#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mx9 n PRO 3023N 0.00 -0.44 -3.15 -1.46 -0.02 -1.26 -4.97 135.00 123.70 1mx9 n PRO 3023Ca 0.00 -0.09 -0.39 0.00 -2.02 0.00 0.00 63.50 61.00 1mx9 n PRO 3023Cb 0.00 -1.78 -0.05 0.00 -0.02 0.00 0.00 33.50 31.65 1mx9 n PRO 3023CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1mx9 s PRO 3024N -3.50 4.36 -0.23 0.52 0.02 -1.26 -4.96 135.00 129.94 1mx9 s PRO 3024Ca 0.55 0.69 0.01 0.00 0.02 0.00 0.00 61.00 62.27 1mx9 s PRO 3024Cb -0.20 -3.47 0.06 0.00 0.02 0.00 0.00 34.50 30.91 1mx9 s PRO 3024CO 0.68 0.03 -0.05 0.08 -0.33 0.00 0.00 177.00 177.41 1mx9 s VAL 3025N 0.99 1.51 0.09 3.83 1.01 -1.26 -0.19 120.40 126.38 1mx9 s VAL 3025Ca 0.32 -1.21 0.04 0.00 0.00 0.00 0.00 61.98 61.12 1mx9 s VAL 3025Cb -0.16 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1mx9 s VAL 3025CO 0.14 -0.11 0.05 -0.69 0.00 0.00 0.00 175.10 174.49 1mx9 s VAL 3026N 1.40 4.31 0.22 2.92 1.01 -0.31 -4.90 120.40 125.05 1mx9 s VAL 3026Ca -0.06 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.03 1mx9 s VAL 3026Cb -0.19 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1mx9 s VAL 3026CO -0.06 0.10 0.41 -0.62 0.00 0.00 0.00 175.10 174.93 1mx9 s ASP 3027N -2.41 6.38 0.23 3.32 -1.08 -1.26 0.71 116.67 122.55 1mx9 s ASP 3027Ca 0.28 0.40 -0.02 0.00 -0.52 0.00 0.00 52.55 52.68 1mx9 s ASP 3027Cb -0.12 -2.01 -0.03 0.00 -1.46 0.00 0.00 42.92 39.30 1mx9 s ASP 3027CO 0.21 -0.07 0.22 0.42 0.52 0.00 0.00 175.17 176.46 1mx9 s THR 3028N -1.92 0.00 0.19 1.71 -4.23 0.29 -4.82 115.64 106.86 1mx9 s THR 3028Ca 0.38 -1.88 -0.12 0.00 -1.18 0.00 0.00 61.69 58.90 1mx9 s THR 3028Cb -0.11 -2.46 0.10 0.00 1.34 0.00 0.00 72.50 71.38 1mx9 s THR 3028CO 0.30 0.00 1.80 0.58 -0.54 0.00 0.00 174.62 176.76 1mx9 h VAL 3029N 2.49 0.98 0.00 2.29 2.07 -1.95 -2.17 116.25 119.96 1mx9 h VAL 3029Ca -0.33 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1mx9 h VAL 3029Cb 1.25 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1mx9 h VAL 3029CO 0.48 0.11 0.00 1.41 0.02 0.00 0.00 177.57 179.59 1mx9 n HIS 3030N -4.83 0.00 -1.65 1.57 8.25 -1.26 -5.01 115.22 112.29 1mx9 n HIS 3030Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1mx9 n HIS 3030Cb 0.14 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 30.86 1mx9 n HIS 3030CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1mx9 n GLY 3031N 1.31 0.11 3.88 -1.41 0.00 -0.82 -2.00 105.19 106.26 1mx9 n GLY 3031Ca 0.11 -1.61 -0.34 0.00 0.00 0.00 0.00 46.02 44.17 1mx9 n GLY 3031CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mx9 s LYS 3032N -2.00 3.68 -0.06 1.61 1.02 -1.23 0.10 119.74 122.86 1mx9 s LYS 3032Ca 0.00 0.05 0.04 0.00 0.02 0.00 0.00 55.97 56.08 1mx9 s LYS 3032Cb 0.00 -3.03 -0.00 0.00 -0.52 0.00 0.00 37.83 34.28 1mx9 s LYS 3032CO 0.00 0.60 -0.18 0.14 -0.92 0.00 0.00 175.35 174.98 1mx9 s VAL 3033N -1.37 1.56 -0.28 3.17 -7.23 0.22 -0.36 120.40 116.12 1mx9 s VAL 3033Ca 0.31 -0.77 -0.10 0.00 -1.81 0.00 0.00 61.98 59.61 1mx9 s VAL 3033Cb -0.14 -1.35 -0.04 0.00 0.56 0.00 0.00 36.38 35.42 1mx9 s VAL 3033CO 0.18 0.45 0.15 -0.22 -0.31 0.00 0.00 175.10 175.35 1mx9 s LEU 3034N 0.15 3.87 0.00 1.32 1.98 -0.33 -1.17 118.68 124.51 1mx9 s LEU 3034Ca -0.08 -0.12 0.00 0.00 -2.89 0.00 0.00 54.13 51.05 1mx9 s LEU 3034Cb -0.13 -2.05 0.00 0.00 0.66 0.00 0.00 46.19 44.66 1mx9 s LEU 3034CO 0.04 -0.06 0.00 0.61 -1.89 0.00 0.00 176.35 175.04 1mx9 n GLY 3035N 5.02 3.36 3.37 7.98 0.00 0.73 -0.22 105.19 125.42 1mx9 n GLY 3035Ca -0.15 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 43.87 1mx9 n GLY 3035CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mx9 s LYS 3036N 3.11 0.76 -0.02 1.61 -2.85 -0.30 -4.30 119.74 117.75 1mx9 s LYS 3036Ca 0.00 0.19 -0.18 0.00 -1.00 0.00 0.00 55.97 54.99 1mx9 s LYS 3036Cb 0.00 0.36 -0.05 0.00 -2.06 0.00 0.00 37.83 36.07 1mx9 s LYS 3036CO 0.00 -0.20 0.49 -0.06 0.10 0.00 0.00 175.35 175.68 1mx9 s PHE 3037N -0.85 3.68 -0.02 1.78 2.99 -1.26 -0.75 117.98 123.54 1mx9 s PHE 3037Ca -0.09 1.05 0.03 0.00 0.00 0.00 0.00 56.93 57.92 1mx9 s PHE 3037Cb -0.03 -2.46 -0.00 0.00 0.00 0.00 0.00 43.02 40.53 1mx9 s PHE 3037CO 0.05 0.45 -0.11 0.08 -0.00 0.00 0.00 175.22 175.69 1mx9 s VAL 3038N -0.45 0.89 0.01 -0.44 1.01 -0.37 -4.97 120.40 116.08 1mx9 s VAL 3038Ca 0.27 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1mx9 s VAL 3038Cb -0.17 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1mx9 s VAL 3038CO 0.14 0.26 0.05 -0.44 0.00 0.00 0.00 175.10 175.12 1mx9 s SER 3039N -0.05 5.46 -0.01 3.32 0.01 -1.26 -0.47 113.70 120.70 1mx9 s SER 3039Ca 0.01 0.07 0.07 0.00 1.31 0.00 0.00 55.95 57.40 1mx9 s SER 3039Cb -0.07 -1.50 -0.02 0.00 0.21 0.00 0.00 66.02 64.64 1mx9 s SER 3039CO 0.00 0.26 -0.22 -0.22 0.41 0.00 0.00 173.24 173.46 1mx9 s LEU 3040N -1.80 2.05 0.03 2.44 2.96 -1.26 -5.00 118.68 118.10 1mx9 s LEU 3040Ca 0.23 -0.41 -0.33 0.00 -0.22 0.00 0.00 54.13 53.40 1mx9 s LEU 3040Cb -0.12 -1.14 -0.11 0.00 0.50 0.00 0.00 46.19 45.31 1mx9 s LEU 3040CO 0.14 0.27 1.83 -0.62 -1.32 0.00 0.00 176.35 176.65 1mx9 n GLU 3041N 2.48 2.43 0.00 1.98 -0.58 -1.26 -2.00 120.64 123.69 1mx9 n GLU 3041Ca -0.16 0.89 0.00 0.00 -0.42 0.00 0.00 57.16 57.47 1mx9 n GLU 3041Cb 0.52 -2.75 0.00 0.00 -0.57 0.00 0.00 31.44 28.65 1mx9 n GLU 3041CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1mx9 n GLY 3042N 4.19 0.23 3.01 0.62 0.00 -1.26 -5.06 105.19 106.92 1mx9 n GLY 3042Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 1mx9 n GLY 3042CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mx9 s PHE 3043N -2.00 1.88 0.16 1.61 0.40 -0.85 -5.01 117.98 114.18 1mx9 s PHE 3043Ca 0.00 -0.95 -0.05 0.00 -0.60 0.00 0.00 56.93 55.33 1mx9 s PHE 3043Cb 0.00 -1.41 0.02 0.00 0.51 0.00 0.00 43.02 42.14 1mx9 s PHE 3043CO 0.00 -0.53 1.43 0.00 0.70 0.00 0.00 175.22 176.82 1mx9 h ALA 3044N 7.76 0.56 -1.47 5.36 0.00 -1.97 -3.41 119.26 126.09 1mx9 h ALA 3044Ca -0.33 -0.56 -0.53 0.00 0.00 0.00 0.00 54.91 53.49 1mx9 h ALA 3044Cb 1.15 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 1mx9 h ALA 3044CO 0.48 0.71 1.13 -1.14 0.00 0.00 0.00 179.25 180.44 1mx9 s GLN 3045N -3.85 3.12 0.35 0.00 2.00 -1.26 -4.98 119.66 115.04 1mx9 s GLN 3045Ca -0.08 0.19 -0.27 0.00 -2.00 0.00 0.00 55.36 53.20 1mx9 s GLN 3045Cb 0.10 -4.20 -0.12 0.00 0.80 0.00 0.00 33.01 29.59 1mx9 s GLN 3045CO 0.86 -2.19 1.18 -2.30 -0.50 0.00 0.00 175.29 172.34 1mx9 n PRO 3046N 9.07 1.81 -3.04 1.67 -0.02 -1.26 -4.90 135.00 138.32 1mx9 n PRO 3046Ca 0.10 0.64 -0.40 0.00 -2.02 0.00 0.00 63.50 61.82 1mx9 n PRO 3046Cb 0.50 -2.18 -0.05 0.00 -0.02 0.00 0.00 33.50 31.75 1mx9 n PRO 3046CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1mx9 s VAL 3047N -1.13 4.97 -0.04 -1.45 1.01 0.38 -4.85 120.40 119.29 1mx9 s VAL 3047Ca 0.58 1.47 -0.25 0.00 0.00 0.00 0.00 61.98 63.79 1mx9 s VAL 3047Cb -0.59 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 31.71 1mx9 s VAL 3047CO 0.60 0.28 0.76 0.00 0.00 0.00 0.00 175.10 176.75 1mx9 s ALA 3048N 0.56 3.30 -0.04 5.51 0.00 -0.26 -1.24 121.76 129.59 1mx9 s ALA 3048Ca 0.37 0.23 0.07 0.00 0.00 0.00 0.00 51.96 52.63 1mx9 s ALA 3048Cb -0.18 -3.04 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 1mx9 s ALA 3048CO 0.19 -0.11 -0.24 0.42 0.00 0.00 0.00 175.76 176.02 1mx9 s ILE 3049N 0.75 1.96 -0.19 0.00 1.01 0.07 -1.90 121.20 122.88 1mx9 s ILE 3049Ca 0.40 -1.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 1mx9 s ILE 3049Cb -0.19 -1.64 0.05 0.00 0.01 0.00 0.00 42.46 40.70 1mx9 s ILE 3049CO 0.21 0.55 -0.01 -0.36 0.00 0.00 0.00 174.94 175.33 1mx9 s PHE 3050N -0.36 1.51 -0.24 3.97 0.40 -0.82 -1.15 117.98 121.28 1mx9 s PHE 3050Ca 0.03 -1.11 -0.07 0.00 -0.60 0.00 0.00 56.93 55.19 1mx9 s PHE 3050Cb -0.11 -1.22 -0.02 0.00 0.51 0.00 0.00 43.02 42.17 1mx9 s PHE 3050CO 0.01 -0.64 0.04 -0.51 0.70 0.00 0.00 175.22 174.83 1mx9 s LEU 3051N 1.70 3.33 0.00 -0.37 1.43 -0.14 -0.68 118.68 123.95 1mx9 s LEU 3051Ca -0.02 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 1mx9 s LEU 3051Cb -0.17 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.17 1mx9 s LEU 3051CO -0.07 -0.02 0.00 0.61 0.23 0.00 0.00 176.35 177.10 1mx9 n GLY 3052N 4.83 1.13 3.71 -3.19 0.00 -1.21 -3.79 105.19 106.68 1mx9 n GLY 3052Ca -0.17 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 1mx9 n GLY 3052CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mx9 s ILE 3053N -2.07 4.30 0.28 -0.61 1.01 -0.40 -4.73 121.20 118.98 1mx9 s ILE 3053Ca 0.00 1.68 -0.29 0.00 0.00 0.00 0.00 60.65 62.04 1mx9 s ILE 3053Cb 0.00 -4.07 -0.09 0.00 0.01 0.00 0.00 42.46 38.30 1mx9 s ILE 3053CO 0.00 0.15 1.00 -2.16 0.00 0.00 0.00 174.94 173.92 1mx9 s PRO 3054N 0.91 4.68 -0.09 2.79 0.04 -1.26 0.89 135.00 142.96 1mx9 s PRO 3054Ca 0.56 1.55 0.13 0.00 0.04 0.00 0.00 61.00 63.27 1mx9 s PRO 3054Cb -0.27 -3.09 0.19 0.00 0.04 0.00 0.00 34.50 31.37 1mx9 s PRO 3054CO 0.29 0.32 1.09 1.97 0.04 0.00 0.00 177.00 180.72 1mx9 n PHE 3055N 1.08 0.00 -3.65 0.56 1.16 -1.00 -4.90 117.46 110.71 1mx9 n PHE 3055Ca -0.00 -0.68 -0.02 0.00 -1.87 0.00 0.00 57.45 54.88 1mx9 n PHE 3055Cb 0.47 -0.12 -0.03 0.00 -1.61 0.00 0.00 39.48 38.19 1mx9 n PHE 3055CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1mx9 s ALA 3056N -1.94 -2.16 0.47 1.98 0.00 -1.26 -4.52 121.76 114.33 1mx9 s ALA 3056Ca 0.21 1.92 -0.24 0.00 0.00 0.00 0.00 51.96 53.85 1mx9 s ALA 3056Cb 0.18 -1.10 -0.07 0.00 0.00 0.00 0.00 23.12 22.13 1mx9 s ALA 3056CO 0.02 -0.36 1.33 0.21 0.00 0.00 0.00 175.76 176.96 1mx9 s LYS 3057N -1.43 3.60 0.08 0.00 2.20 -0.02 -4.57 119.74 119.59 1mx9 s LYS 3057Ca 0.10 2.19 -0.30 0.00 -0.36 0.00 0.00 55.97 57.60 1mx9 s LYS 3057Cb -0.01 -2.52 -0.09 0.00 -1.51 0.00 0.00 37.83 33.70 1mx9 s LYS 3057CO -0.06 -0.81 1.87 -2.14 -0.36 0.00 0.00 175.35 173.86 1mx9 s PRO 3058N -2.57 4.14 -0.67 4.03 0.02 -1.26 -4.60 135.00 134.08 1mx9 s PRO 3058Ca 0.64 2.57 -0.04 0.00 0.02 0.00 0.00 61.00 64.19 1mx9 s PRO 3058Cb -0.39 -3.86 -0.05 0.00 0.02 0.00 0.00 34.50 30.22 1mx9 s PRO 3058CO 0.48 -0.89 1.94 -0.35 -0.33 0.00 0.00 177.00 177.85 1mx9 n PRO 3059N 6.55 1.65 -3.54 5.54 -0.04 -1.26 -4.88 135.00 139.01 1mx9 n PRO 3059Ca 0.19 -1.20 -0.19 0.00 -0.04 0.00 0.00 63.50 62.25 1mx9 n PRO 3059Cb 0.40 -2.30 -0.01 0.00 -0.04 0.00 0.00 33.50 31.55 1mx9 n PRO 3059CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1mx9 s LEU 3060N 0.07 3.94 0.00 1.53 1.43 -1.26 -3.52 118.68 120.86 1mx9 s LEU 3060Ca 0.33 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.21 1mx9 s LEU 3060Cb 0.09 -2.68 0.00 0.00 0.03 0.00 0.00 46.19 43.63 1mx9 s LEU 3060CO -0.02 -0.40 0.00 0.61 0.23 0.00 0.00 176.35 176.76 1mx9 n GLY 3061N -1.59 1.92 0.26 -3.19 0.00 -1.26 -0.24 105.19 101.08 1mx9 n GLY 3061Ca -0.01 0.50 0.13 0.00 0.00 0.00 0.00 46.02 46.64 1mx9 n GLY 3061CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mx9 h PRO 3062N 0.00 0.00 0.00 1.61 0.13 -1.93 -2.89 132.00 128.91 1mx9 h PRO 3062Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1mx9 h PRO 3062Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1mx9 h PRO 3062CO 0.00 0.13 0.00 1.28 -0.23 0.00 0.00 178.00 179.18 1mx9 n LEU 3063N -3.45 0.66 -4.78 1.56 4.77 0.66 -4.82 117.00 111.61 1mx9 n LEU 3063Ca -0.01 0.58 -0.41 0.00 -0.03 0.00 0.00 56.01 56.14 1mx9 n LEU 3063Cb 0.30 -0.39 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 1mx9 n LEU 3063CO 0.30 -0.23 1.11 -0.60 -1.33 0.00 0.00 177.39 176.64 1mx9 s ARG 3064N -3.12 4.15 -0.99 3.23 3.52 -1.10 -2.72 118.95 121.93 1mx9 s ARG 3064Ca 0.10 2.51 -0.01 0.00 -0.13 0.00 0.00 55.73 58.19 1mx9 s ARG 3064Cb 0.13 -2.99 -0.02 0.00 -1.56 0.00 0.00 34.95 30.51 1mx9 s ARG 3064CO 0.54 -0.47 0.83 1.19 -0.81 0.00 0.00 175.30 176.58 1mx9 n PHE 3065N 0.56 -1.94 -3.65 5.12 3.72 -1.26 -5.02 117.46 114.99 1mx9 n PHE 3065Ca 0.01 0.78 -0.10 0.00 -0.05 0.00 0.00 57.45 58.09 1mx9 n PHE 3065Cb 0.40 -4.42 -0.04 0.00 -0.94 0.00 0.00 39.48 34.48 1mx9 n PHE 3065CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1mx9 s THR 3066N -3.31 0.03 0.63 4.37 -4.23 -1.10 -4.95 115.64 107.08 1mx9 s THR 3066Ca 0.11 -0.58 -0.16 0.00 -1.18 0.00 0.00 61.69 59.89 1mx9 s THR 3066Cb -0.01 -1.35 -0.01 0.00 1.34 0.00 0.00 72.50 72.46 1mx9 s THR 3066CO 0.63 -0.16 1.13 -2.16 -0.54 0.00 0.00 174.62 173.52 1mx9 s PRO 3067N -3.83 2.88 0.63 3.99 0.04 -1.26 -4.91 135.00 132.54 1mx9 s PRO 3067Ca 0.06 1.50 -0.18 0.00 0.04 0.00 0.00 61.00 62.42 1mx9 s PRO 3067Cb -0.00 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 1mx9 s PRO 3067CO -0.07 -1.21 1.27 -1.25 0.04 0.00 0.00 177.00 175.78 1mx9 s PRO 3068N -3.84 2.66 0.19 0.56 0.04 -1.26 -5.04 135.00 128.31 1mx9 s PRO 3068Ca 0.70 1.99 0.11 0.00 0.04 0.00 0.00 61.00 63.83 1mx9 s PRO 3068Cb -0.23 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 1mx9 s PRO 3068CO 0.38 -1.50 -0.19 -0.65 0.04 0.00 0.00 177.00 175.08 1mx9 s GLN 3069N -3.38 1.70 0.81 4.56 -0.21 -1.26 -5.02 119.66 116.85 1mx9 s GLN 3069Ca 0.81 -1.44 -0.15 0.00 0.02 0.00 0.00 55.36 54.60 1mx9 s GLN 3069Cb -0.35 -1.95 -0.00 0.00 1.00 0.00 0.00 33.01 31.70 1mx9 s GLN 3069CO 0.38 0.41 0.52 -0.35 -2.12 0.00 0.00 175.29 174.13 1mx9 n PRO 3070N 0.19 0.08 -2.85 2.91 -0.04 -1.26 -0.84 135.00 133.19 1mx9 n PRO 3070Ca -0.12 0.08 -0.32 0.00 -0.04 0.00 0.00 63.50 63.10 1mx9 n PRO 3070Cb 0.56 -1.88 -0.05 0.00 -0.04 0.00 0.00 33.50 32.09 1mx9 n PRO 3070CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mx9 s ALA 3071N -2.10 3.21 0.35 0.55 0.00 -1.26 -2.67 121.76 119.84 1mx9 s ALA 3071Ca 0.63 0.09 -0.25 0.00 0.00 0.00 0.00 51.96 52.42 1mx9 s ALA 3071Cb -0.29 -2.91 -0.10 0.00 0.00 0.00 0.00 23.12 19.82 1mx9 s ALA 3071CO 0.61 0.09 0.98 -2.00 0.00 0.00 0.00 175.76 175.44 1mx9 s GLU 3072N -3.46 4.45 0.37 0.00 2.56 -1.26 -4.85 118.70 116.51 1mx9 s GLU 3072Ca 0.56 1.38 -0.24 0.00 0.00 0.00 0.00 54.97 56.67 1mx9 s GLU 3072Cb -0.10 -2.71 -0.10 0.00 2.00 0.00 0.00 34.13 33.23 1mx9 s GLU 3072CO 0.23 0.15 0.98 -1.25 -0.56 0.00 0.00 175.26 174.80 1mx9 s PRO 3073N -2.22 4.38 0.14 4.30 0.04 -1.26 -5.02 135.00 135.35 1mx9 s PRO 3073Ca 0.53 1.33 0.06 0.00 0.04 0.00 0.00 61.00 62.96 1mx9 s PRO 3073Cb -0.19 -2.58 -0.04 0.00 0.04 0.00 0.00 34.50 31.73 1mx9 s PRO 3073CO 0.25 0.08 -0.00 1.67 0.04 0.00 0.00 177.00 179.04 1mx9 s TRP 3074N -1.76 2.89 -0.45 0.56 -2.14 -0.85 -5.06 118.94 112.12 1mx9 s TRP 3074Ca 0.55 -0.10 0.23 0.00 2.66 0.00 0.00 56.10 59.45 1mx9 s TRP 3074Cb -0.17 -1.44 0.26 0.00 -3.10 0.00 0.00 33.47 29.02 1mx9 s TRP 3074CO 0.22 0.50 1.32 0.77 -2.66 0.00 0.00 176.95 177.10 1mx9 h SER 3075N 2.97 0.00 0.00 -2.66 0.02 -1.98 -3.42 113.55 108.49 1mx9 h SER 3075Ca -0.47 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 1mx9 h SER 3075Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1mx9 h SER 3075CO 0.58 0.03 0.00 0.49 -1.14 0.00 0.00 176.83 176.80 1mx9 n PHE 3076N -2.56 0.00 -3.71 3.45 3.01 -1.26 -5.00 117.46 111.39 1mx9 n PHE 3076Ca 0.02 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.10 1mx9 n PHE 3076Cb 0.50 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.86 1mx9 n PHE 3076CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1mx9 s VAL 3077N 3.99 3.77 -0.51 -4.37 1.01 -1.26 -3.50 120.40 119.53 1mx9 s VAL 3077Ca 0.00 -1.46 -0.27 0.00 0.00 0.00 0.00 61.98 60.25 1mx9 s VAL 3077Cb 0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 1mx9 s VAL 3077CO 0.00 -0.41 1.86 -0.75 0.00 0.00 0.00 175.10 175.80 1mx9 s LYS 3078N 1.34 2.85 -0.67 2.72 2.20 0.52 -4.75 119.74 123.95 1mx9 s LYS 3078Ca 0.02 0.94 -0.26 0.00 -0.36 0.00 0.00 55.97 56.31 1mx9 s LYS 3078Cb -0.22 -4.33 -0.11 0.00 -1.51 0.00 0.00 37.83 31.67 1mx9 s LYS 3078CO 0.01 -2.45 2.39 1.21 -0.36 0.00 0.00 175.35 176.14 1mx9 s ASN 3079N 7.60 4.15 -1.19 1.43 2.47 -1.26 -1.18 114.94 126.95 1mx9 s ASN 3079Ca 0.73 0.44 -0.04 0.00 0.42 0.00 0.00 52.86 54.41 1mx9 s ASN 3079Cb -0.16 -2.53 0.21 0.00 -1.45 0.00 0.00 41.25 37.32 1mx9 s ASN 3079CO 0.26 -3.44 2.10 0.00 -3.72 0.00 0.00 177.10 172.29 1mx9 n ALA 3080N 17.40 6.38 -0.34 1.71 0.00 0.69 -4.51 120.51 141.84 1mx9 n ALA 3080Ca 0.42 -4.34 0.00 0.00 0.00 0.00 0.00 53.44 49.53 1mx9 n ALA 3080Cb 0.48 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.40 1mx9 n ALA 3080CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1mx9 n THR 3081N 1.09 0.36 -4.76 0.00 -2.24 -1.25 -0.97 114.28 106.52 1mx9 n THR 3081Ca 0.54 -0.51 -0.33 0.00 -2.27 0.00 0.00 64.05 61.47 1mx9 n THR 3081Cb 0.26 0.97 -0.12 0.00 -2.10 0.00 0.00 70.33 69.34 1mx9 n THR 3081CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1mx9 s SER 3082N -0.36 4.34 0.23 3.42 0.01 -1.25 -4.88 113.70 115.20 1mx9 s SER 3082Ca 0.00 -0.11 -0.30 0.00 1.31 0.00 0.00 55.95 56.86 1mx9 s SER 3082Cb 0.00 -1.01 -0.09 0.00 0.21 0.00 0.00 66.02 65.13 1mx9 s SER 3082CO 0.00 0.35 1.28 -0.31 0.41 0.00 0.00 173.24 174.97 1mx9 s TYR 3083N -0.77 3.27 0.95 2.43 2.02 -1.26 -4.07 117.35 119.91 1mx9 s TYR 3083Ca 0.12 1.32 -0.12 0.00 -0.37 0.00 0.00 57.07 58.02 1mx9 s TYR 3083Cb -0.11 -3.57 0.16 0.00 -0.40 0.00 0.00 41.96 38.05 1mx9 s TYR 3083CO 0.01 -1.67 1.09 -1.25 -1.57 0.00 0.00 175.55 172.16 1mx9 s PRO 3084N -0.54 0.82 0.65 -1.71 0.04 -1.26 -4.98 135.00 128.03 1mx9 s PRO 3084Ca 0.54 0.65 -0.09 0.00 0.04 0.00 0.00 61.00 62.14 1mx9 s PRO 3084Cb -0.36 -1.77 0.15 0.00 0.04 0.00 0.00 34.50 32.55 1mx9 s PRO 3084CO 0.41 -2.49 0.89 -0.35 0.04 0.00 0.00 177.00 175.49 1mx9 n PRO 3085N -4.03 -0.68 -4.34 0.56 -0.04 -1.26 -4.69 135.00 120.51 1mx9 n PRO 3085Ca 0.06 -1.57 -0.30 0.00 -0.04 0.00 0.00 63.50 61.66 1mx9 n PRO 3085Cb 0.56 -0.85 -0.11 0.00 -0.04 0.00 0.00 33.50 33.06 1mx9 n PRO 3085CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mx9 s MET 3086N -4.89 1.92 0.42 0.54 0.23 0.84 -4.84 119.30 113.53 1mx9 s MET 3086Ca 0.52 -1.10 -0.25 0.00 -1.03 0.00 0.00 55.69 53.83 1mx9 s MET 3086Cb -0.02 -2.18 -0.10 0.00 -1.53 0.00 0.00 34.83 31.00 1mx9 s MET 3086CO 0.36 0.50 1.18 0.00 -2.03 0.00 0.00 175.02 175.02 1mx9 n THR 3088N -0.29 0.13 -3.95 0.00 -1.04 -1.13 -4.70 114.28 103.31 1mx9 n THR 3088Ca 0.08 -0.02 -0.11 0.00 -2.04 0.00 0.00 64.05 61.95 1mx9 n THR 3088Cb 0.39 -0.79 -0.01 0.00 -1.82 0.00 0.00 70.33 68.10 1mx9 n THR 3088CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mx9 s GLN 3089N 2.73 2.01 -0.10 -2.82 -2.07 -1.26 -4.71 119.66 113.43 1mx9 s GLN 3089Ca 0.99 -1.53 -0.29 0.00 -1.82 0.00 0.00 55.36 