.00 0.00 36.38 34.79 1mws s VAL 302 CO 0.02 0.46 1.26 -1.81 0.00 0.00 0.00 175.10 175.02 1mws s ASP 303 N -0.39 6.97 0.44 3.32 1.01 -0.27 -1.18 116.67 126.56 1mws s ASP 303 Ca 0.06 2.39 -0.25 0.00 0.71 0.00 0.00 52.55 55.46 1mws s ASP 303 Cb -0.09 -2.62 -0.09 0.00 1.01 0.00 0.00 42.92 41.13 1mws s ASP 303 CO -0.00 -0.44 1.28 0.47 0.21 0.00 0.00 175.17 176.68 1mws n ASP 304 N 2.15 2.56 0.00 0.27 8.00 -0.42 -1.21 116.55 127.89 1mws n ASP 304 Ca 0.04 1.09 0.00 0.00 0.71 0.00 0.00 54.79 56.63 1mws n ASP 304 Cb 0.43 -1.51 0.00 0.00 -0.02 0.00 0.00 41.12 40.02 1mws n ASP 304 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1mws n ASN 305 N 0.05 0.00 0.00 -2.24 3.02 -1.26 -4.07 115.26 110.76 1mws n ASN 305 Ca 0.07 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 54.78 1mws n ASN 305 Cb 0.40 0.00 0.62 0.00 -0.61 0.00 0.00 39.78 40.19 1mws n ASN 305 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1mws h SER 306 N 0.00 0.12 -3.87 6.41 4.64 -2.00 -3.45 113.55 115.40 1mws h SER 306 Ca 0.00 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.94 1mws h SER 306 Cb 0.00 -0.02 0.04 0.00 -0.31 0.00 0.00 62.40 62.11 1mws h SER 306 CO 0.00 0.07 -0.55 0.59 -0.87 0.00 0.00 176.83 176.07 1mws n ASN 307 N -4.43 -5.77 -4.75 4.97 3.02 -0.35 -4.98 115.26 102.96 1mws n ASN 307 Ca 0.08 -0.21 -0.40 0.00 -0.03 0.00 0.00 54.58 54.02 1mws n ASN 307 Cb 0.47 -4.64 -0.05 0.00 -0.61 0.00 0.00 39.78 34.95 1mws n ASN 307 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1mws s THR 308 N -3.10 4.69 -0.54 3.41 2.01 -1.24 -4.81 115.64 116.05 1mws s THR 308 Ca 0.22 1.60 -0.28 0.00 0.31 0.00 0.00 61.69 63.54 1mws s THR 308 Cb -0.10 -4.10 0.03 0.00 0.01 0.00 0.00 72.50 68.34 1mws s THR 308 CO 0.28 0.40 1.16 -0.63 -0.69 0.00 0.00 174.62 175.13 1mws s ILE 309 N -0.27 4.11 0.13 1.82 1.01 -1.26 -1.11 121.20 125.62 1mws s ILE 309 Ca 0.37 0.99 0.01 0.00 0.00 0.00 0.00 60.65 62.02 1mws s ILE 309 Cb -0.21 -4.67 -0.20 0.00 0.01 0.00 0.00 42.46 37.39 1mws s ILE 309 CO 0.23 -1.21 1.28 0.00 0.00 0.00 0.00 174.94 175.25 1mws h ALA 310 N 9.42 0.35 -2.40 9.38 0.00 -1.25 -3.47 119.26 131.29 1mws h ALA 310 Ca -0.24 -0.81 -0.09 0.00 0.00 0.00 0.00 54.91 53.78 1mws h ALA 310 Cb 1.06 -0.06 -0.22 0.00 0.00 0.00 0.00 17.79 18.56 1mws h ALA 310 CO 1.16 0.99 -0.07 -1.01 0.00 0.00 0.00 179.25 180.32 1mws s HIS 311 N -2.95 -0.59 -0.42 0.00 3.76 -1.06 -4.97 115.29 109.05 1mws s HIS 311 Ca -0.03 1.43 -0.15 0.00 -0.15 0.00 0.00 55.06 56.16 1mws s HIS 311 Cb 0.09 0.21 0.03 0.00 1.11 0.00 0.00 32.58 34.02 1mws s HIS 311 CO 0.85 -0.30 0.31 0.99 -0.85 0.00 0.00 174.74 175.74 1mws s THR 312 N 0.20 5.24 -0.01 1.30 2.01 -1.26 -0.60 115.64 122.52 1mws s THR 312 Ca -0.01 -0.72 -0.19 0.00 0.31 0.00 0.00 61.69 61.08 1mws s THR 312 Cb -0.04 -3.95 -0.29 0.00 0.01 0.00 0.00 72.50 68.23 1mws s THR 312 CO 0.01 -0.35 1.00 -0.07 -0.69 0.00 0.00 174.62 174.52 1mws h LEU 313 N 8.64 0.60 -7.40 4.42 3.38 -1.08 -3.47 115.31 120.40 1mws h LEU 313 Ca -0.27 -0.87 -0.15 0.00 0.09 0.00 0.00 57.88 56.67 1mws h LEU 313 Cb 1.12 -0.19 -0.26 0.00 0.09 0.00 0.00 40.66 41.42 1mws h LEU 313 CO 0.75 1.42 -0.37 -0.63 0.09 0.00 0.00 178.44 179.70 1mws s ILE 314 N -2.76 -0.01 -0.06 1.22 1.01 -1.08 -4.76 121.20 114.77 1mws s ILE 314 Ca -0.12 0.02 -0.02 0.00 0.00 0.00 0.00 60.65 60.52 1mws s ILE 314 Cb 0.03 -0.43 0.04 0.00 0.01 0.00 0.00 42.46 42.11 1mws s ILE 314 CO 0.86 0.01 0.13 -0.70 0.00 0.00 0.00 174.94 175.24 1mws s GLU 315 N 0.35 0.07 -0.29 2.79 2.12 -1.26 -0.76 118.70 121.71 1mws s GLU 315 Ca -0.02 0.36 0.02 0.00 0.36 0.00 0.00 54.97 55.70 1mws s GLU 315 Cb -0.03 -0.20 0.07 0.00 0.26 0.00 0.00 34.13 34.23 1mws s GLU 315 CO -0.01 -0.18 -0.04 0.21 -0.54 0.00 0.00 175.26 174.70 1mws s LYS 316 N 1.25 2.05 0.63 4.30 2.20 0.04 -4.99 119.74 125.21 1mws s LYS 316 Ca -0.08 -1.50 -0.19 0.00 -0.36 0.00 0.00 55.97 53.84 1mws s LYS 316 Cb -0.12 -3.05 -0.02 0.00 -1.51 0.00 0.00 37.83 33.14 1mws s LYS 316 CO -0.05 -0.70 1.31 0.15 -0.36 0.00 0.00 175.35 175.69 1mws s LYS 317 N 1.07 2.63 0.48 4.03 1.02 -1.26 -1.26 119.74 126.45 1mws s LYS 317 Ca -0.02 2.10 -0.20 0.00 0.02 0.00 0.00 55.97 57.87 1mws s LYS 317 Cb -0.20 -1.90 -0.09 0.00 -0.52 0.00 0.00 37.83 35.12 1mws s LYS 317 CO -0.05 -1.55 1.01 -1.59 -0.92 0.00 0.00 175.35 172.25 1mws s LYS 318 N -3.31 3.90 -0.35 1.68 -2.85 -1.26 -4.37 119.74 113.18 1mws s LYS 318 Ca 0.81 1.26 -0.02 0.00 -1.00 0.00 0.00 55.97 57.02 1mws s LYS 318 Cb -0.38 -2.12 0.08 0.00 -2.06 0.00 0.00 37.83 33.35 1mws s LYS 318 CO 0.41 -0.33 0.09 0.15 0.10 0.00 0.00 175.35 175.77 1mws s LYS 319 N -3.31 2.18 0.49 1.78 1.02 -0.01 -4.89 119.74 116.99 1mws s LYS 319 Ca 0.65 -1.55 -0.17 0.00 0.02 0.00 0.00 55.97 54.92 1mws s LYS 319 Cb -0.14 -3.37 -0.08 0.00 -0.52 0.00 0.00 37.83 33.72 1mws s LYS 319 CO 0.20 -0.84 0.97 -0.51 -0.92 0.00 0.00 175.35 174.24 1mws s ASP 320 N 1.47 6.67 0.60 2.83 1.01 -1.26 -0.86 116.67 127.13 1mws s ASP 320 Ca 0.02 1.56 -0.15 0.00 0.71 0.00 0.00 52.55 54.69 1mws s ASP 320 Cb -0.21 -2.50 -0.04 0.00 1.01 0.00 0.00 42.92 41.18 1mws s ASP 320 CO -0.03 -0.54 1.05 -0.83 0.21 0.00 0.00 175.17 175.04 1mws s GLY 321 N -2.93 2.08 -0.03 0.21 0.00 0.15 -4.79 107.32 102.01 1mws s GLY 321 Ca 0.59 0.35 -0.13 0.00 0.00 0.00 0.00 44.72 45.53 1mws s GLY 321 CO 0.28 0.67 0.34 0.54 0.00 0.00 0.00 173.10 174.92 1mws s LYS 322 N -4.16 3.79 0.57 2.90 1.02 -1.14 -4.05 119.74 118.67 1mws s LYS 322 Ca 0.63 0.26 -0.16 0.00 0.02 0.00 0.00 55.97 56.72 1mws s LYS 322 Cb -0.15 -3.21 -0.05 0.00 -0.52 0.00 0.00 37.83 33.89 1mws s LYS 322 CO 0.38 0.71 1.04 -0.51 -0.92 0.00 0.00 175.35 176.05 1mws s ASP 323 N -1.05 6.05 -0.09 2.83 1.01 -1.26 -4.20 116.67 119.96 1mws s ASP 323 Ca 0.21 1.75 0.04 0.00 0.71 0.00 0.00 52.55 55.27 1mws s ASP 323 Cb -0.15 -2.53 -0.00 0.00 1.01 0.00 0.00 42.92 41.25 1mws s ASP 323 CO 0.11 -0.98 -0.24 -0.63 0.21 0.00 0.00 175.17 173.64 1mws s ILE 324 N -2.47 2.05 -0.18 0.77 1.01 0.03 -4.91 121.20 117.49 1mws s ILE 324 Ca 0.62 -1.02 -0.07 0.00 0.00 0.00 0.00 60.65 60.19 1mws s ILE 324 Cb -0.14 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.52 1mws s ILE 324 CO 0.34 0.56 0.04 -1.58 0.00 0.00 0.00 174.94 174.31 1mws s GLN 325 N 0.28 3.91 0.43 2.79 0.74 -1.26 -0.28 119.66 126.28 1mws s GLN 325 Ca -0.17 -0.38 0.06 0.00 0.05 0.00 0.00 55.36 54.92 1mws s GLN 325 Cb -0.17 -3.16 0.01 0.00 1.10 0.00 0.00 33.01 30.79 1mws s GLN 325 CO 0.08 0.26 0.60 -0.51 -0.55 0.00 0.00 175.29 175.17 1mws s LEU 326 N 0.40 3.64 0.23 3.68 1.43 0.94 -1.58 118.68 127.42 1mws s LEU 326 Ca 0.02 -0.23 0.24 0.00 -1.03 0.00 0.00 54.13 53.12 1mws s LEU 326 Cb -0.13 -2.76 0.31 0.00 0.03 0.00 0.00 46.19 43.64 1mws s LEU 326 CO 0.01 -0.77 1.38 0.71 0.23 0.00 0.00 176.35 177.90 1mws h THR 327 N 0.55 0.00 -2.30 5.49 1.35 -0.98 -2.28 112.91 114.73 1mws h THR 327 Ca -0.42 -0.75 -0.61 0.00 -0.55 0.00 0.00 66.41 64.07 1mws h THR 327 Cb 1.28 1.47 0.08 0.00 -1.73 0.00 0.00 68.15 69.25 1mws h THR 327 CO 0.49 0.00 0.49 -0.38 -0.25 0.00 0.00 175.52 175.87 1mws n ILE 328 N -2.53 0.78 -3.65 6.82 2.08 -0.90 -4.42 119.36 117.55 1mws n ILE 328 Ca 0.03 -0.19 -0.39 0.00 0.56 0.00 0.00 62.75 62.76 1mws n ILE 328 Cb 0.49 -1.21 -0.12 0.00 -0.75 0.00 0.00 39.64 38.06 1mws n ILE 328 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1mws s ASP 329 N 0.25 5.60 0.52 4.38 -1.08 0.18 -1.02 116.67 125.51 1mws s ASP 329 Ca 0.72 -0.45 0.23 0.00 -0.52 0.00 0.00 52.55 52.53 1mws s ASP 329 Cb -0.75 -2.02 1.36 0.00 -1.46 0.00 0.00 42.92 40.05 1mws s ASP 329 CO 0.49 -0.18 2.01 0.00 0.52 0.00 0.00 175.17 178.02 1mws h ALA 330 N 8.36 2.41 -0.02 3.66 0.00 -1.94 -1.58 119.26 130.15 1mws h ALA 330 Ca -0.33 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1mws h ALA 330 Cb 1.15 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1mws h ALA 330 CO 0.61 -0.55 0.01 0.87 0.00 0.00 0.00 179.25 180.19 1mws h LYS 331 N 0.03 0.02 -0.31 0.00 1.57 -1.93 -1.02 116.57 114.92 1mws h LYS 331 Ca 0.23 -0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.83 1mws h LYS 331 Cb 0.87 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 1mws h LYS 331 CO -0.01 0.08 -0.48 0.28 -0.57 0.00 0.00 179.45 178.75 1mws h VAL 332 N -0.04 1.28 -0.37 0.50 2.07 -1.71 -1.97 116.25 116.02 1mws h VAL 332 Ca 0.01 -1.67 0.03 0.00 0.82 0.00 0.00 66.70 65.89 1mws h VAL 332 Cb 0.06 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1mws h VAL 332 CO -0.00 0.54 0.18 -0.61 0.02 0.00 0.00 177.57 177.70 1mws h GLN 333 N 0.66 0.36 -0.01 1.57 5.75 -1.20 -1.66 115.11 120.58 1mws h GLN 333 Ca 0.03 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1mws h GLN 333 Cb 1.07 -0.08 -0.00 0.00 1.07 0.00 0.00 27.48 29.54 1mws h GLN 333 CO 0.11 0.24 -0.01 -0.22 -2.65 0.00 0.00 178.83 176.30 1mws h LYS 334 N 0.37 0.02 -0.48 1.69 3.64 -1.15 -2.40 116.57 118.27 1mws h LYS 334 Ca 0.16 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.55 1mws h LYS 334 Cb 0.08 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1mws h LYS 334 CO -0.12 0.48 0.28 1.03 -2.27 0.00 0.00 179.45 178.85 1mws h SER 335 N -0.43 0.44 -0.14 4.20 0.87 -1.32 -0.23 113.55 116.95 1mws h SER 335 Ca 0.00 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1mws h SER 335 Cb 0.47 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1mws h SER 335 CO 0.00 0.31 0.08 0.40 -0.53 0.00 0.00 176.83 177.10 1mws h ILE 336 N 0.55 1.08 -0.29 2.23 2.04 -1.37 -2.04 117.51 119.71 1mws h ILE 336 Ca 0.19 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 1mws h ILE 336 Cb 0.03 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1mws h ILE 336 CO -0.10 0.08 0.16 0.22 0.00 0.00 0.00 178.15 178.51 1mws h TYR 337 N 0.14 0.40 -0.88 1.37 3.20 -1.10 -2.25 116.97 117.85 1mws h TYR 337 Ca 0.05 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.99 1mws h TYR 337 Cb 0.05 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.14 1mws h TYR 337 CO -0.05 0.32 0.57 -0.91 -1.64 0.00 0.00 178.16 176.46 1mws h ASN 338 N 0.36 0.85 -0.02 -2.11 2.35 -0.95 0.35 115.58 116.41 1mws h ASN 338 Ca 0.10 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1mws h ASN 338 Cb 0.05 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.25 1mws h ASN 338 CO -0.02 0.53 0.00 0.59 -1.65 0.00 0.00 177.43 176.88 1mws n ASN 339 N -4.50 0.74 0.00 5.81 3.02 -0.78 -3.92 115.26 115.63 1mws n ASN 339 Ca 0.14 -1.29 0.00 0.00 -0.03 0.00 0.00 54.58 53.40 1mws n ASN 339 Cb 0.24 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 1mws n ASN 339 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1mws n MET 340 N -0.40 0.30 -0.38 3.52 2.81 -0.72 -4.93 117.12 117.31 1mws n MET 340 Ca 0.21 -0.12 0.32 0.00 -1.81 0.00 0.00 57.70 56.30 1mws n MET 340 Cb 0.22 -0.53 0.63 0.00 -0.71 0.00 0.00 33.22 32.83 1mws n MET 340 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1mws h LYS 341 N 0.00 0.18 0.00 0.03 2.10 -0.45 0.01 116.57 118.44 1mws h LYS 341 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1mws h LYS 341 Cb 0.26 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 1mws h LYS 341 CO 0.00 0.12 -0.95 0.09 -2.00 0.00 0.00 179.45 176.71 1mws n ASN 342 N -4.50 0.66 -4.86 7.07 3.02 -1.26 -4.30 115.26 111.10 1mws n ASN 342 Ca 0.30 0.03 -0.32 0.00 -0.03 0.00 0.00 54.58 54.57 1mws n ASN 342 Cb 1.20 0.58 -0.05 0.00 -0.61 0.00 0.00 39.78 40.91 1mws n ASN 342 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1mws s ASP 343 N -4.39 6.66 -0.25 6.41 1.01 -0.01 -4.73 116.67 121.37 1mws s ASP 343 Ca 0.03 1.30 -0.23 0.00 0.71 0.00 0.00 52.55 54.35 1mws s ASP 343 Cb 0.13 -2.39 -0.01 0.00 1.01 0.00 0.00 42.92 41.66 1mws s ASP 343 CO 0.78 -0.36 0.78 -0.47 0.21 0.00 0.00 175.17 176.11 1mws s TYR 344 N -2.26 3.30 -5.00 4.23 5.04 -1.26 -2.63 117.35 118.77 1mws s TYR 344 Ca 0.54 1.05 0.00 0.00 -2.44 0.00 0.00 57.07 56.22 1mws s TYR 344 Cb -0.10 -3.00 0.00 0.00 0.35 0.00 0.00 41.96 39.21 1mws s TYR 344 CO 0.25 -0.38 0.00 0.41 -1.34 0.00 0.00 175.55 174.49 1mws n GLY 345 N 3.86 -0.47 3.22 8.97 0.00 -0.35 -0.98 105.19 119.45 1mws n GLY 345 Ca 0.04 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 1mws n GLY 345 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1mws s SER 346 N -4.00 -0.07 -0.09 1.61 1.04 -0.45 -1.70 113.70 110.05 1mws s SER 346 Ca 0.00 -0.23 -0.00 0.00 0.48 0.00 0.00 55.95 56.20 1mws s SER 346 Cb 0.00 0.32 0.02 0.00 0.10 0.00 0.00 66.02 66.47 1mws s SER 346 CO 0.00 -0.57 -0.06 -0.83 0.98 0.00 0.00 173.24 172.76 1mws s GLY 347 N -1.99 0.71 0.07 7.32 0.00 -0.57 -0.83 107.32 112.02 1mws s GLY 347 Ca -0.06 -0.39 0.06 0.00 0.00 0.00 0.00 44.72 44.33 1mws s GLY 347 CO -0.03 0.77 -0.16 -0.51 0.00 0.00 0.00 173.10 173.17 1mws s THR 348 N 1.57 1.31 0.02 0.90 -4.23 0.24 -1.52 115.64 113.93 1mws s THR 348 Ca 0.01 -1.26 0.02 0.00 -1.18 0.00 0.00 61.69 59.28 1mws s THR 348 Cb -0.13 -1.20 -0.01 0.00 1.34 0.00 0.00 72.50 72.49 1mws s THR 348 CO -0.05 -0.08 -0.06 0.00 -0.54 0.00 0.00 174.62 173.89 1mws s ALA 349 N -1.07 0.45 0.02 3.99 0.00 -0.71 0.45 121.76 124.88 1mws s ALA 349 Ca 0.02 -0.51 -0.11 0.00 0.00 0.00 0.00 51.96 51.36 1mws s ALA 349 Cb -0.09 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.03 1mws s ALA 349 CO 0.02 0.02 0.23 -1.50 0.00 0.00 0.00 175.76 174.54 1mws s ILE 350 N -0.84 0.08 -0.54 0.00 2.07 -0.09 -0.55 121.20 121.34 1mws s ILE 350 Ca -0.05 -0.69 -0.19 0.00 -1.41 0.00 0.00 60.65 58.30 1mws s ILE 350 Cb -0.06 -0.72 0.07 0.00 0.13 0.00 0.00 42.46 41.88 1mws s ILE 350 CO 0.00 -0.38 0.66 -2.28 -1.91 0.00 0.00 174.94 171.03 1mws s HIS 351 N -1.93 3.02 0.35 3.50 5.65 0.11 -1.01 115.29 124.97 1mws s HIS 351 Ca -0.10 -0.66 0.14 0.00 0.25 0.00 0.00 55.06 54.69 1mws s HIS 351 Cb -0.04 -3.71 1.02 0.00 -1.18 0.00 0.00 32.58 28.68 1mws s HIS 351 CO -0.00 -1.13 1.71 -1.35 -0.65 0.00 0.00 174.74 173.31 1mws h PRO 352 N 9.07 0.42 0.00 2.88 0.11 -1.82 0.03 132.00 142.70 1mws h PRO 352 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1mws h PRO 352 Cb 1.09 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1mws h PRO 352 CO 1.01 0.28 0.00 1.04 -0.21 0.00 0.00 178.00 180.12 1mws n GLN 353 N -4.89 0.19 0.00 1.05 3.00 -1.26 -4.13 117.38 111.34 1mws n GLN 353 Ca 0.29 0.25 0.00 0.00 -0.01 0.00 0.00 57.00 57.53 1mws n GLN 353 Cb 0.89 -1.77 0.00 0.00 0.00 0.00 0.00 30.24 29.36 1mws n GLN 353 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1mws n THR 354 N -2.11 0.00 -0.50 5.09 -2.24 -0.99 -5.00 114.28 108.53 1mws n THR 354 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1mws n THR 354 Cb 0.34 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 1mws n THR 354 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mws n GLY 355 N 1.15 0.75 3.69 3.38 0.00 -0.04 -4.56 105.19 109.57 1mws n GLY 355 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1mws n GLY 355 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mws s GLU 356 N -0.50 4.26 -0.18 1.61 2.02 -1.23 -1.24 118.70 123.44 1mws s GLU 356 Ca 0.00 2.11 -0.26 0.00 0.02 0.00 0.00 54.97 56.84 1mws s GLU 356 Cb 0.00 -3.53 -0.01 0.00 0.10 0.00 0.00 34.13 30.69 1mws s GLU 356 CO 0.00 -0.61 0.88 -0.51 0.02 0.00 0.00 175.26 175.04 1mws s LEU 357 N 2.30 4.16 0.04 1.80 1.43 -0.16 -0.72 118.68 127.53 1mws s LEU 357 Ca 0.67 1.23 0.18 0.00 -1.03 0.00 0.00 54.13 55.18 1mws s LEU 357 Cb -0.35 -3.31 -0.15 0.00 0.03 0.00 0.00 46.19 42.40 1mws s LEU 357 CO 0.29 -0.46 0.74 0.18 0.23 0.00 0.00 176.35 177.32 1mws n LEU 358 N 5.47 0.69 -3.67 1.79 4.77 0.29 -2.12 117.00 124.22 1mws n LEU 358 Ca 0.06 0.30 -0.14 0.00 -0.03 0.00 0.00 56.01 56.20 1mws n LEU 358 Cb 0.48 0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.58 1mws n LEU 358 CO 0.49 0.13 0.28 0.00 -1.33 0.00 0.00 177.39 176.96 1mws s ALA 359 N -2.98 -1.46 -0.31 -1.18 0.00 -1.04 -0.65 121.76 114.14 1mws s ALA 359 Ca -0.04 1.67 -0.02 0.00 0.00 0.00 0.00 51.96 53.57 1mws s ALA 359 Cb 0.09 -0.97 0.11 0.00 0.00 0.00 0.00 23.12 22.35 1mws s ALA 359 CO 0.82 -0.28 0.15 -0.51 0.00 0.00 0.00 175.76 175.94 1mws s LEU 360 N 0.32 1.10 -0.06 0.00 1.43 -1.26 -1.74 118.68 118.47 1mws s LEU 360 Ca -0.00 -1.61 0.06 0.00 -1.03 0.00 0.00 54.13 51.55 1mws s LEU 360 Cb -0.04 -0.50 -0.01 0.00 0.03 0.00 0.00 46.19 45.67 1mws s LEU 360 CO 0.01 -0.40 -0.25 -0.69 0.23 0.00 0.00 176.35 175.25 1mws s VAL 361 N 1.70 2.01 -0.07 -1.59 1.01 -0.58 -4.74 120.40 118.15 1mws s VAL 361 Ca 0.11 -1.04 0.04 0.00 0.00 0.00 0.00 61.98 61.09 1mws s VAL 361 Cb -0.18 -1.70 0.00 0.00 0.00 0.00 0.00 36.38 34.50 1mws s VAL 361 CO -0.25 0.56 -0.19 -0.55 0.00 0.00 0.00 175.10 174.67 1mws s SER 362 N -0.15 2.43 0.04 3.32 0.15 -1.26 -1.51 113.70 116.72 1mws s SER 362 Ca -0.04 -0.42 0.03 0.00 0.70 0.00 0.00 55.95 56.23 1mws s SER 362 Cb -0.14 -0.92 -0.02 0.00 -1.71 0.00 0.00 66.02 63.24 1mws s SER 362 CO 0.04 0.14 -0.10 0.42 1.20 0.00 0.00 173.24 174.93 1mws s THR 363 N 0.26 0.79 0.84 6.45 -4.23 -0.69 -3.96 115.64 115.10 1mws s THR 363 Ca -0.11 -1.04 -0.11 0.00 -1.18 0.00 0.00 61.69 59.25 1mws s THR 363 Cb -0.15 -0.78 0.10 0.00 1.34 0.00 0.00 72.50 73.01 1mws s THR 363 CO 0.05 -0.22 1.09 -2.84 -0.54 0.00 0.00 174.62 172.16 1mws s PRO 364 N -1.40 1.72 0.00 3.99 0.02 -1.08 -1.21 135.00 137.05 1mws s PRO 364 Ca -0.05 0.94 0.00 0.00 0.02 0.00 0.00 61.00 61.91 1mws s PRO 364 Cb -0.09 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.58 1mws s PRO 364 CO 0.01 -1.95 0.00 0.45 -0.33 0.00 0.00 177.00 175.18 1mws n SER 365 N -3.70 0.75 -3.63 2.53 2.88 -1.25 -4.35 113.62 106.84 1mws n SER 365 Ca 0.08 -0.95 -0.10 0.00 -1.33 0.00 0.00 58.87 56.57 1mws n SER 365 Cb 0.54 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.96 1mws n SER 365 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1mws s TYR 366 N 0.32 -0.23 -0.14 0.66 -0.85 -1.26 -4.88 117.35 110.98 1mws s TYR 366 Ca 0.00 -0.08 -0.29 0.00 -0.52 0.00 0.00 57.07 56.17 1mws s TYR 366 Cb 0.00 0.34 -0.02 0.00 0.38 0.00 0.00 41.96 42.66 1mws s TYR 366 CO 0.00 -0.78 1.25 0.34 -1.52 0.00 0.00 175.55 174.84 1mws s ASP 367 N -2.82 6.97 0.35 -0.18 -1.08 -1.26 -4.68 116.67 113.98 1mws s ASP 367 Ca 0.04 1.72 0.20 0.00 -0.52 0.00 0.00 52.55 54.00 1mws s ASP 367 Cb 0.01 -2.54 0.20 0.00 -1.46 0.00 0.00 42.92 39.13 1mws s ASP 367 CO -0.10 -0.72 1.49 -0.37 0.52 0.00 0.00 175.17 175.99 1mws h VAL 368 N 5.38 0.33 -0.75 1.11 -1.51 -1.93 -3.36 116.25 115.53 1mws h VAL 368 Ca -0.28 -1.48 0.11 0.00 -1.23 0.00 0.00 66.70 63.82 1mws h VAL 368 Cb 1.12 2.12 -0.08 0.00 -2.13 0.00 0.00 31.29 32.32 1mws h VAL 368 CO 0.95 0.19 0.37 1.88 -1.23 0.00 0.00 177.57 179.73 1mws h TYR 369 N 0.00 0.65 0.00 5.19 0.99 -1.96 -0.02 116.97 121.82 1mws h TYR 369 Ca -0.01 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.75 1mws h TYR 369 Cb 1.16 -0.18 -0.00 0.00 1.00 0.00 0.00 36.73 38.71 1mws h TYR 369 CO 0.00 0.21 -0.01 -1.35 -0.00 0.00 0.00 178.16 177.01 1mws h PRO 370 N 0.60 0.00 0.00 4.88 0.11 -1.88 0.15 132.00 135.86 1mws h PRO 370 Ca 0.38 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.43 1mws h PRO 370 Cb 0.44 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 1mws h PRO 370 CO -0.30 0.01 -0.28 0.74 -0.21 0.00 0.00 178.00 177.96 1mws h PHE 371 N 0.00 0.00 0.18 0.65 -1.00 -1.24 -0.25 116.94 115.29 1mws h PHE 371 Ca -0.00 0.00 -0.34 0.00 2.81 0.00 0.00 57.97 60.44 1mws h PHE 371 Cb 0.13 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.70 1mws h PHE 371 CO 0.00 0.28 -1.71 0.52 -1.61 0.00 0.00 178.31 175.80 1mws h MET 372 N 0.00 0.38 0.00 1.51 2.86 -0.62 -3.40 114.93 115.66 1mws h MET 372 Ca -0.00 -0.65 0.00 0.00 -2.06 0.00 0.00 59.70 56.98 1mws h MET 372 Cb 1.14 0.24 0.00 0.00 0.06 0.00 0.00 31.60 33.05 1mws h MET 372 CO 0.04 1.29 -1.46 0.66 1.06 0.00 0.00 176.91 178.50 1mws n TYR 373 N -3.58 0.14 0.00 -0.22 0.53 0.19 -4.97 117.16 109.25 1mws n TYR 373 Ca -0.23 0.04 0.00 0.00 -1.02 0.00 0.00 57.90 56.69 1mws n TYR 373 Cb 1.07 -0.41 0.00 0.00 -1.03 0.00 0.00 39.34 38.97 1mws n TYR 373 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1mws n GLY 374 N 1.33 3.44 2.95 2.72 0.00 -0.11 -4.68 105.19 110.84 1mws n GLY 374 Ca -0.00 -1.49 -0.12 0.00 0.00 0.00 0.00 46.02 44.40 1mws n GLY 374 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1mws s MET 375 N -5.17 0.11 0.85 1.61 1.75 -1.23 -4.78 119.30 112.44 1mws s MET 375 Ca 0.00 0.02 -0.12 0.00 -1.25 0.00 0.00 55.69 54.34 1mws s MET 375 Cb 0.00 0.05 0.10 0.00 2.84 0.00 0.00 34.83 37.82 1mws s MET 375 CO 0.00 -0.02 1.12 -1.54 -0.65 0.00 0.00 175.02 173.94 1mws s SER 376 N -0.14 4.06 0.26 1.11 1.04 -1.26 -4.85 113.70 113.92 1mws s SER 376 Ca -0.02 1.10 -0.02 0.00 0.48 0.00 0.00 55.95 57.49 1mws s SER 376 Cb -0.01 -1.74 0.34 0.00 0.10 0.00 0.00 66.02 64.71 1mws s SER 376 CO 0.00 -2.22 1.77 0.78 0.98 0.00 0.00 173.24 174.55 1mws h ASN 377 N -1.27 0.76 -0.74 7.02 4.21 -1.99 -1.85 115.58 121.72 1mws h ASN 377 Ca -0.49 -0.18 -0.06 0.00 1.21 0.00 0.00 56.30 56.79 1mws h ASN 377 Cb 1.30 -0.20 -0.03 0.00 -1.12 0.00 0.00 38.32 38.27 1mws h ASN 377 CO 0.61 0.82 0.24 -0.08 -1.29 0.00 0.00 177.43 177.72 1mws h GLU 378 N 0.74 1.15 -0.52 0.81 4.57 -1.99 0.12 114.58 119.46 1mws h GLU 378 Ca 0.15 -0.24 -0.02 0.00 -1.18 0.00 0.00 59.36 58.07 1mws h GLU 378 Cb 0.43 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 1mws h GLU 378 CO 0.02 0.97 0.25 0.93 -1.18 0.00 0.00 179.01 180.00 1mws h GLU 379 N 1.10 0.75 -0.56 1.92 5.08 -1.84 -1.67 114.58 119.36 1mws h GLU 379 Ca 0.24 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.39 1mws h GLU 379 Cb 0.30 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1mws h GLU 379 CO -0.01 0.62 -0.05 -0.92 -1.00 0.00 0.00 179.01 177.65 1mws h TYR 380 N 0.69 1.13 -0.68 4.33 3.20 -0.89 -2.89 116.97 121.85 1mws h TYR 380 Ca 0.18 -0.21 0.01 0.00 3.14 0.00 0.00 58.73 61.84 1mws h TYR 380 Cb 0.12 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.06 1mws h TYR 380 CO -0.01 1.02 0.45 -0.91 -1.64 0.00 0.00 178.16 177.07 1mws h ASN 381 N 0.92 0.79 -0.32 -2.11 2.35 -0.45 -1.22 115.58 115.55 1mws h ASN 381 Ca 0.16 -0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.91 1mws h ASN 381 Cb 0.61 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 1mws h ASN 381 CO 0.04 0.57 0.21 0.11 -1.65 0.00 0.00 177.43 176.71 1mws h LYS 382 N 0.93 0.32 0.01 0.81 1.79 -1.09 0.39 116.57 119.73 1mws h LYS 382 Ca 0.25 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.70 1mws h LYS 382 Cb -0.10 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.48 1mws h LYS 382 CO -0.05 0.21 -0.00 -0.07 -1.08 0.00 0.00 179.45 178.46 1mws h LEU 383 N 0.33 -0.01 -1.09 2.94 3.38 -1.28 -3.00 115.31 116.59 1mws h LEU 383 Ca 0.13 -0.83 -0.06 0.00 0.09 0.00 0.00 57.88 57.21 1mws h LEU 383 Cb 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1mws h LEU 383 CO -0.03 0.87 0.02 0.71 0.09 0.00 0.00 178.44 180.10 1mws h THR 384 N -0.93 1.22 0.00 0.22 1.35 -1.24 -2.79 112.91 110.75 1mws h THR 384 Ca -0.00 -0.87 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 1mws h THR 384 Cb 0.84 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 1mws h THR 384 CO 0.00 0.31 -0.02 -0.62 -0.25 0.00 0.00 175.52 174.93 1mws n GLU 385 N -4.25 0.04 -1.78 4.72 1.02 0.11 -4.86 120.64 115.64 1mws n GLU 385 Ca 0.02 0.03 -0.42 0.00 -0.02 0.00 0.00 57.16 56.78 1mws n GLU 385 Cb 0.26 -1.55 -0.03 0.00 -0.02 0.00 0.00 31.44 30.10 1mws n GLU 385 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1mws s ASP 386 N -3.25 6.50 0.52 1.62 -1.08 -1.05 -4.90 116.67 115.03 1mws s ASP 386 Ca 0.13 2.62 0.20 0.00 -0.52 0.00 0.00 52.55 54.98 1mws s ASP 386 Cb 0.18 -2.55 1.36 0.00 -1.46 0.00 0.00 42.92 40.45 1mws s ASP 386 CO 0.55 -0.98 2.13 0.11 0.52 0.00 0.00 175.17 177.50 1mws h LYS 387 N 9.16 0.00 0.00 4.34 1.79 -1.90 -1.66 116.57 128.30 1mws h LYS 387 Ca -0.45 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 1mws h LYS 387 Cb 1.22 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 1mws h LYS 387 CO 0.94 0.05 0.00 1.63 -1.08 0.00 0.00 179.45 180.99 1mws n LYS 388 N -4.24 0.85 -4.07 3.15 5.02 -1.26 -4.94 118.16 112.67 1mws n LYS 388 Ca -0.03 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.85 1mws n LYS 388 Cb 0.14 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1mws n LYS 388 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1mws n GLU 389 N -0.87 -0.61 -0.32 1.97 1.02 -0.62 -4.29 120.64 116.91 1mws n GLU 389 Ca 0.15 0.13 0.10 0.00 -0.02 0.00 0.00 57.16 57.52 1mws n GLU 389 Cb 0.07 -2.98 0.31 0.00 -0.02 0.00 0.00 31.44 28.82 1mws n GLU 389 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1mws h PRO 390 N -2.38 0.82 0.00 3.49 0.11 -1.81 -0.41 132.00 131.81 1mws h PRO 390 Ca -0.70 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.34 1mws h PRO 390 Cb 1.40 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1mws h PRO 390 CO 0.55 0.55 -0.12 -0.07 -0.21 0.00 0.00 178.00 178.69 1mws h LEU 391 