52.70 1mx9 s GLN 3089Cb -1.25 0.53 -0.05 0.00 -1.09 0.00 0.00 33.01 31.16 1mx9 s GLN 3089CO 0.70 -0.89 1.67 0.34 -1.32 0.00 0.00 175.29 175.79 1mx9 s ASP 3090N -3.13 6.54 0.46 12.60 -1.08 -1.26 -4.86 116.67 125.94 1mx9 s ASP 3090Ca 0.22 2.06 0.18 0.00 -0.52 0.00 0.00 52.55 54.50 1mx9 s ASP 3090Cb -0.03 -2.53 1.10 0.00 -1.46 0.00 0.00 42.92 40.00 1mx9 s ASP 3090CO 0.15 -1.06 1.99 1.55 0.52 0.00 0.00 175.17 178.32 1mx9 h PRO 3091N 10.08 0.00 0.28 4.34 0.13 -1.98 -0.55 132.00 144.30 1mx9 h PRO 3091Ca -0.38 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 1mx9 h PRO 3091Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1mx9 h PRO 3091CO 0.97 0.20 -0.13 0.87 -0.23 0.00 0.00 178.00 179.67 1mx9 h LYS 3092N 0.00 -0.36 -0.19 0.86 1.57 -2.00 -2.38 116.57 114.07 1mx9 h LYS 3092Ca -0.00 0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1mx9 h LYS 3092Cb 0.39 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1mx9 h LYS 3092CO 0.03 -0.09 -0.14 0.00 -0.57 0.00 0.00 179.45 178.68 1mx9 h ALA 3093N -0.78 1.42 0.27 3.86 0.00 -1.97 -1.42 119.26 120.64 1mx9 h ALA 3093Ca -0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1mx9 h ALA 3093Cb 0.44 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1mx9 h ALA 3093CO 0.06 0.40 -0.16 0.78 0.00 0.00 0.00 179.25 180.34 1mx9 h GLY 3094N 0.82 -0.41 1.09 0.00 0.00 -1.16 -1.58 103.07 101.83 1mx9 h GLY 3094Ca 0.06 0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.51 1mx9 h GLY 3094CO 0.02 -0.16 0.27 -1.61 0.00 0.00 0.00 176.54 175.07 1mx9 h GLN 3095N -0.40 1.15 -0.18 4.80 4.15 -1.11 -1.45 115.11 122.07 1mx9 h GLN 3095Ca -0.03 -0.22 -0.01 0.00 0.77 0.00 0.00 58.65 59.16 1mx9 h GLN 3095Cb 0.33 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 1mx9 h GLN 3095CO 0.03 0.95 0.05 1.25 -1.93 0.00 0.00 178.83 179.18 1mx9 h LEU 3096N 1.11 0.21 0.14 -2.39 5.85 -1.07 -1.32 115.31 117.84 1mx9 h LEU 3096Ca 0.25 -0.02 -0.29 0.00 0.84 0.00 0.00 57.88 58.66 1mx9 h LEU 3096Cb 0.25 -0.05 0.02 0.00 0.37 0.00 0.00 40.66 41.25 1mx9 h LEU 3096CO -0.02 0.22 -1.29 0.25 -0.34 0.00 0.00 178.44 177.26 1mx9 h LEU 3097N 0.24 0.58 0.15 2.25 5.85 -0.79 -2.66 115.31 120.93 1mx9 h LEU 3097Ca 0.06 -0.60 -0.00 0.00 0.84 0.00 0.00 57.88 58.17 1mx9 h LEU 3097Cb 0.09 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 40.93 1mx9 h LEU 3097CO -0.00 1.46 -0.10 -1.28 -0.34 0.00 0.00 178.44 178.18 1mx9 h SER 3098N 0.12 -0.26 0.22 1.25 0.87 -0.68 -1.78 113.55 113.29 1mx9 h SER 3098Ca -0.17 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.42 1mx9 h SER 3098Cb 2.00 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 64.01 1mx9 h SER 3098CO 0.22 -0.16 -0.39 -0.33 -0.53 0.00 0.00 176.83 175.64 1mx9 h GLU 3099N -0.25 -0.67 -0.56 2.24 5.08 -1.34 0.19 114.58 119.28 1mx9 h GLU 3099Ca -0.01 0.05 0.16 0.00 -1.00 0.00 0.00 59.36 58.56 1mx9 h GLU 3099Cb 0.22 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 1mx9 h GLU 3099CO 0.00 -0.44 0.44 -0.07 -1.00 0.00 0.00 179.01 177.94 1mx9 h LEU 3100N -0.69 0.00 0.00 1.33 3.38 -1.34 -3.14 115.31 114.85 1mx9 h LEU 3100Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1mx9 h LEU 3100Cb 0.68 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 1mx9 h LEU 3100CO -0.17 0.00 -1.64 0.49 0.09 0.00 0.00 178.44 177.21 1mx9 n PHE 3101N -4.19 0.00 -1.69 1.13 3.72 -0.68 -4.96 117.46 110.79 1mx9 n PHE 3101Ca 0.10 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.14 1mx9 n PHE 3101Cb 0.66 -0.33 0.07 0.00 -0.94 0.00 0.00 39.48 38.95 1mx9 n PHE 3101CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 1mx9 s THR 3102N -2.90 2.09 -0.85 4.37 -1.32 0.62 -4.88 115.64 112.77 1mx9 s THR 3102Ca -0.05 0.05 0.12 0.00 -1.21 0.00 0.00 61.69 60.61 1mx9 s THR 3102Cb 0.08 -2.95 0.36 0.00 -1.51 0.00 0.00 72.50 68.49 1mx9 s THR 3102CO 0.56 -0.01 1.30 -0.46 -2.21 0.00 0.00 174.62 173.80 1mx9 n ASN 3103N -2.05 3.16 -4.91 8.08 6.94 -1.25 -5.00 115.26 120.23 1mx9 n ASN 3103Ca 0.15 -2.17 -0.27 0.00 -0.02 0.00 0.00 54.58 52.27 1mx9 n ASN 3103Cb 0.49 -0.30 -0.00 0.00 -2.36 0.00 0.00 39.78 37.60 1mx9 n ASN 3103CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1mx9 s ARG 3104N -1.31 3.55 0.00 -3.83 0.52 -1.26 -4.11 118.95 112.51 1mx9 s ARG 3104Ca 0.28 0.18 0.21 0.00 -0.52 0.00 0.00 55.73 55.88 1mx9 s ARG 3104Cb 0.16 -2.39 0.94 0.00 0.52 0.00 0.00 34.95 34.18 1mx9 s ARG 3104CO 0.15 -0.18 1.67 1.17 0.02 0.00 0.00 175.30 178.14 1mx9 n LYS 3105N -2.18 0.10 -3.66 3.54 0.00 -1.26 -4.65 118.16 110.05 1mx9 n LYS 3105Ca 0.00 0.13 -0.08 0.00 0.00 0.00 0.00 58.31 58.36 1mx9 n LYS 3105Cb 0.55 -1.50 -0.08 0.00 0.00 0.00 0.00 35.03 34.00 1mx9 n LYS 3105CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1mx9 s GLU 3106N -2.86 0.62 0.78 1.64 2.12 -1.26 -5.03 118.70 114.70 1mx9 s GLU 3106Ca 0.13 1.10 -0.14 0.00 0.36 0.00 0.00 54.97 56.42 1mx9 s GLU 3106Cb 0.14 0.09 0.07 0.00 0.26 0.00 0.00 34.13 34.69 1mx9 s GLU 3106CO 0.36 -0.15 1.20 1.21 -0.54 0.00 0.00 175.26 177.34 1mx9 s ASN 3107N 1.56 3.83 -0.33 -1.70 3.04 -1.26 -4.99 114.94 115.08 1mx9 s ASN 3107Ca -0.10 2.34 -0.09 0.00 0.04 0.00 0.00 52.86 55.05 1mx9 s ASN 3107Cb -0.06 -2.59 0.02 0.00 -1.54 0.00 0.00 41.25 37.08 1mx9 s ASN 3107CO -0.18 -2.51 0.15 -0.63 -3.04 0.00 0.00 177.10 170.89 1mx9 s ILE 3108N -2.12 4.31 -0.04 -5.21 1.01 -1.26 -5.06 121.20 112.82 1mx9 s ILE 3108Ca 0.73 -0.76 -0.30 0.00 0.00 0.00 0.00 60.65 60.33 1mx9 s ILE 3108Cb -0.28 -3.31 -0.06 0.00 0.01 0.00 0.00 42.46 38.81 1mx9 s ILE 3108CO 0.49 -0.08 1.76 -2.84 0.00 0.00 0.00 174.94 174.27 1mx9 s PRO 3109N 1.53 4.12 0.30 2.79 0.02 -1.26 -4.98 135.00 137.52 1mx9 s PRO 3109Ca 0.02 2.28 0.07 0.00 0.02 0.00 0.00 61.00 63.39 1mx9 s PRO 3109Cb -0.18 -4.05 -0.02 0.00 0.02 0.00 0.00 34.50 30.26 1mx9 s PRO 3109CO 0.05 -0.94 0.36 -0.51 -0.33 0.00 0.00 177.00 175.63 1mx9 s LEU 3110N 4.34 3.91 0.08 -5.54 1.43 -1.26 -5.12 118.68 116.52 1mx9 s LEU 3110Ca 0.78 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.69 1mx9 s LEU 3110Cb -0.36 -2.56 -0.04 0.00 0.03 0.00 0.00 46.19 43.26 1mx9 s LEU 3110CO 0.33 -0.28 0.06 -0.75 0.23 0.00 0.00 176.35 175.94 1mx9 s LYS 3111N -4.04 2.80 0.41 1.70 2.47 -1.26 -4.95 119.74 116.87 1mx9 s LYS 3111Ca 0.40 -0.72 -0.06 0.00 -1.56 0.00 0.00 55.97 54.02 1mx9 s LYS 3111Cb -0.08 -2.68 -0.05 0.00 -1.46 0.00 0.00 37.83 33.56 1mx9 s LYS 3111CO 0.28 0.56 0.72 -0.51 0.16 0.00 0.00 175.35 176.57 1mx9 s LEU 3112N -2.35 3.80 0.00 5.43 1.43 -1.26 -0.11 118.68 125.62 1mx9 s LEU 3112Ca 0.28 0.92 0.00 0.00 -1.03 0.00 0.00 54.13 54.30 1mx9 s LEU 3112Cb -0.12 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.28 1mx9 s LEU 3112CO 0.21 -0.43 0.00 -0.24 0.23 0.00 0.00 176.35 176.12 1mx9 n SER 3113N -1.66 0.00 0.19 2.29 2.88 -0.80 -4.78 113.62 111.74 1mx9 n SER 3113Ca 0.00 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.60 1mx9 n SER 3113Cb 0.55 0.00 0.33 0.00 -0.75 0.00 0.00 64.21 64.33 1mx9 n SER 3113CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1mx9 h GLU 3114N 0.00 0.00 -5.26 -1.46 5.08 -1.94 -2.99 114.58 108.01 1mx9 h GLU 3114Ca 0.00 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.70 1mx9 h GLU 3114Cb 0.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 1mx9 h GLU 3114CO 0.00 0.36 2.38 -3.47 -1.00 0.00 0.00 179.01 177.28 1mx9 n ASP 3115N -3.48 4.40 0.00 1.42 2.03 -1.26 -4.51 116.55 115.14 1mx9 n ASP 3115Ca 0.00 -2.87 0.00 0.00 0.52 0.00 0.00 54.79 52.44 1mx9 n ASP 3115Cb 0.52 -1.70 0.00 0.00 -0.72 0.00 0.00 41.12 39.22 1mx9 n ASP 3115CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1mx9 n LEU 3117N -0.24 6.21 -4.37 0.00 4.77 -1.26 -4.59 117.00 117.52 1mx9 n LEU 3117Ca 0.00 -4.04 -0.19 0.00 -0.03 0.00 0.00 56.01 51.75 1mx9 n LEU 3117Cb 0.27 -1.68 -0.10 0.00 -2.33 0.00 0.00 43.42 39.58 1mx9 n LEU 3117CO 0.00 0.77 -0.34 -0.31 -1.33 0.00 0.00 177.39 176.18 1mx9 s TYR 3118N 3.61 1.73 0.08 -1.77 1.51 -1.26 -2.39 117.35 118.86 1mx9 s TYR 3118Ca 0.49 -0.83 0.02 0.00 -1.01 0.00 0.00 57.07 55.74 1mx9 s TYR 3118Cb 0.11 -1.00 -0.03 0.00 -0.11 0.00 0.00 41.96 40.92 1mx9 s TYR 3118CO -0.03 0.09 -0.07 -0.48 -1.11 0.00 0.00 175.55 173.95 1mx9 s LEU 3119N -3.37 2.41 -0.09 -1.29 0.05 0.26 -2.69 118.68 113.96 1mx9 s LEU 3119Ca 0.29 -0.82 0.01 0.00 0.05 0.00 0.00 54.13 53.66 1mx9 s LEU 3119Cb 0.05 -0.12 -0.02 0.00 -2.05 0.00 0.00 46.19 44.05 1mx9 s LEU 3119CO 0.10 -0.35 -0.12 0.20 -0.55 0.00 0.00 176.35 175.63 1mx9 s ASN 3120N -2.44 4.21 -0.04 1.48 0.01 0.23 -1.28 114.94 117.11 1mx9 s ASN 3120Ca 0.03 -0.19 0.02 0.00 -0.71 0.00 0.00 52.86 52.01 1mx9 s ASN 3120Cb -0.01 -1.21 -0.03 0.00 0.41 0.00 0.00 41.25 40.40 1mx9 s ASN 3120CO -0.03 0.28 -0.08 -0.63 -1.51 0.00 0.00 177.10 175.14 1mx9 s ILE 3121N -0.34 3.61 -0.31 0.60 1.01 0.14 -0.30 121.20 125.62 1mx9 s ILE 3121Ca 0.04 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 60.03 1mx9 s ILE 3121Cb -0.13 -2.51 0.10 0.00 0.01 0.00 0.00 42.46 39.94 1mx9 s ILE 3121CO 0.02 0.51 0.12 -0.31 0.00 0.00 0.00 174.94 175.29 1mx9 s TYR 3122N -0.88 1.04 -0.14 3.97 1.51 0.10 -1.95 117.35 121.00 1mx9 s TYR 3122Ca 0.14 -1.36 0.01 0.00 -1.01 0.00 0.00 57.07 54.85 1mx9 s TYR 3122Cb -0.11 -1.32 0.00 0.00 -0.11 0.00 0.00 41.96 40.43 1mx9 s TYR 3122CO 0.04 -0.85 -0.18 -0.08 -1.11 0.00 0.00 175.55 173.36 1mx9 s THR 3123N 1.77 2.42 -2.40 -0.71 -1.32 -0.80 -0.72 115.64 113.89 1mx9 s THR 3123Ca 0.10 -0.86 0.22 0.00 -1.21 0.00 0.00 61.69 59.94 1mx9 s THR 3123Cb -0.17 -2.00 0.44 0.00 -1.51 0.00 0.00 72.50 69.26 1mx9 s THR 3123CO -0.29 0.53 1.52 -0.81 -2.21 0.00 0.00 174.62 173.36 1mx9 n PRO 3124N 3.98 1.93 -1.37 7.08 -0.04 -1.26 -1.11 135.00 144.22 1mx9 n PRO 3124Ca -0.19 -1.40 -0.31 0.00 -0.04 0.00 0.00 63.50 61.56 1mx9 n PRO 3124Cb 0.52 -1.44 0.08 0.00 -0.04 0.00 0.00 33.50 32.63 1mx9 n PRO 3124CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mx9 s ALA 3125N -1.77 2.33 -0.78 0.55 0.00 -1.26 -4.88 121.76 115.95 1mx9 s ALA 3125Ca 0.34 0.16 -0.19 0.00 0.00 0.00 0.00 51.96 52.27 1mx9 s ALA 3125Cb 0.19 -3.23 0.12 0.00 0.00 0.00 0.00 23.12 20.20 1mx9 s ALA 3125CO 0.29 -1.64 0.96 0.34 0.00 0.00 0.00 175.76 175.71 1mx9 s ASP 3126N -3.55 6.44 0.00 0.00 3.68 -1.26 -4.82 116.67 117.16 1mx9 s ASP 3126Ca 0.60 -1.72 0.00 0.00 2.13 0.00 0.00 52.55 53.56 1mx9 s ASP 3126Cb -0.16 -2.36 0.00 0.00 -1.45 0.00 0.00 42.92 38.94 1mx9 s ASP 3126CO 0.56 -1.12 0.40 0.18 0.13 0.00 0.00 175.17 175.32 1mx9 n LEU 3127N 6.53 0.00 -0.00 -1.34 4.77 -1.26 0.14 117.00 125.84 1mx9 n LEU 3127Ca 0.09 0.03 0.11 0.00 -0.03 0.00 0.00 56.01 56.22 1mx9 n LEU 3127Cb 0.47 -0.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.58 1mx9 n LEU 3127CO 0.54 -0.03 0.19 0.35 -1.33 0.00 0.00 177.39 177.11 1mx9 n THR 3128N -0.90 0.00 -4.36 -5.08 -2.24 -1.26 -4.91 114.28 95.53 1mx9 n THR 3128Ca 0.00 -0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.59 1mx9 n THR 3128Cb 0.01 0.64 -0.10 0.00 -2.10 0.00 0.00 70.33 68.79 1mx9 n THR 3128CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1mx9 s LYS 3129N -3.00 1.38 -0.18 -0.78 1.02 0.12 -5.11 119.74 113.20 1mx9 s LYS 3129Ca 0.10 -1.64 -0.29 0.00 0.02 0.00 0.00 55.97 54.15 1mx9 s LYS 3129Cb 0.17 -1.09 0.00 0.00 -0.52 0.00 0.00 37.83 36.39 1mx9 s LYS 3129CO 0.79 0.13 1.01 0.15 -0.92 0.00 0.00 175.35 176.51 1mx9 s LYS 3130N -3.68 4.32 0.21 1.68 1.02 -1.26 -4.76 119.74 117.27 1mx9 s LYS 3130Ca 0.25 1.35 0.08 0.00 0.02 0.00 0.00 55.97 57.66 1mx9 s LYS 3130Cb 0.01 -3.60 -0.05 0.00 -0.52 0.00 0.00 37.83 33.67 1mx9 s LYS 3130CO 0.08 -0.51 -0.13 -0.80 -0.92 0.00 0.00 175.35 173.07 1mx9 s ASN 3131N 1.17 2.59 -0.41 2.83 -0.87 -1.26 -5.08 114.94 113.92 1mx9 s ASN 3131Ca 0.45 -1.04 0.10 0.00 -1.57 0.00 0.00 52.86 50.79 1mx9 s ASN 3131Cb -0.16 -0.14 0.33 0.00 -0.02 0.00 0.00 41.25 41.26 1mx9 s ASN 3131CO 0.10 -0.19 0.87 0.54 -2.57 0.00 0.00 177.10 175.86 1mx9 n ARG 3132N -0.41 0.98 -1.66 -0.60 5.12 -0.79 -4.12 116.66 115.19 1mx9 n ARG 3132Ca -0.08 -2.81 -0.32 0.00 -1.93 0.00 0.00 57.85 52.72 1mx9 n ARG 3132Cb 0.61 -1.44 0.05 0.00 -1.16 0.00 0.00 32.46 30.52 1mx9 n ARG 3132CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1mx9 s LEU 3133N -2.32 3.28 0.43 0.55 1.43 0.38 -3.82 118.68 118.61 1mx9 s LEU 3133Ca 0.33 1.86 -0.24 0.00 -1.03 0.00 0.00 54.13 55.05 1mx9 s LEU 3133Cb 0.32 -4.53 -0.08 0.00 0.03 0.00 0.00 46.19 41.93 1mx9 s LEU 3133CO -0.07 -1.62 1.19 -2.16 0.23 0.00 0.00 176.35 173.92 1mx9 s PRO 3134N -4.43 3.91 -0.08 1.29 0.04 -1.26 0.12 135.00 134.58 1mx9 s PRO 3134Ca 0.63 1.86 0.02 0.00 0.04 0.00 0.00 61.00 63.56 1mx9 s PRO 3134Cb -0.18 -2.58 -0.02 0.00 0.04 0.00 0.00 34.50 31.76 1mx9 s PRO 3134CO 0.46 -0.45 -0.13 0.08 0.04 0.00 0.00 177.00 177.00 1mx9 s VAL 3135N -1.44 3.11 -0.28 -0.36 1.01 -0.95 -0.78 120.40 120.71 1mx9 s VAL 3135Ca 0.60 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1mx9 s VAL 3135Cb -0.31 -2.25 0.06 0.00 0.00 0.00 0.00 36.38 33.87 1mx9 s VAL 3135CO 0.39 0.57 -0.05 -0.04 0.00 0.00 0.00 175.10 175.96 1mx9 s MET 3136N -0.36 2.32 -0.37 2.72 -1.94 -0.43 0.62 119.30 121.86 1mx9 s MET 3136Ca 0.04 -1.32 -0.16 0.00 -1.71 0.00 0.00 55.69 52.54 1mx9 s MET 3136Cb -0.12 -3.04 0.00 0.00 2.01 0.00 0.00 34.83 33.68 1mx9 s MET 3136CO 0.02 -0.60 0.42 0.08 -0.01 0.00 0.00 175.02 174.93 1mx9 s VAL 3137N 1.17 5.11 -0.04 -6.03 1.01 0.26 -1.51 120.40 120.38 1mx9 s VAL 3137Ca -0.07 -0.05 -0.18 0.00 0.00 0.00 0.00 61.98 61.68 1mx9 s VAL 3137Cb -0.20 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 1mx9 s VAL 3137CO -0.03 -0.24 0.49 0.86 0.00 0.00 0.00 175.10 176.19 1mx9 s TRP 3138N 2.13 3.64 -0.24 5.22 -0.11 0.14 -1.88 118.94 127.84 1mx9 s TRP 3138Ca 0.13 1.03 0.02 0.00 1.22 0.00 0.00 56.10 58.50 1mx9 s TRP 3138Cb -0.17 -2.49 0.05 0.00 -1.50 0.00 0.00 33.47 29.37 1mx9 s TRP 3138CO 0.13 0.39 -0.12 0.42 -4.62 0.00 0.00 176.95 173.15 1mx9 s ILE 3139N -0.22 2.04 0.80 5.86 1.01 -0.43 -2.40 121.20 127.86 1mx9 s ILE 3139Ca 0.27 -1.43 -0.12 0.00 0.00 0.00 0.00 60.65 59.37 1mx9 s ILE 3139Cb -0.17 -2.12 0.08 0.00 0.01 0.00 0.00 42.46 40.26 1mx9 s ILE 3139CO 0.14 0.07 1.14 -1.38 0.00 0.00 0.00 174.94 174.91 1mx9 s HIS 3140N 1.19 2.12 0.00 3.97 -3.43 -1.26 -3.86 115.29 114.01 1mx9 s HIS 3140Ca -0.06 1.65 0.00 0.00 -0.80 0.00 0.00 55.06 55.85 1mx9 s HIS 3140Cb -0.18 -3.27 0.00 0.00 -1.43 0.00 0.00 32.58 27.70 1mx9 s HIS 3140CO -0.07 -2.34 0.00 0.41 -2.00 0.00 0.00 174.74 170.75 1mx9 n GLY 3141N -0.24 1.35 0.00 -1.38 0.00 -1.18 -3.35 105.19 100.38 1mx9 n GLY 3141Ca 0.11 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.14 1mx9 n GLY 3141CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mx9 n GLY 3142N 5.00 0.86 2.50 -0.02 0.00 -1.26 -4.51 105.19 107.76 1mx9 n GLY 3142Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1mx9 n GLY 3142CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mx9 n GLY 3143N 0.00 1.11 2.52 -0.02 0.00 -1.26 -2.15 105.19 105.38 1mx9 n GLY 3143Ca 0.00 -0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 1mx9 n GLY 3143CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1mx9 n LEU 3144N -2.38 -1.48 0.00 0.99 4.77 -1.26 -4.75 117.00 112.89 1mx9 n LEU 3144Ca -0.20 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1mx9 n LEU 3144Cb 0.65 -2.67 0.00 0.00 -2.33 0.00 0.00 43.42 39.06 1mx9 n LEU 3144CO 0.28 -0.85 -0.44 0.23 -1.33 0.00 0.00 177.39 175.28 1mx9 n MET 3145N -2.52 2.37 -3.81 3.23 2.81 -0.96 0.26 117.12 118.51 1mx9 n MET 3145Ca -0.20 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.58 1mx9 n MET 3145Cb 0.63 -0.94 -0.08 0.00 -0.71 0.00 0.00 33.22 32.12 1mx9 n MET 3145CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1mx9 s VAL 3146N -1.88 0.09 0.00 2.03 -7.23 -0.92 -4.39 120.40 108.10 1mx9 s VAL 3146Ca 0.00 -0.74 0.00 0.00 -1.81 0.00 0.00 61.98 59.43 1mx9 s VAL 3146Cb 0.00 -0.79 0.00 0.00 0.56 0.00 0.00 36.38 36.15 1mx9 s VAL 3146CO 0.00 -0.41 0.00 0.61 -0.31 0.00 0.00 175.10 174.99 1mx9 n GLY 3147N 0.89 3.75 3.28 2.32 0.00 -1.26 -3.98 105.19 110.19 1mx9 n GLY 3147Ca -0.20 -1.19 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 1mx9 n GLY 3147CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mx9 s ALA 3148N -2.00 -0.52 -0.08 4.61 0.00 -1.26 -4.61 121.76 117.90 1mx9 s ALA 3148Ca 0.00 -0.40 0.14 0.00 0.00 0.00 0.00 51.96 51.70 1mx9 s ALA 3148Cb 0.00 0.62 -0.23 0.00 0.00 0.00 0.00 23.12 23.51 1mx9 s ALA 3148CO 0.00 -0.59 0.52 0.00 0.00 0.00 0.00 175.76 175.69 1mx9 n ALA 3149N -0.15 1.51 0.32 0.00 0.00 -1.26 -4.00 120.51 116.93 1mx9 n ALA 3149Ca -0.14 -0.90 0.04 0.00 0.00 0.00 0.00 53.44 52.44 1mx9 n ALA 3149Cb 0.63 -0.69 0.19 0.00 0.00 0.00 0.00 19.45 19.59 1mx9 n ALA 3149CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1mx9 n SER 3150N -2.97 0.00 -0.03 0.00 7.64 -1.26 -2.37 113.62 114.63 1mx9 n SER 3150Ca -0.21 0.46 -0.07 0.00 1.01 0.00 0.00 58.87 60.07 1mx9 n SER 3150Cb 1.07 -0.47 0.12 0.00 -1.01 0.00 0.00 64.21 63.92 1mx9 n SER 3150CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1mx9 h THR 3151N 0.00 1.28 -3.64 0.44 2.02 -1.94 -3.41 112.91 107.65 1mx9 h THR 3151Ca 0.00 -1.42 -0.68 0.00 0.77 0.00 0.00 66.41 65.08 1mx9 h THR 3151Cb 0.14 1.38 -0.23 0.00 -1.74 0.00 0.00 68.15 67.71 1mx9 h THR 3151CO 0.00 0.46 -0.55 -0.31 0.37 0.00 0.00 175.52 175.49 1mx9 s TYR 3152N -4.43 3.19 -0.27 3.16 1.51 -1.00 -3.95 117.35 115.56 1mx9 s TYR 3152Ca -0.08 -0.66 -0.19 0.00 -1.01 0.00 0.00 57.07 55.13 1mx9 s TYR 3152Cb 0.13 -2.37 -0.02 0.00 -0.11 0.00 0.00 41.96 39.59 1mx9 s TYR 3152CO 0.82 -0.50 0.58 0.34 -1.11 0.00 0.00 175.55 175.69 1mx9 s ASP 3153N 1.60 6.50 0.00 2.29 3.68 -1.26 -4.96 116.67 124.51 1mx9 s ASP 3153Ca 0.04 0.56 0.15 0.00 2.13 0.00 0.00 52.55 55.43 1mx9 s ASP 3153Cb -0.17 -2.31 0.49 0.00 -1.45 0.00 0.00 42.92 39.47 1mx9 s ASP 3153CO 0.06 -0.36 1.37 0.61 0.13 0.00 0.00 175.17 176.98 1mx9 n GLY 3154N 4.32 0.45 0.41 2.66 0.00 -1.26 -4.41 105.19 107.35 1mx9 n GLY 3154Ca -0.02 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 1mx9 n GLY 3154CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1mx9 h LEU 3155N 2.04 -1.54 0.07 0.99 6.46 -1.94 0.11 115.31 121.50 1mx9 h LEU 3155Ca 0.00 0.19 0.01 0.00 -0.12 0.00 0.00 57.88 57.96 1mx9 h LEU 3155Cb 0.46 0.61 -0.03 0.00 -0.73 0.00 0.00 40.66 40.96 1mx9 h LEU 3155CO 0.00 -0.41 -0.37 0.00 -0.62 0.00 0.00 178.44 177.04 1mx9 h ALA 3156N -0.39 -0.86 -0.30 1.25 0.00 -1.86 0.99 119.26 118.08 1mx9 h ALA 3156Ca 0.04 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1mx9 h ALA 3156Cb 0.58 0.77 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 1mx9 h ALA 3156CO -0.41 -0.95 -0.01 1.25 0.00 0.00 0.00 179.25 179.12 1mx9 h LEU 3157N -0.52 -0.15 0.03 0.00 5.85 -1.78 0.43 115.31 119.17 1mx9 h LEU 3157Ca -0.00 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.81 1mx9 h LEU 3157Cb 0.53 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 1mx9 h LEU 3157CO -0.21 -0.04 -0.15 0.00 -0.34 0.00 0.00 178.44 177.71 1mx9 h ALA 3158N 1.27 -0.20 -0.33 1.25 0.00 -0.60 0.20 119.26 120.85 1mx9 h ALA 3158Ca 0.14 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1mx9 h ALA 3158Cb 0.20 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1mx9 h ALA 3158CO -0.25 -0.65 -0.11 0.00 0.00 0.00 0.00 179.25 178.23 1mx9 h ALA 3159N 0.66 0.46 -0.54 0.00 0.00 -0.55 -1.07 119.26 118.22 1mx9 h ALA 3159Ca 0.04 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1mx9 h ALA 3159Cb 0.30 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1mx9 h ALA 3159CO -0.12 0.33 -0.03 0.45 0.00 0.00 0.00 179.25 179.88 1mx9 h HIS 3160N 0.43 1.07 -0.02 0.00 -0.00 -0.00 -3.28 115.15 113.36 1mx9 h HIS 3160Ca 0.08 -0.19 0.00 0.00 -0.00 0.00 0.00 60.37 60.25 1mx9 h HIS 3160Cb 0.63 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 27.76 1mx9 h HIS 3160CO 0.05 0.98 -0.06 0.39 -0.00 0.00 0.00 177.93 179.29 1mx9 n GLU 3161N -4.24 1.36 -3.39 2.45 -0.58 0.05 -4.99 120.64 111.30 1mx9 n GLU 3161Ca 0.02 -1.34 -0.20 0.00 -0.42 0.00 0.00 57.16 55.21 1mx9 n GLU 3161Cb 0.35 -1.30 0.06 0.00 -0.57 0.00 0.00 31.44 29.98 1mx9 n GLU 3161CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1mx9 n ASN 3162N 0.72 -5.65 -4.64 1.62 2.85 -0.42 -5.02 115.26 104.72 1mx9 n ASN 3162Ca 0.09 -0.44 -0.24 0.00 -0.11 0.00 0.00 54.58 53.88 1mx9 n ASN 3162Cb 0.39 -4.27 -0.08 0.00 1.24 0.00 0.00 39.78 37.06 1mx9 n ASN 3162CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1mx9 s VAL 3163N -3.26 2.79 -0.32 3.44 -7.23 -1.15 -4.62 120.40 110.05 1mx9 s VAL 3163Ca 0.48 -1.96 -0.13 0.00 -1.81 0.00 0.00 61.98 58.56 1mx9 s VAL 3163Cb -0.21 -2.80 -0.02 0.00 0.56 0.00 0.00 36.38 33.91 1mx9 s VAL 3163CO 0.59 -0.24 0.28 -0.69 -0.31 0.00 0.00 175.10 174.74 1mx9 s VAL 3164N -2.48 5.24 -0.08 1.32 1.01 0.04 -4.41 120.40 121.04 1mx9 s VAL 3164Ca 0.34 0.02 -0.15 0.00 0.00 0.00 0.00 61.98 62.20 1mx9 s VAL 3164Cb -0.02 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 1mx9 s VAL 3164CO 0.20 0.03 0.38 -0.69 0.00 0.00 0.00 175.10 175.01 1mx9 s VAL 3165N 1.86 5.18 -0.08 2.92 1.01 0.11 -1.32 120.40 130.07 1mx9 s VAL 3165Ca 0.09 0.75 0.01 0.00 0.00 0.00 0.00 61.98 62.83 1mx9 s VAL 3165Cb -0.17 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.53 1mx9 s VAL 3165CO 0.11 0.47 -0.11 -0.69 0.00 0.00 0.00 175.10 174.88 1mx9 s VAL 3166N -0.21 1.12 -0.17 2.92 1.01 -0.57 0.02 120.40 124.52 1mx9 s VAL 3166Ca 0.22 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 1mx9 s VAL 3166Cb -0.15 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 1mx9 s VAL 3166CO 0.09 0.36 -0.10 0.42 0.00 0.00 0.00 175.10 175.87 1mx9 s THR 3167N 1.02 3.09 0.21 3.92 -4.23 0.59 0.25 115.64 120.48 1mx9 s THR 3167Ca -0.08 -0.62 0.08 0.00 -1.18 0.00 0.00 61.69 59.90 1mx9 s THR 3167Cb -0.15 -2.34 -0.04 0.00 1.34 0.00 0.00 72.50 71.31 1mx9 s THR 3167CO -0.01 0.49 -0.03 0.27 -0.54 0.00 0.00 174.62 174.80 1mx9 s ILE 3168N 0.84 3.48 0.38 2.99 -4.36 -1.01 0.74 121.20 124.26 1mx9 s ILE 3168Ca -0.03 -1.65 0.08 0.00 -0.26 0.00 0.00 60.65 58.79 1mx9 s ILE 3168Cb -0.15 -2.78 -0.07 0.00 1.25 0.00 0.00 42.46 40.71 1mx9 s ILE 3168CO 0.01 -0.19 0.00 -1.10 0.24 0.00 0.00 174.94 173.90 1mx9 s GLN 3169N -3.14 1.98 0.01 0.37 -0.21 -1.09 -4.51 119.66 113.05 1mx9 s GLN 3169Ca 0.28 -1.97 -0.28 0.00 0.02 0.00 0.00 55.36 53.41 1mx9 s GLN 3169Cb -0.08 -1.75 0.08 0.00 1.00 0.00 0.00 33.01 32.26 1mx9 s GLN 3169CO 0.18 0.02 0.74 1.52 -2.12 0.00 0.00 175.29 175.63 1mx9 s TYR 3170N -2.64 -0.53 0.27 0.91 1.13 -1.26 -4.69 117.35 110.55 1mx9 s TYR 3170Ca 0.35 0.65 -0.30 0.00 -1.41 0.00 0.00 57.07 56.36 1mx9 s TYR 3170Cb 0.05 0.48 -0.13 0.00 -1.10 0.00 0.00 41.96 41.27 1mx9 s TYR 3170CO 0.18 -0.63 1.36 0.54 -2.51 0.00 0.00 175.55 174.49 1mx9 n ARG 3171N 0.29 2.03 -4.20 -3.49 1.74 -1.26 -4.79 116.66 106.98 1mx9 n ARG 3171Ca -0.15 0.72 -0.25 0.00 -0.77 0.00 0.00 57.85 57.40 1mx9 n ARG 3171Cb 0.60 -2.34 -0.08 0.00 -1.02 0.00 0.00 32.46 29.62 1mx9 n ARG 3171CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1mx9 s LEU 3172N -0.20 3.08 0.00 0.55 1.43 -1.26 -4.09 118.68 118.19 1mx9 s LEU 3172Ca 0.64 -1.12 0.00 0.00 -1.03 0.00 0.00 54.13 52.62 1mx9 s LEU 3172Cb -0.63 -1.36 0.00 0.00 0.03 0.00 0.00 46.19 44.23 1mx9 s LEU 3172CO 0.54 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 177.20 1mx9 n GLY 3173N -1.20 1.09 0.36 -3.19 0.00 0.14 -1.41 105.19 100.98 1mx9 n GLY 3173Ca -0.02 -0.41 -0.03 0.00 0.00 0.00 0.00 46.02 45.56 1mx9 n GLY 3173CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1mx9 n ILE 3174N 0.00 -0.52 -0.08 -0.61 5.41 -1.26 -0.19 119.36 122.11 1mx9 n ILE 3174Ca 0.00 2.19 -0.07 0.00 1.00 0.00 0.00 62.75 65.87 1mx9 n ILE 3174Cb 0.00 -2.85 -0.01 0.00 -0.71 0.00 0.00 39.64 36.08 1mx9 n ILE 3174CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1mx9 h TRP 3175N 0.00 -0.17 -0.00 1.39 6.55 -1.85 -2.41 115.95 119.45 1mx9 h TRP 3175Ca 0.28 0.03 0.00 0.00 0.95 0.00 0.00 58.89 60.15 1mx9 h TRP 3175Cb 0.52 0.12 0.00 0.00 -0.86 0.00 0.00 29.16 28.94 1mx9 h TRP 3175CO -0.84 -0.13 -0.50 0.41 -1.05 0.00 0.00 178.44 176.32 1mx9 n GLY 3176N -1.26 -1.14 0.29 1.49 0.00 0.20 -4.46 105.19 100.32 1mx9 n GLY 3176Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1mx9 n GLY 3176CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mx9 n PHE 3177N -1.37 0.00 -2.24 1.61 3.72 0.73 0.82 117.46 120.72 1mx9 n PHE 3177Ca 0.06 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.05 1mx9 n PHE 3177Cb 0.34 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.84 1mx9 n PHE 3177CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 1mx9 s PHE 3178N 0.00 3.29 0.03 1.38 2.19 -0.91 -4.54 117.98 119.43 1mx9 s PHE 3178Ca 0.00 1.16 0.01 0.00 0.33 0.00 0.00 56.93 58.44 1mx9 s PHE 3178Cb 0.00 -3.59 -0.02 0.00 -1.31 0.00 0.00 43.02 38.10 1mx9 s PHE 3178CO 0.00 -1.90 -0.06 0.45 1.83 0.00 0.00 175.22 175.54 1mx9 s SER 3179N 0.67 0.62 0.00 6.13 0.15 -1.26 -4.05 113.70 115.96 1mx9 s SER 3179Ca 0.59 -0.49 0.11 0.00 0.70 0.00 0.00 55.95 56.86 1mx9 s SER 3179Cb -0.35 0.05 0.12 0.00 -1.71 0.00 0.00 66.02 64.13 1mx9 s SER 3179CO 0.34 -0.21 0.92 0.35 1.20 0.00 0.00 173.24 175.84 1mx9 n THR 3180N 1.64 0.15 -0.92 6.45 -2.24 -0.41 -4.47 114.28 114.49 1mx9 n THR 3180Ca -0.22 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 60.98 1mx9 n THR 3180Cb 0.55 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.91 1mx9 n THR 3180CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mx9 n GLY 3181N 0.63 0.97 2.12 3.38 0.00 -1.26 -4.52 105.19 106.51 1mx9 n GLY 3181Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 1mx9 n GLY 3181CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mx9 n ASP 3182N 0.00 -0.56 0.20 1.61 3.85 -1.26 -5.03 116.55 115.36 1mx9 n ASP 3182Ca 0.00 -2.39 0.18 0.00 -0.71 0.00 0.00 54.79 51.87 1mx9 n ASP 3182Cb 0.00 1.22 0.82 0.00 -1.35 0.00 0.00 41.12 41.80 1mx9 n ASP 3182CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 1mx9 h GLU 3183N 0.00 0.00 0.00 0.11 9.09 -1.96 -2.08 114.58 119.74 1mx9 h GLU 3183Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.25 1mx9 h GLU 3183Cb 0.78 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.88 1mx9 h GLU 3183CO 0.23 0.00 0.00 0.72 0.05 0.00 0.00 179.01 180.01 1mx9 n HIS 3184N -3.48 0.23 -2.66 2.06 8.25 -1.26 -4.37 115.22 113.99 1mx9 n HIS 3184Ca 0.03 0.09 -0.03 0.00 -0.26 0.00 0.00 57.72 57.54 1mx9 n HIS 3184Cb 0.44 -0.64 0.05 0.00 1.12 0.00 0.00 29.99 30.96 1mx9 n HIS 3184CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1mx9 n SER 3185N -1.71 -1.11 -0.11 0.41 2.88 -0.81 -4.93 113.62 108.24 1mx9 n SER 3185Ca 0.04 -0.93 -0.05 0.00 -1.33 0.00 0.00 58.87 56.60 1mx9 n SER 3185Cb 0.22 0.56 0.02 0.00 -0.75 0.00 0.00 64.21 64.26 1mx9 n SER 3185CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1mx9 h ARG 3186N 3.73 0.05 0.00 -1.46 3.08 -1.70 -1.08 114.38 117.00 1mx9 h ARG 3186Ca -0.09 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1mx9 h ARG 3186Cb 1.19 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1mx9 h ARG 3186CO -0.17 0.03 0.00 0.41 -1.07 0.00 0.00 179.97 179.17 1mx9 n GLY 3187N -1.28 -0.29 2.40 0.04 0.00 -1.26 -4.60 105.19 100.21 1mx9 n GLY 3187Ca 0.02 -2.20 -0.17 0.00 0.00 0.00 0.00 46.02 43.67 1mx9 n GLY 3187CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mx9 n ASN 3188N 0.00 -4.89 -0.30 1.61 3.02 -1.26 -4.84 115.26 108.60 1mx9 n ASN 3188Ca 0.00 0.14 0.11 0.00 -0.03 0.00 0.00 54.58 54.80 1mx9 n ASN 3188Cb 0.00 -4.15 0.34 0.00 -0.61 0.00 0.00 39.78 35.36 1mx9 n ASN 3188CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 1mx9 h TRP 3189N 0.00 0.93 -0.19 3.10 -0.00 -1.19 -1.06 115.95 117.54 1mx9 h TRP 3189Ca -0.39 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 58.52 1mx9 h TRP 3189Cb 1.27 -0.29 -0.01 0.00 -0.00 0.00 0.00 29.16 30.13 1mx9 h TRP 3189CO 0.60 0.33 0.09 0.78 -0.00 0.00 0.00 178.44 180.24 1mx9 h GLY 3190N 0.77 0.29 1.93 1.49 0.00 0.24 -1.71 103.07 106.09 1mx9 h GLY 3190Ca 0.48 -0.15 -0.07 0.00 0.00 0.00 0.00 47.33 47.59 1mx9 h GLY 3190CO -0.24 0.14 -0.31 0.45 0.00 0.00 0.00 176.54 176.58 1mx9 h HIS 3191N 0.17 0.09 -0.48 5.60 3.86 -1.62 -1.30 115.15 121.47 1mx9 h HIS 3191Ca 0.06 -0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.16 1mx9 h HIS 3191Cb 0.13 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 1mx9 h HIS 3191CO -0.02 0.38 -0.11 -0.07 0.86 0.00 0.00 177.93 178.98 1mx9 h LEU 3192N 0.07 0.86 -0.73 2.43 3.38 -0.91 -1.33 115.31 119.08 1mx9 h LEU 3192Ca 0.01 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 1mx9 h LEU 3192Cb 0.58 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1mx9 h LEU 3192CO 0.04 0.98 0.30 0.44 0.09 0.00 0.00 178.44 180.30 1mx9 h ASP 3193N 0.78 1.00 -0.91 -0.43 3.32 -0.48 0.31 116.42 120.00 1mx9 h ASP 3193Ca 0.13 -0.17 0.02 0.00 0.02 0.00 0.00 57.03 57.03 1mx9 h ASP 3193Cb 0.62 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.86 1mx9 h ASP 3193CO 0.04 0.89 0.60 1.56 -1.72 0.00 0.00 179.24 180.61 1mx9 h GLN 3194N 1.04 1.17 -0.03 3.56 4.20 -0.74 0.30 115.11 124.61 1mx9 h GLN 3194Ca 0.24 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.87 1mx9 h GLN 3194Cb 0.20 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 1mx9 h GLN 3194CO -0.02 0.77 -0.03 0.28 -0.67 0.00 0.00 178.83 179.16 1mx9 h VAL 3195N 1.21 1.40 -0.98 -0.54 2.07 -0.66 -2.55 116.25 116.20 1mx9 h VAL 3195Ca 0.35 -1.22 0.23 0.00 0.82 0.00 0.00 66.70 66.87 1mx9 h VAL 3195Cb -0.09 2.16 -0.08 0.00 -1.52 0.00 0.00 31.29 31.76 1mx9 h VAL 3195CO -0.09 0.33 0.64 0.00 0.02 0.00 0.00 177.57 178.46 1mx9 h ALA 3196N 0.51 2.18 -0.27 1.67 0.00 0.04 0.57 119.26 123.96 1mx9 h ALA 3196Ca 0.00 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1mx9 h ALA 3196Cb 0.55 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1mx9 h ALA 3196CO 0.01 -0.52 -0.08 0.00 0.00 0.00 0.00 179.25 178.66 1mx9 h ALA 3197N 1.61 0.37 0.00 0.00 0.00 -0.75 -2.29 119.26 118.21 1mx9 h ALA 3197Ca 0.54 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1mx9 h ALA 3197Cb 1.30 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1mx9 h ALA 3197CO -0.24 0.20 -0.00 -0.07 0.00 0.00 0.00 179.25 179.13 1mx9 h LEU 3198N 0.28 0.00 0.01 0.00 3.38 -0.51 0.71 115.31 119.17 1mx9 h LEU 3198Ca 0.07 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.79 1mx9 h LEU 3198Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1mx9 h LEU 3198CO 0.03 0.00 -1.11 -0.09 0.09 0.00 0.00 178.44 177.36 1mx9 h ARG 3199N 0.00 0.21 0.26 1.13 2.43 -0.99 -2.86 114.38 114.57 1mx9 h ARG 3199Ca -0.00 -0.32 -0.01 0.00 -0.81 0.00 0.00 59.98 58.83 1mx9 h ARG 3199Cb 0.28 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1mx9 h ARG 3199CO 0.00 1.12 -0.13 2.35 -1.51 0.00 0.00 179.97 181.80 1mx9 h TRP 3200N 0.08 -0.33 -0.44 2.20 7.01 -0.32 -2.73 115.95 121.41 1mx9 h TRP 3200Ca -0.09 -0.01 0.09 0.00 2.11 0.00 0.00 58.89 60.99 1mx9 h TRP 3200Cb 1.82 0.11 -0.08 0.00 -2.10 0.00 0.00 29.16 28.91 1mx9 h TRP 3200CO 0.04 -0.20 -0.07 0.28 -2.79 0.00 0.00 178.44 175.70 1mx9 h VAL 3201N -0.37 0.59 -0.77 2.65 2.07 -1.33 -1.02 116.25 118.08 1mx9 h VAL 3201Ca -0.04 -0.01 0.10 0.00 0.82 0.00 0.00 66.70 67.57 1mx9 h VAL 3201Cb 0.28 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 1mx9 h VAL 3201CO 0.06 0.01 0.50 1.56 0.02 0.00 0.00 177.57 179.72 1mx9 h GLN 3202N 0.03 0.66 -0.01 1.57 1.08 -1.35 0.30 115.11 117.40 1mx9 h GLN 3202Ca 0.21 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.37 1mx9 h GLN 3202Cb 0.32 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1mx9 h GLN 3202CO -0.42 0.44 -0.35 -0.25 -0.95 0.00 0.00 178.83 177.30 1mx9 n ASP 3203N -4.50 1.00 0.00 1.46 8.00 -0.50 -4.57 116.55 117.44 1mx9 n ASP 3203Ca 0.13 -0.82 0.00 0.00 0.71 0.00 0.00 54.79 54.81 1mx9 n ASP 3203Cb 0.34 0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 1mx9 n ASP 3203CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1mx9 n ASN 3204N -0.79 0.00 -0.06 -2.24 3.02 -0.54 -4.69 115.26 109.96 1mx9 n ASN 3204Ca 0.10 0.00 0.20 0.00 -0.03 0.00 0.00 54.58 54.85 1mx9 n ASN 3204Cb 0.35 0.00 0.65 0.00 -0.61 0.00 0.00 39.78 40.17 1mx9 n ASN 3204CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1mx9 h ILE 3205N 0.00 0.73 -0.84 2.41 6.09 -0.59 -0.63 117.51 124.69 1mx9 h ILE 3205Ca 0.00 -0.04 0.11 0.00 -1.37 0.00 0.00 64.86 63.57 1mx9 h ILE 3205Cb 0.00 0.62 -0.06 0.00 0.47 0.00 0.00 36.82 37.85 1mx9 h ILE 3205CO 0.00 0.02 0.54 0.00 -3.07 0.00 0.00 178.15 175.64 1mx9 h ALA 3206N 1.70 1.78 0.00 0.18 0.00 -1.76 -0.93 119.26 120.22 1mx9 h ALA 3206Ca 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1mx9 h ALA 3206Cb 1.04 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1mx9 h ALA 3206CO -0.03 0.03 0.00 0.77 0.00 0.00 0.00 179.25 180.02 1mx9 h SER 3207N 0.73 0.00 -0.52 0.00 0.02 -1.39 -1.68 113.55 110.70 1mx9 h SER 3207Ca 0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 1mx9 h SER 3207Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 1mx9 h SER 3207CO -0.16 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.02 1mx9 n PHE 3208N -2.41 1.20 -0.60 3.45 3.01 -0.37 -4.82 117.46 116.92 1mx9 n PHE 3208Ca -0.01 -0.64 0.00 0.00 1.01 0.00 0.00 57.45 57.82 1mx9 n PHE 3208Cb 0.10 -0.21 0.00 0.00 -0.01 0.00 0.00 39.48 39.36 1mx9 n PHE 3208CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1mx9 n GLY 3209N 0.72 0.75 3.91 1.37 0.00 -0.63 -4.67 105.19 106.65 1mx9 n GLY 3209Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 1mx9 n GLY 3209CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mx9 s GLY 3210N -1.79 2.16 -0.44 -0.02 0.00 -1.10 -0.47 107.32 105.66 1mx9 s GLY 3210Ca 0.00 -0.85 -0.21 0.00 0.00 0.00 0.00 44.72 43.65 1mx9 s GLY 3210CO 0.00 -0.84 0.68 0.21 0.00 0.00 0.00 173.10 173.15 1mx9 s ASN 3211N -2.53 6.34 0.59 1.64 2.47 0.33 -3.27 114.94 120.51 1mx9 s ASN 3211Ca 0.35 -0.28 0.35 0.00 0.42 0.00 0.00 52.86 53.69 1mx9 s ASN 3211Cb -0.13 -2.33 1.87 0.00 -1.45 0.00 0.00 41.25 39.20 1mx9 s ASN 3211CO 0.28 -0.81 2.21 1.55 -3.72 0.00 0.00 177.10 176.61 1mx9 h PRO 3212N 8.89 0.00 0.00 0.43 0.13 -1.89 -1.81 132.00 137.75 1mx9 h PRO 3212Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1mx9 h PRO 3212Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1mx9 h PRO 3212CO 0.91 0.04 0.00 0.41 -0.23 0.00 0.00 178.00 179.12 1mx9 n GLY 3213N -0.88 -0.89 2.72 1.56 0.00 -1.26 -4.23 105.19 102.21 1mx9 n GLY 3213Ca -0.02 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 1mx9 n GLY 3213CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1mx9 s SER 3214N -1.49 0.11 -0.17 1.61 0.15 -0.68 -4.93 113.70 108.30 1mx9 s SER 3214Ca 0.18 -1.92 -0.01 0.00 0.70 0.00 0.00 55.95 54.90 1mx9 s SER 3214Cb 0.08 0.88 -0.00 0.00 -1.71 0.00 0.00 66.02 65.28 1mx9 s SER 3214CO 0.14 -0.16 -0.13 -0.69 1.20 0.00 0.00 173.24 173.60 1mx9 s VAL 3215N 0.95 2.84 -0.19 4.45 1.01 -1.26 -2.24 120.40 125.96 1mx9 s VAL 3215Ca 0.25 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.48 1mx9 s VAL 3215Cb -0.05 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 1mx9 s VAL 3215CO -0.08 0.50 0.00 -0.89 0.00 0.00 0.00 175.10 174.63 1mx9 s THR 3216N 0.97 4.10 0.07 3.92 2.01 0.20 -0.14 115.64 126.78 1mx9 s THR 3216Ca -0.02 -0.27 0.01 0.00 0.31 0.00 0.00 61.69 61.72 1mx9 s THR 3216Cb -0.15 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.48 1mx9 s THR 3216CO -0.02 0.45 0.17 0.27 -0.69 0.00 0.00 174.62 174.80 1mx9 s ILE 3217N 0.75 5.13 -0.11 1.82 -4.36 -0.93 0.91 121.20 124.42 1mx9 s ILE 3217Ca 0.00 -0.51 -0.30 0.00 -0.26 0.00 0.00 60.65 59.58 1mx9 s ILE 3217Cb -0.14 -3.50 0.12 0.00 1.25 0.00 0.00 42.46 40.19 1mx9 s ILE 3217CO 0.02 0.13 0.99 0.72 0.24 0.00 0.00 174.94 177.04 1mx9 s PHE 3218N -1.48 -0.32 -0.02 1.37 -0.71 -0.79 -1.99 117.98 114.03 1mx9 s PHE 3218Ca 0.33 0.39 -0.30 0.00 -1.04 0.00 0.00 56.93 56.31 1mx9 s PHE 3218Cb -0.13 0.49 0.12 0.00 -1.21 0.00 0.00 43.02 42.30 1mx9 s PHE 3218CO 0.26 -0.40 1.30 0.20 -1.34 0.00 0.00 175.22 175.25 1mx9 s GLY 3219N -1.77 -0.38 0.15 1.99 0.00 -1.21 -1.32 107.32 104.79 1mx9 s GLY 3219Ca 0.02 0.62 0.11 0.00 0.00 0.00 0.00 44.72 45.47 1mx9 s GLY 3219CO -0.03 0.96 -0.25 -1.83 0.00 0.00 0.00 173.10 171.95 1mx9 s GLU 3220N -2.32 1.49 7.84 2.90 4.04 -1.25 -1.36 118.70 130.05 1mx9 s GLU 3220Ca 0.17 -1.39 0.00 0.00 0.04 0.00 0.00 54.97 53.79 1mx9 s GLU 3220Cb 0.04 -1.91 0.00 0.00 0.02 0.00 0.00 34.13 32.28 1mx9 s GLU 3220CO -0.04 0.44 0.00 0.45 -1.84 0.00 0.00 175.26 174.27 1mx9 n SER 3221N 0.67 0.00 0.31 0.83 2.88 0.90 -1.14 113.62 118.07 1mx9 n SER 3221Ca -0.16 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.56 1mx9 n SER 3221Cb 0.54 0.00 1.00 0.00 -0.75 0.00 0.00 64.21 65.00 1mx9 n SER 3221CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1mx9 h