N 0.85 0.00 -9.74 2.35 4.07 -1.85 -3.43 115.31 107.56 1mws h LEU 391 Ca 0.48 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.92 1mws h LEU 391 Cb 0.62 0.00 0.03 0.00 1.08 0.00 0.00 40.66 42.39 1mws h LEU 391 CO -0.25 0.12 0.59 -0.22 -1.08 0.00 0.00 178.44 177.61 1mws s LEU 392 N -7.05 4.45 -0.77 1.67 0.20 -0.17 -4.97 118.68 112.05 1mws s LEU 392 Ca -0.02 2.39 -0.17 0.00 0.69 0.00 0.00 54.13 57.02 1mws s LEU 392 Cb 0.12 -3.62 0.15 0.00 -0.43 0.00 0.00 46.19 42.41 1mws s LEU 392 CO 0.58 -0.42 0.85 0.21 -0.29 0.00 0.00 176.35 177.28 1mws s ASN 393 N -0.11 6.51 0.23 3.68 3.84 -1.26 -4.88 114.94 122.95 1mws s ASN 393 Ca 0.52 -2.05 0.22 0.00 0.21 0.00 0.00 52.86 51.76 1mws s ASN 393 Cb -0.35 -2.30 0.94 0.00 -0.55 0.00 0.00 41.25 38.99 1mws s ASN 393 CO 0.41 -0.91 1.67 0.29 -2.79 0.00 0.00 177.10 175.78 1mws n LYS 394 N 5.57 0.17 0.00 0.43 4.01 -1.26 -2.29 118.16 124.79 1mws n LYS 394 Ca 0.08 0.41 0.13 0.00 -0.51 0.00 0.00 58.31 58.42 1mws n LYS 394 Cb 0.46 -1.83 0.34 0.00 -0.51 0.00 0.00 35.03 33.50 1mws n LYS 394 CO 0.00 0.00 0.00 1.97 -1.11 0.00 0.00 177.40 178.26 1mws n PHE 395 N -2.14 0.00 -0.11 2.13 -1.74 -1.26 -4.25 117.46 110.09 1mws n PHE 395 Ca 0.02 0.00 -0.20 0.00 -0.56 0.00 0.00 57.45 56.72 1mws n PHE 395 Cb 0.21 -0.08 -0.12 0.00 1.52 0.00 0.00 39.48 41.01 1mws n PHE 395 CO 0.00 0.00 0.00 0.94 -0.56 0.00 0.00 176.76 177.14 1mws n GLN 396 N -0.36 0.66 -1.44 3.97 7.27 -0.97 -4.46 117.38 122.06 1mws n GLN 396 Ca 0.13 0.19 -0.30 0.00 0.07 0.00 0.00 57.00 57.09 1mws n GLN 396 Cb 0.37 -1.55 0.20 0.00 2.41 0.00 0.00 30.24 31.67 1mws n GLN 396 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 1mws s ILE 397 N -2.52 1.82 0.24 1.69 -4.36 -1.12 -1.79 121.20 115.15 1mws s ILE 397 Ca -0.33 0.00 -0.00 0.00 -0.26 0.00 0.00 60.65 60.06 1mws s ILE 397 Cb 0.09 -2.70 -0.04 0.00 1.25 0.00 0.00 42.46 41.06 1mws s ILE 397 CO 0.62 0.00 0.43 0.42 0.24 0.00 0.00 174.94 176.65 1mws s THR 398 N -3.33 5.17 0.24 8.37 -4.23 -1.26 -4.16 115.64 116.44 1mws s THR 398 Ca 0.70 -0.40 -0.13 0.00 -1.18 0.00 0.00 61.69 60.69 1mws s THR 398 Cb -0.09 -3.77 -0.00 0.00 1.34 0.00 0.00 72.50 69.98 1mws s THR 398 CO 0.55 -0.27 0.47 0.28 -0.54 0.00 0.00 174.62 175.10 1mws s THR 399 N -1.98 0.00 0.06 3.99 -1.32 0.78 -4.79 115.64 112.39 1mws s THR 399 Ca 0.39 -1.39 -0.31 0.00 -1.21 0.00 0.00 61.69 59.17 1mws s THR 399 Cb -0.11 -2.17 -0.07 0.00 -1.51 0.00 0.00 72.50 68.64 1mws s THR 399 CO 0.30 -0.01 1.40 -0.55 -2.21 0.00 0.00 174.62 173.55 1mws s SER 400 N -3.01 6.84 0.54 8.08 0.15 -1.26 -0.39 113.70 124.64 1mws s SER 400 Ca 0.22 2.23 0.32 0.00 0.70 0.00 0.00 55.95 59.42 1mws s SER 400 Cb -0.00 -2.57 1.40 0.00 -1.71 0.00 0.00 66.02 63.13 1mws s SER 400 CO 0.08 -0.68 2.01 1.55 1.20 0.00 0.00 173.24 177.40 1mws h PRO 401 N 7.29 0.00 0.00 5.44 0.13 -1.85 -3.47 132.00 139.54 1mws h PRO 401 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1mws h PRO 401 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1mws h PRO 401 CO 0.88 0.06 0.00 0.41 -0.23 0.00 0.00 178.00 179.12 1mws n GLY 402 N -0.15 0.00 3.04 1.56 0.00 -1.24 -3.84 105.19 104.56 1mws n GLY 402 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1mws n GLY 402 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mws n THR 404 N 0.00 0.00 0.17 2.61 -2.24 -1.26 -3.60 114.28 109.95 1mws n THR 404 Ca 0.00 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 1mws n THR 404 Cb 0.00 0.00 0.66 0.00 -2.10 0.00 0.00 70.33 68.89 1mws n THR 404 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1mws h GLN 405 N 0.00 0.01 -1.00 -0.78 5.75 -1.88 -2.58 115.11 114.61 1mws h GLN 405 Ca 0.00 -0.00 0.15 0.00 -0.15 0.00 0.00 58.65 58.65 1mws h GLN 405 Cb 0.00 -0.00 -0.09 0.00 1.07 0.00 0.00 27.48 28.45 1mws h GLN 405 CO 0.00 0.00 0.62 0.87 -2.65 0.00 0.00 178.83 177.68 1mws h LYS 406 N 0.01 0.87 -0.25 1.69 1.57 -1.75 0.61 116.57 119.32 1mws h LYS 406 Ca 0.09 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.69 1mws h LYS 406 Cb 0.36 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1mws h LYS 406 CO -0.00 0.57 -0.38 0.82 -0.57 0.00 0.00 179.45 179.89 1mws h ILE 407 N 0.89 1.30 -0.30 1.86 1.08 -1.82 -0.72 117.51 119.80 1mws h ILE 407 Ca 0.53 -1.53 -0.15 0.00 -0.39 0.00 0.00 64.86 63.32 1mws h ILE 407 Cb 0.67 1.52 -0.01 0.00 -3.07 0.00 0.00 36.82 35.94 1mws h ILE 407 CO -0.31 0.48 -0.41 -0.07 -0.69 0.00 0.00 178.15 177.15 1mws h LEU 408 N 0.47 0.79 -0.74 1.44 3.38 -1.19 -1.04 115.31 118.42 1mws h LEU 408 Ca 0.04 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1mws h LEU 408 Cb 0.88 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 1mws h LEU 408 CO 0.08 1.09 0.44 0.74 0.09 0.00 0.00 178.44 180.88 1mws h THR 409 N 0.60 1.21 -0.74 0.22 2.02 -0.71 -1.65 112.91 113.87 1mws h THR 409 Ca 0.05 -0.48 -0.06 0.00 0.77 0.00 0.00 66.41 66.68 1mws h THR 409 Cb 0.95 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1mws h THR 409 CO 0.09 0.22 0.21 0.00 0.37 0.00 0.00 175.52 176.42 1mws h ALA 410 N 1.23 0.98 -0.39 6.16 0.00 -0.88 -1.25 119.26 125.10 1mws h ALA 410 Ca 0.26 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1mws h ALA 410 Cb -0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1mws h ALA 410 CO -0.05 0.67 0.21 0.52 0.00 0.00 0.00 179.25 180.60 1mws h MET 411 N 1.11 0.54 -0.42 0.00 2.07 -0.73 0.58 114.93 118.08 1mws h MET 411 Ca 0.24 -0.07 -0.06 0.00 -2.07 0.00 0.00 59.70 57.74 1mws h MET 411 Cb 0.33 -0.10 -0.02 0.00 -1.87 0.00 0.00 31.60 29.94 1mws h MET 411 CO -0.00 0.45 0.02 0.82 1.07 0.00 0.00 176.91 179.27 1mws h ILE 412 N 0.49 1.26 -0.29 -1.22 2.04 -1.08 -0.25 117.51 118.46 1mws h ILE 412 Ca 0.14 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 65.01 1mws h ILE 412 Cb 0.07 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1mws h ILE 412 CO -0.02 0.34 0.19 1.23 0.00 0.00 0.00 178.15 179.89 1mws h GLY 413 N 0.57 0.41 1.02 5.37 0.00 -1.04 -0.12 103.07 109.28 1mws h GLY 413 Ca 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 1mws h GLY 413 CO 0.02 0.15 0.31 1.41 0.00 0.00 0.00 176.54 178.43 1mws h LEU 414 N 0.39 0.96 -0.99 3.11 3.38 -0.76 -0.90 115.31 120.49 1mws h LEU 414 Ca 0.11 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1mws h LEU 414 Cb -0.04 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1mws h LEU 414 CO -0.02 0.85 -0.04 -1.13 0.09 0.00 0.00 178.44 178.18 1mws h ASN 415 N 1.00 0.66 0.16 -0.43 -0.73 -0.65 -1.81 115.58 113.78 1mws h ASN 415 Ca 0.24 -0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.25 1mws h ASN 415 Cb 0.17 -0.17 0.00 0.00 0.27 0.00 0.00 38.32 38.59 1mws h ASN 415 CO -0.02 0.75 -0.03 0.59 -0.37 0.00 0.00 177.43 178.35 1mws n ASN 416 N -4.21 0.40 -1.66 1.15 3.02 -0.09 -4.90 115.26 108.97 1mws n ASN 416 Ca 0.02 -0.88 -0.20 0.00 -0.03 0.00 0.00 54.58 53.49 1mws n ASN 416 Cb 0.31 -0.05 -0.08 0.00 -0.61 0.00 0.00 39.78 39.35 1mws n ASN 416 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1mws n LYS 417 N -0.80 -1.46 0.00 3.52 5.02 -0.44 -4.79 118.16 119.20 1mws n LYS 417 Ca 0.19 1.13 0.13 0.00 -2.02 0.00 0.00 58.31 57.75 1mws n LYS 417 Cb 0.21 -5.53 0.36 0.00 -0.02 0.00 0.00 35.03 30.05 1mws n LYS 417 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1mws n THR 418 N -2.47 0.00 -3.97 -0.18 -2.24 -0.61 -4.82 114.28 100.00 1mws n THR 418 Ca -0.20 -0.19 -0.14 0.00 -2.27 0.00 0.00 64.05 61.25 1mws n THR 418 Cb 0.65 0.57 -0.15 0.00 -2.10 0.00 0.00 70.33 69.30 1mws n THR 418 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1mws s LEU 419 N -2.36 1.80 0.00 3.22 0.20 -1.02 -4.98 118.68 115.54 1mws s LEU 419 Ca 0.27 -0.03 -0.05 0.00 0.69 0.00 0.00 54.13 55.01 1mws s LEU 419 Cb 0.20 -0.13 0.02 0.00 -0.43 0.00 0.00 46.19 45.84 1mws s LEU 419 CO 0.47 -0.00 0.37 -0.90 -0.29 0.00 0.00 176.35 176.00 1mws n ASP 420 N 3.29 -1.06 0.00 3.68 5.68 -1.26 -4.03 116.55 122.85 1mws n ASP 420 Ca -0.16 -2.02 0.08 0.00 -0.50 0.00 0.00 54.79 52.19 1mws n ASP 420 Cb 0.57 1.84 0.46 0.00 -1.14 0.00 0.00 41.12 42.85 1mws n ASP 420 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1mws n ASP 421 N -1.58 0.00 -0.00 -1.12 5.75 -1.26 -2.49 116.55 115.85 1mws n ASP 421 Ca -0.02 -0.69 0.05 0.00 -0.01 0.00 0.00 54.79 54.12 1mws n ASP 421 Cb 0.34 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.36 1mws n ASP 421 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1mws n LYS 422 N -0.91 0.33 -1.65 0.11 5.02 -1.26 -4.89 118.16 114.90 1mws n LYS 422 Ca 0.12 -0.08 -0.44 0.00 -2.02 0.00 0.00 58.31 55.88 1mws n LYS 422 Cb 0.05 -1.21 -0.02 0.00 -0.02 0.00 0.00 35.03 33.83 1mws n LYS 422 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1mws n THR 423 N -1.81 1.50 -3.72 -0.18 -1.04 -1.04 -4.99 114.28 103.00 1mws n THR 423 Ca -0.02 -0.37 -0.14 0.00 -2.04 0.00 0.00 64.05 61.48 1mws n THR 423 Cb 0.24 -1.34 -0.09 0.00 -1.82 0.00 0.00 70.33 67.32 1mws n THR 423 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1mws s SER 424 N -0.11 -0.37 0.05 8.00 1.04 -1.26 -3.94 113.70 117.12 1mws s SER 424 Ca 0.63 0.52 0.09 0.00 0.48 0.00 0.00 55.95 57.67 1mws s SER 424 Cb -0.65 0.60 -0.03 0.00 0.10 0.00 0.00 66.02 66.04 1mws s SER 424 CO 0.56 -0.33 -0.25 -0.31 0.98 0.00 0.00 173.24 173.89 1mws s TYR 425 N -0.59 2.17 -0.30 5.02 1.51 -0.03 -4.87 117.35 120.26 1mws s TYR 425 Ca -0.07 -0.40 -0.25 0.00 -1.01 0.00 0.00 57.07 55.34 1mws s TYR 425 Cb -0.04 -1.29 0.00 0.00 -0.11 0.00 0.00 41.96 40.53 1mws s TYR 425 CO 0.03 0.13 0.87 0.15 -1.11 0.00 0.00 175.55 175.63 1mws s LYS 426 N -1.29 4.02 -0.03 -0.62 1.02 -1.26 0.85 119.74 122.44 1mws s LYS 426 Ca 0.11 0.77 0.02 0.00 0.02 0.00 0.00 55.97 56.89 1mws s LYS 426 Cb -0.10 -3.72 0.01 0.00 -0.52 0.00 0.00 37.83 33.50 1mws s LYS 426 CO 0.02 -0.72 -0.08 0.42 -0.92 0.00 0.00 175.35 174.08 1mws s ILE 427 N 3.13 0.71 -0.16 2.17 1.01 0.31 -4.97 121.20 123.40 1mws s ILE 427 Ca 0.36 -0.31 -0.22 0.00 0.00 0.00 0.00 60.65 60.49 1mws s ILE 427 Cb -0.14 -0.64 0.06 0.00 0.01 0.00 0.00 42.46 41.74 1mws s ILE 427 CO 0.12 0.23 0.57 1.51 0.00 0.00 0.00 174.94 177.37 1mws s ASP 428 N 0.29 -0.57 0.00 3.58 1.47 -1.26 -0.55 116.67 119.63 1mws s ASP 428 Ca -0.04 0.96 0.00 0.00 1.18 0.00 0.00 52.55 54.65 1mws s ASP 428 Cb -0.09 0.97 0.00 0.00 -0.34 0.00 0.00 42.92 43.46 1mws s ASP 428 CO 0.00 -0.30 0.00 0.61 0.68 0.00 0.00 175.17 176.16 1mws n GLY 429 N 2.26 -2.29 0.07 2.12 0.00 -1.26 -4.56 105.19 101.53 1mws n GLY 429 Ca -0.15 -1.71 0.10 0.00 0.00 0.00 0.00 46.02 44.26 1mws n GLY 429 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mws n LYS 430 N -0.18 0.63 -4.51 1.61 5.02 -1.26 -4.81 118.16 114.66 1mws n LYS 430 Ca 0.00 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.03 1mws n LYS 430 Cb 0.00 -1.70 -0.10 0.00 -0.02 0.00 0.00 35.03 33.21 1mws n LYS 430 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1mws s GLY 431 N -4.48 2.23 -0.16 0.72 0.00 -1.26 -1.17 107.32 103.20 1mws s GLY 431 Ca -0.04 -2.11 -0.29 0.00 0.00 0.00 0.00 44.72 42.28 1mws s GLY 431 CO 0.84 -2.02 0.89 0.86 0.00 0.00 0.00 173.10 173.67 1mws s TRP 432 N -2.61 -0.51 -0.01 1.90 -0.00 -0.88 -4.82 118.94 112.01 1mws s TRP 432 Ca 0.33 0.98 -0.06 0.00 -0.00 0.00 0.00 56.10 57.36 1mws s TRP 432 Cb 0.03 0.41 0.00 0.00 -0.00 0.00 0.00 33.47 33.91 1mws s TRP 432 CO 0.17 -0.40 0.11 1.14 -0.00 0.00 0.00 176.95 177.98 1mws s GLN 433 N -0.76 0.37 0.26 5.86 -2.07 -1.26 -0.42 119.66 121.64 1mws s GLN 433 Ca -0.03 -0.27 -0.02 0.00 -1.82 0.00 0.00 55.36 53.21 1mws s GLN 433 Cb -0.02 0.16 0.56 0.00 -1.09 0.00 0.00 33.01 32.62 1mws s GLN 433 CO 0.02 -0.08 1.67 -0.22 -1.32 0.00 0.00 175.29 175.36 1mws h LYS 434 N 4.77 0.24 0.00 9.60 3.64 -1.99 -3.46 116.57 129.37 1mws h LYS 434 Ca -0.29 -0.01 0.32 0.00 -1.27 0.00 0.00 60.65 59.39 1mws h LYS 434 Cb 1.20 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.90 1mws h LYS 434 CO 0.41 0.16 0.80 -0.40 -2.27 0.00 0.00 179.45 178.14 1mws n ASP 435 N -5.19 -0.81 0.20 4.20 5.68 -1.26 -5.02 116.55 114.35 1mws n ASP 435 Ca 0.17 -1.03 0.18 0.00 -0.50 0.00 0.00 54.79 53.61 1mws n ASP 435 Cb 0.54 1.22 0.74 0.00 -1.14 0.00 0.00 41.12 42.48 1mws n ASP 435 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 1mws h LYS 436 N 0.00 0.00 0.00 0.11 3.64 -1.91 -1.43 116.57 116.98 1mws h LYS 436 Ca -0.15 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1mws h LYS 436 Cb 0.92 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.74 1mws h LYS 436 CO 0.23 