ALA 3222N -0.77 1.24 0.00 -1.46 0.00 -1.85 0.90 119.26 117.32 1mx9 h ALA 3222Ca 0.00 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 1mx9 h ALA 3222Cb 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1mx9 h ALA 3222CO 0.00 0.03 -0.74 0.78 0.00 0.00 0.00 179.25 179.32 1mx9 h GLY 3223N 0.29 0.00 1.96 0.00 0.00 -1.13 -1.35 103.07 102.84 1mx9 h GLY 3223Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1mx9 h GLY 3223CO 0.00 0.00 -0.91 -1.33 0.00 0.00 0.00 176.54 174.31 1mx9 h GLY 3224N 3.35 0.03 1.58 4.60 0.00 0.68 -2.29 103.07 111.03 1mx9 h GLY 3224Ca -0.02 -0.07 -0.23 0.00 0.00 0.00 0.00 47.33 47.01 1mx9 h GLY 3224CO 0.09 0.06 -0.98 -2.09 0.00 0.00 0.00 176.54 173.62 1mx9 h GLU 3225N 0.01 0.36 0.03 4.80 4.22 0.00 -2.99 114.58 121.02 1mx9 h GLU 3225Ca -0.02 -0.42 -0.00 0.00 0.08 0.00 0.00 59.36 59.00 1mx9 h GLU 3225Cb 1.59 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.97 1mx9 h GLU 3225CO 0.12 1.11 -0.02 0.77 -2.18 0.00 0.00 179.01 178.81 1mx9 h SER 3226N 0.19 -0.04 -0.97 1.04 0.02 -1.21 0.18 113.55 112.76 1mx9 h SER 3226Ca -0.08 -0.23 0.09 0.00 -0.84 0.00 0.00 61.79 60.73 1mx9 h SER 3226Cb 1.63 0.01 -0.07 0.00 0.14 0.00 0.00 62.40 64.11 1mx9 h SER 3226CO 0.17 0.20 0.62 0.58 -1.14 0.00 0.00 176.83 177.26 1mx9 h VAL 3227N -0.28 1.01 -0.05 2.27 2.07 -1.51 0.32 116.25 120.08 1mx9 h VAL 3227Ca -0.00 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 1mx9 h VAL 3227Cb 0.26 -0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 29.90 1mx9 h VAL 3227CO 0.01 0.19 0.02 -1.28 0.02 0.00 0.00 177.57 176.53 1mx9 h SER 3228N 1.05 0.07 0.09 0.57 0.87 -1.30 -2.03 113.55 112.87 1mx9 h SER 3228Ca 0.44 -0.17 0.01 0.00 -1.23 0.00 0.00 61.79 60.85 1mx9 h SER 3228Cb 0.31 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 1mx9 h SER 3228CO -0.20 0.22 -0.17 0.58 -0.53 0.00 0.00 176.83 176.73 1mx9 h VAL 3229N -0.08 0.60 -0.65 2.23 2.07 0.73 -2.10 116.25 119.05 1mx9 h VAL 3229Ca 0.02 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.68 1mx9 h VAL 3229Cb 0.17 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 1mx9 h VAL 3229CO -0.00 0.00 0.44 -0.07 0.02 0.00 0.00 177.57 177.96 1mx9 h LEU 3230N -0.33 0.26 -1.88 2.57 3.38 -0.35 0.18 115.31 119.14 1mx9 h LEU 3230Ca 0.03 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1mx9 h LEU 3230Cb 0.35 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1mx9 h LEU 3230CO -0.10 0.14 -0.00 0.58 0.09 0.00 0.00 178.44 179.14 1mx9 h VAL 3231N 0.27 0.01 -0.00 1.22 2.07 -0.65 -2.74 116.25 116.43 1mx9 h VAL 3231Ca 0.31 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1mx9 h VAL 3231Cb 0.85 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1mx9 h VAL 3231CO -0.07 0.00 -0.65 0.18 0.02 0.00 0.00 177.57 177.05 1mx9 n LEU 3232N -3.10 0.95 -4.71 2.57 4.77 0.54 -4.97 117.00 113.05 1mx9 n LEU 3232Ca -0.00 -0.56 -0.39 0.00 -0.03 0.00 0.00 56.01 55.03 1mx9 n LEU 3232Cb 0.24 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.28 1mx9 n LEU 3232CO 0.25 0.22 0.27 -0.55 -1.33 0.00 0.00 177.39 176.25 1mx9 s SER 3233N -2.36 6.80 0.54 -1.43 0.15 -0.67 -4.90 113.70 111.81 1mx9 s SER 3233Ca 0.08 0.95 0.28 0.00 0.70 0.00 0.00 55.95 57.96 1mx9 s SER 3233Cb 0.12 -2.34 1.53 0.00 -1.71 0.00 0.00 66.02 63.62 1mx9 s SER 3233CO 0.59 -0.07 2.11 1.55 1.20 0.00 0.00 173.24 178.62 1mx9 h PRO 3234N 6.81 0.00 0.00 5.44 0.13 -1.86 -2.51 132.00 140.01 1mx9 h PRO 3234Ca -0.40 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1mx9 h PRO 3234Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1mx9 h PRO 3234CO 0.76 0.10 -0.02 -0.07 -0.23 0.00 0.00 178.00 178.53 1mx9 h LEU 3235N 0.00 0.00 -2.55 1.56 3.38 -1.82 -2.92 115.31 112.96 1mx9 h LEU 3235Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1mx9 h LEU 3235Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1mx9 h LEU 3235CO 0.01 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.56 1mx9 n ALA 3236N -2.12 2.32 -1.80 1.53 0.00 -0.94 -4.96 120.51 114.54 1mx9 n ALA 3236Ca -0.01 -1.09 -0.41 0.00 0.00 0.00 0.00 53.44 51.93 1mx9 n ALA 3236Cb 0.21 -0.66 -0.02 0.00 0.00 0.00 0.00 19.45 18.98 1mx9 n ALA 3236CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1mx9 s LYS 3237N -1.11 4.17 0.00 0.00 -2.85 -1.10 -1.90 119.74 116.95 1mx9 s LYS 3237Ca 0.33 2.49 0.00 0.00 -1.00 0.00 0.00 55.97 57.78 1mx9 s LYS 3237Cb 0.18 -3.04 0.00 0.00 -2.06 0.00 0.00 37.83 32.91 1mx9 s LYS 3237CO 0.24 -0.54 0.00 0.09 0.10 0.00 0.00 175.35 175.24 1mx9 n ASN 3238N 1.97 -3.82 0.01 0.03 3.02 -1.26 -4.86 115.26 110.36 1mx9 n ASN 3238Ca 0.07 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.72 1mx9 n ASN 3238Cb 0.39 -1.36 -0.04 0.00 -0.61 0.00 0.00 39.78 38.15 1mx9 n ASN 3238CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1mx9 n LEU 3239N 0.00 0.62 -3.66 3.41 4.77 -0.80 -4.96 117.00 116.39 1mx9 n LEU 3239Ca 0.00 -0.17 -0.10 0.00 -0.03 0.00 0.00 56.01 55.71 1mx9 n LEU 3239Cb 0.14 -0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.13 1mx9 n LEU 3239CO 0.00 0.11 0.14 0.72 -1.33 0.00 0.00 177.39 177.03 1mx9 s PHE 3240N -3.18 -0.16 0.00 -1.77 -0.71 -1.26 -4.81 117.98 106.09 1mx9 s PHE 3240Ca 0.03 -0.17 0.00 0.00 -1.04 0.00 0.00 56.93 55.75 1mx9 s PHE 3240Cb 0.15 0.23 0.00 0.00 -1.21 0.00 0.00 43.02 42.19 1mx9 s PHE 3240CO 0.84 -0.70 0.31 0.72 -1.34 0.00 0.00 175.22 175.05 1mx9 n HIS 3241N -0.22 0.00 -3.66 3.49 8.25 0.80 -4.90 115.22 118.99 1mx9 n HIS 3241Ca -0.15 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.16 1mx9 n HIS 3241Cb 0.64 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.67 1mx9 n HIS 3241CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1mx9 s ARG 3242N -0.24 0.75 0.04 -0.41 0.52 -1.19 -4.08 118.95 114.34 1mx9 s ARG 3242Ca 0.00 0.57 0.05 0.00 -0.52 0.00 0.00 55.73 55.83 1mx9 s ARG 3242Cb 0.00 0.36 -0.02 0.00 0.52 0.00 0.00 34.95 35.81 1mx9 s ARG 3242CO 0.00 -0.14 -0.15 0.00 0.02 0.00 0.00 175.30 175.03 1mx9 s ALA 3243N -0.19 1.22 -0.04 2.13 0.00 0.09 -2.18 121.76 122.79 1mx9 s ALA 3243Ca -0.04 -0.86 -0.00 0.00 0.00 0.00 0.00 51.96 51.05 1mx9 s ALA 3243Cb -0.03 -0.19 0.03 0.00 0.00 0.00 0.00 23.12 22.93 1mx9 s ALA 3243CO 0.03 0.23 0.01 0.42 0.00 0.00 0.00 175.76 176.45 1mx9 s ILE 3244N -0.89 0.16 -0.05 0.00 1.01 -0.84 -0.40 121.20 120.20 1mx9 s ILE 3244Ca 0.02 0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.85 1mx9 s ILE 3244Cb -0.08 -0.30 -0.03 0.00 0.01 0.00 0.00 42.46 42.07 1mx9 s ILE 3244CO 0.01 0.17 -0.12 -0.44 0.00 0.00 0.00 174.94 174.57 1mx9 s SER 3245N 1.37 4.23 -0.18 3.58 0.01 0.22 -3.35 113.70 119.60 1mx9 s SER 3245Ca -0.05 -0.15 -0.00 0.00 1.31 0.00 0.00 55.95 57.06 1mx9 s SER 3245Cb -0.13 -0.95 0.04 0.00 0.21 0.00 0.00 66.02 65.20 1mx9 s SER 3245CO -0.03 0.34 -0.05 -1.61 0.41 0.00 0.00 173.24 172.31 1mx9 s GLU 3246N -0.82 1.45 -1.10 12.44 2.02 -0.46 -2.23 118.70 129.99 1mx9 s GLU 3246Ca 0.12 -0.59 -0.18 0.00 0.02 0.00 0.00 54.97 54.34 1mx9 s GLU 3246Cb -0.11 -2.11 -0.02 0.00 0.10 0.00 0.00 34.13 32.00 1mx9 s GLU 3246CO 0.01 -0.46 0.81 0.43 0.02 0.00 0.00 175.26 176.06 1mx9 n SER 3247N 4.85 -5.58 0.00 -0.19 7.64 -0.50 -0.07 113.62 119.76 1mx9 n SER 3247Ca -0.12 -0.95 0.00 0.00 1.01 0.00 0.00 58.87 58.81 1mx9 n SER 3247Cb 0.47 -3.62 0.00 0.00 -1.01 0.00 0.00 64.21 60.05 1mx9 n SER 3247CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mx9 n GLY 3248N -1.63 3.70 3.52 0.23 0.00 -1.26 -1.77 105.19 107.98 1mx9 n GLY 3248Ca -0.09 -0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.59 1mx9 n GLY 3248CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mx9 s VAL 3249N -0.39 0.00 0.30 1.61 -7.23 -1.25 -3.53 120.40 109.91 1mx9 s VAL 3249Ca 0.00 -1.55 0.37 0.00 -1.81 0.00 0.00 61.98 58.99 1mx9 s VAL 3249Cb 0.00 -2.69 0.41 0.00 0.56 0.00 0.00 36.38 34.66 1mx9 s VAL 3249CO 0.00 0.00 2.12 0.00 -0.31 0.00 0.00 175.10 176.91 1mx9 h ALA 3250N 2.08 1.01 -0.38 1.32 0.00 -1.81 -2.32 119.26 119.14 1mx9 h ALA 3250Ca -0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1mx9 h ALA 3250Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1mx9 h ALA 3250CO 0.39 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.92 1mx9 n LEU 3251N -3.10 2.27 -4.28 0.00 4.77 -1.26 -4.70 117.00 110.70 1mx9 n LEU 3251Ca -0.01 -1.14 -0.43 0.00 -0.03 0.00 0.00 56.01 54.41 1mx9 n LEU 3251Cb 0.23 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1mx9 n LEU 3251CO 0.25 0.52 2.09 0.41 -1.33 0.00 0.00 177.39 179.32 1mx9 n THR 3252N 0.61 3.89 0.00 -5.08 -1.04 -0.87 -4.79 114.28 107.00 1mx9 n THR 3252Ca 0.13 -3.92 0.00 0.00 -2.04 0.00 0.00 64.05 58.22 1mx9 n THR 3252Cb 0.38 -2.44 0.00 0.00 -1.82 0.00 0.00 70.33 66.45 1mx9 n THR 3252CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1mx9 n SER 3253N 7.03 0.00 0.28 8.00 7.64 -1.26 -0.60 113.62 134.70 1mx9 n SER 3253Ca 0.47 0.00 0.17 0.00 1.01 0.00 0.00 58.87 60.53 1mx9 n SER 3253Cb 0.43 0.00 0.72 0.00 -1.01 0.00 0.00 64.21 64.35 1mx9 n SER 3253CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 1mx9 h VAL 3254N 0.00 0.05 0.00 0.44 3.04 -1.78 -2.86 116.25 115.14 1mx9 h VAL 3254Ca 0.00 -0.50 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 1mx9 h VAL 3254Cb 0.00 1.48 0.00 0.00 -2.01 0.00 0.00 31.29 30.76 1mx9 h VAL 3254CO 0.00 0.02 -0.76 -0.07 -1.01 0.00 0.00 177.57 175.74 1mx9 h LEU 3255N 0.00 0.00 -8.89 3.16 3.38 -1.23 -3.45 115.31 108.29 1mx9 h LEU 3255Ca -0.00 -0.06 -0.65 0.00 0.09 0.00 0.00 57.88 57.26 1mx9 h LEU 3255Cb 0.48 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.01 1mx9 h LEU 3255CO 0.00 0.03 -0.68 -0.69 0.09 0.00 0.00 178.44 177.19 1mx9 s VAL 3256N -3.29 3.75 -0.36 1.22 1.01 -1.08 -0.36 120.40 121.30 1mx9 s VAL 3256Ca 0.02 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.50 1mx9 s VAL 3256Cb 0.10 -2.61 0.04 0.00 0.00 0.00 0.00 36.38 33.91 1mx9 s VAL 3256CO 0.75 0.53 0.15 -0.54 0.00 0.00 0.00 175.10 175.99 1mx9 s LYS 3257N 0.06 2.70 -0.07 2.72 1.02 0.15 -4.86 119.74 121.46 1mx9 s LYS 3257Ca -0.01 -1.15 -0.01 0.00 0.02 0.00 0.00 55.97 54.82 1mx9 s LYS 3257Cb -0.14 -3.58 -0.03 0.00 -0.52 0.00 0.00 37.83 33.56 1mx9 s LYS 3257CO 0.03 -0.69 0.00 0.15 -0.92 0.00 0.00 175.35 173.93 1mx9 s LYS 3258N 1.47 2.95 0.00 1.68 1.02 -1.26 -4.28 119.74 121.32 1mx9 s LYS 3258Ca -0.00 -0.44 0.00 0.00 0.02 0.00 0.00 55.97 55.54 1mx9 s LYS 3258Cb -0.19 -2.77 0.00 0.00 -0.52 0.00 0.00 37.83 34.34 1mx9 s LYS 3258CO 0.04 0.69 0.00 0.41 -0.92 0.00 0.00 175.35 175.57 1mx9 n GLY 3259N 1.97 -1.19 3.57 -3.33 0.00 -1.26 -4.92 105.19 100.03 1mx9 n GLY 3259Ca -0.18 -2.12 -0.40 0.00 0.00 0.00 0.00 46.02 43.33 1mx9 n GLY 3259CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mx9 s ASP 3260N -4.00 5.13 0.16 1.61 2.15 -1.26 -4.82 116.67 115.64 1mx9 s ASP 3260Ca 0.00 1.19 0.24 0.00 0.43 0.00 0.00 52.55 54.41 1mx9 s ASP 3260Cb 0.00 -2.51 0.32 0.00 -0.30 0.00 0.00 42.92 40.43 1mx9 s ASP 3260CO 0.00 -2.33 1.33 -0.37 -0.17 0.00 0.00 175.17 173.63 1mx9 h VAL 3261N 7.23 0.00 -0.72 1.11 -1.51 -1.92 -3.38 116.25 117.07 1mx9 h VAL 3261Ca -0.31 -0.62 0.14 0.00 -1.23 0.00 0.00 66.70 64.68 1mx9 h VAL 3261Cb 1.22 1.25 -0.14 0.00 -2.13 0.00 0.00 31.29 31.50 1mx9 h VAL 3261CO 1.09 0.00 -0.24 0.50 -1.23 0.00 0.00 177.57 177.70 1mx9 h LYS 3262N 0.00 -0.04 -0.76 5.19 1.63 -1.85 -1.34 116.57 119.39 1mx9 h LYS 3262Ca 0.00 0.00 0.18 0.00 -0.85 0.00 0.00 60.65 59.98 1mx9 h LYS 3262Cb 0.81 0.01 -0.13 0.00 -0.60 0.00 0.00 32.23 32.32 1mx9 h LYS 3262CO 0.00 -0.03 0.07 -1.35 -3.45 0.00 0.00 179.45 174.69 1mx9 h PRO 3263N -0.04 0.14 0.09 1.90 0.11 -1.96 -1.46 132.00 130.78 1mx9 h PRO 3263Ca 0.32 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.42 1mx9 h PRO 3263Cb 0.55 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.63 1mx9 h PRO 3263CO -0.76 0.10 -0.05 1.25 -0.21 0.00 0.00 178.00 178.33 1mx9 h LEU 3264N 0.15 -0.11 -0.85 2.35 6.46 -1.54 -2.28 115.31 119.49 1mx9 h LEU 3264Ca 0.43 -0.04 0.17 0.00 -0.12 0.00 0.00 57.88 58.32 1mx9 h LEU 3264Cb 0.77 0.03 -0.11 0.00 -0.73 0.00 0.00 40.66 40.62 1mx9 h LEU 3264CO -0.63 -0.03 0.40 0.00 -0.62 0.00 0.00 178.44 177.56 1mx9 h ALA 3265N 0.72 1.30 -0.34 1.25 0.00 -1.09 0.21 119.26 121.31 1mx9 h ALA 3265Ca -0.01 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1mx9 h ALA 3265Cb 0.14 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1mx9 h ALA 3265CO 0.02 -0.20 -0.25 0.93 0.00 0.00 0.00 179.25 179.75 1mx9 h GLU 3266N 0.51 0.69 -0.63 0.00 5.08 -1.23 0.30 114.58 119.31 1mx9 h GLU 3266Ca 0.49 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1mx9 h GLU 3266Cb 0.80 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.99 1mx9 h GLU 3266CO -0.43 0.87 0.38 0.37 -1.00 0.00 0.00 179.01 179.21 1mx9 h GLN 3267N 0.60 0.85 0.49 2.33 4.15 -0.14 0.91 115.11 124.30 1mx9 h GLN 3267Ca 0.08 -0.08 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 1mx9 h GLN 3267Cb 0.74 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.26 1mx9 h GLN 3267CO 0.06 0.61 -0.23 0.82 -1.93 0.00 0.00 178.83 178.15 1mx9 h ILE 3268N 0.85 0.44 0.07 2.39 2.04 -0.40 -1.92 117.51 120.98 1mx9 h ILE 3268Ca 0.23 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.74 1mx9 h ILE 3268Cb -0.03 0.58 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 1mx9 h ILE 3268CO -0.04 0.06 -0.36 0.00 0.00 0.00 0.00 178.15 177.81 1mx9 h ALA 3269N -0.53 -0.58 -0.95 1.87 0.00 -0.11 0.32 119.26 119.28 1mx9 h ALA 3269Ca -0.07 -0.04 0.21 0.00 0.00 0.00 0.00 54.91 55.01 1mx9 h ALA 3269Cb 0.59 0.61 -0.08 0.00 0.00 0.00 0.00 17.79 18.91 1mx9 h ALA 3269CO 0.11 -0.89 0.62 0.82 0.00 0.00 0.00 179.25 179.90 1mx9 h ILE 3270N -0.55 0.66 -0.10 0.00 2.04 0.81 0.28 117.51 120.66 1mx9 h ILE 3270Ca 0.04 -0.16 -0.11 0.00 1.00 0.00 0.00 64.86 65.62 1mx9 h ILE 3270Cb 0.61 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1mx9 h ILE 3270CO -0.24 0.09 -0.45 0.74 0.00 0.00 0.00 178.15 178.28 1mx9 h THR 3271N 0.48 1.33 -0.19 -0.27 2.02 -0.21 -2.51 112.91 113.55 1mx9 h THR 3271Ca 0.51 -1.62 0.00 0.00 0.77 0.00 0.00 66.41 66.07 1mx9 h THR 3271Cb 1.17 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 69.34 1mx9 h THR 3271CO -0.23 0.48 0.00 0.00 0.37 0.00 0.00 175.52 176.14 1mx9 n ALA 3272N -2.47 2.62 -2.61 6.16 0.00 0.92 -4.88 120.51 120.24 1mx9 n ALA 3272Ca -0.02 -0.43 -0.15 0.00 0.00 0.00 0.00 53.44 52.85 1mx9 n ALA 3272Cb 0.51 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 18.97 1mx9 n ALA 3272CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mx9 n GLY 3273N 0.60 -0.17 4.00 0.00 0.00 -0.92 -5.03 105.19 103.68 1mx9 n GLY 3273Ca 0.07 -0.20 -0.19 0.00 0.00 0.00 0.00 46.02 45.70 1mx9 n GLY 3273CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mx9 s LYS 3275N -4.47 3.19 -0.12 0.00 1.02 -1.26 -4.42 119.74 113.68 1mx9 s LYS 3275Ca 0.56 -0.79 0.16 0.00 0.02 0.00 0.00 55.97 55.92 1mx9 s LYS 3275Cb -0.07 -2.79 0.30 0.00 -0.52 0.00 0.00 37.83 34.75 1mx9 s LYS 3275CO 0.34 0.47 1.18 0.25 -0.92 0.00 0.00 175.35 176.68 1mx9 n THR 3276N -0.74 1.82 -0.31 2.17 -2.24 -1.26 -4.22 114.28 109.50 1mx9 n THR 3276Ca -0.08 -2.00 0.16 0.00 -2.27 0.00 0.00 64.05 59.86 1mx9 n THR 3276Cb 0.55 -0.13 0.34 0.00 -2.10 0.00 0.00 70.33 69.00 1mx9 n THR 3276CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1mx9 h THR 3277N 0.38 0.40 -3.23 4.28 2.02 -1.96 -3.43 112.91 111.37 1mx9 h THR 3277Ca 0.00 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.01 1mx9 h THR 3277Cb 1.01 0.02 -0.14 0.00 -1.74 0.00 0.00 68.15 67.30 1mx9 h THR 3277CO 0.04 0.06 -0.03 0.42 0.37 0.00 0.00 175.52 176.39 1mx9 s THR 3278N -5.85 0.05 0.12 3.16 -4.23 -1.26 -5.04 115.64 102.60 1mx9 s THR 3278Ca -0.11 -0.45 -0.31 0.00 -1.18 0.00 0.00 61.69 59.64 1mx9 s THR 3278Cb 0.27 -1.10 -0.09 0.00 1.34 0.00 0.00 72.50 72.92 1mx9 s THR 3278CO 0.78 -0.25 1.58 -1.28 -0.54 0.00 0.00 174.62 174.91 1mx9 h SER 3279N 2.44 -1.40 -0.76 3.99 0.87 -1.96 -0.15 113.55 116.58 1mx9 h SER 3279Ca -0.33 0.17 0.05 0.00 -1.23 0.00 0.00 61.79 60.44 1mx9 h SER 3279Cb 1.25 0.55 -0.04 0.00 -0.44 0.00 0.00 62.40 63.72 1mx9 h SER 3279CO 0.45 -0.47 0.50 0.00 -0.53 0.00 0.00 176.83 176.78 1mx9 h ALA 3280N -0.11 1.60 -0.57 6.23 0.00 -1.97 -1.89 119.26 122.54 1mx9 h ALA 3280Ca 0.05 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1mx9 h ALA 3280Cb 0.67 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1mx9 h ALA 3280CO -0.35 0.31 0.14 0.28 0.00 0.00 0.00 179.25 179.63 1mx9 h VAL 3281N 0.88 1.25 -0.10 0.00 2.07 -1.76 -1.49 116.25 117.10 1mx9 h VAL 3281Ca 0.31 -0.88 0.01 0.00 0.82 0.00 0.00 66.70 66.96 1mx9 h VAL 3281Cb 0.13 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1mx9 h VAL 3281CO -0.10 0.33 0.02 0.24 0.02 0.00 0.00 177.57 178.08 1mx9 h MET 3282N 0.82 0.07 -0.63 1.57 0.00 -0.25 -1.69 114.93 114.81 1mx9 h MET 3282Ca 0.18 -0.00 0.01 0.00 0.00 0.00 0.00 59.70 59.88 1mx9 h MET 3282Cb 0.34 -0.02 -0.03 0.00 0.00 0.00 0.00 31.60 31.89 1mx9 h MET 3282CO 0.00 0.04 0.42 0.28 0.00 0.00 0.00 176.91 177.65 1mx9 h VAL 3283N 0.07 1.16 0.29 -2.22 2.07 -1.32 -1.66 116.25 114.64 1mx9 h VAL 3283Ca 0.04 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1mx9 h VAL 3283Cb 0.03 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1mx9 h VAL 3283CO -0.05 0.16 -0.17 -0.74 0.02 0.00 0.00 177.57 176.78 1mx9 h HIS 3284N 0.85 -0.46 -0.69 1.57 -0.00 -1.12 0.37 115.15 115.67 1mx9 h HIS 3284Ca 0.23 -0.01 0.09 0.00 -0.00 0.00 0.00 60.37 60.69 1mx9 h HIS 3284Cb -0.09 0.16 -0.07 0.00 -0.00 0.00 0.00 27.41 27.41 1mx9 h HIS 3284CO -0.03 -0.27 0.34 0.00 -0.00 0.00 0.00 177.93 177.96 1mx9 h LEU 3286N 0.58 0.00 0.00 0.00 3.38 -1.04 -2.54 115.31 115.69 1mx9 h LEU 3286Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1mx9 h LEU 3286Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1mx9 h LEU 3286CO -0.26 0.32 0.00 0.54 0.09 0.00 0.00 178.44 179.13 1mx9 n ARG 3287N -3.55 0.00 0.00 1.13 1.74 0.10 -2.79 116.66 113.29 1mx9 n ARG 3287Ca -0.00 0.11 0.10 0.00 -0.77 0.00 0.00 57.85 57.29 1mx9 n ARG 3287Cb 0.46 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.32 1mx9 n ARG 3287CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1mx9 n GLN 3288N -1.50 0.07 -2.65 5.56 1.13 -0.96 -4.85 117.38 114.18 1mx9 n GLN 3288Ca 0.06 -0.02 -0.35 0.00 -1.94 0.00 0.00 57.00 54.74 1mx9 n GLN 3288Cb 0.27 -1.51 -0.05 0.00 0.11 0.00 0.00 30.24 29.06 1mx9 n GLN 