0.00 -0.05 0.66 -2.27 0.00 0.00 179.45 178.02 1mws h SER 437 N 0.00 0.00 0.10 4.20 4.64 -1.99 0.35 113.55 120.86 1mws h SER 437 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1mws h SER 437 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1mws h SER 437 CO -0.00 0.05 0.00 0.79 -0.87 0.00 0.00 176.83 176.80 1mws n TRP 438 N -4.01 0.00 0.00 4.77 7.02 -0.54 -4.95 117.44 119.73 1mws n TRP 438 Ca -0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.45 1mws n TRP 438 Cb 0.14 -0.08 0.00 0.00 -2.42 0.00 0.00 31.31 28.95 1mws n TRP 438 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1mws n GLY 439 N 0.28 3.69 0.03 6.99 0.00 0.11 -1.95 105.19 114.34 1mws n GLY 439 Ca 0.13 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1mws n GLY 439 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mws n GLY 440 N 0.00 -1.44 3.75 -0.02 0.00 -1.26 -4.90 105.19 101.32 1mws n GLY 440 Ca 0.00 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 1mws n GLY 440 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mws s TYR 441 N -3.05 3.63 -0.01 1.61 5.04 -0.82 -5.04 117.35 118.70 1mws s TYR 441 Ca 0.11 1.69 -0.05 0.00 -2.44 0.00 0.00 57.07 56.37 1mws s TYR 441 Cb 0.16 -3.25 0.00 0.00 0.35 0.00 0.00 41.96 39.22 1mws s TYR 441 CO 0.63 -0.46 0.11 -0.80 -1.34 0.00 0.00 175.55 173.69 1mws s ASN 442 N -0.64 0.03 -0.09 4.32 0.01 -1.26 -4.72 114.94 112.59 1mws s ASN 442 Ca 0.46 -0.16 -0.24 0.00 -0.71 0.00 0.00 52.86 52.21 1mws s ASN 442 Cb -0.30 0.20 -0.03 0.00 0.41 0.00 0.00 41.25 41.53 1mws s ASN 442 CO 0.38 -0.29 0.74 -0.69 -1.51 0.00 0.00 177.10 175.73 1mws s VAL 443 N -1.09 5.00 0.05 1.60 1.01 0.43 -4.86 120.40 122.54 1mws s VAL 443 Ca -0.12 1.50 0.06 0.00 0.00 0.00 0.00 61.98 63.42 1mws s VAL 443 Cb -0.07 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1mws s VAL 443 CO 0.01 0.19 -0.15 0.42 0.00 0.00 0.00 175.10 175.57 1mws s THR 444 N 1.16 3.05 0.20 3.92 -4.23 -1.26 -2.07 115.64 116.41 1mws s THR 444 Ca 0.38 -1.13 0.09 0.00 -1.18 0.00 0.00 61.69 59.85 1mws s THR 444 Cb -0.18 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.30 1mws s THR 444 CO 0.17 0.31 -0.07 0.00 -0.54 0.00 0.00 174.62 174.49 1mws s ARG 445 N -1.57 2.13 -0.01 3.99 1.70 -0.31 -4.72 118.95 120.15 1mws s ARG 445 Ca 0.16 -1.30 0.00 0.00 -0.47 0.00 0.00 55.73 54.12 1mws s ARG 445 Cb -0.11 -2.16 -0.26 0.00 -0.57 0.00 0.00 34.95 31.85 1mws s ARG 445 CO 0.07 0.42 0.81 0.10 -1.08 0.00 0.00 175.30 175.62 1mws h TYR 446 N 2.65 0.33 -3.62 5.89 -0.00 -1.89 -3.45 116.97 116.88 1mws h TYR 446 Ca -0.46 -0.24 -0.68 0.00 -0.00 0.00 0.00 58.73 57.35 1mws h TYR 446 Cb 1.22 -0.01 -0.31 0.00 -0.00 0.00 0.00 36.73 37.63 1mws h TYR 446 CO 0.66 1.32 -0.69 -2.00 -0.00 0.00 0.00 178.16 177.44 1mws s GLU 447 N -2.62 2.74 -0.29 0.10 2.12 -1.26 -5.08 118.70 114.42 1mws s GLU 447 Ca -0.09 -1.06 -0.25 0.00 0.36 0.00 0.00 54.97 53.93 1mws s GLU 447 Cb 0.07 -3.17 0.00 0.00 0.26 0.00 0.00 34.13 31.30 1mws s GLU 447 CO 0.84 -0.50 0.87 0.08 -0.54 0.00 0.00 175.26 176.01 1mws s VAL 448 N 1.35 4.74 -0.26 3.70 1.01 -1.26 -4.95 120.40 124.72 1mws s VAL 448 Ca -0.01 1.44 -0.02 0.00 0.00 0.00 0.00 61.98 63.39 1mws s VAL 448 Cb -0.18 -4.20 0.08 0.00 0.00 0.00 0.00 36.38 32.08 1mws s VAL 448 CO -0.01 -0.25 0.07 0.68 0.00 0.00 0.00 175.10 175.59 1mws s VAL 449 N 3.09 0.64 0.34 2.92 -7.23 -1.26 -5.05 120.40 113.85 1mws s VAL 449 Ca 0.36 -0.98 -0.21 0.00 -1.81 0.00 0.00 61.98 59.34 1mws s VAL 449 Cb -0.14 -1.34 -0.10 0.00 0.56 0.00 0.00 36.38 35.37 1mws s VAL 449 CO 0.11 -0.49 0.87 0.20 -0.31 0.00 0.00 175.10 175.49 1mws s ASN 450 N 1.77 7.05 0.00 4.85 0.01 -1.26 -4.72 114.94 122.64 1mws s ASN 450 Ca 0.05 1.61 0.00 0.00 -0.71 0.00 0.00 52.86 53.81 1mws s ASN 450 Cb -0.17 -2.50 0.00 0.00 0.41 0.00 0.00 41.25 38.99 1mws s ASN 450 CO -0.20 -0.18 0.00 0.61 -1.51 0.00 0.00 177.10 175.83 1mws n GLY 451 N 0.01 0.48 3.55 0.66 0.00 0.29 -4.96 105.19 105.21 1mws n GLY 451 Ca 0.03 -2.09 -0.43 0.00 0.00 0.00 0.00 46.02 43.53 1mws n GLY 451 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mws s ASN 452 N -4.00 6.43 -0.22 1.61 0.01 -1.26 -0.53 114.94 116.99 1mws s ASN 452 Ca 0.00 -0.07 -0.15 0.00 -0.71 0.00 0.00 52.86 51.94 1mws s ASN 452 Cb 0.00 -2.42 -0.04 0.00 0.41 0.00 0.00 41.25 39.20 1mws s ASN 452 CO 0.00 -1.01 0.35 -0.63 -1.51 0.00 0.00 177.10 174.29 1mws s ILE 453 N 3.56 5.23 0.52 0.60 -1.09 0.25 -4.84 121.20 125.42 1mws s ILE 453 Ca 0.33 0.59 0.08 0.00 -2.23 0.00 0.00 60.65 59.41 1mws s ILE 453 Cb -0.11 -3.68 0.05 0.00 -1.58 0.00 0.00 42.46 37.13 1mws s ILE 453 CO 0.24 0.26 0.60 1.51 -1.23 0.00 0.00 174.94 176.31 1mws s ASP 454 N 1.12 5.08 0.22 3.58 1.47 -1.26 -0.85 116.67 126.02 1mws s ASP 454 Ca 0.16 -0.85 -0.09 0.00 1.18 0.00 0.00 52.55 52.95 1mws s ASP 454 Cb -0.15 0.03 0.19 0.00 -0.34 0.00 0.00 42.92 42.66 1mws s ASP 454 CO 0.07 -1.08 1.88 0.25 0.68 0.00 0.00 175.17 176.97 1mws h LEU 455 N 0.52 0.88 -0.61 2.11 5.85 -1.85 -1.06 115.31 121.15 1mws h LEU 455 Ca -0.35 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.38 1mws h LEU 455 Cb 1.29 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.07 1mws h LEU 455 CO 0.48 0.63 0.38 0.11 -0.34 0.00 0.00 178.44 179.69 1mws h LYS 456 N 1.04 0.73 -0.12 1.25 1.57 -1.94 -1.35 116.57 117.75 1mws h LYS 456 Ca 0.30 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1mws h LYS 456 Cb -0.07 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 1mws h LYS 456 CO -0.08 0.48 0.05 0.37 -0.57 0.00 0.00 179.45 179.70 1mws h GLN 457 N 0.75 0.18 -0.69 3.15 5.75 -1.88 -1.52 115.11 120.85 1mws h GLN 457 Ca 0.24 -0.03 0.11 0.00 -0.15 0.00 0.00 58.65 58.82 1mws h GLN 457 Cb 0.00 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.48 1mws h GLN 457 CO -0.09 0.28 0.46 0.00 -2.65 0.00 0.00 178.83 176.83 1mws h ALA 458 N 0.88 2.00 -0.06 3.38 0.00 -0.84 0.15 119.26 124.78 1mws h ALA 458 Ca 0.04 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1mws h ALA 458 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1mws h ALA 458 CO -0.00 -0.16 -0.21 0.82 0.00 0.00 0.00 179.25 179.69 1mws h ILE 459 N 0.47 1.44 -0.58 0.00 2.04 -1.08 0.82 117.51 120.62 1mws h ILE 459 Ca 0.32 -1.62 0.09 0.00 1.00 0.00 0.00 64.86 64.65 1mws h ILE 459 Cb 0.63 2.33 -0.07 0.00 -0.74 0.00 0.00 36.82 38.97 1mws h ILE 459 CO -0.10 0.45 0.21 -0.08 0.00 0.00 0.00 178.15 178.63 1mws h GLU 460 N -0.27 0.38 -0.63 2.37 4.81 0.11 -2.57 114.58 118.79 1mws h GLU 460 Ca -0.01 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1mws h GLU 460 Cb 0.85 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.14 1mws h GLU 460 CO 0.05 0.25 0.00 -1.13 -0.73 0.00 0.00 179.01 177.45 1mws n SER 461 N -5.00 3.70 -3.99 1.04 3.41 0.32 -4.61 113.62 108.49 1mws n SER 461 Ca 0.08 -1.99 -0.29 0.00 -0.26 0.00 0.00 58.87 56.40 1mws n SER 461 Cb 0.25 -0.42 -0.02 0.00 -0.26 0.00 0.00 64.21 63.76 1mws n SER 461 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1mws n SER 462 N 1.40 -1.07 -4.60 4.04 2.88 0.14 -4.62 113.62 111.79 1mws n SER 462 Ca 0.21 -1.08 -0.43 0.00 -1.33 0.00 0.00 58.87 56.24 1mws n SER 462 Cb 0.58 -2.73 -0.03 0.00 -0.75 0.00 0.00 64.21 61.29 1mws n SER 462 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1mws s ASP 463 N -4.19 6.01 0.32 -3.46 2.15 -0.35 -4.81 116.67 112.33 1mws s ASP 463 Ca 0.11 1.22 0.00 0.00 0.43 0.00 0.00 52.55 54.30 1mws s ASP 463 Cb -0.05 -2.53 0.52 0.00 -0.30 0.00 0.00 42.92 40.56 1mws s ASP 463 CO 0.91 -1.63 1.94 0.78 -0.17 0.00 0.00 175.17 177.00 1mws h ASN 464 N 12.32 0.78 -0.29 -0.34 2.35 -1.88 -3.08 115.58 125.46 1mws h ASN 464 Ca -0.32 -0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.29 1mws h ASN 464 Cb 1.15 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.32 1mws h ASN 464 CO 1.04 0.64 -0.11 0.40 -1.65 0.00 0.00 177.43 177.75 1mws h ILE 465 N 0.89 1.29 -0.20 2.81 2.04 -1.90 -0.92 117.51 121.53 1mws h ILE 465 Ca 0.23 -1.18 0.05 0.00 1.00 0.00 0.00 64.86 64.96 1mws h ILE 465 Cb 0.03 1.46 -0.06 0.00 -0.74 0.00 0.00 36.82 37.51 1mws h ILE 465 CO -0.04 0.38 -0.21 0.15 0.00 0.00 0.00 178.15 178.43 1mws h PHE 466 N 0.33 -0.56 0.00 1.37 3.57 -1.96 -0.17 116.94 119.53 1mws h PHE 466 Ca 0.07 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.51 1mws h PHE 466 Cb 0.62 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 1mws h PHE 466 CO 0.06 -0.29 -0.42 0.74 -2.23 0.00 0.00 178.31 176.17 1mws h PHE 467 N -0.24 0.00 -0.56 0.41 -1.00 -1.51 -1.73 116.94 112.32 1mws h PHE 467 Ca 0.12 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.85 1mws h PHE 467 Cb 0.42 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.96 1mws h PHE 467 CO -0.35 0.42 0.13 0.00 -1.61 0.00 0.00 178.31 176.90 1mws h ALA 468 N 1.58 0.73 -0.17 2.45 0.00 -0.43 -2.26 119.26 121.16 1mws h ALA 468 Ca -0.00 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 1mws h ALA 468 Cb 0.90 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1mws h ALA 468 CO 0.05 0.44 -0.34 0.00 0.00 0.00 0.00 179.25 179.40 1mws h ARG 469 N 0.79 0.36 -0.61 0.00 3.08 -0.62 -2.02 114.38 115.36 1mws h ARG 469 Ca 0.17 -0.15 -0.09 0.00 0.07 0.00 0.00 59.98 59.98 1mws h ARG 469 Cb 0.35 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1mws h ARG 469 CO 0.00 0.66 0.02 0.28 -1.07 0.00 0.00 179.97 179.86 1mws h VAL 470 N 0.31 1.26 -0.25 2.04 2.07 -1.07 -1.46 116.25 119.15 1mws h VAL 470 Ca 0.04 -1.12 -0.04 0.00 0.82 0.00 0.00 66.70 66.40 1mws h VAL 470 Cb 0.75 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1mws h VAL 470 CO 0.06 0.41 0.01 0.00 0.02 0.00 0.00 177.57 178.07 1mws h ALA 471 N 1.04 0.34 -0.90 1.67 0.00 -1.14 -1.65 119.26 118.62 1mws h ALA 471 Ca 0.18 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1mws h ALA 471 Cb 0.53 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1mws h ALA 471 CO 0.03 0.06 0.57 -0.07 0.00 0.00 0.00 179.25 179.83 1mws h LEU 472 N 0.22 0.90 -1.32 0.00 3.38 -1.25 -0.52 115.31 116.73 1mws h LEU 472 Ca 0.07 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1mws h LEU 472 Cb 0.39 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1mws h LEU 472 CO 0.01 0.58 0.25 -0.08 0.09 0.00 0.00 178.44 179.29 1mws h GLU 473 N 1.04 0.71 0.00 1.13 4.57 -1.04 -2.46 114.58 118.53 1mws h GLU 473 Ca 0.39 -0.08 -0.19 0.00 -1.18 0.00 0.00 59.36 58.30 1mws h GLU 473 Cb 0.15 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 1mws h GLU 473 CO -0.17 0.55 -0.88 -0.07 -1.18 0.00 0.00 179.01 177.26 1mws h LEU 474 N 0.72 0.02 0.00 1.64 3.38 -0.17 -3.50 115.31 117.39 1mws h LEU 474 Ca 0.18 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1mws h LEU 474 Cb 0.07 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1mws h LEU 474 CO -0.03 0.89 0.00 0.61 0.09 0.00 0.00 178.44 180.00 1mws n GLY 475 N 0.99 -2.59 0.27 0.83 0.00 -0.42 -3.90 105.19 100.37 1mws n GLY 475 Ca -0.01 -1.35 0.02 0.00 0.00 0.00 0.00 46.02 44.68 1mws n GLY 475 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1mws h SER 476 N 0.00 0.48 -0.11 1.61 4.64 -1.82 -1.03 113.55 117.32 1mws h SER 476 Ca 0.00 0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1mws h SER 476 Cb 0.00 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 1mws h SER 476 CO 0.00 0.27 0.07 0.50 -0.87 0.00 0.00 176.83 176.80 1mws h LYS 477 N 0.62 0.15 -0.08 4.77 3.64 -1.91 -0.59 116.57 123.17 1mws h LYS 477 Ca 0.36 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.63 1mws h LYS 477 Cb 0.38 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1mws h LYS 477 CO -0.27 0.14 -0.37 0.87 -2.27 0.00 0.00 179.45 177.56 1mws h LYS 478 N 0.11 0.16 0.29 1.90 1.57 -1.62 -1.93 116.57 117.06 1mws h LYS 478 Ca 0.04 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1mws h LYS 478 Cb 0.03 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1mws h LYS 478 CO -0.01 0.51 -0.14 0.35 -0.57 0.00 0.00 179.45 179.60 1mws h PHE 479 N 0.14 -0.36 -0.46 -1.35 3.57 -0.84 -0.37 116.94 117.27 1mws h PHE 479 Ca 0.02 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.51 1mws h PHE 479 Cb 0.72 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.55 1mws h PHE 479 CO 0.01 -0.05 0.31 1.49 -2.23 0.00 0.00 178.31 177.83 1mws h GLU 480 N -0.68 0.61 -0.67 1.11 4.81 -1.09 -0.76 114.58 117.91 1mws h GLU 480 Ca -0.04 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1mws h GLU 480 Cb 0.47 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.67 1mws h GLU 480 CO 0.07 0.40 0.41 -0.22 -0.73 0.00 0.00 179.01 178.94 1mws h LYS 481 N 0.63 0.77 0.02 1.92 3.64 -1.37 -2.04 116.57 120.14 1mws h LYS 481 Ca 0.17 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1mws h LYS 481 Cb -0.07 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.55 1mws h LYS 481 CO -0.04 0.51 -0.10 0.78 -2.27 0.00 0.00 179.45 178.33 1mws h GLY 482 N 0.79 -0.13 0.43 5.01 0.00 -0.41 -1.04 103.07 107.72 1mws h GLY 482 Ca 0.27 0.12 0.09 0.00 0.00 0.00 0.00 47.33 47.81 1mws h GLY 482 CO -0.12 -0.11 0.28 -0.33 0.00 0.00 0.00 176.54 176.26 1mws h MET 483 N -0.18 0.47 -0.72 4.80 2.86 -0.84 -1.85 114.93 119.48 1mws h MET 483 Ca 0.03 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1mws h MET 483 Cb 0.22 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 1mws h MET 483 CO -0.09 0.31 0.41 -0.22 1.06 0.00 0.00 176.91 178.38 1mws h LYS 484 N 0.48 0.99 -0.04 1.72 3.64 -1.06 -0.52 116.57 121.78 1mws h LYS 484 Ca 0.32 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1mws h LYS 484 Cb 0.36 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1mws h LYS 484 CO -0.28 0.72 -0.01 -0.22 -2.27 0.00 0.00 179.45 177.39 1mws h LYS 485 N 0.98 0.06 0.00 1.90 3.64 -0.40 0.34 116.57 123.09 1mws h LYS 485 Ca 0.25 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1mws h LYS 485 Cb 0.01 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1mws h LYS 485 CO -0.04 0.08 0.00 1.28 -2.27 0.00 0.00 179.45 178.49 1mws n LEU 486 N -4.49 0.39 0.00 5.20 4.77 -0.32 -4.87 117.00 117.69 1mws n LEU 486 Ca -0.02 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 1mws n LEU 486 Cb 0.12 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1mws n LEU 486 CO 0.35 -0.22 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 1mws n GLY 487 N 0.84 0.69 3.63 -0.72 0.00 0.12 -4.93 105.19 104.82 1mws n GLY 487 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1mws n GLY 487 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mws s VAL 488 N -2.00 3.99 0.00 1.61 1.01 -0.53 -2.68 120.40 121.80 1mws s VAL 488 Ca 0.00 1.12 0.00 0.00 0.00 0.00 0.00 61.98 63.10 1mws s VAL 488 Cb 0.00 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.40 1mws s VAL 488 CO 0.00 -0.39 0.00 0.61 0.00 0.00 0.00 175.10 175.32 1mws n GLY 489 N 4.39 1.98 3.82 4.51 0.00 -1.26 -3.89 105.19 114.73 1mws n GLY 489 Ca 0.16 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 1mws n GLY 489 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mws s GLU 490 N 0.00 2.55 0.35 1.61 2.02 -1.09 -4.56 118.70 119.58 1mws s GLU 490 Ca 0.00 0.77 -0.27 0.00 0.02 0.00 0.00 54.97 55.49 1mws s GLU 490 Cb 0.00 -1.96 -0.09 0.00 0.10 0.00 0.00 34.13 32.18 1mws s GLU 490 CO 0.00 -1.33 1.17 -0.51 0.02 0.00 0.00 175.26 174.62 1mws s ASP 491 N -3.90 6.79 -0.33 -0.19 1.11 -1.26 -4.54 116.67 114.36 1mws s ASP 491 Ca 0.59 2.38 -0.26 0.00 0.18 0.00 0.00 52.55 55.45 1mws s ASP 491 Cb -0.14 -2.62 0.01 0.00 1.07 0.00 0.00 42.92 41.24 1mws s ASP 491 CO 0.54 -0.49 0.92 -0.63 1.18 0.00 0.00 175.17 176.69 1mws s ILE 492 N -1.30 4.64 -0.87 0.77 1.01 -1.26 -4.95 121.20 119.24 1mws s ILE 492 Ca 0.52 1.34 -0.13 0.00 0.00 0.00 0.00 60.65 62.38 1mws s ILE 492 Cb -0.32 -4.29 -0.09 0.00 0.01 0.00 0.00 42.46 37.76 1mws s ILE 492 CO 0.42 -0.42 2.03 -0.81 0.00 0.00 0.00 174.94 176.16 1mws n PRO 493 N 6.60 1.85 -4.04 2.79 -0.04 -1.26 -4.85 135.00 136.04 1mws n PRO 493 Ca 0.07 -1.65 -0.27 0.00 -0.04 0.00 0.00 63.50 61.61 1mws n PRO 493 Cb 0.48 -2.67 -0.03 0.00 -0.04 0.00 0.00 33.50 31.24 1mws n PRO 493 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1mws s SER 494 N 4.09 4.55 -0.07 3.54 0.15 -1.26 -4.52 113.70 120.17 1mws s SER 494 Ca 0.47 -1.28 0.18 0.00 0.70 0.00 0.00 55.95 56.02 1mws s SER 494 Cb 0.12 0.30 0.61 0.00 -1.71 0.00 0.00 66.02 65.35 1mws s SER 494 CO 0.03 -0.99 1.53 -0.90 1.20 0.00 0.00 173.24 174.11 1mws n ASP 495 N -1.62 4.17 -3.84 5.45 3.85 -1.26 -4.87 116.55 118.42 1mws n ASP 495 Ca -0.04 -2.30 -0.12 0.00 -0.71 0.00 0.00 54.79 51.62 1mws n ASP 495 Cb 0.65 -0.49 -0.13 0.00 -1.35 0.00 0.00 41.12 39.80 1mws n ASP 495 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.20 175.72 1mws s TYR 496 N -1.56 -0.09 -0.58 2.11 6.14 -1.26 -4.90 117.35 117.21 1mws s TYR 496 Ca 0.45 0.23 -0.28 0.00 0.64 0.00 0.00 57.07 58.11 1mws s TYR 496 Cb 0.27 0.03 0.02 0.00 0.42 0.00 0.00 41.96 42.70 1mws s TYR 496 CO 0.24 -0.07 1.35 -1.25 0.64 0.00 0.00 175.55 176.46 1mws s PRO 497 N -0.07 3.35 -0.03 4.97 0.04 -1.26 -5.00 135.00 136.99 1mws s PRO 497 Ca -0.01 0.37 -0.00 0.00 0.04 0.00 0.00 61.00 61.39 1mws s PRO 497 Cb -0.01 -4.10 -0.04 0.00 0.04 0.00 0.00 34.50 30.39 1mws s PRO 497 CO 0.00 -1.89 0.01 -0.06 0.04 0.00 0.00 177.00 175.11 1mws s PHE 498 N 5.77 3.13 0.25 0.56 0.40 -1.26 -4.93 117.98 121.90 1mws s PHE 498 Ca 0.49 0.14 -0.30 0.00 -0.60 0.00 0.00 56.93 56.66 1mws s PHE 498 Cb -0.10 -1.72 -0.09 0.00 0.51 0.00 0.00 43.02 41.62 1mws s PHE 498 CO 0.25 0.48 1.10 0.71 0.70 0.00 0.00 175.22 178.45 1mws s TYR 499 N -1.02 3.60 0.58 0.36 1.51 -0.74 -4.67 117.35 116.96 1mws s TYR 499 Ca 0.18 1.67 -0.16 0.00 -1.01 0.00 0.00 57.07 57.74 1mws s TYR 499 Cb -0.11 -3.27 -0.04 0.00 -0.11 0.00 0.00 41.96 38.42 1mws s TYR 499 CO 0.08 -0.55 1.05 0.54 -1.11 0.00 0.00 175.55 175.56 1mws s ASN 500 N -0.63 5.89 0.70 2.29 4.22 -1.26 -4.35 114.94 121.79 1mws s ASN 500 Ca 0.46 1.82 -0.13 0.00 -2.14 0.00 0.00 52.86 52.87 1mws s ASN 500 Cb -0.31 -2.54 0.02 0.00 1.28 0.00 0.00 41.25 39.70 1mws s ASN 500 CO 0.39 -1.10 1.09 0.00 -2.04 0.00 0.00 177.10 175.44 1mws s ALA 501 N -2.40 2.45 -0.22 3.54 0.00 -1.26 -4.86 121.76 119.00 1mws s ALA 501 Ca 0.64 0.38 -0.03 0.00 0.00 0.00 0.00 51.96 52.95 1mws s ALA 501 Cb -0.16 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1mws s ALA 501 CO 0.35 -1.39 -0.06 -0.65 0.00 0.00 0.00 175.76 174.00 1mws s GLN 502 N -4.48 3.19 -0.06 0.00 -1.52 -0.27 -4.49 119.66 112.03 1mws s GLN 502 Ca 0.64 -0.74 -0.30 0.00 -1.95 0.00 0.00 55.36 53.01 1mws s GLN 502 Cb -0.18 -2.96 0.07 0.00 -0.22 0.00 0.00 33.01 29.72 1mws s GLN 502 CO 0.47 -0.26 0.66 -1.50 -0.25 0.00 0.00 175.29 174.42 1mws s ILE 503 N 1.42 0.00 0.00 1.08 2.07 -1.26 -2.65 121.20 121.86 1mws s ILE 503 Ca 0.04 -0.02 0.00 0.00 -1.41 0.00 0.00 60.65 59.26 1mws s ILE 503 Cb -0.15 -0.98 0.00 0.00 0.13 0.00 0.00 42.46 41.47 1mws s ILE 503 CO -0.05 -0.01 0.00 0.18 -1.91 0.00 0.00 174.94 173.15 1mws n LEU 508 N 1.05 0.00 0.16 8.50 4.77 -1.26 -5.08 117.00 125.13 1mws n LEU 508 Ca -0.19 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.83 1mws n LEU 508 Cb 0.57 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.81 1mws n LEU 508 CO 0.23 0.00 0.56 0.44 -1.33 0.00 0.00 177.39 177.28 1mws h ASP 509 N 0.00 0.00 -3.00 -1.43 3.32 -1.97 -3.41 116.42 109.92 1mws h ASP 509 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 1mws h ASP 509 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 1mws h ASP 509 CO 0.00 0.45 1.05 0.21 -1.72 0.00 0.00 179.24 179.23 1mws s ASN 510 N -6.43 6.49 0.36 6.45 3.84 -1.26 -4.90 114.94 119.49 1mws s ASN 510 Ca 0.03 1.31 0.12 0.00 0.21 0.00 0.00 52.86 54.53 1mws s ASN 510 Cb 0.09 -2.54 0.93 0.00 -0.55 0.00 0.00 41.25 39.18 1mws s ASN 510 CO 0.72 -1.22 1.80 -0.08 -2.79 0.00 0.00 177.10 175.53 1mws h GLU 511 N 10.15 0.55 -0.21 0.43 4.81 -2.00 -0.13 114.58 128.19 1mws h GLU 511 Ca -0.29 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 58.71 1mws h GLU 511 Cb 1.12 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 30.38 1mws h GLU 511 CO 1.03 0.36 -0.62 0.82 -0.73 0.00 0.00 179.01 179.88 1mws h ILE 512 N 0.57 1.29 0.00 2.32 2.04 -1.95 -2.23 117.51 119.55 1mws h ILE 512 Ca 0.55 -1.82 -0.06 0.00 1.00 0.00 0.00 64.86 64.53 1mws h ILE 512 Cb 1.13 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 1mws h ILE 512 CO -0.30 0.58 -0.28 0.25 0.00 0.00 0.00 178.15 178.39 1mws h LEU 513 N 0.52 0.00 -0.22 1.44 7.12 -1.61 -1.06 115.31 121.50 1mws h LEU 513 Ca -0.02 0.00 -0.12 0.00 0.13 0.00 0.00 57.88 57.88 1mws h LEU 513 Cb 1.24 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.37 1mws h LEU 513 CO 0.13 0.28 -0.32 0.25 -0.13 0.00 0.00 178.44 178.65 1mws h LEU 514 N 0.00 0.66 -0.20 2.25 6.46 -0.92 0.10 115.31 123.66 1mws h LEU 514 Ca -0.00 -0.52 -0.00 0.00 -0.12 0.00 0.00 57.88 57.24 1mws h LEU 514 Cb 0.53 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.26 1mws h LEU 514 CO 0.04 1.05 0.11 0.00 -0.62 0.00 0.00 178.44 179.01 1mws h ALA 515 N 0.63 0.25 -0.67 1.25 0.00 -0.82 -2.03 119.26 117.88 1mws h ALA 515 Ca 0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1mws h ALA 515 Cb 0.90 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1mws h ALA 515 CO 0.07 -0.23 0.29 -0.44 0.00 0.00 0.00 179.25 178.95 1mws h ASP 516 N 0.22 0.90 -0.01 0.00 3.32 -1.16 -1.45 116.42 118.24 1mws h ASP 516 Ca 0.07 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1mws h ASP 516 Cb 0.05 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 1mws h ASP 516 CO -0.01 0.80 0.04 0.28 -1.72 0.00 0.00 179.24 178.63 1mws h SER 517 N 0.93 0.00 0.29 6.45 0.02 -0.38 -1.52 113.55 119.35 1mws h SER 517 Ca 0.23 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.09 1mws h SER 517 Cb 0.17 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1mws h SER 517 CO -0.02 0.00 -0.35 1.23 -1.14 0.00 0.00 176.83 176.55 1mws h GLY 518 N 0.00 0.09 -0.53 -3.77 0.00 -0.54 -3.19 103.07 95.13 1mws h GLY 518 Ca 0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1mws h GLY 518 CO -0.00 0.07 -0.26 1.58 0.00 0.00 0.00 176.54 177.93 1mws n TYR 519 N -4.10 0.00 -0.91 5.60 0.18 -0.92 -4.20 117.16 112.80 1mws n TYR 519 Ca -0.02 -1.25 0.00 0.00 1.88 0.00 0.00 57.90 58.52 1mws n TYR 519 Cb 0.40 -0.20 0.00 0.00 -0.38 0.00 0.00 39.34 39.16 1mws n TYR 519 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1mws n GLY 520 N -1.26 0.48 0.56 -7.48 0.00 -1.11 -4.76 105.19 91.62 1mws n GLY 520 Ca 0.17 -0.93 0.06 0.00 0.00 0.00 0.00 46.02 45.32 1mws n GLY 520 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1mws n GLN 521 N -2.72 1.59 0.00 1.61 6.02 -0.62 -3.72 117.38 119.54 1mws n GLN 521 Ca 0.00 -3.14 0.00 0.00 -0.01 0.00 0.00 57.00 53.85 1mws n GLN 521 Cb 0.03 -1.62 0.00 0.00 1.02 0.00 0.00 30.24 29.67 1mws n GLN 521 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1mws n GLY 522 N -1.17 1.62 0.22 1.08 0.00 -1.24 -4.69 105.19 101.02 1mws n GLY 522 Ca 0.20 -1.55 0.05 0.00 0.00 0.00 0.00 46.02 44.72 1mws n GLY 522 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1mws n GLU 523 N 0.00 2.38 -2.70 1.61 -0.58 -1.26 -4.97 120.64 115.12 1mws n GLU 523 Ca 0.00 -2.11 -0.41 0.00 -0.42 0.00 0.00 57.16 54.21 1mws n GLU 523 Cb 0.00 -1.31 -0.04 0.00 -0.57 0.00 0.00 31.44 29.52 1mws n GLU 523 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1mws s ILE 524 N -1.87 4.51 -0.12 -3.67 1.01 -1.26 -4.87 121.20 114.93 1mws s ILE 524 Ca 0.19 2.01 0.02 0.00 0.00 0.00 0.00 60.65 62.88 1mws s ILE 524 Cb 0.16 -4.29 0.01 0.00 0.01 0.00 0.00 42.46 38.35 1mws s ILE 524 CO 0.04 0.27 -0.18 -0.76 0.00 0.00 0.00 174.94 174.32 1mws s LEU 525 N 0.22 1.86 0.04 2.97 1.43 -1.08 -4.29 118.68 119.83 1mws s LEU 525 Ca 0.49 -0.49 0.05 0.00 -1.03 0.00 0.00 54.13 53.15 1mws s LEU 525 Cb -0.24 -1.21 -0.02 0.00 0.03 0.00 0.00 46.19 44.75 1mws s LEU 525 CO 0.30 0.05 -0.14 -0.63 0.23 0.00 0.00 176.35 176.15 1mws s ILE 526 N 0.87 1.14 0.24 -0.59 1.01 0.47 -1.11 121.20 123.22 1mws s ILE 526 Ca -0.08 -1.01 -0.30 0.00 0.00 0.00 0.00 60.65 59.27 1mws s ILE 526 Cb -0.15 -1.03 -0.09 0.00 0.01 0.00 0.00 42.46 41.20 1mws s ILE 526 CO -0.01 0.02 1.20 0.21 0.00 0.00 0.00 174.94 176.36 1mws s ASN 527 N -1.14 7.07 0.24 3.58 3.84 -1.26 -0.15 114.94 127.13 1mws s ASN 527 Ca 0.02 2.33 -0.04 0.00 0.21 0.00 0.00 52.86 55.38 1mws s ASN 527 Cb -0.08 -2.62 0.43 0.00 -0.55 0.00 0.00 41.25 38.43 1mws s ASN 527 CO 0.01 -0.34 1.76 -0.65 -2.79 0.00 0.00 177.10 175.09 1mws h PRO 528 N 4.53 0.55 -0.35 0.43 0.11 -1.81 -0.05 132.00 135.42 1mws h PRO 528 Ca -0.46 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 1mws h PRO 528 Cb 1.21 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1mws h PRO 528 CO 0.71 0.37 -0.06 0.28 -0.21 0.00 0.00 178.00 179.09 1mws h VAL 529 N 0.57 1.22 -0.36 3.15 2.07 -1.92 -0.95 116.25 120.03 1mws h VAL 529 Ca 0.40 -0.94 -0.11 0.00 0.82 0.00 0.00 66.70 66.87 1mws h VAL 529 Cb 0.52 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1mws