3288CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1mx9 s LYS 3289N -3.05 4.20 0.96 -1.09 -0.14 -1.12 -5.03 119.74 114.47 1mx9 s LYS 3289Ca 0.07 1.36 -0.12 0.00 -1.36 0.00 0.00 55.97 55.92 1mx9 s LYS 3289Cb 0.16 -2.44 0.17 0.00 -1.68 0.00 0.00 37.83 34.04 1mx9 s LYS 3289CO 0.85 -0.08 1.11 0.95 -0.76 0.00 0.00 175.35 177.43 1mx9 s THR 3290N -1.82 2.00 0.08 2.17 -4.23 -1.26 -4.82 115.64 107.76 1mx9 s THR 3290Ca 0.59 0.00 -0.32 0.00 -1.18 0.00 0.00 61.69 60.78 1mx9 s THR 3290Cb -0.18 -2.61 -0.16 0.00 1.34 0.00 0.00 72.50 70.89 1mx9 s THR 3290CO 0.22 0.00 1.62 -0.08 -0.54 0.00 0.00 174.62 175.84 1mx9 h GLU 3291N -1.73 -0.80 0.00 3.99 4.81 -1.99 -1.54 114.58 117.33 1mx9 h GLU 3291Ca -0.53 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.74 1mx9 h GLU 3291Cb 1.33 0.18 -0.00 0.00 0.63 0.00 0.00 28.75 30.89 1mx9 h GLU 3291CO 0.60 -0.53 -0.07 1.49 -0.73 0.00 0.00 179.01 179.77 1mx9 h GLU 3292N -0.83 0.00 -0.81 1.92 4.81 -1.98 0.51 114.58 118.21 1mx9 h GLU 3292Ca -0.06 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 1mx9 h GLU 3292Cb 0.68 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.03 1mx9 h GLU 3292CO 0.04 0.07 0.34 0.93 -0.73 0.00 0.00 179.01 179.66 1mx9 h GLU 3293N 0.00 1.20 0.00 1.92 5.08 -1.73 -0.18 114.58 120.88 1mx9 h GLU 3293Ca -0.00 -0.21 -0.19 0.00 -1.00 0.00 0.00 59.36 57.96 1mx9 h GLU 3293Cb 0.14 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1mx9 h GLU 3293CO 0.01 0.96 -0.87 -0.07 -1.00 0.00 0.00 179.01 178.04 1mx9 h LEU 3294N 1.18 0.20 -1.02 1.33 3.38 -0.11 -3.03 115.31 117.24 1mx9 h LEU 3294Ca 0.27 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 1mx9 h LEU 3294Cb 0.19 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1mx9 h LEU 3294CO -0.03 0.97 -0.11 0.25 0.09 0.00 0.00 178.44 179.61 1mx9 h LEU 3295N 0.08 0.56 -1.09 1.67 5.85 -0.54 0.39 115.31 122.23 1mx9 h LEU 3295Ca -0.04 -0.15 -0.08 0.00 0.84 0.00 0.00 57.88 58.46 1mx9 h LEU 3295Cb 1.50 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.37 1mx9 h LEU 3295CO 0.13 0.70 -0.20 -0.08 -0.34 0.00 0.00 178.44 178.65 1mx9 h GLU 3296N 0.53 0.40 0.05 1.25 4.57 -0.98 -1.66 114.58 118.74 1mx9 h GLU 3296Ca 0.10 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1mx9 h GLU 3296Cb 0.51 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1mx9 h GLU 3296CO 0.03 0.59 -0.03 1.15 -1.18 0.00 0.00 179.01 179.58 1mx9 h THR 3297N 0.37 1.25 -0.89 0.32 2.02 -1.24 -1.49 112.91 113.26 1mx9 h THR 3297Ca 0.06 -1.10 0.19 0.00 0.77 0.00 0.00 66.41 66.34 1mx9 h THR 3297Cb 0.56 1.97 -0.07 0.00 -1.74 0.00 0.00 68.15 68.87 1mx9 h THR 3297CO 0.04 0.27 0.59 0.74 0.37 0.00 0.00 175.52 177.53 1mx9 h THR 3298N -0.57 0.70 0.40 3.16 2.02 -0.68 -1.28 112.91 116.66 1mx9 h THR 3298Ca -0.01 -0.15 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 1mx9 h THR 3298Cb 0.50 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 1mx9 h THR 3298CO 0.01 0.08 -0.19 0.25 0.37 0.00 0.00 175.52 176.04 1mx9 h LEU 3299N 0.45 -0.45 -1.68 2.58 5.85 -1.15 -3.12 115.31 117.79 1mx9 h LEU 3299Ca 0.46 0.02 0.29 0.00 0.84 0.00 0.00 57.88 59.49 1mx9 h LEU 3299Cb 1.08 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 42.16 1mx9 h LEU 3299CO -0.18 -0.10 0.73 0.11 -0.34 0.00 0.00 178.44 178.66 1mx9 h LYS 3300N -0.99 0.20 -0.16 1.25 1.57 -0.88 0.51 116.57 118.06 1mx9 h LYS 3300Ca -0.05 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 1mx9 h LYS 3300Cb 0.41 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1mx9 h LYS 3300CO 0.09 0.13 -0.23 0.52 -0.57 0.00 0.00 179.45 179.39 1mx9 h MET 3301N 0.20 0.29 -4.41 3.15 2.86 -1.30 -3.48 114.93 112.24 1mx9 h MET 3301Ca 0.56 -0.09 -0.21 0.00 -2.06 0.00 0.00 59.70 57.90 1mx9 h MET 3301Cb 1.79 -0.03 0.11 0.00 0.06 0.00 0.00 31.60 33.54 1mx9 h MET 3301CO -0.15 0.51 -0.51 1.63 1.06 0.00 0.00 176.91 179.45 1mx9 n LYS 3302N -4.17 -4.02 -0.88 1.72 5.02 0.18 -5.02 118.16 110.99 1mx9 n LYS 3302Ca -0.01 0.56 -0.29 0.00 -2.02 0.00 0.00 58.31 56.55 1mx9 n LYS 3302Cb 0.36 -4.67 0.24 0.00 -0.02 0.00 0.00 35.03 30.94 1mx9 n LYS 3302CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1mx9 s PHE 3303N -3.24 0.82 -1.50 2.13 0.40 -1.26 -3.96 117.98 111.37 1mx9 s PHE 3303Ca 0.03 0.74 -0.13 0.00 -0.60 0.00 0.00 56.93 56.97 1mx9 s PHE 3303Cb -0.00 -3.24 0.07 0.00 0.51 0.00 0.00 43.02 40.36 1mx9 s PHE 3303CO 0.48 -3.87 1.01 1.28 0.70 0.00 0.00 175.22 174.82 1mx9 n LEU 3304N -4.83 -2.67 -3.66 -0.37 4.77 0.13 -4.96 117.00 105.41 1mx9 n LEU 3304Ca 0.09 -0.72 -0.10 0.00 -0.03 0.00 0.00 56.01 55.25 1mx9 n LEU 3304Cb 0.58 -2.64 -0.03 0.00 -2.33 0.00 0.00 43.42 39.00 1mx9 n LEU 3304CO 0.50 0.49 0.33 -0.44 -1.33 0.00 0.00 177.39 176.95 1mx9 s SER 3305N -3.28 -0.35 -0.26 -1.43 0.01 -1.25 -4.29 113.70 102.85 1mx9 s SER 3305Ca 0.65 -0.35 -0.09 0.00 1.31 0.00 0.00 55.95 57.47 1mx9 s SER 3305Cb -0.32 0.60 -0.04 0.00 0.21 0.00 0.00 66.02 66.47 1mx9 s SER 3305CO 0.80 -1.06 0.13 -0.22 0.41 0.00 0.00 173.24 173.30 1mx9 s LEU 3306N -2.84 3.74 -0.53 2.44 2.96 -1.00 -4.77 118.68 118.69 1mx9 s LEU 3306Ca 0.07 -0.10 -0.27 0.00 -0.22 0.00 0.00 54.13 53.61 1mx9 s LEU 3306Cb -0.02 -2.02 0.03 0.00 0.50 0.00 0.00 46.19 44.68 1mx9 s LEU 3306CO -0.05 -0.04 1.06 -0.62 -1.32 0.00 0.00 176.35 175.39 1mx9 s ASP 3307N 1.66 6.46 0.18 3.68 3.68 -1.26 -4.88 116.67 126.19 1mx9 s ASP 3307Ca 0.07 0.05 0.26 0.00 2.13 0.00 0.00 52.55 55.05 1mx9 s ASP 3307Cb -0.15 -2.50 0.90 0.00 -1.45 0.00 0.00 42.92 39.71 1mx9 s ASP 3307CO 0.07 -1.29 1.78 0.18 0.13 0.00 0.00 175.17 176.04 1mx9 n LEU 3308N 7.82 0.63 -4.60 -1.34 4.77 -1.26 -4.76 117.00 118.27 1mx9 n LEU 3308Ca 0.07 0.58 -0.34 0.00 -0.03 0.00 0.00 56.01 56.28 1mx9 n LEU 3308Cb 0.48 -0.40 -0.11 0.00 -2.33 0.00 0.00 43.42 41.07 1mx9 n LEU 3308CO 0.68 -0.22 -0.32 -1.10 -1.33 0.00 0.00 177.39 175.10 1mx9 s GLN 3309N -3.12 3.47 0.02 3.23 1.11 -1.26 -5.03 119.66 118.08 1mx9 s GLN 3309Ca 0.10 -0.44 0.00 0.00 0.01 0.00 0.00 55.36 55.03 1mx9 s GLN 3309Cb 0.13 -2.93 0.00 0.00 -1.01 0.00 0.00 33.01 29.20 1mx9 s GLN 3309CO 0.54 0.43 0.00 0.41 0.01 0.00 0.00 175.29 176.67 1mx9 n GLY 3310N 3.00 -1.89 3.67 3.09 0.00 -1.26 -4.91 105.19 106.89 1mx9 n GLY 3310Ca -0.18 -2.00 -0.38 0.00 0.00 0.00 0.00 46.02 43.46 1mx9 n GLY 3310CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mx9 s ASP 3311N -4.00 6.43 0.61 1.61 -1.08 -1.26 -4.97 116.67 114.01 1mx9 s ASP 3311Ca 0.00 0.51 0.32 0.00 -0.52 0.00 0.00 52.55 52.86 1mx9 s ASP 3311Cb 0.00 -2.23 1.91 0.00 -1.46 0.00 0.00 42.92 41.14 1mx9 s ASP 3311CO 0.00 -0.06 2.25 -0.65 0.52 0.00 0.00 175.17 177.23 1mx9 h PRO 3312N 7.34 0.00 0.00 4.34 0.11 -1.89 -1.72 132.00 140.17 1mx9 h PRO 3312Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1mx9 h PRO 3312Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1mx9 h PRO 3312CO 0.72 0.00 -0.25 0.54 -0.21 0.00 0.00 178.00 178.80 1mx9 n ARG 3313N -3.69 0.06 0.00 1.05 1.74 -1.26 -3.45 116.66 111.11 1mx9 n ARG 3313Ca -0.02 0.03 0.10 0.00 -0.77 0.00 0.00 57.85 57.20 1mx9 n ARG 3313Cb 0.12 -1.56 0.03 0.00 -1.02 0.00 0.00 32.46 30.03 1mx9 n ARG 3313CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1mx9 n GLU 3314N -1.66 1.58 -3.37 5.56 1.02 -0.65 -4.87 120.64 118.25 1mx9 n GLU 3314Ca 0.06 -1.24 -0.40 0.00 -0.02 0.00 0.00 57.16 55.56 1mx9 n GLU 3314Cb 0.36 -1.42 -0.09 0.00 -0.02 0.00 0.00 31.44 30.27 1mx9 n GLU 3314CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1mx9 s SER 3315N -2.17 6.23 -0.74 1.62 1.04 -1.20 -5.01 113.70 113.47 1mx9 s SER 3315Ca 0.20 0.01 -0.09 0.00 0.48 0.00 0.00 55.95 56.54 1mx9 s SER 3315Cb 0.17 -2.21 0.19 0.00 0.10 0.00 0.00 66.02 64.27 1mx9 s SER 3315CO 0.45 -0.30 0.63 -1.58 0.98 0.00 0.00 173.24 173.41 1mx9 s GLN 3316N 2.10 3.17 0.30 4.02 2.00 -1.26 -4.74 119.66 125.24 1mx9 s GLN 3316Ca 0.14 -2.49 0.24 0.00 -2.00 0.00 0.00 55.36 51.25 1mx9 s GLN 3316Cb -0.16 -4.14 1.07 0.00 0.80 0.00 0.00 33.01 30.58 1mx9 s GLN 3316CO 0.11 -1.24 1.72 -1.00 -0.50 0.00 0.00 175.29 174.38 1mx9 h PRO 3317N 7.46 0.00 -3.75 1.67 0.13 -1.92 -3.44 132.00 132.15 1mx9 h PRO 3317Ca 0.05 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.01 1mx9 h PRO 3317Cb 1.00 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 31.91 1mx9 h PRO 3317CO 0.74 0.00 -0.62 -0.51 -0.23 0.00 0.00 178.00 177.38 1mx9 s LEU 3318N -4.60 1.92 -0.44 1.56 1.43 -1.26 -0.70 118.68 116.59 1mx9 s LEU 3318Ca 0.02 -0.28 -0.12 0.00 -1.03 0.00 0.00 54.13 52.73 1mx9 s LEU 3318Cb 0.09 0.31 0.08 0.00 0.03 0.00 0.00 46.19 46.69 1mx9 s LEU 3318CO 0.35 -0.27 0.32 -0.22 0.23 0.00 0.00 176.35 176.76 1mx9 s LEU 3319N -1.13 5.35 0.00 1.79 2.96 -1.26 -5.05 118.68 121.34 1mx9 s LEU 3319Ca -0.12 -1.43 0.00 0.00 -0.22 0.00 0.00 54.13 52.36 1mx9 s LEU 3319Cb -0.07 -2.07 0.00 0.00 0.50 0.00 0.00 46.19 44.55 1mx9 s LEU 3319CO 0.00 -0.58 0.00 0.61 -1.32 0.00 0.00 176.35 175.06 1mx9 n GLY 3320N 5.04 4.73 3.79 7.98 0.00 -1.26 -4.74 105.19 120.72 1mx9 n GLY 3320Ca -0.11 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 43.67 1mx9 n GLY 3320CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mx9 s THR 3321N 2.00 3.65 0.08 2.61 2.01 0.52 -4.77 115.64 121.73 1mx9 s THR 3321Ca 0.00 1.08 0.01 0.00 0.31 0.00 0.00 61.69 63.09 1mx9 s THR 3321Cb 0.00 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 1mx9 s THR 3321CO 0.00 -0.17 -0.06 0.68 -0.69 0.00 0.00 174.62 174.38 1mx9 s VAL 3322N -1.87 0.53 -1.14 3.82 -7.23 -1.26 0.33 120.40 113.57 1mx9 s VAL 3322Ca 0.66 -1.80 -0.21 0.00 -1.81 0.00 0.00 61.98 58.83 1mx9 s VAL 3322Cb -0.19 -1.50 0.02 0.00 0.56 0.00 0.00 36.38 35.27 1mx9 s VAL 3322CO 0.23 -0.86 1.72 -0.63 -0.31 0.00 0.00 175.10 175.25 1mx9 s ILE 3323N -3.45 3.87 0.17 -0.62 -1.09 -1.26 -4.70 121.20 114.13 1mx9 s ILE 3323Ca 0.08 -1.19 0.16 0.00 -2.23 0.00 0.00 60.65 57.47 1mx9 s ILE 3323Cb 0.04 -4.89 0.09 0.00 -1.58 0.00 0.00 42.46 36.12 1mx9 s ILE 3323CO -0.06 -1.67 1.68 -2.24 -1.23 0.00 0.00 174.94 171.42 1mx9 h ASP 3324N 9.11 0.00 0.00 3.58 3.04 -1.85 -3.47 116.42 126.82 1mx9 h ASP 3324Ca 0.29 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.08 1mx9 h ASP 3324Cb 0.94 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.23 1mx9 h ASP 3324CO 1.38 0.45 0.00 0.61 -2.04 0.00 0.00 179.24 179.63 1mx9 n GLY 3325N 0.31 1.04 0.71 7.15 0.00 -0.03 -4.87 105.19 109.49 1mx9 n GLY 3325Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1mx9 n GLY 3325CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1mx9 n MET 3326N -1.64 0.20 0.06 1.61 2.81 -1.26 -4.68 117.12 114.22 1mx9 n MET 3326Ca 0.00 0.08 -0.06 0.00 -1.81 0.00 0.00 57.70 55.91 1mx9 n MET 3326Cb 0.00 -0.83 -0.04 0.00 -0.71 0.00 0.00 33.22 31.64 1mx9 n MET 3326CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1mx9 h LEU 3327N -0.35 -0.22 -8.65 4.03 5.85 -1.93 -3.43 115.31 110.62 1mx9 h LEU 3327Ca -0.14 -0.11 -0.65 0.00 0.84 0.00 0.00 57.88 57.82 1mx9 h LEU 3327Cb 0.83 0.06 -0.25 0.00 0.37 0.00 0.00 40.66 41.67 1mx9 h LEU 3327CO -0.08 0.29 -0.70 -0.76 -0.34 0.00 0.00 178.44 176.85 1mx9 s LEU 3328N -8.84 3.04 0.02 2.25 1.43 -1.26 -4.06 118.68 111.25 1mx9 s LEU 3328Ca -0.07 -0.26 0.26 0.00 -1.03 0.00 0.00 54.13 53.04 1mx9 s LEU 3328Cb 0.00 -1.74 0.67 0.00 0.03 0.00 0.00 46.19 45.15 1mx9 s LEU 3328CO 0.22 0.10 1.53 0.18 0.23 0.00 0.00 176.35 178.61 1mx9 n LEU 3329N 3.99 0.41 -3.87 1.79 4.77 -1.26 -0.86 117.00 121.97 1mx9 n LEU 3329Ca -0.18 0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 55.95 1mx9 n LEU 3329Cb 0.52 -0.30 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 1mx9 n LEU 3329CO 0.31 0.07 0.91 -1.59 -1.33 0.00 0.00 177.39 175.76 1mx9 s LYS 3330N -3.02 0.94 0.34 3.23 -2.85 -1.26 -4.85 119.74 112.26 1mx9 s LYS 3330Ca 0.11 -0.59 -0.29 0.00 -1.00 0.00 0.00 55.97 54.21 1mx9 s LYS 3330Cb 0.17 0.27 -0.12 0.00 -2.06 0.00 0.00 37.83 36.10 1mx9 s LYS 3330CO 0.66 -0.44 1.44 0.25 0.10 0.00 0.00 175.35 177.36 1mx9 n THR 3331N -0.71 1.71 -0.40 3.79 -2.24 -1.26 -4.79 114.28 110.38 1mx9 n THR 3331Ca -0.02 -0.43 0.33 0.00 -2.27 0.00 0.00 64.05 61.66 1mx9 n THR 3331Cb 0.60 -1.79 0.63 0.00 -2.10 0.00 0.00 70.33 67.66 1mx9 n THR 3331CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1mx9 h PRO 3332N 3.30 0.17 -0.85 -0.78 0.11 -1.99 0.90 132.00 132.85 1mx9 h PRO 3332Ca -0.48 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1mx9 h PRO 3332Cb 1.26 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 1mx9 h PRO 3332CO 0.68 0.11 0.46 0.93 -0.21 0.00 0.00 178.00 179.97 1mx9 h GLU 3333N 0.17 1.19 -0.23 1.05 3.07 -1.93 -2.57 114.58 115.33 1mx9 h GLU 3333Ca 0.71 -0.14 -0.20 0.00 -0.50 0.00 0.00 59.36 59.23 1mx9 h GLU 3333Cb 2.23 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 29.92 1mx9 h GLU 3333CO -0.29 0.88 -0.64 0.93 -1.40 0.00 0.00 179.01 178.49 1mx9 h GLU 3334N 1.19 0.84 0.00 2.33 5.08 -1.17 -3.21 114.58 119.64 1mx9 h GLU 3334Ca 0.30 -0.59 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 1mx9 h GLU 3334Cb 0.04 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1mx9 h GLU 3334CO -0.05 1.21 -0.04 -0.07 -1.00 0.00 0.00 179.01 179.07 1mx9 h LEU 3335N 0.62 0.00 0.03 1.33 3.38 -1.29 -1.59 115.31 117.79 1mx9 h LEU 3335Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1mx9 h LEU 3335Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1mx9 h LEU 3335CO 0.14 0.04 -0.47 1.56 0.09 0.00 0.00 178.44 179.79 1mx9 h GLN 3336N 0.00 0.07 0.00 1.13 4.20 -1.48 -3.25 115.11 115.78 1mx9 h GLN 3336Ca -0.00 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 1mx9 h GLN 3336Cb 0.31 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.14 1mx9 h GLN 3336CO 0.00 1.06 -0.01 0.00 -0.67 0.00 0.00 178.83 179.21 1mx9 h ALA 3337N -0.07 1.86 -2.47 3.87 0.00 -1.54 -3.40 119.26 117.50 1mx9 h ALA 3337Ca -0.11 -0.01 -0.51 0.00 0.00 0.00 0.00 54.91 54.28 1mx9 h ALA 3337Cb 1.22 -0.00 0.10 0.00 0.00 0.00 0.00 17.79 19.11 1mx9 h ALA 3337CO -0.01 0.02 0.38 -2.00 0.00 0.00 0.00 179.25 177.64 1mx9 s GLU 3338N -4.93 2.89 -0.05 0.00 2.12 -0.61 -5.03 118.70 113.09 1mx9 s GLU 3338Ca -0.05 1.41 0.04 0.00 0.36 0.00 0.00 54.97 56.73 1mx9 s GLU 3338Cb 0.16 -1.96 0.00 0.00 0.26 0.00 0.00 34.13 32.59 1mx9 s GLU 3338CO 0.64 -1.18 -0.16 0.50 -0.54 0.00 0.00 175.26 174.52 1mx9 s ARG 3339N -3.98 1.79 0.23 4.30 3.00 -1.26 -4.91 118.95 118.11 1mx9 s ARG 3339Ca 0.68 -0.56 0.10 0.00 -1.00 0.00 0.00 55.73 54.94 1mx9 s ARG 3339Cb -0.21 -1.52 -0.04 0.00 0.00 0.00 0.00 34.95 33.18 1mx9 s ARG 3339CO 0.39 0.18 -0.09 -0.80 0.00 0.00 0.00 175.30 174.98 1mx9 s ASN 3340N 0.20 4.16 0.11 -2.12 0.01 -1.26 -5.05 114.94 110.99 1mx9 s ASN 3340Ca -0.07 -0.72 0.13 0.00 -0.71 0.00 0.00 52.86 51.49 1mx9 s ASN 3340Cb -0.13 -0.64 -0.12 0.00 0.41 0.00 0.00 41.25 40.77 1mx9 s ASN 3340CO 0.03 0.05 1.07 -0.26 -1.51 0.00 0.00 177.10 176.49 1mx9 h PHE 3341N 2.43 0.00 -3.49 2.20 -1.00 -2.00 -3.42 116.94 111.66 1mx9 h PHE 3341Ca -0.44 0.00 -0.68 0.00 2.81 0.00 0.00 57.97 59.65 1mx9 h PHE 3341Cb 1.23 0.00 -0.18 0.00 3.61 0.00 0.00 35.95 40.61 1mx9 h PHE 3341CO 0.70 0.74 -0.07 -1.58 -1.61 0.00 0.00 178.31 176.49 1mx9 s HIS 3342N -2.82 3.12 0.22 -0.55 2.46 -1.26 -5.02 115.29 111.44 1mx9 s HIS 3342Ca -0.00 -0.34 0.10 0.00 0.47 0.00 0.00 55.06 55.28 1mx9 s HIS 3342Cb 0.09 -3.16 -0.05 0.00 -0.13 0.00 0.00 32.58 29.33 1mx9 s HIS 3342CO 0.80 -0.82 -0.19 0.95 -2.47 0.00 0.00 174.74 173.02 1mx9 s THR 3343N 2.41 2.08 0.06 0.89 -4.23 -1.26 -5.12 115.64 110.46 1mx9 s THR 3343Ca 0.15 -2.17 -0.05 0.00 -1.18 0.00 0.00 61.69 58.44 1mx9 s THR 3343Cb -0.17 -2.08 -0.02 0.00 1.34 0.00 0.00 72.50 71.57 1mx9 s THR 3343CO 0.15 -0.39 0.07 0.68 -0.54 0.00 0.00 174.62 174.58 1mx9 s VAL 3344N -2.40 0.17 0.36 2.29 -7.23 -1.26 -5.04 120.40 107.29 1mx9 s VAL 3344Ca 0.23 -1.41 -0.28 0.00 -1.81 0.00 0.00 61.98 58.71 1mx9 s VAL 3344Cb -0.04 -1.28 -0.11 0.00 0.56 0.00 0.00 36.38 35.51 1mx9 s VAL 3344CO 0.10 -0.78 1.51 -2.65 -0.31 0.00 0.00 175.10 172.97 1mx9 n PRO 3345N 0.25 2.66 -3.96 4.82 -0.02 -1.26 -4.50 135.00 132.99 1mx9 n PRO 3345Ca -0.16 0.94 -0.20 0.00 -2.02 0.00 0.00 63.50 62.06 1mx9 n PRO 3345Cb 0.61 -2.67 -0.17 0.00 -0.02 0.00 0.00 33.50 31.25 1mx9 n PRO 3345CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1mx9 s TYR 3346N -0.86 0.58 -0.23 6.00 6.04 -0.67 -0.73 117.35 127.47 1mx9 s TYR 3346Ca 0.56 -0.12 -0.05 0.00 0.04 0.00 0.00 57.07 57.50 1mx9 s TYR 3346Cb -0.48 -0.62 -0.01 0.00 -1.04 0.00 0.00 41.96 39.80 1mx9 s TYR 3346CO 0.60 -0.21 -0.00 1.41 -1.54 0.00 0.00 175.55 175.81 1mx9 s MET 3347N 1.29 3.46 -0.18 4.97 -2.45 0.47 -1.66 119.30 125.20 1mx9 s MET 3347Ca -0.06 -0.58 0.01 0.00 -1.25 0.00 0.00 55.69 53.81 1mx9 s MET 3347Cb -0.13 -3.13 0.03 0.00 1.25 0.00 0.00 34.83 32.85 1mx9 s MET 3347CO -0.02 -0.20 -0.15 0.08 1.05 0.00 0.00 175.02 175.78 1mx9 s VAL 3348N 1.53 1.78 0.29 10.11 1.01 0.20 0.73 120.40 136.04 1mx9 s VAL 3348Ca 0.06 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.17 1mx9 s VAL 3348Cb -0.15 -1.71 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 1mx9 s VAL 3348CO -0.01 0.37 0.10 -0.83 0.00 0.00 0.00 175.10 174.73 1mx9 s GLY 3349N 1.38 1.90 0.07 4.51 0.00 -0.95 -3.39 107.32 110.84 1mx9 s GLY 3349Ca 0.02 -1.86 -0.10 0.00 0.00 0.00 0.00 44.72 42.79 1mx9 s GLY 3349CO -0.10 -1.65 0.21 -0.26 0.00 0.00 0.00 173.10 171.30 1mx9 s ILE 3350N -3.61 0.12 0.28 0.90 -4.36 -0.53 -1.42 121.20 112.58 1mx9 s ILE 3350Ca 0.36 -1.01 -0.04 0.00 -0.26 0.00 0.00 60.65 59.70 1mx9 s ILE 3350Cb 0.07 -1.16 -0.05 0.00 1.25 0.00 0.00 42.46 42.57 1mx9 s ILE 3350CO 0.15 -0.56 0.53 0.20 0.24 0.00 0.00 174.94 175.50 1mx9 s ASN 3351N -2.54 6.42 0.22 4.36 0.02 -1.26 -0.61 114.94 121.55 1mx9 s ASN 3351Ca 0.01 0.65 -0.08 0.00 -1.02 0.00 0.00 52.86 52.42 1mx9 s ASN 3351Cb 0.02 -2.12 0.35 0.00 0.02 0.00 0.00 41.25 39.53 1mx9 s ASN 3351CO -0.08 -0.18 1.73 0.50 0.02 0.00 0.00 177.10 179.08 1mx9 h LYS 3352N 1.66 0.37 -2.84 -0.60 1.63 -0.08 -3.30 116.57 113.40 1mx9 h LYS 3352Ca -0.48 -0.02 -0.61 0.00 -0.85 0.00 0.00 60.65 58.69 1mx9 h LYS 3352Cb 1.19 -0.08 -0.41 0.00 -0.60 0.00 0.00 32.23 32.33 1mx9 h LYS 3352CO 0.66 0.25 -0.70 1.04 -3.45 0.00 0.00 179.45 177.25 1mx9 n GLN 3353N -5.03 1.35 -0.23 1.90 6.02 0.22 -4.96 117.38 116.64 1mx9 n GLN 3353Ca 0.11 -4.09 -0.02 0.00 -0.01 0.00 0.00 57.00 52.99 1mx9 n GLN 3353Cb 0.34 -2.09 0.18 0.00 1.02 0.00 0.00 30.24 29.68 1mx9 n GLN 3353CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1mx9 