h VAL 529 CO -0.33 0.32 -0.22 -0.61 0.02 0.00 0.00 177.57 176.74 1mws h GLN 530 N 0.54 0.72 -0.59 1.57 4.15 -1.43 -0.14 115.11 119.92 1mws h GLN 530 Ca 0.11 -0.28 -0.05 0.00 0.77 0.00 0.00 58.65 59.19 1mws h GLN 530 Cb 0.43 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.06 1mws h GLN 530 CO 0.02 0.88 0.16 0.82 -1.93 0.00 0.00 178.83 178.78 1mws h ILE 531 N 0.63 1.25 -0.58 2.39 2.04 -0.79 -1.85 117.51 120.58 1mws h ILE 531 Ca 0.09 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 65.04 1mws h ILE 531 Cb 0.71 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 1mws h ILE 531 CO 0.05 0.32 0.21 0.25 0.00 0.00 0.00 178.15 178.98 1mws h LEU 532 N 0.85 0.83 -1.12 1.44 6.46 -0.90 -1.86 115.31 121.01 1mws h LEU 532 Ca 0.19 -0.19 -0.07 0.00 -0.12 0.00 0.00 57.88 57.68 1mws h LEU 532 Cb 0.32 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.02 1mws h LEU 532 CO -0.00 0.80 -0.18 0.77 -0.62 0.00 0.00 178.44 179.21 1mws h SER 533 N 0.81 0.40 -0.56 1.25 4.64 -0.74 0.68 113.55 120.03 1mws h SER 533 Ca 0.19 -0.11 -0.11 0.00 -0.47 0.00 0.00 61.79 61.29 1mws h SER 533 Cb 0.25 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 1mws h SER 533 CO -0.01 0.60 -0.07 0.40 -0.87 0.00 0.00 176.83 176.87 1mws h ILE 534 N 0.37 1.27 0.00 0.95 2.04 -0.99 -2.74 117.51 118.41 1mws h ILE 534 Ca 0.07 -1.23 -0.07 0.00 1.00 0.00 0.00 64.86 64.63 1mws h ILE 534 Cb 0.53 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1mws h ILE 534 CO 0.03 0.44 -0.31 1.88 0.00 0.00 0.00 178.15 180.19 1mws h TYR 535 N 0.92 0.00 0.00 1.37 -1.99 -0.67 -2.73 116.97 113.87 1mws h TYR 535 Ca 0.15 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.88 1mws h TYR 535 Cb 0.64 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.37 1mws h TYR 535 CO 0.04 0.31 0.00 -1.13 -0.00 0.00 0.00 178.16 177.39 1mws n SER 536 N -4.04 0.61 0.26 3.88 3.41 0.17 -2.05 113.62 115.86 1mws n SER 536 Ca -0.02 0.70 0.10 0.00 -0.26 0.00 0.00 58.87 59.38 1mws n SER 536 Cb 0.37 -0.81 0.69 0.00 -0.26 0.00 0.00 64.21 64.20 1mws n SER 536 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mws h ALA 537 N 2.17 1.72 -0.37 7.33 0.00 -1.50 -1.20 119.26 127.40 1mws h ALA 537 Ca 0.00 -0.05 0.11 0.00 0.00 0.00 0.00 54.91 54.96 1mws h ALA 537 Cb 0.23 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1mws h ALA 537 CO 0.00 0.07 0.34 -0.07 0.00 0.00 0.00 179.25 179.59 1mws h LEU 538 N 0.00 0.00 -3.51 0.00 3.38 -1.63 -1.17 115.31 112.37 1mws h LEU 538 Ca -0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.68 1mws h LEU 538 Cb 0.12 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 40.62 1mws h LEU 538 CO 0.01 0.00 -0.72 -0.62 0.09 0.00 0.00 178.44 177.20 1mws n GLU 539 N -3.99 2.49 -2.57 1.13 -0.58 -0.46 -4.66 120.64 112.00 1mws n GLU 539 Ca 0.06 -3.67 -0.01 0.00 -0.42 0.00 0.00 57.16 53.13 1mws n GLU 539 Cb 0.51 -1.85 0.06 0.00 -0.57 0.00 0.00 31.44 29.59 1mws n GLU 539 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1mws n ASN 540 N -0.81 0.50 -2.83 1.62 5.15 -0.51 -4.20 115.26 114.18 1mws n ASN 540 Ca 0.30 -2.08 -0.18 0.00 -0.60 0.00 0.00 54.58 52.02 1mws n ASN 540 Cb 0.86 -0.08 0.00 0.00 -0.53 0.00 0.00 39.78 40.02 1mws n ASN 540 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1mws n ASN 541 N -0.75 -4.21 0.00 1.20 3.02 -1.23 -0.97 115.26 112.32 1mws n ASN 541 Ca -0.02 -0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 1mws n ASN 541 Cb 0.85 -3.51 0.00 0.00 -0.61 0.00 0.00 39.78 36.51 1mws n ASN 541 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mws n GLY 542 N -1.04 0.73 3.66 7.41 0.00 -0.82 -4.80 105.19 110.33 1mws n GLY 542 Ca -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 1mws n GLY 542 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mws s ASN 543 N -2.38 4.66 -0.20 1.61 0.01 -0.14 -0.05 114.94 118.44 1mws s ASN 543 Ca 0.00 -0.57 -0.02 0.00 -0.71 0.00 0.00 52.86 51.56 1mws s ASN 543 Cb 0.00 -0.92 0.00 0.00 0.41 0.00 0.00 41.25 40.74 1mws s ASN 543 CO 0.00 0.01 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.88 1mws s ILE 544 N -2.19 2.94 0.53 0.60 1.01 -0.08 -3.97 121.20 120.04 1mws s ILE 544 Ca 0.31 -0.64 -0.09 0.00 0.00 0.00 0.00 60.65 60.23 1mws s ILE 544 Cb -0.07 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.05 1mws s ILE 544 CO 0.20 0.46 0.89 0.20 0.00 0.00 0.00 174.94 176.70 1mws s ASN 545 N 1.38 6.29 0.09 3.58 0.01 -1.26 -0.35 114.94 124.68 1mws s ASN 545 Ca 0.05 1.18 -0.31 0.00 -0.71 0.00 0.00 52.86 53.07 1mws s ASN 545 Cb -0.14 -2.36 -0.07 0.00 0.41 0.00 0.00 41.25 39.10 1mws s ASN 545 CO -0.06 -0.68 1.28 0.00 -1.51 0.00 0.00 177.10 176.12 1mws s ALA 546 N -2.89 3.48 0.27 0.60 0.00 -0.58 -4.63 121.76 118.01 1mws s ALA 546 Ca 0.51 0.97 -0.29 0.00 0.00 0.00 0.00 51.96 53.15 1mws s ALA 546 Cb -0.11 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.44 1mws s ALA 546 CO 0.47 -0.50 1.02 -1.25 0.00 0.00 0.00 175.76 175.50 1mws s PRO 547 N 1.00 4.70 0.15 0.00 0.04 -1.26 -4.46 135.00 135.17 1mws s PRO 547 Ca 0.61 1.63 -0.19 0.00 0.04 0.00 0.00 61.00 63.09 1mws s PRO 547 Cb -0.33 -3.17 0.05 0.00 0.04 0.00 0.00 34.50 31.09 1mws s PRO 547 CO 0.30 0.33 0.50 -3.38 0.04 0.00 0.00 177.00 174.79 1mws s HIS 548 N -1.22 -0.35 0.00 0.56 -3.43 -0.37 -4.22 115.29 106.25 1mws s HIS 548 Ca 0.44 0.08 0.00 0.00 -0.80 0.00 0.00 55.06 54.78 1mws s HIS 548 Cb -0.28 0.41 0.00 0.00 -1.43 0.00 0.00 32.58 31.28 1mws s HIS 548 CO 0.36 -0.79 0.45 1.47 -2.00 0.00 0.00 174.74 174.23 1mws n LEU 549 N -0.31 0.90 -4.74 5.38 -0.00 -1.26 -0.99 117.00 115.99 1mws n LEU 549 Ca -0.16 -0.94 -0.35 0.00 -0.00 0.00 0.00 56.01 54.56 1mws n LEU 549 Cb 0.64 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.98 1mws n LEU 549 CO 0.15 0.23 -0.17 -0.76 -0.00 0.00 0.00 177.39 176.83 1mws s LEU 550 N -0.15 4.22 0.24 1.47 1.43 -1.26 -0.45 118.68 124.19 1mws s LEU 550 Ca 0.00 0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 53.32 1mws s LEU 550 Cb 0.00 -2.11 0.42 0.00 0.03 0.00 0.00 46.19 44.53 1mws s LEU 550 CO 0.00 0.19 1.78 0.50 0.23 0.00 0.00 176.35 179.05 1mws h LYS 551 N 6.59 0.64 -0.50 1.70 1.63 -1.52 -1.45 116.57 123.65 1mws h LYS 551 Ca -0.42 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.34 1mws h LYS 551 Cb 1.15 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.64 1mws h LYS 551 CO 0.75 0.42 0.00 -0.40 -3.45 0.00 0.00 179.45 176.78 1mws n ASP 552 N -4.83 2.31 -4.71 4.20 5.68 -1.26 -4.80 116.55 113.14 1mws n ASP 552 Ca 0.14 -2.14 -0.42 0.00 -0.50 0.00 0.00 54.79 51.87 1mws n ASP 552 Cb 0.33 -0.35 -0.03 0.00 -1.14 0.00 0.00 41.12 39.93 1mws n ASP 552 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1mws s THR 553 N -1.63 4.87 0.19 2.12 2.01 -0.55 -5.01 115.64 117.65 1mws s THR 553 Ca 0.24 1.98 -0.30 0.00 0.31 0.00 0.00 61.69 63.92 1mws s THR 553 Cb 0.15 -4.28 -0.08 0.00 0.01 0.00 0.00 72.50 68.29 1mws s THR 553 CO 0.13 0.14 1.16 -0.54 -0.69 0.00 0.00 174.62 174.82 1mws s LYS 554 N 1.21 4.53 0.47 4.92 1.02 -1.26 -4.96 119.74 125.67 1mws s LYS 554 Ca 0.49 1.82 -0.23 0.00 0.02 0.00 0.00 55.97 58.08 1mws s LYS 554 Cb -0.20 -3.25 -0.07 0.00 -0.52 0.00 0.00 37.83 33.79 1mws s LYS 554 CO 0.25 -0.02 1.26 -0.80 -0.92 0.00 0.00 175.35 175.11 1mws s ASN 555 N -0.00 5.93 -0.00 2.83 0.01 -1.26 -5.03 114.94 117.41 1mws s ASN 555 Ca 0.51 2.54 -0.24 0.00 -0.71 0.00 0.00 52.86 54.95 1mws s ASN 555 Cb -0.32 -2.62 0.05 0.00 0.41 0.00 0.00 41.25 38.78 1mws s ASN 555 CO 0.36 -1.10 0.54 -1.59 -1.51 0.00 0.00 177.10 173.81 1mws s LYS 556 N -2.64 0.97 0.12 -0.60 -2.85 -1.26 -5.06 119.74 108.42 1mws s LYS 556 Ca 0.64 -0.02 -0.27 0.00 -1.00 0.00 0.00 55.97 55.32 1mws s LYS 556 Cb -0.35 0.45 -0.07 0.00 -2.06 0.00 0.00 37.83 35.81 1mws s LYS 556 CO 0.42 -0.32 0.86 0.08 0.10 0.00 0.00 175.35 176.49 1mws s VAL 557 N -1.70 4.47 -0.24 1.79 1.01 -1.26 -1.52 120.40 122.95 1mws s VAL 557 Ca -0.09 1.86 -0.14 0.00 0.00 0.00 0.00 61.98 63.61 1mws s VAL 557 Cb -0.01 -4.22 -0.10 0.00 0.00 0.00 0.00 36.38 32.05 1mws s VAL 557 CO 0.04 0.40 -0.33 1.87 0.00 0.00 0.00 175.10 177.09 1mws n TRP 558 N 2.33 0.00 -5.07 5.22 -0.00 0.53 -4.78 117.44 115.66 1mws n TRP 558 Ca -0.02 0.00 -0.29 0.00 -0.00 0.00 0.00 57.50 57.20 1mws n TRP 558 Cb 0.49 -0.82 -0.16 0.00 -0.00 0.00 0.00 31.31 30.82 1mws n TRP 558 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1mws s LYS 559 N -2.56 2.07 -0.12 5.87 -0.14 -0.35 -4.97 119.74 119.55 1mws s LYS 559 Ca -0.34 -0.77 -0.04 0.00 -1.36 0.00 0.00 55.97 53.45 1mws s LYS 559 Cb 0.11 -1.83 -0.04 0.00 -1.68 0.00 0.00 37.83 34.40 1mws s LYS 559 CO 0.44 0.37 0.05 0.15 -0.76 0.00 0.00 175.35 175.60 1mws s LYS 560 N -0.21 3.32 -1.31 1.68 1.02 -1.26 -0.90 119.74 122.07 1mws s LYS 560 Ca 0.00 -0.32 -0.15 0.00 0.02 0.00 0.00 55.97 55.52 1mws s LYS 560 Cb -0.11 -2.99 0.01 0.00 -0.52 0.00 0.00 37.83 34.22 1mws s LYS 560 CO 0.02 0.63 0.50 0.09 -0.92 0.00 0.00 175.35 175.67 1mws n ASN 561 N 2.39 -2.38 0.22 2.83 3.02 -1.16 -4.87 115.26 115.32 1mws n ASN 561 Ca -0.19 -1.15 0.13 0.00 -0.03 0.00 0.00 54.58 53.35 1mws n ASN 561 Cb 0.54 -2.45 0.31 0.00 -0.61 0.00 0.00 39.78 37.57 1mws n ASN 561 CO 0.00 0.00 0.00 0.16 -2.62 0.00 0.00 177.26 174.80 1mws h ILE 562 N -2.08 0.00 -2.72 2.41 3.07 -0.76 -3.45 117.51 113.98 1mws h ILE 562 Ca -0.67 -0.83 -0.12 0.00 1.55 0.00 0.00 64.86 64.79 1mws h ILE 562 Cb 1.39 1.82 -0.25 0.00 -0.27 0.00 0.00 36.82 39.51 1mws h ILE 562 CO 0.58 0.00 -0.28 -0.51 -1.05 0.00 0.00 178.15 176.88 1mws s ILE 563 N -3.31 -0.01 0.71 0.16 2.07 -1.22 -4.89 121.20 114.70 1mws s ILE 563 Ca 0.06 0.05 -0.14 0.00 -1.41 0.00 0.00 60.65 59.21 1mws s ILE 563 Cb 0.07 -0.58 0.03 0.00 0.13 0.00 0.00 42.46 42.11 1mws s ILE 563 CO 0.63 0.02 1.12 -0.94 -1.91 0.00 0.00 174.94 173.86 1mws s SER 564 N 0.81 4.74 0.38 4.50 1.04 -1.26 -4.25 113.70 119.65 1mws s SER 564 Ca -0.05 2.01 0.09 0.00 0.48 0.00 0.00 55.95 58.48 1mws s SER 564 Cb -0.06 -2.55 0.84 0.00 0.10 0.00 0.00 66.02 64.35 1mws s SER 564 CO -0.06 -1.88 1.93 0.11 0.98 0.00 0.00 173.24 174.32 1mws h LYS 565 N -0.40 0.63 0.21 4.02 1.57 -1.99 -1.49 116.57 119.12 1mws h LYS 565 Ca -0.46 -0.04 -0.32 0.00 -1.87 0.00 0.00 60.65 57.96 1mws h LYS 565 Cb 1.25 -0.14 0.03 0.00 0.08 0.00 0.00 32.23 33.45 1mws h LYS 565 CO 0.52 0.42 -1.40 1.05 -0.57 0.00 0.00 179.45 179.47 1mws h GLU 566 N 0.65 0.50 0.00 3.15 4.11 -2.02 -3.22 114.58 117.75 1mws h GLU 566 Ca 0.35 -0.82 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1mws h GLU 566 Cb 0.49 0.30 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1mws h GLU 566 CO -0.13 1.39 0.00 -0.91 0.07 0.00 0.00 179.01 179.43 1mws h ASN 567 N 0.15 0.00 0.19 3.06 2.35 -1.77 -2.82 115.58 116.75 1mws h ASN 567 Ca -0.22 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 1mws h ASN 567 Cb 2.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.47 1mws h ASN 567 CO 0.26 0.00 -0.09 0.40 -1.65 0.00 0.00 177.43 176.34 1mws h ILE 568 N 0.00 0.90 -0.51 2.81 2.04 -1.30 -2.88 117.51 118.57 1mws h ILE 568 Ca 0.00 -0.59 0.12 0.00 1.00 0.00 0.00 64.86 65.39 1mws h ILE 568 Cb 0.35 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 1mws h ILE 568 CO 0.00 0.13 0.35 -1.13 0.00 0.00 0.00 178.15 177.51 1mws h ASN 569 N -0.56 0.15 -0.64 1.72 -0.73 -1.58 -0.51 115.58 113.42 1mws h ASN 569 Ca -0.03 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.13 1mws h ASN 569 Cb 0.42 -0.03 -0.03 0.00 0.27 0.00 0.00 38.32 38.95 1mws h ASN 569 CO 0.04 0.09 0.35 0.25 -0.37 0.00 0.00 177.43 177.79 1mws h LEU 570 N 0.16 0.80 0.04 0.34 6.46 -1.44 -0.18 115.31 121.50 1mws h LEU 570 Ca 0.24 -0.10 -0.28 0.00 -0.12 0.00 0.00 57.88 57.63 1mws h LEU 570 Cb 0.74 -0.20 0.02 0.00 -0.73 0.00 0.00 40.66 40.49 1mws h LEU 570 CO -0.04 0.67 -1.12 -0.07 -0.62 0.00 0.00 178.44 177.26 1mws h LEU 571 N 0.88 0.88 -1.62 2.25 3.38 -1.02 -3.13 115.31 116.93 1mws h LEU 571 Ca 0.23 -0.75 -0.04 0.00 0.09 0.00 0.00 57.88 57.41 1mws h LEU 571 Cb 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1mws h LEU 571 CO -0.04 1.55 -0.18 0.71 0.09 0.00 0.00 178.44 180.57 1mws h THR 572 N 0.34 0.68 -0.37 0.22 1.35 -1.15 -0.12 112.91 113.86 1mws h THR 572 Ca -0.15 -0.79 -0.04 0.00 -0.55 0.00 0.00 66.41 64.88 1mws h THR 572 Cb 1.78 1.50 -0.02 0.00 -1.73 0.00 0.00 68.15 69.69 1mws h THR 572 CO 0.22 0.18 0.09 0.44 -0.25 0.00 0.00 175.52 176.20 1mws h ASP 573 N 0.00 0.56 -0.33 5.36 5.19 -1.01 0.16 116.42 126.36 1mws h ASP 573 Ca -0.00 -0.23 -0.10 0.00 -0.62 0.00 0.00 57.03 56.08 1mws h ASP 573 Cb 0.48 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.84 1mws h ASP 573 CO 0.02 0.64 -0.20 1.23 -3.12 0.00 0.00 179.24 177.82 1mws h GLY 574 N 0.45 0.77 2.00 2.75 0.00 -1.31 -3.04 103.07 104.69 1mws h GLY 574 Ca 0.12 -0.72 -0.02 0.00 0.00 0.00 0.00 47.33 46.70 1mws h GLY 574 CO 0.00 0.66 -0.09 -0.33 0.00 0.00 0.00 176.54 176.77 1mws h MET 575 N 0.48 0.00 -0.45 4.80 2.86 -0.87 -1.55 114.93 120.20 1mws h MET 575 Ca 0.07 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.65 1mws h MET 575 Cb 0.75 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.39 1mws h MET 575 CO 0.06 0.09 0.05 0.37 1.06 0.00 0.00 176.91 178.53 1mws h GLN 576 N 0.00 0.70 0.00 1.72 5.75 -0.84 -2.16 115.11 120.28 1mws h GLN 576 Ca -0.00 -0.16 -0.13 0.00 -0.15 0.00 0.00 58.65 58.21 1mws h GLN 576 Cb 0.20 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 1mws h GLN 576 CO 0.01 0.69 -0.61 1.96 -2.65 0.00 0.00 178.83 178.23 1mws h GLN 577 N 0.67 0.00 -0.92 1.69 1.08 -1.33 -1.42 115.11 114.88 1mws h GLN 577 Ca 0.14 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.42 1mws h GLN 577 Cb 0.35 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.72 1mws h GLN 577 CO 0.01 0.61 0.60 0.28 -0.95 0.00 0.00 178.83 179.37 1mws h VAL 578 N 0.00 1.03 0.02 -0.54 2.07 -1.24 0.26 116.25 117.85 1mws h VAL 578 Ca -0.01 -0.35 -0.23 0.00 0.82 0.00 0.00 66.70 66.94 1mws h VAL 578 Cb 1.33 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1mws h VAL 578 CO 0.08 0.18 -1.24 0.58 0.02 0.00 0.00 177.57 177.19 1mws h VAL 579 N 1.01 0.96 0.00 2.57 2.07 -1.55 -0.12 116.25 121.18 1mws h VAL 579 Ca 0.41 -2.22 -0.04 0.00 0.82 0.00 0.00 66.70 65.67 1mws h VAL 579 Cb 0.27 2.35 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 1mws h VAL 579 CO -0.16 0.40 -0.19 0.78 0.02 0.00 0.00 177.57 178.41 1mws h ASN 580 N -0.87 0.00 0.00 0.57 4.21 -1.18 -2.59 115.58 115.72 1mws h ASN 580 Ca -0.33 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.18 1mws h ASN 580 Cb 1.37 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.57 1mws h ASN 580 CO -0.16 0.19 0.00 0.29 -1.29 0.00 0.00 177.43 176.47 1mws n LYS 581 N -3.82 0.00 -0.23 0.81 5.02 0.86 -4.54 118.16 116.26 1mws n LYS 581 Ca -0.02 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.26 1mws n LYS 581 Cb 0.29 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.36 1mws n LYS 581 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1mws h THR 582 N 0.00 0.25 -0.58 -0.18 2.02 -1.45 -2.45 112.91 110.52 1mws h THR 582 Ca 0.00 0.00 -0.41 0.00 0.77 0.00 0.00 66.41 66.77 1mws h THR 582 Cb 0.00 0.25 -0.29 0.00 -1.74 0.00 0.00 68.15 66.36 1mws h THR 582 CO 0.00 0.00 -0.49 1.41 0.37 0.00 0.00 175.52 176.81 1mws n HIS 583 N -5.46 2.06 -0.22 3.16 8.25 -0.06 -4.84 115.22 118.11 1mws n HIS 583 Ca 0.07 -2.09 0.02 0.00 -0.26 0.00 0.00 57.72 55.47 1mws n HIS 583 Cb 0.36 -0.46 0.12 0.00 1.12 0.00 0.00 29.99 31.14 1mws n HIS 583 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1mws h LYS 584 N 1.78 0.16 0.00 -0.41 2.10 -1.01 -1.35 116.57 117.84 1mws h LYS 584 Ca 0.31 -0.01 -0.09 0.00 -2.00 0.00 0.00 60.65 58.86 1mws h LYS 584 Cb 1.38 -0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 32.66 1mws h LYS 584 CO 0.65 0.10 -0.44 1.49 -2.00 0.00 0.00 179.45 179.26 1mws h GLU 585 N 0.16 0.00 0.09 0.07 4.81 -1.86 -2.52 114.58 115.33 1mws h GLU 585 Ca 0.35 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 59.29 1mws h GLU 585 Cb 0.58 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 1mws h GLU 585 CO -0.53 0.44 -1.49 -0.44 -0.73 0.00 0.00 179.01 176.26 1mws h ASP 586 N 0.00 0.31 0.00 1.04 3.32 -1.65 -3.44 116.42 116.00 1mws h ASP 586 Ca -0.00 -0.43 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1mws h ASP 586 Cb 0.91 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.36 1mws h ASP 586 CO 0.06 1.36 -0.09 0.00 -1.72 0.00 0.00 179.24 178.84 1mws n ILE 587 N -3.40 0.00 -1.73 0.35 3.06 -0.61 -4.04 119.36 112.98 1mws n ILE 587 Ca -0.15 -0.02 -0.42 0.00 -2.50 0.00 0.00 62.75 59.67 1mws n ILE 587 Cb 1.03 0.36 0.00 0.00 0.54 0.00 0.00 39.64 41.58 1mws n ILE 587 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1mws n TYR 588 N -0.18 2.56 -3.91 9.51 4.19 -0.95 -4.82 117.16 123.56 1mws n TYR 588 Ca 0.00 0.50 -0.16 0.00 3.31 0.00 0.00 57.90 61.55 1mws n TYR 588 Cb 0.00 -2.46 -0.16 0.00 0.49 0.00 0.00 39.34 37.22 1mws n TYR 588 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 1mws s ARG 589 N -2.05 0.21 0.33 2.98 1.81 -1.26 -4.94 118.95 116.02 1mws s ARG 589 Ca 0.56 0.06 0.09 0.00 -1.72 0.00 0.00 55.73 54.72 1mws s ARG 589 Cb -0.52 -0.36 0.58 0.00 -0.45 0.00 0.00 34.95 34.21 1mws s ARG 589 CO 0.62 -0.10 1.77 0.66 -0.68 0.00 0.00 175.30 177.57 1mws h SER 590 N 6.98 0.16 0.49 0.23 4.64 -2.00 -2.97 113.55 121.08 1mws h SER 590 Ca -0.39 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1mws h SER 590 Cb 1.15 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1mws h SER 590 CO 0.49 0.52 0.00 0.00 -0.87 0.00 0.00 176.83 176.96 1mws n TYR 591 N -4.08 0.00 -4.03 4.77 0.18 -1.26 -4.84 117.16 107.91 1mws n TYR 591 Ca -0.01 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.69 1mws n TYR 591 Cb 0.43 -0.25 -0.09 0.00 -0.38 0.00 0.00 39.34 39.04 1mws n TYR 591 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1mws s ALA 592 N -2.51 0.31 -0.92 -3.48 0.00 -1.12 -5.00 121.76 109.04 1mws s ALA 592 Ca 0.29 -1.05 -0.00 0.00 0.00 0.00 0.00 51.96 51.20 1mws s ALA 592 Cb 0.20 0.36 0.29 0.00 0.00 0.00 0.00 23.12 23.96 1mws s ALA 592 CO 0.43 -0.42 1.25 -1.71 0.00 0.00 0.00 175.76 175.31 1mws n ASN 593 N 0.05 5.55 -4.77 0.00 5.15 -1.26 -4.55 115.26 115.44 1mws n ASN 593 Ca -0.14 -3.45 -0.38 0.00 -0.60 0.00 0.00 54.58 50.01 1mws n ASN 593 Cb 0.61 -1.05 -0.05 0.00 -0.53 0.00 0.00 39.78 38.77 1mws n ASN 593 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1mws s LEU 594 N -2.80 4.39 0.16 1.20 1.43 -1.26 -1.14 118.68 120.65 1mws s LEU 594 Ca 0.35 2.08 -0.00 0.00 -1.03 0.00 0.00 54.13 55.53 1mws s LEU 594 Cb 0.10 -3.88 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 1mws s LEU 594 CO 0.05 -0.21 0.05 0.27 0.23 0.00 0.00 176.35 176.74 1mws s ILE 595 N -1.41 0.28 -0.39 -0.59 -4.36 -0.71 -4.75 121.20 109.27 1mws s ILE 595 Ca 0.50 -1.94 0.00 0.00 -0.26 0.00 0.00 60.65 58.94 1mws s ILE 595 Cb -0.26 -2.15 0.00 0.00 1.25 0.00 0.00 42.46 41.31 1mws s ILE 595 CO 0.32 -0.39 0.00 0.61 0.24 0.00 0.00 174.94 175.72 1mws n GLY 596 N -0.18 -1.23 3.05 6.27 0.00 -0.84 -2.34 105.19 109.93 1mws n GLY 596 Ca -0.05 -0.99 -0.28 0.00 0.00 0.00 0.00 46.02 44.70 1mws n GLY 596 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mws s LYS 597 N -1.59 2.14 0.00 1.61 2.47 0.57 -4.42 119.74 120.53 1mws s LYS 597 Ca 0.00 -0.54 0.00 0.00 -1.56 0.00 0.00 55.97 53.87 1mws s LYS 597 Cb 0.00 -1.81 0.00 0.00 -1.46 0.00 0.00 37.83 34.56 1mws s LYS 597 CO 0.00 -0.04 0.00 0.45 0.16 0.00 0.00 175.35 175.92 1mws n SER 598 N 4.11 0.00 0.00 1.43 2.88 -1.26 -0.66 113.62 120.12 1mws n SER 598 Ca -0.20 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.34 1mws n SER 598 Cb 0.51 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 1mws n SER 598 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1mws n GLY 599 N 5.00 2.46 3.48 0.46 0.00 -1.24 -4.59 105.19 110.76 1mws n GLY 599 Ca 0.00 -1.83 -0.23 0.00 0.00 0.00 0.00 46.02 43.95 1mws n GLY 599 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1mws s THR 600 N -2.53 1.91 -0.02 2.61 -4.23 -1.26 -2.55 115.64 109.56 1mws s THR 600 Ca 0.00 -2.16 -0.14 0.00 -1.18 0.00 0.00 61.69 58.21 1mws s THR 600 Cb 0.00 -2.55 0.02 0.00 1.34 0.00 0.00 72.50 71.32 1mws s THR 600 CO 0.00 -0.25 0.31 0.00 -0.54 0.00 0.00 174.62 174.14 1mws s ALA 601 N -2.83 -0.78 0.22 3.99 0.00 -0.92 -4.96 121.76 116.48 1mws s ALA 601 Ca 0.31 0.38 -0.30 0.00 0.00 0.00 0.00 51.96 52.35 1mws s ALA 601 Cb 0.03 0.02 -0.09 0.00 0.00 0.00 0.00 23.12 23.08 1mws s ALA 601 CO 0.14 -0.25 1.02 -1.21 0.00 0.00 0.00 175.76 175.46 1mws s GLU 602 N -1.18 4.73 0.54 0.00 2.02 -1.26 -0.71 118.70 122.83 1mws s GLU 602 Ca -0.12 1.62 -0.20 0.00 0.02 0.00 0.00 54.97 56.29 1mws s GLU 602 Cb -0.05 -3.27 -0.06 0.00 0.10 0.00 0.00 34.13 30.85 1mws s GLU 602 CO 0.04 0.31 1.13 -1.17 0.02 0.00 0.00 175.26 175.59 1mws s LEU 603 N -0.96 3.77 0.00 1.80 0.20 0.15 -4.86 118.68 118.78 1mws s LEU 603 Ca 0.44 2.17 -0.01 0.00 0.69 0.00 0.00 54.13 57.43 1mws s LEU 603 Cb -0.28 -4.56 -0.03 0.00 -0.43 0.00 0.00 46.19 40.89 1mws s LEU 603 CO 0.35 -1.18 0.72 1.17 -0.29 0.00 0.00 176.35 177.12 1mws n LYS 604 N -1.24 0.25 0.00 1.98 3.00 -1.26 -4.83 118.16 116.06 1mws n LYS 604 Ca 0.11 -0.09 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 1mws n LYS 604 Cb 0.51 -1.52 0.00 0.00 0.00 0.00 0.00 35.03 34.02 1mws n LYS 604 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1mws n GLY 611 N 2.55 0.00 3.80 3.14 0.00 -1.26 -5.21 105.19 108.22 1mws n GLY 611 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1mws n GLY 611 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mws s ARG 612 N -0.30 4.32 0.03 1.61 0.52 -1.26 -4.83 118.95 119.05 1mws s ARG 612 Ca 0.00 0.90 0.06 0.00 -0.52 0.00 0.00 55.73 56.17 1mws s ARG 612 Cb 0.00 -3.11 -0.02 0.00 0.52 0.00 0.00 34.95 32.34 1mws s ARG 612 CO 0.00 0.53 -0.17 -0.65 0.02 0.00 0.00 175.30 175.03 1mws s GLN 613 N -1.45 1.20 -0.15 3.54 -1.52 -1.26 -0.67 119.66 119.34 1mws s GLN 613 Ca 0.36 -0.81 -0.04 0.00 -1.95 0.00 0.00 55.36 52.93 1mws s GLN 613 Cb -0.19 -1.25 -0.03 0.00 -0.22 0.00 0.00 33.01 31.32 1mws s GLN 613 CO 0.22 0.32 -0.03 0.42 -0.25 0.00 0.00 175.29 175.97 1mws s ILE 614 N -0.75 3.94 0.05 1.08 -1.09 0.12 0.07 121.20 124.62 1mws s ILE 614 Ca 0.05 -0.34 0.03 0.00 -2.23 0.00 0.00 60.65 58.15 1mws s ILE 614 Cb -0.08 -2.72 -0.04 0.00 -1.58 0.00 0.00 42.46 38.04 1mws s ILE 614 CO 0.01 0.50 0.04 -0.83 -1.23 0.00 0.00 174.94 173.44 1mws s GLY 615 N 0.27 1.97 -0.03 6.18 0.00 0.61 -2.16 107.32 114.15 1mws s GLY 615 Ca -0.03 -1.00 -0.05 0.00 0.00 0.00 0.00 44.72 43.64 1mws s GLY 615 CO 0.03 -0.95 0.13 -0.98 0.00 0.00 0.00 173.10 171.33 1mws s TRP 616 N -1.28 -0.06 -0.17 1.90 0.52 -1.06 -1.59 118.94 117.21 1mws s TRP 616 Ca 0.25 0.14 -0.06 0.00 0.02 0.00 0.00 56.10 56.45 1mws s TRP 616 Cb -0.12 0.00 0.08 0.00 -1.15 0.00 0.00 33.47 32.28 1mws s TRP 616 CO 0.17 -0.15 0.36 0.12 0.02 0.00 0.00 176.95 177.47 1mws s PHE 617 N -0.52 -0.65 -0.13 -1.98 5.36 -0.54 -3.61 117.98 115.91 1mws s PHE 617 Ca -0.06 1.31 0.01 0.00 -0.96 0.00 0.00 56.93 57.23 1mws s PHE 617 Cb -0.04 0.18 -0.00 0.00 -0.34 0.00 0.00 43.02 42.82 1mws s PHE 617 CO 0.01 -0.43 -0.17 0.42 -1.46 0.00 0.00 175.22 173.58 1mws s ILE 618 N 2.46 2.57 0.20 3.12 1.01 0.17 -1.38 121.20 129.35 1mws s ILE 618 Ca -0.01 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 59.75 1mws s ILE 618 Cb -0.12 -2.05 -0.02 0.00 0.01 0.00 0.00 42.46 40.28 1mws s ILE 618 CO -0.11 0.53 0.28 -0.94 0.00 0.00 0.00 174.94 174.70 1mws s SER 619 N 0.55 0.05 -0.05 3.58 1.04 -0.66 -0.32 113.70 117.90 1mws s SER 619 Ca -0.11 -1.10 -0.31 0.00 0.48 0.00 0.00 55.95 54.91 1mws s SER 619 Cb -0.16 0.46 0.11 0.00 0.10 0.00 0.00 66.02 66.53 1mws s SER 619 CO 0.04 -0.95 1.03 -0.72 0.98 0.00 0.00 173.24 173.63 1mws s TYR 620 N -4.06 -0.23 -0.39 5.02 1.13 -0.99 -1.16 117.35 116.68 1mws s TYR 620 Ca 0.27 0.10 -0.20 0.00 -1.41 0.00 0.00 57.07 55.83 1mws s TYR 620 Cb 0.04 0.54 0.01 0.00 -1.10 0.00 0.00 41.96 41.45 1mws s TYR 620 CO 0.08 -0.44 0.63 0.34 -2.51 0.00 0.00 175.55 173.65 1mws s ASP 621 N -2.47 6.37 0.49 -0.18 3.68 -1.26 -1.74 116.67 121.56 1mws s ASP 621 Ca 0.08 -0.09 0.22 0.00 2.13 0.00 0.00 52.55 54.89 1mws s ASP 621 Cb -0.01 -2.32 1.28 0.00 -1.45 0.00 0.00 42.92 40.43 1mws s ASP 621 CO -0.06 -0.68 2.05 0.50 0.13 0.00 0.00 175.17 177.12 1mws h LYS 622 N 8.66 0.00 0.00 4.34 3.64 -1.48 0.22 116.57 131.95 1mws h LYS 622 Ca -0.26 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1mws h LYS 622 Cb 1.10 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1mws h LYS 622 CO 0.86 0.14 -0.01 -0.44 -2.27 0.00 0.00 179.45 177.73 1mws h ASP 623 N 0.00 0.00 -0.85 4.20 3.32 -1.92 -3.38 116.42 117.80 1mws h ASP 623 Ca -0.00 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.69 1mws h ASP 623 Cb 0.30 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 39.60 1mws h ASP 623 CO 