h GLU 3354N 5.41 1.04 -0.94 -1.09 4.39 -1.65 -1.58 114.58 120.17 1mx9 h GLU 3354Ca 0.19 -0.12 -0.53 0.00 0.34 0.00 0.00 59.36 59.24 1mx9 h GLU 3354Cb 0.80 -0.20 -0.29 0.00 -0.10 0.00 0.00 28.75 28.96 1mx9 h GLU 3354CO 0.61 0.78 0.61 0.34 -1.16 0.00 0.00 179.01 180.19 1mx9 n PHE 3355N -4.35 2.93 0.22 4.33 -0.00 -1.26 -3.83 117.46 115.51 1mx9 n PHE 3355Ca 0.07 -2.11 -0.09 0.00 -0.00 0.00 0.00 57.45 55.32 1mx9 n PHE 3355Cb 0.11 -1.01 -0.04 0.00 -0.00 0.00 0.00 39.48 38.54 1mx9 n PHE 3355CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 1mx9 h GLY 3356N 1.25 -0.61 0.00 7.13 0.00 -1.61 -3.45 103.07 105.79 1mx9 h GLY 3356Ca 0.59 0.23 0.00 0.00 0.00 0.00 0.00 47.33 48.15 1mx9 h GLY 3356CO 1.15 -0.22 0.00 1.87 0.00 0.00 0.00 176.54 179.34 1mx9 n TRP 3357N -3.91 -2.74 -0.35 5.60 -0.00 -1.26 -4.90 117.44 109.88 1mx9 n TRP 3357Ca -0.07 0.64 -0.05 0.00 -0.00 0.00 0.00 57.50 58.02 1mx9 n TRP 3357Cb 0.23 1.33 -0.01 0.00 -0.00 0.00 0.00 31.31 32.86 1mx9 n TRP 3357CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 177.69 178.94 1mx9 h LEU 3358N 0.00 -1.60 0.60 5.87 5.85 -1.89 -0.22 115.31 123.91 1mx9 h LEU 3358Ca 0.00 0.30 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 1mx9 h LEU 3358Cb 0.00 0.78 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 1mx9 h LEU 3358CO 0.00 -0.28 -0.39 0.40 -0.34 0.00 0.00 178.44 177.82 1mx9 h ILE 3359N -0.05 0.21 -0.83 4.05 2.04 -1.92 -1.17 117.51 119.83 1mx9 h ILE 3359Ca 0.27 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.20 1mx9 h ILE 3359Cb 0.55 0.21 -0.06 0.00 -0.74 0.00 0.00 36.82 36.77 1mx9 h ILE 3359CO -0.90 0.00 0.50 -0.65 0.00 0.00 0.00 178.15 177.10 1mx9 h PRO 3360N -0.94 0.87 0.17 2.37 0.11 -1.80 -1.59 132.00 131.18 1mx9 h PRO 3360Ca -0.07 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1mx9 h PRO 3360Cb 0.77 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.65 1mx9 h PRO 3360CO 0.06 0.57 -0.42 1.98 -0.21 0.00 0.00 178.00 179.98 1mx9 h MET 3361N 0.89 -0.63 -0.31 1.05 -1.53 -0.85 -1.73 114.93 111.81 1mx9 h MET 3361Ca 0.38 0.04 0.09 0.00 -3.44 0.00 0.00 59.70 56.77 1mx9 h MET 3361Cb 0.23 0.14 -0.01 0.00 -0.55 0.00 0.00 31.60 31.41 1mx9 h MET 3361CO -0.20 -0.42 0.25 -0.07 0.14 0.00 0.00 176.91 176.62 1mx9 h LEU 3363N -0.65 0.00 -1.48 3.39 3.38 -0.81 -2.31 115.31 116.82 1mx9 h LEU 3363Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1mx9 h LEU 3363Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1mx9 h LEU 3363CO -0.19 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.57 1mx9 n MET 3364N -4.22 1.99 -3.66 1.13 2.81 -0.64 -4.76 117.12 109.77 1mx9 n MET 3364Ca 0.05 -1.47 -0.25 0.00 -1.81 0.00 0.00 57.70 54.22 1mx9 n MET 3364Cb 0.42 -1.45 0.07 0.00 -0.71 0.00 0.00 33.22 31.55 1mx9 n MET 3364CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1mx9 n SER 3365N 0.71 -5.67 -4.75 7.83 7.64 -0.72 -2.36 113.62 116.31 1mx9 n SER 3365Ca 0.17 -0.60 -0.41 0.00 1.01 0.00 0.00 58.87 59.03 1mx9 n SER 3365Cb 0.44 -4.76 -0.02 0.00 -1.01 0.00 0.00 64.21 58.85 1mx9 n SER 3365CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1mx9 s TYR 3366N -3.33 2.88 -1.11 1.43 5.04 -0.81 -4.69 117.35 116.76 1mx9 s TYR 3366Ca 0.56 0.96 -0.13 0.00 -2.44 0.00 0.00 57.07 56.02 1mx9 s TYR 3366Cb -0.25 -3.93 -0.07 0.00 0.35 0.00 0.00 41.96 38.05 1mx9 s TYR 3366CO 0.75 -3.03 2.24 -2.30 -1.34 0.00 0.00 175.55 171.87 1mx9 n PRO 3367N 2.04 2.36 -4.06 4.97 -0.02 -1.26 -4.88 135.00 134.14 1mx9 n PRO 3367Ca 0.06 -1.92 -0.22 0.00 -2.02 0.00 0.00 63.50 59.40 1mx9 n PRO 3367Cb 0.39 -2.81 -0.17 0.00 -0.02 0.00 0.00 33.50 30.89 1mx9 n PRO 3367CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1mx9 s LEU 3368N 0.82 1.15 -0.05 2.45 1.43 -1.26 -4.97 118.68 118.25 1mx9 s LEU 3368Ca 0.52 -0.15 0.09 0.00 -1.03 0.00 0.00 54.13 53.55 1mx9 s LEU 3368Cb 0.14 -0.53 0.17 0.00 0.03 0.00 0.00 46.19 46.00 1mx9 s LEU 3368CO -0.01 -0.09 1.11 -1.54 0.23 0.00 0.00 176.35 176.05 1mx9 n SER 3369N 4.42 -0.46 -3.69 2.29 3.41 -1.26 -5.09 113.62 113.24 1mx9 n SER 3369Ca -0.19 -2.02 -0.14 0.00 -0.26 0.00 0.00 58.87 56.26 1mx9 n SER 3369Cb 0.51 0.16 -0.14 0.00 -0.26 0.00 0.00 64.21 64.48 1mx9 n SER 3369CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1mx9 s GLU 3370N -0.15 0.12 0.00 4.33 0.41 -1.26 -5.01 118.70 117.14 1mx9 s GLU 3370Ca 0.10 0.60 0.08 0.00 -0.41 0.00 0.00 54.97 55.34 1mx9 s GLU 3370Cb 0.16 -0.14 0.39 0.00 -1.78 0.00 0.00 34.13 32.76 1mx9 s GLU 3370CO -0.06 -0.25 1.11 0.41 -0.49 0.00 0.00 175.26 175.98 1mx9 n GLY 3371N 4.94 -0.54 3.75 -1.39 0.00 -1.26 -4.62 105.19 106.07 1mx9 n GLY 3371Ca -0.13 -0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 1mx9 n GLY 3371CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1mx9 s GLN 3372N -2.57 2.65 -0.30 1.61 1.11 -1.26 -3.64 119.66 117.26 1mx9 s GLN 3372Ca 0.07 -1.23 -0.08 0.00 0.01 0.00 0.00 55.36 54.13 1mx9 s GLN 3372Cb 0.05 -2.38 0.18 0.00 -1.01 0.00 0.00 33.01 29.85 1mx9 s GLN 3372CO 0.12 0.35 0.86 -1.17 0.01 0.00 0.00 175.29 175.46 1mx9 s LEU 3373N -3.79 -0.86 0.71 2.90 2.96 -1.01 -4.88 118.68 114.71 1mx9 s LEU 3373Ca 0.33 0.56 -0.11 0.00 -0.22 0.00 0.00 54.13 54.69 1mx9 s LEU 3373Cb -0.07 1.73 0.02 0.00 0.50 0.00 0.00 46.19 48.37 1mx9 s LEU 3373CO 0.23 -0.16 1.08 1.51 -1.32 0.00 0.00 176.35 177.69 1mx9 s ASP 3374N 2.90 5.34 0.57 3.68 -4.77 -1.26 -4.52 116.67 118.61 1mx9 s ASP 3374Ca 0.08 1.25 0.35 0.00 -3.30 0.00 0.00 52.55 50.94 1mx9 s ASP 3374Cb -0.12 -2.08 1.59 0.00 -1.09 0.00 0.00 42.92 41.22 1mx9 s ASP 3374CO -0.15 -1.42 2.07 1.56 0.70 0.00 0.00 175.17 177.93 1mx9 h GLN 3375N -0.71 0.00 -0.04 2.11 4.20 -1.99 -2.07 115.11 116.62 1mx9 h GLN 3375Ca -0.45 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.19 1mx9 h GLN 3375Cb 1.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 1mx9 h GLN 3375CO 0.62 0.02 -0.26 -0.22 -0.67 0.00 0.00 178.83 178.32 1mx9 h LYS 3376N 0.00 0.25 0.00 1.46 3.64 -2.00 -2.70 116.57 117.22 1mx9 h LYS 3376Ca -0.00 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 59.10 1mx9 h LYS 3376Cb 0.40 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 1mx9 h LYS 3376CO 0.00 0.87 -0.31 1.15 -2.27 0.00 0.00 179.45 178.89 1mx9 h THR 3377N -0.30 0.84 -0.34 1.00 2.02 -1.90 -2.74 112.91 111.49 1mx9 h THR 3377Ca -0.02 -1.26 -0.17 0.00 0.77 0.00 0.00 66.41 65.73 1mx9 h THR 3377Cb 0.93 1.77 -0.00 0.00 -1.74 0.00 0.00 68.15 69.10 1mx9 h THR 3377CO 0.05 0.30 -0.44 0.00 0.37 0.00 0.00 175.52 175.81 1mx9 h ALA 3378N 1.69 0.58 -0.05 6.16 0.00 -1.39 -2.22 119.26 124.02 1mx9 h ALA 3378Ca -0.00 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 1mx9 h ALA 3378Cb 0.74 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1mx9 h ALA 3378CO 0.04 0.68 -0.43 0.52 0.00 0.00 0.00 179.25 180.05 1mx9 h MET 3379N 0.70 0.12 -0.11 0.00 2.07 -1.23 -0.79 114.93 115.68 1mx9 h MET 3379Ca 0.04 -0.06 -0.20 0.00 -2.07 0.00 0.00 59.70 57.41 1mx9 h MET 3379Cb 1.03 -0.00 0.01 0.00 -1.87 0.00 0.00 31.60 30.77 1mx9 h MET 3379CO 0.10 0.54 -0.72 0.77 1.07 0.00 0.00 176.91 178.67 1mx9 h SER 3380N 0.10 0.83 -0.27 1.22 0.02 -1.38 -2.88 113.55 111.19 1mx9 h SER 3380Ca 0.01 -0.65 -0.18 0.00 -0.84 0.00 0.00 61.79 60.13 1mx9 h SER 3380Cb 0.81 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 1mx9 h SER 3380CO 0.06 1.35 -0.51 -0.07 -1.14 0.00 0.00 176.83 176.52 1mx9 h LEU 3381N 0.37 0.94 -1.38 5.07 3.38 -1.31 -1.81 115.31 120.56 1mx9 h LEU 3381Ca -0.06 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.37 1mx9 h LEU 3381Cb 1.36 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1mx9 h LEU 3381CO 0.15 1.28 -0.20 0.25 0.09 0.00 0.00 178.44 180.00 1mx9 h LEU 3382N 0.66 0.15 -0.02 1.67 5.85 -1.21 0.84 115.31 123.26 1mx9 h LEU 3382Ca 0.02 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1mx9 h LEU 3382Cb 1.11 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1mx9 h LEU 3382CO 0.11 0.37 -0.04 -0.25 -0.34 0.00 0.00 178.44 178.29 1mx9 h TRP 3383N 0.15 0.07 0.00 1.25 -0.00 -1.35 -2.98 115.95 113.09 1mx9 h TRP 3383Ca 0.03 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1mx9 h TRP 3383Cb 0.45 -0.01 -0.00 0.00 -0.00 0.00 0.00 29.16 29.59 1mx9 h TRP 3383CO 0.00 0.62 -0.00 0.87 -0.00 0.00 0.00 178.44 179.93 1mx9 h LYS 3384N -0.50 0.00 -0.18 2.65 1.79 -0.88 0.81 116.57 120.26 1mx9 h LYS 3384Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1mx9 h LYS 3384Cb 0.61 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 1mx9 h LYS 3384CO 0.01 0.00 0.00 0.43 -1.08 0.00 0.00 179.45 178.81 1mx9 n SER 3385N -3.77 1.11 -0.37 0.86 7.64 0.25 -4.48 113.62 114.86 1mx9 n SER 3385Ca -0.03 -1.89 0.02 0.00 1.01 0.00 0.00 58.87 57.99 1mx9 n SER 3385Cb 0.08 -0.12 0.08 0.00 -1.01 0.00 0.00 64.21 63.24 1mx9 n SER 3385CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1mx9 h TYR 3386N 1.27 -0.84 -0.03 1.43 3.20 -0.75 0.69 116.97 121.94 1mx9 h TYR 3386Ca 0.00 0.10 0.01 0.00 3.14 0.00 0.00 58.73 61.98 1mx9 h TYR 3386Cb 0.29 0.52 -0.00 0.00 1.54 0.00 0.00 36.73 39.07 1mx9 h TYR 3386CO 0.12 -0.42 0.08 -1.00 -1.64 0.00 0.00 178.16 175.31 1mx9 h PRO 3387N -0.00 0.00 0.06 1.82 0.13 -1.79 1.37 132.00 133.59 1mx9 h PRO 3387Ca 0.41 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.38 1mx9 h PRO 3387Cb 0.66 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.78 1mx9 h PRO 3387CO -1.01 0.00 -0.78 -0.07 -0.23 0.00 0.00 178.00 175.91 1mx9 h LEU 3388N 0.00 0.21 0.00 1.56 3.38 0.02 -3.39 115.31 117.08 1mx9 h LEU 3388Ca 0.02 -0.86 -0.15 0.00 0.09 0.00 0.00 57.88 56.97 1mx9 h LEU 3388Cb 0.18 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1mx9 h LEU 3388CO -0.00 1.34 -1.82 1.33 0.09 0.00 0.00 178.44 179.38 1mx9 n VAL 3389N -4.29 0.57 -3.21 1.22 0.24 -0.77 -4.46 118.33 107.62 1mx9 n VAL 3389Ca -0.19 -0.48 -0.15 0.00 -2.04 0.00 0.00 64.34 61.48 1mx9 n VAL 3389Cb 0.70 -0.33 0.07 0.00 -1.47 0.00 0.00 33.84 32.81 1mx9 n VAL 3389CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1mx9 s ILE 3391N -3.38 3.47 0.43 0.00 1.01 -1.26 -5.07 121.20 116.40 1mx9 s ILE 3391Ca 0.44 -0.47 -0.24 0.00 0.00 0.00 0.00 60.65 60.38 1mx9 s ILE 3391Cb -0.06 -2.57 -0.10 0.00 0.01 0.00 0.00 42.46 39.74 1mx9 s ILE 3391CO 0.72 0.43 1.09 0.00 0.00 0.00 0.00 174.94 177.19 1mx9 n ALA 3392N 4.62 0.54 0.07 9.38 0.00 -1.26 -4.83 120.51 129.03 1mx9 n ALA 3392Ca -0.18 0.23 0.16 0.00 0.00 0.00 0.00 53.44 53.66 1mx9 n ALA 3392Cb 0.51 -2.14 0.67 0.00 0.00 0.00 0.00 19.45 18.49 1mx9 n ALA 3392CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1mx9 h LYS 3393N 1.66 0.01 0.00 0.00 3.64 -1.99 -1.67 116.57 118.22 1mx9 h LYS 3393Ca -0.46 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.90 1mx9 h LYS 3393Cb 1.33 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1mx9 h LYS 3393CO 0.58 0.01 -0.10 1.05 -2.27 0.00 0.00 179.45 178.71 1mx9 h GLU 3394N 0.01 0.00 0.00 1.90 9.09 -2.03 -3.14 114.58 120.41 1mx9 h GLU 3394Ca 0.18 0.00 -0.26 0.00 0.05 0.00 0.00 59.36 59.33 1mx9 h GLU 3394Cb 0.71 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.76 1mx9 h GLU 3394CO -0.00 0.10 -1.74 1.28 0.05 0.00 0.00 179.01 178.70 1mx9 n LEU 3395N -3.27 0.69 -0.34 3.06 4.77 -0.64 -4.58 117.00 116.70 1mx9 n LEU 3395Ca 0.00 0.32 -0.05 0.00 -0.03 0.00 0.00 56.01 56.25 1mx9 n LEU 3395Cb 0.34 0.19 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 1mx9 n LEU 3395CO 0.30 0.32 0.46 -0.38 -1.33 0.00 0.00 177.39 176.76 1mx9 n ILE 3396N -2.92 -0.51 -0.16 -0.08 2.08 -1.16 -0.62 119.36 115.99 1mx9 n ILE 3396Ca -0.17 2.04 -0.02 0.00 0.56 0.00 0.00 62.75 65.16 1mx9 n ILE 3396Cb 0.99 -2.61 0.06 0.00 -0.75 0.00 0.00 39.64 37.33 1mx9 n ILE 3396CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 1mx9 h PRO 3397N 0.00 0.10 -0.49 0.38 0.11 -1.81 0.73 132.00 131.03 1mx9 h PRO 3397Ca 0.23 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.31 1mx9 h PRO 3397Cb 0.44 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 1mx9 h PRO 3397CO -0.83 0.07 0.25 1.49 -0.21 0.00 0.00 178.00 178.77 1mx9 h GLU 3398N 0.11 0.69 -0.53 1.05 4.81 -1.15 -1.85 114.58 117.70 1mx9 h GLU 3398Ca 0.26 -0.09 -0.10 0.00 -0.13 0.00 0.00 59.36 59.30 1mx9 h GLU 3398Cb 0.39 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1mx9 h GLU 3398CO -0.43 0.56 -0.05 0.00 -0.73 0.00 0.00 179.01 178.36 1mx9 h ALA 3399N 1.09 0.71 -0.51 2.92 0.00 -0.65 -2.21 119.26 120.62 1mx9 h ALA 3399Ca 0.17 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1mx9 h ALA 3399Cb 0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1mx9 h ALA 3399CO -0.02 0.58 0.07 1.15 0.00 0.00 0.00 179.25 181.03 1mx9 h THR 3400N 0.83 1.25 -0.07 0.00 2.02 -0.74 -2.98 112.91 113.22 1mx9 h THR 3400Ca 0.14 -0.96 -0.00 0.00 0.77 0.00 0.00 66.41 66.36 1mx9 h THR 3400Cb 0.60 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 1mx9 h THR 3400CO 0.04 0.34 0.03 -0.08 0.37 0.00 0.00 175.52 176.21 1mx9 h GLU 3401N 0.73 0.11 -1.10 6.66 4.57 -1.33 0.85 114.58 125.06 1mx9 h GLU 3401Ca 0.15 -0.02 0.31 0.00 -1.18 0.00 0.00 59.36 58.62 1mx9 h GLU 3401Cb 0.42 -0.02 -0.11 0.00 -0.16 0.00 0.00 28.75 28.88 1mx9 h GLU 3401CO 0.01 0.26 0.70 -0.22 -1.18 0.00 0.00 179.01 178.57 1mx9 h LYS 3402N -0.06 0.31 0.00 1.92 1.63 -1.30 -1.21 116.57 117.87 1mx9 h LYS 3402Ca 0.02 -0.02 -0.17 0.00 -0.85 0.00 0.00 60.65 59.63 1mx9 h LYS 3402Cb 0.19 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.72 1mx9 h LYS 3402CO -0.00 0.21 -1.36 0.66 -3.45 0.00 0.00 179.45 175.50 1mx9 n TYR 3403N -4.71 0.40 -0.04 1.91 4.02 -1.07 -4.75 117.16 112.92 1mx9 n TYR 3403Ca 0.29 0.18 -0.14 0.00 -0.01 0.00 0.00 57.90 58.21 1mx9 n TYR 3403Cb 1.02 -0.81 -0.11 0.00 -0.02 0.00 0.00 39.34 39.42 1mx9 n TYR 3403CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1mx9 h LEU 3404N -1.00 0.10 -0.80 7.72 3.38 -0.82 -3.32 115.31 120.58 1mx9 h LEU 3404Ca -0.26 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 56.96 1mx9 h LEU 3404Cb 1.11 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1mx9 h LEU 3404CO -0.16 0.84 0.00 0.61 0.09 0.00 0.00 178.44 179.83 1mx9 n GLY 3405N 0.96 0.00 0.11 0.83 0.00 -0.46 -2.32 105.19 104.31 1mx9 n GLY 3405Ca -0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 1mx9 n GLY 3405CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1mx9 h GLY 3406N 0.61 0.20 -2.21 -0.02 0.00 -1.73 -3.48 103.07 96.44 1mx9 h GLY 3406Ca 0.00 -0.52 -0.51 0.00 0.00 0.00 0.00 47.33 46.30 1mx9 h GLY 3406CO 0.00 0.45 -0.68 -0.51 0.00 0.00 0.00 176.54 175.80 1mx9 s THR 3407N -2.42 1.75 -0.08 4.70 -4.23 -0.98 -5.04 115.64 109.34 1mx9 s THR 3407Ca -0.21 -2.15 0.14 0.00 -1.18 0.00 0.00 61.69 58.30 1mx9 s THR 3407Cb 0.03 -2.45 -0.13 0.00 1.34 0.00 0.00 72.50 71.30 1mx9 s THR 3407CO 0.73 -0.31 0.96 0.44 -0.54 0.00 0.00 174.62 175.91 1mx9 h ASP 3408N 2.26 0.00 -1.07 3.99 3.32 -1.93 -3.46 116.42 119.53 1mx9 h ASP 3408Ca -0.40 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.01 1mx9 h ASP 3408Cb 1.24 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 1mx9 h ASP 3408CO 0.67 0.71 1.46 -0.67 -1.72 0.00 0.00 179.24 179.69 1mx9 n ASP 3409N -3.04 2.04 0.19 6.45 -0.08 -1.26 -4.82 116.55 116.04 1mx9 n ASP 3409Ca -0.08 0.31 0.03 0.00 -1.51 0.00 0.00 54.79 53.55 1mx9 n ASP 3409Cb 0.88 -1.27 0.40 0.00 2.34 0.00 0.00 41.12 43.46 1mx9 n ASP 3409CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1mx9 h THR 3410N 7.21 1.23 -0.00 5.18 1.35 -1.89 -0.46 112.91 125.52 1mx9 h THR 3410Ca -0.26 -1.09 -0.17 0.00 -0.55 0.00 0.00 66.41 64.34 1mx9 h THR 3410Cb 1.31 1.58 -0.02 0.00 -1.73 0.00 0.00 68.15 69.30 1mx9 h THR 3410CO 1.05 0.31 -0.78 0.58 -0.25 0.00 0.00 175.52 176.43 1mx9 h VAL 3411N 0.00 1.52 0.00 6.82 2.07 -1.88 -2.45 116.25 122.34 1mx9 h VAL 3411Ca -0.00 -2.57 -0.04 0.00 0.82 0.00 0.00 66.70 64.91 1mx9 h VAL 3411Cb 0.56 2.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 1mx9 h VAL 3411CO 0.04 0.74 -0.17 0.50 0.02 0.00 0.00 177.57 178.70 1mx9 h LYS 3412N 0.04 0.00 0.00 1.57 3.64 -1.70 -3.11 116.57 117.01 1mx9 h LYS 3412Ca -0.02 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 1mx9 h LYS 3412Cb 1.38 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.19 1mx9 h LYS 3412CO 0.11 0.17 -0.40 0.87 -2.27 0.00 0.00 179.45 177.94 1mx9 h LYS 3413N 0.00 0.00 0.14 1.90 1.57 -0.64 -2.97 116.57 116.58 1mx9 h LYS 3413Ca -0.00 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.55 1mx9 h LYS 3413Cb 1.02 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.34 1mx9 h LYS 3413CO 0.02 0.40 -1.06 1.57 -0.57 0.00 0.00 179.45 179.81 1mx9 h LYS 3414N 0.00 0.30 -0.75 3.15 5.09 -1.47 -2.89 116.57 120.01 1mx9 h LYS 3414Ca -0.00 -0.51 0.18 0.00 0.09 0.00 0.00 60.65 60.40 1mx9 h LYS 3414Cb 0.74 0.19 -0.04 0.00 0.10 0.00 0.00 32.23 33.22 1mx9 h LYS 3414CO 0.05 1.25 0.52 -0.44 -2.09 0.00 0.00 179.45 178.73 1mx9 h ASP 3415N -0.31 0.21 -0.14 7.07 5.19 -1.55 0.42 116.42 127.31 1mx9 h ASP 3415Ca -0.20 0.02 -0.22 0.00 -0.62 0.00 0.00 57.03 56.01 1mx9 h ASP 3415Cb 1.72 -0.03 0.01 0.00 0.18 0.00 0.00 39.33 41.22 1mx9 h ASP 3415CO 0.13 0.10 -0.74 -0.07 -3.12 0.00 0.00 179.24 175.54 1mx9 h LEU 3416N 0.22 0.92 -0.33 1.55 3.38 -1.57 -2.32 115.31 117.16 1mx9 h LEU 3416Ca 0.37 -0.58 0.04 0.00 0.09 0.00 0.00 57.88 57.79 1mx9 h LEU 3416Cb 1.12 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.56 1mx9 h LEU 3416CO -0.08 1.38 0.10 0.15 0.09 0.00 0.00 178.44 180.08 1mx9 h PHE 3417N 0.54 0.17 0.00 1.13 3.57 -0.03 0.37 116.94 122.69 1mx9 h PHE 3417Ca -0.04 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1mx9 h PHE 3417Cb 1.36 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 40.07 1mx9 h PHE 3417CO 0.08 0.07 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.14 1mx9 h LEU 3418N 0.23 0.00 0.17 0.59 3.38 -0.94 -1.84 115.31 116.90 1mx9 h LEU 3418Ca 0.15 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.81 1mx9 h LEU 3418Cb 0.14 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.90 1mx9 h LEU 3418CO -0.17 0.02 -1.43 0.44 0.09 0.00 0.00 178.44 177.40 1mx9 h ASP 3419N 0.00 0.56 -0.10 -0.43 3.32 0.19 -3.03 116.42 116.93 1mx9 h ASP 3419Ca -0.00 -0.65 -0.01 0.00 0.02 0.00 0.00 57.03 56.40 1mx9 h ASP 3419Cb 0.11 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 1mx9 h ASP 3419CO 0.00 1.52 0.04 0.17 -1.72 0.00 0.00 179.24 179.25 1mx9 h LEU 3420N 0.10 0.13 -0.28 1.55 8.10 -0.05 -0.58 115.31 124.29 1mx9 h LEU 3420Ca -0.21 -0.16 0.07 0.00 0.11 0.00 0.00 57.88 57.68 1mx9 h LEU 3420Cb 2.05 -0.04 -0.08 0.00 -0.44 0.00 0.00 40.66 42.16 1mx9 h LEU 3420CO 0.21 0.26 -0.32 0.40 -4.11 0.00 0.00 178.44 174.89 1mx9 h ILE 3421N 0.00 0.26 -0.29 0.15 1.08 -1.56 0.28 117.51 117.43 1mx9 h ILE 3421Ca 0.03 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 1mx9 h ILE 3421Cb 0.17 0.26 -0.01 0.00 -3.07 0.00 0.00 36.82 34.17 1mx9 h ILE 3421CO -0.00 0.00 0.19 0.00 -0.69 0.00 0.00 178.15 177.65 1mx9 h ALA 3422N 0.62 1.79 -0.22 1.87 0.00 -1.38 0.10 119.26 122.03 1mx9 h ALA 3422Ca 0.14 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1mx9 h ALA 3422Cb 0.53 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1mx9 h ALA 3422CO -0.45 0.20 -0.20 -0.44 0.00 0.00 0.00 179.25 178.35 1mx9 h ASP 3423N 0.40 0.55 0.86 0.00 3.32 0.63 -1.01 116.42 121.17 1mx9 h ASP 3423Ca 0.11 -0.47 -0.04 0.00 0.02 0.00 0.00 57.03 56.65 1mx9 h ASP 3423Cb -0.04 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1mx9 h ASP 3423CO -0.02 0.90 -0.18 0.58 -1.72 0.00 0.00 179.24 178.80 1mx9 h VAL 3424N 0.20 0.48 0.02 -1.35 2.07 0.23 0.08 116.25 117.98 1mx9 h VAL 3424Ca 0.04 -0.96 -0.38 0.00 0.82 0.00 0.00 66.70 66.21 1mx9 h VAL 3424Cb 0.74 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 32.13 1mx9 h VAL 3424CO 0.05 0.18 -2.20 0.23 0.02 0.00 0.00 177.57 175.85 1mx9 n MET 3425N -3.38 0.64 -0.01 1.57 2.81 -0.05 -4.69 117.12 114.01 1mx9 n MET 3425Ca -0.00 0.28 -0.02 0.00 -1.81 0.00 0.00 57.70 56.15 1mx9 n MET 3425Cb 0.39 -1.59 -0.01 0.00 -0.71 0.00 0.00 33.22 31.30 1mx9 n MET 3425CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1mx9 n PHE 3426N -3.84 0.00 0.00 2.03 3.01 -0.49 -4.53 117.46 113.64 1mx9 n PHE 3426Ca -0.44 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.02 1mx9 n PHE 3426Cb 0.91 -0.08 0.00 0.00 -0.01 0.00 0.00 39.48 40.30 1mx9 n PHE 3426CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1mx9 n GLY 3427N 2.86 -1.60 0.36 1.37 0.00 -0.59 0.49 105.19 108.08 1mx9 n GLY 3427Ca -0.04 0.11 -0.04 0.00 0.00 0.00 0.00 46.02 46.05 1mx9 n GLY 3427CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1mx9 n VAL 3428N -0.18 -0.53 -0.17 1.61 0.31 0.01 0.40 118.33 119.77 1mx9 n VAL 3428Ca 0.00 2.17 -0.01 0.00 -0.01 0.00 0.00 64.34 66.49 1mx9 n VAL 3428Cb 0.00 -2.81 0.08 0.00 -0.91 0.00 0.00 33.84 30.20 1mx9 n VAL 3428CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1mx9 h PRO 3429N 0.00 0.20 0.15 5.55 0.11 -1.71 -1.32 132.00 134.98 1mx9 h PRO 3429Ca 0.26 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.36 1mx9 h PRO 3429Cb 0.49 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 1mx9 h PRO 3429CO -0.90 0.13 -0.12 0.77 -0.21 0.00 0.00 178.00 177.67 1mx9 h SER 3430N 0.20 -0.31 -0.37 -2.05 0.02 0.50 -2.23 113.55 109.30 1mx9 h SER 3430Ca 0.27 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.23 1mx9 h SER 3430Cb 0.39 0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 1mx9 h SER 3430CO -0.38 -0.19 0.17 0.58 -1.14 0.00 0.00 176.83 175.87 1mx9 h VAL 3431N -0.29 1.16 0.33 2.27 2.07 -0.94 -1.02 116.25 119.84 1mx9 h VAL 3431Ca -0.01 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 1mx9 h VAL 3431Cb 0.26 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1mx9 h VAL 3431CO -0.01 0.20 -0.16 0.40 0.02 0.00 0.00 177.57 178.01 1mx9 h ILE 3432N 0.60 0.69 -0.75 4.57 2.04 -1.01 0.19 117.51 123.85 1mx9 h ILE 3432Ca 0.15 -0.33 0.13 0.00 1.00 0.00 0.00 64.86 65.80 1mx9 h ILE 3432Cb 0.12 0.87 -0.09 0.00 -0.74 0.00 0.00 36.82 36.98 1mx9 h ILE 3432CO -0.01 0.07 0.32 0.58 0.00 0.00 0.00 178.15 179.11 1mx9 h VAL 3433N -0.63 0.71 -0.93 1.67 2.07 -1.25 0.25 116.25 118.15 1mx9 h VAL 3433Ca -0.05 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.33 1mx9 h VAL 3433Cb 0.45 0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 1mx9 h VAL 3433CO 0.08 0.09 0.61 0.00 0.02 0.00 0.00 177.57 178.36 1mx9 h ALA 3434N 1.52 1.39 -0.11 1.67 0.00 -0.94 -1.76 119.26 121.03 1mx9 h ALA 3434Ca 0.40 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.23 1mx9 h ALA 3434Cb 0.56 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1mx9 h ALA 3434CO -0.36 0.53 -0.04 0.00 0.00 0.00 0.00 179.25 179.38 1mx9 h ARG 3435N 1.19 0.22 -0.42 0.00 3.08 0.16 -2.35 114.38 116.25 1mx9 h ARG 3435Ca 0.36 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 60.24 1mx9 h ARG 3435Cb -0.03 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1mx9 h ARG 3435CO -0.10 0.54 -0.08 -0.91 -1.07 0.00 0.00 179.97 178.35 1mx9 h ASN 3436N -0.12 0.71 -0.46 7.04 -0.26 -1.09 0.85 115.58 122.26 1mx9 h ASN 3436Ca 0.03 -0.20 -0.01 0.00 -0.56 0.00 0.00 56.30 55.56 1mx9 h ASN 3436Cb 0.47 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.52 1mx9 h ASN 3436CO 0.01 0.83 0.25 -0.74 -1.06 0.00 0.00 177.43 176.72 1mx9 h HIS 3437N 0.67 0.63 0.43 1.19 2.76 -1.33 0.10 115.15 119.60 1mx9 h HIS 3437Ca 0.12 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.27 1mx9 h HIS 3437Cb 0.53 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.27 1mx9 h HIS 3437CO 0.03 0.48 -0.39 -0.09 -1.30 0.00 0.00 177.93 176.66 1mx9 h ARG 3438N 0.60 -0.80 0.00 5.26 2.43 -0.85 -2.55 114.38 118.47 1mx9 h ARG 3438Ca 0.16 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1mx9 h ARG 3438Cb 0.06 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1mx9 h ARG 3438CO -0.03 -0.53 0.00 -0.25 -1.51 0.00 0.00 179.97 177.65 1mx9 n ASP 3439N -5.49 0.25 -0.35 -3.80 8.00 0.24 -0.94 116.55 114.45 1mx9 n ASP 3439Ca -0.11 0.58 0.14 0.00 0.71 0.00 0.00 54.79 56.11 1mx9 n ASP 3439Cb 0.39 -0.62 0.63 0.00 -0.02 0.00 0.00 41.12 41.50 1mx9 n ASP 3439CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mx9 n ALA 3440N -1.61 2.60 0.00 2.24 0.00 0.00 -4.92 120.51 118.83 1mx9 n ALA 3440Ca 0.02 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1mx9 n ALA 3440Cb 0.14 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1mx9 n ALA 3440CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mx9 n GLY 3441N 1.13 1.81 3.87 0.00 0.00 -0.12 -4.94 105.19 106.93 1mx9 n GLY 3441Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 1mx9 n GLY 3441CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mx9 s ALA 3442N -2.39 3.17 0.26 4.61 0.00 -1.13 -5.02 121.76 121.25 1mx9 s ALA 3442Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 51.96 51.56 1mx9 s ALA 3442Cb 0.00 -2.97 -0.09 0.00 0.00 0.00 0.00 23.12 20.06 1mx9 s ALA 3442CO 0.00 -0.44 1.29 -2.14 0.00 0.00 0.00 175.76 174.47 1mx9 s PRO 3443N -4.67 4.41 0.11 0.00 0.02 -1.26 -4.29 135.00 129.31 1mx9 s PRO 3443Ca 0.54 2.08 0.02 0.00 0.02 0.00 0.00 61.00 63.67 1mx9 s PRO 3443Cb -0.11 -3.15 -0.04 0.00 0.02 0.00 0.00 34.50 31.22 1mx9 s PRO 3443CO 0.44 -0.18 -0.07 0.99 -0.33 0.00 0.00 177.00 177.86 1mx9 s THR 3444N -0.48 0.79 -0.03 0.99 2.01 -1.26 -1.68 115.64 115.98 1mx9 s THR 3444Ca 0.53 -1.96 -0.20 0.00 0.31 0.00 0.00 61.69 60.37 1mx9 s THR 3444Cb -0.37 -1.73 0.04 0.00 0.01 0.00 0.00 72.50 70.45 1mx9 s THR 3444CO 0.44 -0.84 0.43 -0.31 -0.69 0.00 0.00 174.62 173.65 1mx9 s TYR 3445N -3.57 -0.34 0.27 4.92 2.02 -0.67 -1.96 117.35 118.03 1mx9 s TYR 3445Ca 0.13 0.58 0.02 0.00 -0.37 0.00 0.00 57.07 57.43 1mx9 s TYR 3445Cb 0.05 0.20 -0.04 0.00 -0.40 0.00 0.00 41.96 41.76 1mx9 s TYR 3445CO -0.03 -0.45 0.13 -1.64 -1.57 0.00 0.00 175.55 171.98 1mx9 s MET 3446N -1.19 1.48 -0.12 -0.62 -1.94 -1.26 -0.63 119.30 115.02 1mx9 s MET 3446Ca -0.12 -1.82 -0.31 0.00 -1.71 0.00 0.00 55.69 51.73 1mx9 s MET 3446Cb -0.04 -0.15 0.12 0.00 2.01 0.00 0.00 34.83 36.78 1mx9 s MET 3446CO 0.06 -0.37 1.02 1.52 -0.01 0.00 0.00 175.02 177.23 1mx9 s TYR 3447N -3.72 -0.30 -0.18 -0.03 1.13 -1.22 -2.83 117.35 110.19 1mx9 s TYR 3447Ca 0.37 0.36 -0.00 0.00 -1.41 0.00 0.00 57.07 56.39 1mx9 s TYR 3447Cb 0.06 0.49 0.05 0.00 -1.10 0.00 0.00 41.96 41.46 1mx9 s TYR 3447CO 0.15 -0.37 -0.06 -2.00 -2.51 0.00 0.00 175.55 170.77 1mx9 s GLU 3448N -2.00 1.51 -0.16 -3.49 2.12 -0.73 -1.46 118.70 114.49 1mx9 s GLU 3448Ca 0.03 -0.63 -0.25 0.00 0.36 0.00 0.00 54.97 54.47 1mx9 s GLU 3448Cb -0.01 -2.16 -0.02 0.00 0.26 0.00 0.00 34.13 32.20 1mx9 s GLU 3448CO -0.04 -0.47 0.84 0.12 -0.54 0.00 0.00 175.26 175.17 1mx9 s PHE 3449N 1.57 3.43 -0.43 5.30 5.36 0.22 -1.90 117.98 131.53 1mx9 s PHE 3449Ca -0.01 1.27 0.02 0.00 -0.96 0.00 0.00 56.93 57.26 1mx9 s PHE 3449Cb -0.16 -3.02 0.15 0.00 -0.34 0.00 0.00 43.02 39.65 1mx9 s PHE 3449CO -0.08 -0.23 0.28 -1.14 -1.46 0.00 0.00 175.22 172.60 1mx9 s GLN 3450N 2.10 1.08 0.16 10.12 0.74 0.01 0.30 119.66 134.17 1mx9 s GLN 3450Ca 0.39 -1.96 -0.18 0.00 0.05 0.00 0.00 55.36 53.66 1mx9 s GLN 3450Cb -0.17 -1.88 0.04 0.00 1.10 0.00 0.00 33.01 32.10 1mx9 s GLN 3450CO 0.13 -1.25 0.49 -0.47 -0.55 0.00 0.00 175.29 173.64 1mx9 s TYR 3451N 0.32 -0.22 -0.40 1.67 5.04 -1.26 -4.30 117.35 118.19 1mx9 s TYR 3451Ca 0.22 -0.09 0.02 0.00 -2.44 0.00 0.00 57.07 54.78 1mx9 s TYR 3451Cb -0.15 0.37 0.12 0.00 0.35 0.00 0.00 41.96 42.65 1mx9 s TYR 3451CO -0.06 -0.83 0.17 0.50 -1.34 0.00 0.00 175.55 173.98 1mx9 s ARG 3452N -3.83 1.36 0.64 4.97 3.52 -1.26 -1.60 118.95 122.75 1mx9 s ARG 3452Ca 0.06 -1.91 -0.17 0.00 -0.13 0.00 0.00 55.73 53.57 1mx9 s ARG 3452Cb 0.00 -2.70 -0.05 0.00 -1.56 0.00 0.00 34.95 30.65 1mx9 s ARG 3452CO -0.08 -1.06 0.77 -0.35 -0.81 0.00 0.00 175.30 173.77 1mx9 n PRO 3453N 3.91 0.61 -0.00 5.12 -0.04 -1.26 -4.84 135.00 138.49 1mx9 n PRO 3453Ca 0.04 0.25 0.14 0.00 -0.04 0.00 0.00 63.50 63.89 1mx9 n PRO 3453Cb 0.37 -1.99 0.78 0.00 -0.04 0.00 0.00 33.50 32.62 1mx9 n PRO 3453CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1mx9 n SER 3454N -0.51 0.13 -1.01 3.54 3.41 -1.26 -3.02 113.62 114.90 1mx9 n SER 3454Ca 0.13 -1.19 0.11 0.00 -0.26 0.00 0.00 58.87 57.66 1mx9 n SER 3454Cb 0.48 -0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.68 1mx9 n SER 3454CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1mx9 n PHE 3455N -0.83 0.42 -0.98 7.33 3.01 -1.26 -4.98 117.46 120.17 1mx9 n PHE 3455Ca 0.20 -0.21 -0.31 0.00 1.01 0.00 0.00 57.45 58.14 1mx9 n PHE 3455Cb 0.11 0.00 0.13 0.00 -0.01 0.00 0.00 39.48 39.72 1mx9 n PHE 3455CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1mx9 s SER 3456N -1.51 3.63 0.49 4.37 0.01 -1.17 -4.96 113.70 114.55 1mx9 s SER 3456Ca 0.37 2.07 -0.23 0.00 1.31 0.00 0.00 55.95 59.47 1mx9 s SER 3456Cb 0.21 -2.55 -0.07 0.00 0.21 0.00 0.00 66.02 63.83 1mx9 s SER 3456CO 0.30 -2.63 1.30 -0.55 0.41 0.00 0.00 173.24 172.07 1mx9 s SER 3457N -2.87 5.76 0.53 2.44 0.15 -1.26 -4.88 113.70 113.57 1mx9 s SER 3457Ca 0.65 2.62 0.29 0.00 0.70 0.00 0.00 55.95 60.22 1mx9 s SER 3457Cb -0.21 -2.63 1.45 0.00 -1.71 0.00 0.00 66.02 62.92 1mx9 s SER 3457CO 0.56 -1.22 2.05 0.44 1.20 0.00 0.00 173.24 176.27 1mx9 h ASP 3458N 1.91 0.00 1.03 5.45 3.32 -1.99 -1.98 116.42 124.16 1mx9 h ASP 3458Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1mx9 h ASP 3458Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1mx9 h ASP 3458CO 0.59 0.11 0.00 0.23 -1.72 0.00 0.00 179.24 178.45 1mx9 n MET 3459N -3.47 0.18 -3.03 3.56 2.81 -1.26 -4.69 117.12 111.23 1mx9 n MET 3459Ca -0.01 0.28 -0.40 0.00 -1.81 0.00 0.00 57.70 55.75 1mx9 n MET 3459Cb 0.26 -1.77 -0.05 0.00 -0.71 0.00 0.00 33.22 30.95 1mx9 n MET 3459CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 1mx9 s LYS 3460N -3.17 4.27 0.54 0.03 2.20 -0.75 -5.03 119.74 117.83 1mx9 s LYS 3460Ca 0.08 0.79 -0.21 0.00 -0.36 0.00 0.00 55.97 56.28 1mx9 s LYS 3460Cb 0.12 -3.56 -0.07 0.00 -1.51 0.00 0.00 37.83 32.81 1mx9 s LYS 3460CO 0.47 -0.24 1.03 -2.30 -0.36 0.00 0.00 175.35 173.95 1mx9 n PRO 3461N 4.97 1.16 0.31 4.03 -0.02 -1.26 -4.88 135.00 139.31 1mx9 n PRO 3461Ca 0.01 0.43 0.19 0.00 -2.02 0.00 0.00 63.50 62.11 1mx9 n PRO 3461Cb 0.50 -2.18 1.03 0.00 -0.02 0.00 0.00 33.50 32.83 1mx9 n PRO 3461CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1mx9 h LYS 3462N 0.96 0.00 -0.00 -0.52 1.79 -1.95 -2.59 116.57 114.25 1mx9 h LYS 3462Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 1mx9 h LYS 3462Cb 1.35 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.00 1mx9 h LYS 3462CO 0.53 0.02 -0.10 0.25 -1.08 0.00 0.00 179.45 179.07 1mx9 n THR 3463N -3.36 0.00 -2.79 -0.16 -2.24 -1.26 -4.80 114.28 99.67 1mx9 n THR 3463Ca -0.03 -0.08 -0.43 0.00 -2.27 0.00 0.00 64.05 61.24 1mx9 n THR 3463Cb 0.12 -0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.28 1mx9 n THR 3463CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1mx9 s VAL 3464N -2.37 4.47 -0.09 2.28 1.01 -0.98 -5.02 120.40 119.71 1mx9 s VAL 3464Ca 0.32 0.94 0.04 0.00 0.00 0.00 0.00 61.98 63.28 1mx9 s VAL 3464Cb 0.20 -4.42 -0.00 0.00 0.00 0.00 0.00 36.38 32.16 1mx9 s VAL 3464CO 0.45 -0.76 -0.23 -0.63 0.00 0.00 0.00 175.10 173.92 1mx9 s ILE 3465N 3.75 1.98 -0.20 2.22 1.01 -1.26 -4.67 121.20 124.04 1mx9 s ILE 3465Ca 0.39 -0.98 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 1mx9 s ILE 3465Cb -0.10 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.66 1mx9 s ILE 3465CO 0.25 0.54 0.11 0.61 0.00 0.00 0.00 174.94 176.45 1mx9 n GLY 3466N 3.42 0.60 3.66 6.18 0.00 -0.63 -3.50 105.19 114.92 1mx9 n GLY 3466Ca -0.19 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 1mx9 n GLY 3466CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mx9 s ASP 3467N -2.99 2.48 0.25 1.61 2.15 -1.24 0.68 116.67 119.62 1mx9 s ASP 3467Ca 0.05 1.28 -0.31 0.00 0.43 0.00 0.00 52.55 54.00 1mx9 s ASP 3467Cb -0.02 -1.96 -0.12 0.00 -0.30 0.00 0.00 42.92 40.52 1mx9 s ASP 3467CO 0.07 -3.23 1.66 -2.28 -0.17 0.00 0.00 175.17 171.21 1mx9 s HIS 3468N -2.89 2.82 0.00 -5.34 5.04 -1.21 -2.47 115.29 111.23 1mx9 s HIS 3468Ca 0.66 0.57 0.00 0.00 -1.54 0.00 0.00 55.06 54.74 1mx9 s HIS 3468Cb -0.19 -4.11 0.00 0.00 0.04 0.00 0.00 32.58 28.32 1mx9 s HIS 3468CO 0.58 -3.96 0.00 0.41 -2.34 0.00 0.00 174.74 169.43 1mx9 n GLY 3469N 3.02 2.14 0.37 1.59 0.00 -1.26 -4.86 105.19 106.19 1mx9 n GLY 3469Ca 0.12 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.33 1mx9 n GLY 3469CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1mx9 h ASP 3470N 0.00 0.00 1.30 1.61 5.19 -1.83 0.25 116.42 122.94 1mx9 h ASP 3470Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1mx9 h ASP 3470Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1mx9 h ASP 3470CO 0.00 0.00 0.00 1.05 -3.12 0.00 0.00 179.24 177.17 1mx9 h GLU 3471N 0.00 0.00 -0.06 3.56 9.09 -1.91 -3.29 114.58 121.97 1mx9 h GLU 3471Ca 0.19 0.00 0.02 0.00 0.05 0.00 0.00 59.36 59.62 1mx9 h GLU 3471Cb 0.91 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.01 1mx9 h GLU 3471CO -0.00 0.00 0.06 -0.07 0.05 0.00 0.00 179.01 179.05 1mx9 h LEU 3472N 0.00 0.00 0.00 3.06 3.38 -1.33 -1.42 115.31 119.00 1mx9 h LEU 3472Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1mx9 h LEU 3472Cb 0.65 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1mx9 h LEU 3472CO 0.00 0.00 -0.69 -0.26 0.09 0.00 0.00 178.44 177.58 1mx9 h PHE 3473N 0.00 0.00 0.02 1.13 -1.00 -1.76 -1.78 116.94 113.54 1mx9 h PHE 3473Ca 0.03 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.77 1mx9 h PHE 3473Cb 0.15 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.71 1mx9 h PHE 3473CO 0.00 0.64 -0.16 0.77 -1.61 0.00 0.00 178.31 177.95 1mx9 h SER 3474N 0.00 0.05 -0.62 2.17 0.02 -1.61 0.13 113.55 113.70 1mx9 h SER 3474Ca -0.02 -0.97 -0.03 0.00 -0.84 0.00 0.00 61.79 59.94 1mx9 h SER 3474Cb 1.50 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 64.00 1mx9 h SER 3474CO 0.08 1.07 0.29 0.58 -1.14 0.00 0.00 176.83 177.71 1mx9 h VAL 3475N -0.93 1.22 -0.64 2.27 2.07 -1.38 -2.52 116.25 116.33 1mx9 h VAL 3475Ca -0.04 -0.64 -0.09 0.00 0.82 0.00 0.00 66.70 66.76 1mx9 h VAL 3475Cb 1.09 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.22 1mx9 h VAL 3475CO 0.00 0.26 0.11 0.49 0.02 0.00 0.00 177.57 178.46 1mx9 n PHE 3476N -4.33 2.23 -4.10 1.57 3.01 -0.67 -4.72 117.46 110.45 1mx9 n PHE 3476Ca 0.06 -0.91 -0.42 0.00 1.01 0.00 0.00 57.45 57.19 1mx9 n PHE 3476Cb 0.15 -0.58 -0.01 0.00 -0.01 0.00 0.00 39.48 39.03 1mx9 n PHE 3476CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1mx9 n GLY 3477N 0.32 -0.67 0.24 1.37 0.00 -0.95 -4.57 105.19 100.94 1mx9 n GLY 3477Ca 0.33 0.30 0.12 0.00 0.00 0.00 0.00 46.02 46.77 1mx9 n GLY 3477CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mx9 h ALA 3478N 1.38 1.03 0.00 4.61 0.00 -1.02 -2.71 119.26 122.54 1mx9 h ALA 3478Ca -0.70 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1mx9 h ALA 3478Cb 1.40 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1mx9 h ALA 3478CO 0.56 0.18 0.00 -2.30 0.00 0.00 0.00 179.25 177.70 1mx9 n PRO 3479N -3.31 0.04 -0.07 0.00 -0.02 -1.26 -0.82 135.00 129.56 1mx9 n PRO 3479Ca 0.00 0.26 0.06 0.00 -2.02 0.00 0.00 63.50 61.80 1mx9 n PRO 3479Cb 0.39 -1.50 0.09 0.00 -0.02 0.00 0.00 33.50 32.46 1mx9 n PRO 3479CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1mx9 n PHE 3480N -1.46 0.19 0.00 6.00 3.01 -1.02 -4.65 117.46 119.53 1mx9 n PHE 3480Ca 0.04 -0.20 0.00 0.00 1.01 0.00 0.00 57.45 58.30 1mx9 n PHE 3480Cb 0.14 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.60 1mx9 n PHE 3480CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1mx9 n LEU 3481N 0.63 1.73 0.00 4.37 4.77 -0.85 -4.96 117.00 122.69 1mx9 n LEU 3481Ca 0.09 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.97 1mx9 n LEU 3481Cb 0.35 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.49 1mx9 n LEU 3481CO 0.08 0.27 0.22 0.29 -1.33 0.00 0.00 177.39 176.92 1mx9 n LYS 3482N -2.59 0.42 -4.59 3.23 5.02 -0.00 -4.31 118.16 115.34 1mx9 n LYS 3482Ca 0.00 -1.21 -0.27 0.00 -2.02 0.00 0.00 58.31 54.81 1mx9 n LYS 3482Cb 0.45 -0.25 -0.11 0.00 -0.02 0.00 0.00 35.03 35.10 1mx9 n LYS 3482CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1mx9 s GLU 3483N -3.46 1.91 0.00 1.97 2.02 -1.26 -4.81 118.70 115.06 1mx9 s GLU 3483Ca 0.28 -2.07 0.00 0.00 0.02 0.00 0.00 54.97 53.20 1mx9 s GLU 3483Cb -0.02 -1.55 0.00 0.00 0.10 0.00 0.00 34.13 32.67 1mx9 s GLU 3483CO 0.18 -0.05 0.00 0.41 0.02 0.00 0.00 175.26 175.82 1mx9 n GLY 3484N -0.92 0.76 3.73 -1.39 0.00 -1.26 -5.02 105.19 101.09 1mx9 n GLY 3484Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 1mx9 n GLY 3484CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mx9 s ALA 3485N -2.71 3.32 1.11 4.61 0.00 -1.26 -4.99 121.76 121.84 1mx9 s ALA 3485Ca 0.00 0.73 -0.10 0.00 