0.02 0.01 -0.76 -3.20 -1.72 0.00 0.00 179.24 173.59 1mws n ASN 624 N -3.10 -1.41 -1.98 6.45 5.15 -0.72 -5.05 115.26 114.60 1mws n ASN 624 Ca 0.04 -3.17 -0.01 0.00 -0.60 0.00 0.00 54.58 50.84 1mws n ASN 624 Cb 0.50 0.81 -0.02 0.00 -0.53 0.00 0.00 39.78 40.54 1mws n ASN 624 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1mws n PRO 625 N 1.16 0.48 0.00 1.20 -0.04 0.70 -4.35 135.00 134.15 1mws n PRO 625 Ca 0.14 -0.12 0.13 0.00 -0.04 0.00 0.00 63.50 63.62 1mws n PRO 625 Cb 0.62 -1.43 0.51 0.00 -0.04 0.00 0.00 33.50 33.15 1mws n PRO 625 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1mws n ASN 626 N 2.14 0.34 -3.63 3.54 0.23 -1.26 -4.63 115.26 111.99 1mws n ASN 626 Ca 0.05 -0.15 -0.05 0.00 -0.53 0.00 0.00 54.58 53.90 1mws n ASN 626 Cb 0.23 -0.11 -0.07 0.00 -2.08 0.00 0.00 39.78 37.75 1mws n ASN 626 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1mws s MET 627 N -2.79 0.45 -0.17 -3.83 0.23 -1.26 -4.30 119.30 107.63 1mws s MET 627 Ca 0.19 1.21 -0.13 0.00 -1.03 0.00 0.00 55.69 55.93 1mws s MET 627 Cb 0.19 0.56 -0.05 0.00 -1.53 0.00 0.00 34.83 34.00 1mws s MET 627 CO 0.56 -0.25 0.25 1.41 -2.03 0.00 0.00 175.02 174.95 1mws s MET 628 N 2.75 4.22 -0.03 3.16 1.75 -0.18 -4.46 119.30 126.51 1mws s MET 628 Ca -0.02 0.01 0.07 0.00 -1.25 0.00 0.00 55.69 54.50 1mws s MET 628 Cb -0.12 -3.42 -0.02 0.00 2.84 0.00 0.00 34.83 34.11 1mws s MET 628 CO -0.16 0.27 -0.24 1.41 -0.65 0.00 0.00 175.02 175.65 1mws s MET 629 N 0.39 2.11 -0.19 4.11 0.00 -0.31 -0.91 119.30 124.50 1mws s MET 629 Ca 0.14 -0.88 0.01 0.00 0.00 0.00 0.00 55.69 54.96 1mws s MET 629 Cb -0.12 -1.97 0.04 0.00 0.00 0.00 0.00 34.83 32.77 1mws s MET 629 CO 0.02 0.49 -0.12 0.00 0.00 0.00 0.00 175.02 175.41 1mws s ALA 630 N -0.47 2.01 -0.22 4.11 0.00 0.17 -1.65 121.76 125.71 1mws s ALA 630 Ca 0.06 -1.15 -0.06 0.00 0.00 0.00 0.00 51.96 50.82 1mws s ALA 630 Cb -0.10 -1.23 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 1mws s ALA 630 CO 0.00 -0.69 0.02 0.42 0.00 0.00 0.00 175.76 175.52 1mws s ILE 631 N 1.40 4.06 -0.12 0.00 -1.09 -0.48 -0.59 121.20 124.38 1mws s ILE 631 Ca 0.01 -0.27 0.02 0.00 -2.23 0.00 0.00 60.65 58.17 1mws s ILE 631 Cb -0.15 -2.86 0.01 0.00 -1.58 0.00 0.00 42.46 37.88 1mws s ILE 631 CO -0.09 0.40 -0.16 0.21 -1.23 0.00 0.00 174.94 174.07 1mws s ASN 632 N 1.22 2.59 -0.01 3.58 3.04 -0.01 -1.47 114.94 123.87 1mws s ASN 632 Ca 0.04 -0.47 0.03 0.00 0.04 0.00 0.00 52.86 52.50 1mws s ASN 632 Cb -0.15 -1.16 -0.01 0.00 -1.54 0.00 0.00 41.25 38.39 1mws s ASN 632 CO 0.02 0.02 -0.10 -0.69 -3.04 0.00 0.00 177.10 173.31 1mws s VAL 633 N 1.00 0.83 0.13 -5.21 1.01 -0.62 -1.34 120.40 116.20 1mws s VAL 633 Ca -0.06 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 1mws s VAL 633 Cb -0.15 -0.70 -0.06 0.00 0.00 0.00 0.00 36.38 35.47 1mws s VAL 633 CO -0.02 0.24 0.41 -0.75 0.00 0.00 0.00 175.10 174.97 1mws s LYS 634 N -0.18 3.70 -0.82 2.72 2.20 -0.15 -0.28 119.74 126.92 1mws s LYS 634 Ca 0.03 0.07 -0.04 0.00 -0.36 0.00 0.00 55.97 55.67 1mws s LYS 634 Cb -0.05 -2.88 -0.05 0.00 -1.51 0.00 0.00 37.83 33.34 1mws s LYS 634 CO -0.00 0.49 0.73 -0.25 -0.36 0.00 0.00 175.35 175.95 1mws n ASP 635 N 0.40 -6.09 -0.98 1.43 8.00 0.11 -4.62 116.55 114.80 1mws n ASP 635 Ca -0.04 -0.48 0.12 0.00 0.71 0.00 0.00 54.79 55.10 1mws n ASP 635 Cb 0.52 -4.47 0.19 0.00 -0.02 0.00 0.00 41.12 37.33 1mws n ASP 635 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1mws n VAL 636 N -2.66 0.19 -0.30 2.53 0.24 -0.55 -4.54 118.33 113.24 1mws n VAL 636 Ca -0.05 -0.57 0.17 0.00 -2.04 0.00 0.00 64.34 61.86 1mws n VAL 636 Cb 0.58 1.18 0.42 0.00 -1.47 0.00 0.00 33.84 34.56 1mws n VAL 636 CO 0.00 0.00 0.00 0.06 -2.14 0.00 0.00 176.83 174.75 1mws h GLN 637 N 4.34 0.56 -0.36 7.34 -0.00 -1.88 0.00 115.11 125.11 1mws h GLN 637 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.62 1mws h GLN 637 Cb 0.94 -0.13 0.00 0.00 -0.00 0.00 0.00 27.48 28.29 1mws h GLN 637 CO 0.00 0.37 0.00 -0.25 -0.00 0.00 0.00 178.83 178.95 1mws n ASP 638 N -4.63 3.98 -0.40 0.06 8.00 -1.26 -4.47 116.55 117.83 1mws n ASP 638 Ca 0.22 -2.71 0.04 0.00 0.71 0.00 0.00 54.79 53.04 1mws n ASP 638 Cb 0.66 -0.49 0.11 0.00 -0.02 0.00 0.00 41.12 41.37 1mws n ASP 638 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1mws n LYS 639 N 0.04 2.84 0.00 -1.24 5.02 -0.12 -4.94 118.16 119.75 1mws n LYS 639 Ca 0.20 -1.94 0.00 0.00 -2.02 0.00 0.00 58.31 54.55 1mws n LYS 639 Cb 0.82 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 34.60 1mws n LYS 639 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mws n GLY 640 N -0.03 1.05 7.00 0.72 0.00 -1.19 -4.25 105.19 108.49 1mws n GLY 640 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1mws n GLY 640 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1mws n MET 641 N -1.68 0.00 0.27 1.61 2.81 -0.54 -1.58 117.12 118.01 1mws n MET 641 Ca 0.00 0.00 0.14 0.00 -1.81 0.00 0.00 57.70 56.03 1mws n MET 641 Cb 0.00 0.00 0.73 0.00 -0.71 0.00 0.00 33.22 33.24 1mws n MET 641 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1mws h ALA 642 N -0.78 1.18 0.00 3.04 0.00 -1.88 -2.64 119.26 118.18 1mws h ALA 642 Ca 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1mws h ALA 642 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1mws h ALA 642 CO 0.00 0.13 -0.18 0.77 0.00 0.00 0.00 179.25 179.97 1mws h SER 643 N 0.00 0.00 -0.30 0.00 0.02 -1.64 -3.16 113.55 108.47 1mws h SER 643 Ca -0.00 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1mws h SER 643 Cb 0.38 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 1mws h SER 643 CO 0.01 0.18 0.17 0.22 -1.14 0.00 0.00 176.83 176.28 1mws h TYR 644 N 0.00 0.32 0.00 3.45 3.20 -1.58 -0.90 116.97 121.47 1mws h TYR 644 Ca -0.00 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.77 1mws h TYR 644 Cb 0.47 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 1mws h TYR 644 CO 0.00 0.19 -0.53 -0.91 -1.64 0.00 0.00 178.16 175.27 1mws h ASN 645 N 0.36 0.00 -0.58 -2.11 -0.26 -1.75 -2.44 115.58 108.79 1mws h ASN 645 Ca 0.12 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.77 1mws h ASN 645 Cb -0.00 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.24 1mws h ASN 645 CO -0.06 0.53 0.02 0.00 -1.06 0.00 0.00 177.43 176.86 1mws h ALA 646 N 1.47 0.89 -0.35 -0.83 0.00 -1.46 -0.64 119.26 118.34 1mws h ALA 646 Ca -0.01 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 1mws h ALA 646 Cb 1.29 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1mws h ALA 646 CO 0.07 0.66 -0.04 0.87 0.00 0.00 0.00 179.25 180.81 1mws h LYS 647 N 0.95 0.65 -0.40 0.00 1.57 -0.99 -1.49 116.57 116.86 1mws h LYS 647 Ca 0.17 -0.23 0.04 0.00 -1.87 0.00 0.00 60.65 58.77 1mws h LYS 647 Cb 0.52 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.74 1mws h LYS 647 CO 0.03 0.79 0.15 0.82 -0.57 0.00 0.00 179.45 180.67 1mws h ILE 648 N 0.45 0.90 -0.51 1.86 2.04 -1.23 -1.14 117.51 119.88 1mws h ILE 648 Ca 0.10 -0.11 0.01 0.00 1.00 0.00 0.00 64.86 65.86 1mws h ILE 648 Cb 0.52 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 1mws h ILE 648 CO 0.03 0.06 0.33 0.28 0.00 0.00 0.00 178.15 178.84 1mws h SER 649 N 0.32 0.55 -0.42 1.72 0.02 -0.91 -2.31 113.55 112.53 1mws h SER 649 Ca 0.18 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.15 1mws h SER 649 Cb 0.15 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1mws h SER 649 CO -0.17 0.39 0.22 1.23 -1.14 0.00 0.00 176.83 177.36 1mws h GLY 650 N 0.66 0.57 1.52 -3.77 0.00 -0.73 -1.44 103.07 99.87 1mws h GLY 650 Ca 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1mws h GLY 650 CO -0.06 0.12 0.25 0.50 0.00 0.00 0.00 176.54 177.36 1mws h LYS 651 N 0.45 0.64 -0.21 4.80 1.57 -0.90 -1.55 116.57 121.36 1mws h LYS 651 Ca 0.17 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 1mws h LYS 651 Cb 0.06 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1mws h LYS 651 CO -0.11 0.47 -0.03 0.28 -0.57 0.00 0.00 179.45 179.49 1mws h VAL 652 N 0.64 1.27 -0.71 0.50 2.07 -0.82 -2.31 116.25 116.90 1mws h VAL 652 Ca 0.17 -0.98 -0.06 0.00 0.82 0.00 0.00 66.70 66.65 1mws h VAL 652 Cb 0.02 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1mws h VAL 652 CO -0.03 0.30 0.20 1.88 0.02 0.00 0.00 177.57 179.95 1mws h TYR 653 N 0.14 1.15 -0.69 1.57 -1.99 -0.96 0.02 116.97 116.20 1mws h TYR 653 Ca 0.06 -0.12 0.09 0.00 2.00 0.00 0.00 58.73 60.76 1mws h TYR 653 Cb 0.46 -0.33 -0.07 0.00 2.00 0.00 0.00 36.73 38.79 1mws h TYR 653 CO 0.05 0.92 0.34 -0.44 -0.00 0.00 0.00 178.16 179.02 1mws h ASP 654 N 1.06 0.43 -0.14 3.88 3.32 -1.13 0.33 116.42 124.17 1mws h ASP 654 Ca 0.23 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.31 1mws h ASP 654 Cb 0.32 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 1mws h ASP 654 CO -0.00 0.25 -0.03 -0.33 -1.72 0.00 0.00 179.24 177.41 1mws h GLU 655 N 0.58 0.26 0.00 3.56 5.08 -0.83 0.64 114.58 123.87 1mws h GLU 655 Ca 0.34 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.57 1mws h GLU 655 Cb 0.36 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1mws h GLU 655 CO -0.27 0.54 -0.14 -0.07 -1.00 0.00 0.00 179.01 178.07 1mws h LEU 656 N -0.03 0.00 -2.58 1.33 3.38 -0.44 -2.87 115.31 114.10 1mws h LEU 656 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1mws h LEU 656 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1mws h LEU 656 CO 0.01 0.14 0.00 -1.22 0.09 0.00 0.00 178.44 177.46 1mws n TYR 657 N -3.38 0.44 -4.01 1.13 4.02 0.11 -4.04 117.16 111.44 1mws n TYR 657 Ca -0.00 -0.39 -0.31 0.00 -0.01 0.00 0.00 57.90 57.19 1mws n TYR 657 Cb 0.34 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.64 1mws n TYR 657 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1mws n GLU 658 N 0.74 -4.32 -2.17 -0.72 1.02 0.40 -0.71 120.64 114.87 1mws n GLU 658 Ca 0.13 0.49 -0.21 0.00 -0.02 0.00 0.00 57.16 57.56 1mws n GLU 658 Cb 0.44 -5.17 -0.03 0.00 -0.02 0.00 0.00 31.44 26.65 1mws n GLU 658 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1mws n ASN 659 N -2.82 -5.72 0.00 1.62 4.13 0.20 -2.39 115.26 110.28 1mws n ASN 659 Ca -0.04 0.14 0.00 0.00 1.68 0.00 0.00 54.58 56.36 1mws n ASN 659 Cb 0.55 -4.84 0.00 0.00 -1.54 0.00 0.00 39.78 33.95 1mws n ASN 659 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mws n GLY 660 N -0.83 0.70 0.15 7.41 0.00 0.11 -4.97 105.19 107.76 1mws n GLY 660 Ca -0.23 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.80 1mws n GLY 660 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1mws h ASN 661 N 0.00 0.00 -5.36 1.61 4.21 -0.94 -3.47 115.58 111.63 1mws h ASN 661 Ca 0.00 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.37 1mws h ASN 661 Cb 0.00 0.00 -0.13 0.00 -1.12 0.00 0.00 38.32 37.07 1mws h ASN 661 CO 0.00 0.55 -0.43 -1.59 -1.29 0.00 0.00 177.43 174.68 1mws s LYS 662 N -3.28 1.16 -0.27 0.81 -2.85 -0.71 -5.02 119.74 109.58 1mws s LYS 662 Ca 0.01 -1.33 -0.13 0.00 -1.00 0.00 0.00 55.97 53.53 1mws s LYS 662 Cb 0.10 0.34 -0.04 0.00 -2.06 0.00 0.00 37.83 36.16 1mws s LYS 662 CO 0.74 -0.41 0.27 0.21 0.10 0.00 0.00 175.35 176.27 1mws s LYS 663 N -4.03 3.99 0.25 1.78 2.20 -1.26 -4.52 119.74 118.15 1mws s LYS 663 Ca 0.23 -0.15 -0.31 0.00 -0.36 0.00 0.00 55.97 55.39 1mws s LYS 663 Cb 0.04 -3.65 -0.14 0.00 -1.51 0.00 0.00 37.83 32.58 1mws s LYS 663 CO 0.04 -0.21 1.33 0.98 -0.36 0.00 0.00 175.35 177.12 1mws n TYR 664 N 5.14 2.00 -3.81 4.03 4.19 -1.26 -4.98 117.16 122.47 1mws n TYR 664 Ca -0.11 0.50 -0.26 0.00 3.31 0.00 0.00 57.90 61.34 1mws n TYR 664 Cb 0.51 -2.41 -0.17 0.00 0.49 0.00 0.00 39.34 37.76 1mws n TYR 664 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1mws s ASP 665 N 0.09 2.25 0.53 2.98 -1.08 -1.26 -4.99 116.67 115.19 1mws s ASP 665 Ca 0.66 -0.41 0.20 0.00 -0.52 0.00 0.00 52.55 52.48 1mws s ASP 665 Cb -0.67 -0.65 1.40 0.00 -1.46 0.00 0.00 42.92 41.55 1mws s ASP 665 CO 0.53 -0.20 2.16 0.16 0.52 0.00 0.00 175.17 178.34 1mws h ILE 666 N 6.35 0.88 -0.47 4.11 3.07 -1.93 -2.51 117.51 127.01 1mws h ILE 666 Ca -0.22 -0.07 0.00 0.00 1.55 0.00 0.00 64.86 66.13 1mws h ILE 666 Cb 1.12 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.71 1mws h ILE 666 CO 0.33 0.02 0.00 0.47 -1.05 0.00 0.00 178.15 177.92 1mws n ASP 667 N -4.32 3.95 -0.77 2.16 10.43 -1.26 -4.83 116.55 121.91 1mws n ASP 667 Ca -0.03 -2.45 0.13 0.00 2.57 0.00 0.00 54.79 55.01 1mws n ASP 667 Cb 0.10 -0.54 0.27 0.00 1.84 0.00 0.00 41.12 42.79 1mws n ASP 667 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34