0.00 0.00 0.00 51.96 52.59 1mx9 s ALA 3485Cb 0.00 -3.34 0.15 0.00 0.00 0.00 0.00 23.12 19.93 1mx9 s ALA 3485CO 0.00 -0.17 0.57 -1.13 0.00 0.00 0.00 175.76 175.02 1mx9 n SER 3486N 2.75 -1.39 0.10 0.00 3.41 -1.26 -4.89 113.62 112.33 1mx9 n SER 3486Ca 0.03 -0.88 0.12 0.00 -0.26 0.00 0.00 58.87 57.88 1mx9 n SER 3486Cb 0.47 -0.51 0.15 0.00 -0.26 0.00 0.00 64.21 64.07 1mx9 n SER 3486CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1mx9 h GLU 3487N 0.00 0.00 0.16 4.33 4.39 -2.00 -3.17 114.58 118.28 1mx9 h GLU 3487Ca -0.21 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.19 1mx9 h GLU 3487Cb 0.63 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.29 1mx9 h GLU 3487CO 0.14 0.00 -1.42 1.49 -1.16 0.00 0.00 179.01 178.06 1mx9 h GLU 3488N 0.00 0.33 -0.03 2.33 4.81 -2.00 -3.21 114.58 116.81 1mx9 h GLU 3488Ca 0.00 -0.56 -0.14 0.00 -0.13 0.00 0.00 59.36 58.53 1mx9 h GLU 3488Cb 0.85 0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 1mx9 h GLU 3488CO 0.00 1.24 -0.63 1.49 -0.73 0.00 0.00 179.01 180.38 1mx9 h GLU 3489N 0.09 0.10 -0.07 1.92 4.81 -1.92 -2.44 114.58 117.07 1mx9 h GLU 3489Ca -0.21 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 58.92 1mx9 h GLU 3489Cb 2.04 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 31.43 1mx9 h GLU 3489CO 0.20 0.70 -0.07 0.82 -0.73 0.00 0.00 179.01 179.93 1mx9 h ILE 3490N 0.08 1.37 -0.56 2.32 2.04 -1.67 -2.17 117.51 118.93 1mx9 h ILE 3490Ca -0.01 -1.24 0.05 0.00 1.00 0.00 0.00 64.86 64.66 1mx9 h ILE 3490Cb 1.13 2.05 -0.05 0.00 -0.74 0.00 0.00 36.82 39.21 1mx9 h ILE 3490CO 0.09 0.34 0.28 0.03 0.00 0.00 0.00 178.15 178.89 1mx9 h ARG 3491N -0.26 0.52 -0.71 2.37 3.08 -1.55 0.59 114.38 118.42 1mx9 h ARG 3491Ca 0.01 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 1mx9 h ARG 3491Cb 0.59 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 1mx9 h ARG 3491CO 0.02 0.34 0.29 1.25 -1.07 0.00 0.00 179.97 180.80 1mx9 h LEU 3492N 0.53 0.95 -0.40 3.04 5.85 -1.43 -0.25 115.31 123.60 1mx9 h LEU 3492Ca 0.25 -0.13 -0.16 0.00 0.84 0.00 0.00 57.88 58.68 1mx9 h LEU 3492Cb 0.18 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1mx9 h LEU 3492CO -0.18 0.84 -0.40 -1.28 -0.34 0.00 0.00 178.44 177.08 1mx9 h SER 3493N 1.02 0.99 0.72 1.25 0.87 -0.67 -0.82 113.55 116.91 1mx9 h SER 3493Ca 0.24 -0.46 -0.08 0.00 -1.23 0.00 0.00 61.79 60.26 1mx9 h SER 3493Cb 0.18 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1mx9 h SER 3493CO -0.02 1.26 -0.37 0.50 -0.53 0.00 0.00 176.83 177.67 1mx9 h LYS 3494N 0.75 0.00 -0.08 2.24 3.64 -0.66 -1.01 116.57 121.45 1mx9 h LYS 3494Ca 0.06 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 1mx9 h LYS 3494Cb 0.99 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1mx9 h LYS 3494CO 0.10 0.37 -0.26 1.98 -2.27 0.00 0.00 179.45 179.36 1mx9 h MET 3495N 0.00 0.33 -0.21 1.90 4.05 -0.63 -1.50 114.93 118.87 1mx9 h MET 3495Ca -0.00 -0.24 -0.03 0.00 -0.28 0.00 0.00 59.70 59.15 1mx9 h MET 3495Cb 0.83 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.66 1mx9 h MET 3495CO 0.05 0.86 0.01 0.28 0.23 0.00 0.00 176.91 178.34 1mx9 h VAL 3496N -0.15 1.25 -0.68 -5.77 2.07 -1.11 -1.78 116.25 110.08 1mx9 h VAL 3496Ca -0.01 -0.85 0.10 0.00 0.82 0.00 0.00 66.70 66.77 1mx9 h VAL 3496Cb 0.89 1.40 -0.08 0.00 -1.52 0.00 0.00 31.29 31.98 1mx9 h VAL 3496CO 0.06 0.26 0.30 0.24 0.02 0.00 0.00 177.57 178.44 1mx9 h MET 3497N 0.13 0.48 -0.58 1.57 2.07 -1.22 0.17 114.93 117.55 1mx9 h MET 3497Ca 0.06 -0.03 -0.01 0.00 -2.07 0.00 0.00 59.70 57.65 1mx9 h MET 3497Cb 0.38 -0.11 -0.03 0.00 -1.87 0.00 0.00 31.60 29.97 1mx9 h MET 3497CO 0.01 0.32 0.31 0.87 1.07 0.00 0.00 176.91 179.48 1mx9 h LYS 3498N 0.50 0.82 0.56 1.72 1.79 -1.12 -2.22 116.57 118.61 1mx9 h LYS 3498Ca 0.35 -0.10 -0.02 0.00 -2.18 0.00 0.00 60.65 58.69 1mx9 h LYS 3498Cb 0.43 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 30.92 1mx9 h LYS 3498CO -0.31 0.63 -0.32 0.74 -1.08 0.00 0.00 179.45 179.11 1mx9 h PHE 3499N 0.78 -0.84 -0.91 -1.35 0.05 -0.32 -0.88 116.94 113.47 1mx9 h PHE 3499Ca 0.20 -0.01 0.12 0.00 3.82 0.00 0.00 57.97 62.10 1mx9 h PHE 3499Cb 0.06 0.29 -0.07 0.00 2.00 0.00 0.00 35.95 38.24 1mx9 h PHE 3499CO -0.01 -0.50 0.58 -1.49 -0.18 0.00 0.00 178.31 176.71 1mx9 h TRP 3500N -0.83 0.92 0.10 -0.55 -0.00 -0.64 -2.39 115.95 112.57 1mx9 h TRP 3500Ca -0.07 0.03 -0.29 0.00 -0.00 0.00 0.00 58.89 58.56 1mx9 h TRP 3500Cb 0.66 -0.29 0.02 0.00 -0.00 0.00 0.00 29.16 29.55 1mx9 h TRP 3500CO -0.08 0.37 -1.20 0.00 -0.00 0.00 0.00 178.44 177.53 1mx9 h ALA 3501N 1.58 0.07 -0.61 1.49 0.00 -1.28 -1.59 119.26 118.92 1mx9 h ALA 3501Ca 0.44 -0.78 0.03 0.00 0.00 0.00 0.00 54.91 54.61 1mx9 h ALA 3501Cb 0.57 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1mx9 h ALA 3501CO -0.21 0.75 0.40 -0.91 0.00 0.00 0.00 179.25 179.29 1mx9 h ASN 3502N 0.24 0.62 -0.29 0.00 2.35 -0.85 -0.05 115.58 117.61 1mx9 h ASN 3502Ca -0.16 -0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.47 1mx9 h ASN 3502Cb 1.87 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 40.09 1mx9 h ASN 3502CO 0.22 0.43 -0.24 0.15 -1.65 0.00 0.00 177.43 176.34 1mx9 h PHE 3503N 0.72 0.80 -0.89 1.19 3.57 -1.38 0.81 116.94 121.74 1mx9 h PHE 3503Ca 0.24 -0.23 0.23 0.00 3.53 0.00 0.00 57.97 61.75 1mx9 h PHE 3503Cb 0.08 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.60 1mx9 h PHE 3503CO -0.00 0.95 0.62 0.00 -2.23 0.00 0.00 178.31 177.65 1mx9 h ALA 3504N 0.71 2.56 0.00 2.41 0.00 0.00 -1.19 119.26 123.75 1mx9 h ALA 3504Ca 0.05 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.73 1mx9 h ALA 3504Cb 0.80 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1mx9 h ALA 3504CO 0.06 -0.83 -1.86 2.89 0.00 0.00 0.00 179.25 179.51 1mx9 n ARG 3505N -4.38 1.35 0.00 0.00 1.85 -0.66 -4.75 116.66 110.07 1mx9 n ARG 3505Ca 0.19 0.03 0.08 0.00 -1.00 0.00 0.00 57.85 57.15 1mx9 n ARG 3505Cb 0.84 -1.31 0.02 0.00 -1.05 0.00 0.00 32.46 30.96 1mx9 n ARG 3505CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1mx9 n ASN 3506N -2.66 1.84 0.00 2.89 3.02 0.28 -4.94 115.26 115.69 1mx9 n ASN 3506Ca -0.23 -1.42 0.00 0.00 -0.03 0.00 0.00 54.58 52.90 1mx9 n ASN 3506Cb 0.86 0.31 0.00 0.00 -0.61 0.00 0.00 39.78 40.34 1mx9 n ASN 3506CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mx9 n GLY 3507N 1.05 0.23 2.68 7.41 0.00 -0.46 -4.91 105.19 111.20 1mx9 n GLY 3507Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 1mx9 n GLY 3507CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1mx9 s ASN 3508N -2.10 1.56 0.40 1.61 3.84 -1.26 -4.88 114.94 114.11 1mx9 s ASN 3508Ca 0.00 -0.18 0.07 0.00 0.21 0.00 0.00 52.86 52.96 1mx9 s ASN 3508Cb 0.00 -0.05 0.82 0.00 -0.55 0.00 0.00 41.25 41.47 1mx9 s ASN 3508CO 0.00 -0.30 2.03 1.55 -2.79 0.00 0.00 177.10 177.59 1mx9 h PRO 3509N 8.41 0.60 -6.67 0.43 0.13 -1.82 -3.33 132.00 129.75 1mx9 h PRO 3509Ca -0.14 -0.04 -0.55 0.00 -0.87 0.00 0.00 66.00 64.41 1mx9 h PRO 3509Cb 1.13 -0.14 0.20 0.00 0.13 0.00 0.00 31.00 32.33 1mx9 h PRO 3509CO 0.22 0.40 -0.53 0.09 -0.23 0.00 0.00 178.00 177.94 1mx9 n ASN 3510N -4.47 -1.76 0.00 1.44 3.02 -1.26 -4.57 115.26 107.65 1mx9 n ASN 3510Ca 0.05 0.47 0.00 0.00 -0.03 0.00 0.00 54.58 55.08 1mx9 n ASN 3510Cb 0.11 -1.19 0.00 0.00 -0.61 0.00 0.00 39.78 38.09 1mx9 n ASN 3510CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mx9 n GLY 3511N 1.68 0.61 3.68 7.41 0.00 -1.26 -4.92 105.19 112.39 1mx9 n GLY 3511Ca 0.08 -0.69 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 1mx9 n GLY 3511CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1mx9 n GLU 3512N -0.02 1.80 -1.27 1.61 0.28 -1.26 -3.00 120.64 118.78 1mx9 n GLU 3512Ca 0.00 0.64 -0.03 0.00 -0.16 0.00 0.00 57.16 57.61 1mx9 n GLU 3512Cb 0.00 -2.28 -0.01 0.00 1.43 0.00 0.00 31.44 30.58 1mx9 n GLU 3512CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1mx9 n GLY 3513N 0.90 0.54 2.98 -1.84 0.00 -1.26 -5.05 105.19 101.47 1mx9 n GLY 3513Ca 0.07 -0.91 -0.12 0.00 0.00 0.00 0.00 46.02 45.06 1mx9 n GLY 3513CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mx9 s LEU 3514N -0.69 1.72 0.66 0.99 1.43 -1.16 -5.11 118.68 116.52 1mx9 s LEU 3514Ca 0.00 0.04 -0.17 0.00 -1.03 0.00 0.00 54.13 52.97 1mx9 s LEU 3514Cb 0.00 0.33 -0.05 0.00 0.03 0.00 0.00 46.19 46.50 1mx9 s LEU 3514CO 0.00 -0.11 0.64 -0.81 0.23 0.00 0.00 176.35 176.30 1mx9 n PRO 3515N 2.65 0.48 -2.29 1.29 -0.04 -1.26 -4.76 135.00 131.06 1mx9 n PRO 3515Ca -0.15 0.20 -0.40 0.00 -0.04 0.00 0.00 63.50 63.11 1mx9 n PRO 3515Cb 0.58 -1.88 -0.03 0.00 -0.04 0.00 0.00 33.50 32.13 1mx9 n PRO 3515CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1mx9 s HIS 3516N -1.78 3.25 -0.36 0.54 2.46 -1.26 -4.89 115.29 113.24 1mx9 s HIS 3516Ca 0.69 1.55 0.03 0.00 0.47 0.00 0.00 55.06 57.81 1mx9 s HIS 3516Cb -0.39 -3.47 0.11 0.00 -0.13 0.00 0.00 32.58 28.70 1mx9 s HIS 3516CO 0.54 -1.24 0.09 -0.46 -2.47 0.00 0.00 174.74 171.20 1mx9 s TRP 3517N -1.21 3.41 0.53 3.88 -0.11 -1.26 -4.35 118.94 119.82 1mx9 s TRP 3517Ca 0.49 -2.88 -0.23 0.00 1.22 0.00 0.00 56.10 54.71 1mx9 s TRP 3517Cb -0.35 -2.75 -0.06 0.00 -1.50 0.00 0.00 33.47 28.81 1mx9 s TRP 3517CO 0.45 -0.91 1.38 -1.25 -4.62 0.00 0.00 176.95 172.01 1mx9 s PRO 3518N 0.80 3.24 0.49 5.86 0.04 -1.26 -4.81 135.00 139.36 1mx9 s PRO 3518Ca 0.12 2.30 -0.22 0.00 0.04 0.00 0.00 61.00 63.24 1mx9 s PRO 3518Cb -0.20 -2.35 -0.07 0.00 0.04 0.00 0.00 34.50 31.93 1mx9 s PRO 3518CO -0.09 -1.13 1.15 -2.00 0.04 0.00 0.00 177.00 174.97 1mx9 s GLU 3519N -2.81 3.63 -1.42 4.56 2.12 -1.26 -4.55 118.70 118.97 1mx9 s GLU 3519Ca 0.69 1.70 -0.11 0.00 0.36 0.00 0.00 54.97 57.61 1mx9 s GLU 3519Cb -0.42 -2.26 0.06 0.00 0.26 0.00 0.00 34.13 31.77 1mx9 s GLU 3519CO 0.50 -0.64 2.25 0.98 -0.54 0.00 0.00 175.26 177.81 1mx9 n TYR 3520N -0.77 3.14 -1.38 5.30 9.36 -0.83 -4.04 117.16 127.94 1mx9 n TYR 3520Ca 0.09 -2.93 0.00 0.00 3.32 0.00 0.00 57.90 58.38 1mx9 n TYR 3520Cb 0.49 -2.32 0.00 0.00 -0.63 0.00 0.00 39.34 36.88 1mx9 n TYR 3520CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1mx9 n ASN 3521N 4.79 0.00 0.06 2.98 0.23 -1.26 -4.78 115.26 117.28 1mx9 n ASN 3521Ca 0.53 -0.46 0.21 0.00 -0.53 0.00 0.00 54.58 54.33 1mx9 n ASN 3521Cb 0.35 0.00 0.74 0.00 -2.08 0.00 0.00 39.78 38.79 1mx9 n ASN 3521CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1mx9 h GLN 3522N 0.00 0.00 0.00 -3.83 1.08 -1.99 0.35 115.11 110.72 1mx9 h GLN 3522Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1mx9 h GLN 3522Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1mx9 h GLN 3522CO 0.00 0.00 0.00 1.63 -0.95 0.00 0.00 178.83 179.51 1mx9 n LYS 3523N -3.85 0.16 -3.53 1.46 5.02 -1.26 -4.94 118.16 111.21 1mx9 n LYS 3523Ca 0.08 0.21 -0.19 0.00 -2.02 0.00 0.00 58.31 56.39 1mx9 n LYS 3523Cb 0.63 -1.71 0.07 0.00 -0.02 0.00 0.00 35.03 34.00 1mx9 n LYS 3523CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1mx9 n GLU 3524N -1.99 -6.32 -2.60 1.97 1.02 0.12 -3.99 120.64 108.85 1mx9 n GLU 3524Ca 0.05 0.78 -0.41 0.00 -0.02 0.00 0.00 57.16 57.56 1mx9 n GLU 3524Cb 0.34 -5.69 -0.04 0.00 -0.02 0.00 0.00 31.44 26.02 1mx9 n GLU 3524CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1mx9 s GLY 3525N -4.22 2.90 -0.01 0.62 0.00 -1.26 -0.79 107.32 104.56 1mx9 s GLY 3525Ca 0.09 0.72 -0.04 0.00 0.00 0.00 0.00 44.72 45.49 1mx9 s GLY 3525CO 0.75 1.58 0.08 -2.52 0.00 0.00 0.00 173.10 173.00 1mx9 s TYR 3526N -0.11 0.03 0.03 1.90 -0.85 -0.58 -4.00 117.35 113.77 1mx9 s TYR 3526Ca 0.49 -0.05 -0.27 0.00 -0.52 0.00 0.00 57.07 56.71 1mx9 s TYR 3526Cb -0.27 -0.04 -0.05 0.00 0.38 0.00 0.00 41.96 41.98 1mx9 s TYR 3526CO 0.33 -0.16 0.86 -1.17 -1.52 0.00 0.00 175.55 173.89 1mx9 s LEU 3527N -0.75 4.42 -0.46 -3.49 2.96 -1.13 -0.86 118.68 119.37 1mx9 s LEU 3527Ca -0.08 1.55 -0.17 0.00 -0.22 0.00 0.00 54.13 55.21 1mx9 s LEU 3527Cb -0.05 -3.38 0.05 0.00 0.50 0.00 0.00 46.19 43.31 1mx9 s LEU 3527CO 0.00 -0.09 0.44 -1.10 -1.32 0.00 0.00 176.35 174.28 1mx9 s GLN 3528N 0.35 3.03 -0.17 1.98 -0.21 -1.06 -1.77 119.66 121.80 1mx9 s GLN 3528Ca 0.44 -1.08 -0.14 0.00 0.02 0.00 0.00 55.36 54.59 1mx9 s GLN 3528Cb -0.21 -4.07 -0.05 0.00 1.00 0.00 0.00 33.01 29.68 1mx9 s GLN 3528CO 0.25 -1.00 0.30 0.42 -2.12 0.00 0.00 175.29 173.15 1mx9 s ILE 3529N 1.97 5.29 0.00 1.08 1.01 -0.80 -2.99 121.20 126.76 1mx9 s ILE 3529Ca 0.08 0.55 0.00 0.00 0.00 0.00 0.00 60.65 61.29 1mx9 s ILE 3529Cb -0.21 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.62 1mx9 s ILE 3529CO 0.10 0.36 0.00 0.61 0.00 0.00 0.00 174.94 176.01 1mx9 n GLY 3530N 3.52 0.90 0.37 6.18 0.00 -1.26 -0.81 105.19 114.09 1mx9 n GLY 3530Ca -0.11 -0.53 0.12 0.00 0.00 0.00 0.00 46.02 45.49 1mx9 n GLY 3530CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mx9 h ALA 3531N 2.00 1.91 -3.98 4.61 0.00 -1.95 -3.36 119.26 118.48 1mx9 h ALA 3531Ca 0.00 -0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.22 1mx9 h ALA 3531Cb 0.00 -0.12 -0.29 0.00 0.00 0.00 0.00 17.79 17.39 1mx9 h ALA 3531CO 0.00 -0.10 -0.84 -0.80 0.00 0.00 0.00 179.25 177.51 1mx9 s ASN 3532N -5.99 3.41 -0.24 0.00 0.02 -1.26 -5.05 114.94 105.83 1mx9 s ASN 3532Ca -0.09 -0.41 0.01 0.00 -1.02 0.00 0.00 52.86 51.34 1mx9 s ASN 3532Cb 0.21 -0.90 0.06 0.00 0.02 0.00 0.00 41.25 40.64 1mx9 s ASN 3532CO 0.77 0.26 -0.04 -0.89 0.02 0.00 0.00 177.10 177.23 1mx9 s THR 3533N -0.26 1.48 0.01 1.60 2.01 -1.26 -4.58 115.64 114.64 1mx9 s THR 3533Ca -0.00 -1.24 0.00 0.00 0.31 0.00 0.00 61.69 60.77 1mx9 s THR 3533Cb -0.13 -1.79 -0.01 0.00 0.01 0.00 0.00 72.50 70.59 1mx9 s THR 3533CO 0.03 -0.15 -0.02 -1.10 -0.69 0.00 0.00 174.62 172.69 1mx9 s GLN 3534N 1.41 0.17 0.87 4.92 1.11 -1.16 -4.85 119.66 122.14 1mx9 s GLN 3534Ca -0.04 -0.22 -0.11 0.00 0.01 0.00 0.00 55.36 55.00 1mx9 s GLN 3534Cb -0.19 -0.06 0.12 0.00 -1.01 0.00 0.00 33.01 31.88 1mx9 s GLN 3534CO -0.07 0.01 1.15 0.00 0.01 0.00 0.00 175.29 176.39 1mx9 s ALA 3535N -0.44 1.65 0.18 6.09 0.00 -1.26 -2.58 121.76 125.41 1mx9 s ALA 3535Ca -0.04 0.58 -0.02 0.00 0.00 0.00 0.00 51.96 52.48 1mx9 s ALA 3535Cb -0.03 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.67 1mx9 s ALA 3535CO -0.00 -2.53 0.26 0.00 0.00 0.00 0.00 175.76 173.49 1mx9 n ALA 3536N -3.98 -0.24 -2.43 0.00 0.00 -0.04 -4.84 120.51 108.99 1mx9 n ALA 3536Ca 0.12 -0.80 -0.08 0.00 0.00 0.00 0.00 53.44 52.67 1mx9 n ALA 3536Cb 0.52 0.64 -0.08 0.00 0.00 0.00 0.00 19.45 20.53 1mx9 n ALA 3536CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1mx9 s GLN 3537N -2.37 0.81 -0.83 0.00 -0.21 -1.26 -1.53 119.66 114.26 1mx9 s GLN 3537Ca 0.14 -1.06 -0.03 0.00 0.02 0.00 0.00 55.36 54.43 1mx9 s GLN 3537Cb -0.01 0.31 -0.00 0.00 1.00 0.00 0.00 33.01 34.31 1mx9 s GLN 3537CO 0.10 -0.24 0.67 1.63 -2.12 0.00 0.00 175.29 175.33 1mx9 n LYS 3538N -0.03 -1.40 -2.48 2.91 5.02 0.03 -4.91 118.16 117.30 1mx9 n LYS 3538Ca -0.14 1.01 -0.43 0.00 -2.02 0.00 0.00 58.31 56.74 1mx9 n LYS 3538Cb 0.62 -3.93 -0.02 0.00 -0.02 0.00 0.00 35.03 31.68 1mx9 n LYS 3538CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1mx9 s LEU 3539N -4.78 4.16 -2.10 -0.35 2.96 -1.26 -3.46 118.68 113.85 1mx9 s LEU 3539Ca 0.06 1.62 0.00 0.00 -0.22 0.00 0.00 54.13 55.59 1mx9 s LEU 3539Cb -0.02 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.13 1mx9 s LEU 3539CO 0.83 -0.74 0.00 0.29 -1.32 0.00 0.00 176.35 175.41 1mx9 n LYS 3540N 6.55 -1.50 -0.28 1.98 4.76 -1.26 -4.87 118.16 123.53 1mx9 n LYS 3540Ca 0.13 1.18 0.02 0.00 -2.87 0.00 0.00 58.31 56.77 1mx9 n LYS 3540Cb 0.45 -5.63 0.15 0.00 -1.84 0.00 0.00 35.03 28.16 1mx9 n LYS 3540CO 0.00 0.00 0.00 0.22 -1.37 0.00 0.00 177.40 176.25 1mx9 h ASP 3541N 0.00 0.63 -0.24 4.39 1.82 -1.95 -1.68 116.42 119.40 1mx9 h ASP 3541Ca -0.44 0.05 -0.13 0.00 -0.39 0.00 0.00 57.03 56.11 1mx9 h ASP 3541Cb 1.36 -0.08 -0.00 0.00 0.68 0.00 0.00 39.33 41.29 1mx9 h ASP 3541CO 0.61 0.37 -0.35 0.11 -1.61 0.00 0.00 179.24 178.37 1mx9 h LYS 3542N 0.75 0.66 -0.61 0.28 1.79 -1.89 -2.84 116.57 114.70 1mx9 h LYS 3542Ca 0.37 -0.39 -0.04 0.00 -2.18 0.00 0.00 60.65 58.41 1mx9 h LYS 3542Cb 0.32 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.98 1mx9 h LYS 3542CO -0.24 1.00 0.21 0.93 -1.08 0.00 0.00 179.45 180.28 1mx9 h GLU 3543N 0.37 0.94 -0.11 3.15 3.07 -1.90 -1.55 114.58 118.55 1mx9 h GLU 3543Ca 0.02 -0.19 0.04 0.00 -0.50 0.00 0.00 59.36 58.73 1mx9 h GLU 3543Cb 0.94 -0.14 -0.05 0.00 -0.84 0.00 0.00 28.75 28.66 1mx9 h GLU 3543CO 0.08 0.82 -0.18 0.28 -1.40 0.00 0.00 179.01 178.61 1mx9 h VAL 3544N 0.87 0.54 -0.85 3.13 2.07 -1.32 0.24 116.25 120.93 1mx9 h VAL 3544Ca 0.20 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.78 1mx9 h VAL 3544Cb 0.26 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 30.51 1mx9 h VAL 3544CO -0.01 0.00 0.52 0.00 0.02 0.00 0.00 177.57 178.10 1mx9 h ALA 3545N 0.76 1.16 -0.43 1.67 0.00 -1.24 0.23 119.26 121.41 1mx9 h ALA 3545Ca 0.09 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1mx9 h ALA 3545Cb 0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1mx9 h ALA 3545CO -0.25 0.27 -0.23 0.35 0.00 0.00 0.00 179.25 179.39 1mx9 h PHE 3546N 0.96 1.07 0.01 0.00 3.57 -0.36 -2.63 116.94 119.56 1mx9 h PHE 3546Ca 0.37 -0.27 -0.11 0.00 3.53 0.00 0.00 57.97 61.49 1mx9 h PHE 3546Cb 0.17 -0.24 0.01 0.00 2.79 0.00 0.00 35.95 38.67 1mx9 h PHE 3546CO -0.03 1.07 -0.44 -1.49 -2.23 0.00 0.00 178.31 175.19 1mx9 h TRP 3547N 0.76 0.43 -0.55 0.41 4.06 -0.24 -0.97 115.95 119.84 1mx9 h TRP 3547Ca 0.09 -0.24 0.11 0.00 2.06 0.00 0.00 58.89 60.91 1mx9 h TRP 3547Cb 0.80 -0.05 -0.09 0.00 -1.00 0.00 0.00 29.16 28.83 1mx9 h TRP 3547CO 0.06 1.06 0.05 1.15 -3.56 0.00 0.00 178.44 177.20 1mx9 h THR 3548N -0.33 0.61 0.54 1.49 2.02 -0.61 -0.37 112.91 116.26 1mx9 h THR 3548Ca -0.06 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.04 1mx9 h THR 3548Cb 1.19 0.42 0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1mx9 h THR 3548CO 0.09 0.03 -0.26 -1.13 0.37 0.00 0.00 175.52 174.62 1mx9 h ASN 3549N 0.18 -0.61 -0.83 4.18 -1.24 -1.51 -3.24 115.58 112.50 1mx9 h ASN 3549Ca 0.28 0.02 0.20 0.00 0.71 0.00 0.00 56.30 57.52 1mx9 h ASN 3549Cb 0.43 0.16 -0.14 0.00 0.73 0.00 0.00 38.32 39.50 1mx9 h ASN 3549CO -0.42 -0.36 0.08 0.25 -1.29 0.00 0.00 177.43 175.69 1mx9 h LEU 3550N -0.88 -0.26 0.00 0.34 5.85 -0.93 0.64 115.31 120.07 1mx9 h LEU 3550Ca -0.07 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1mx9 h LEU 3550Cb 0.55 0.34 0.00 0.00 0.37 0.00 0.00 40.66 41.92 1mx9 h LEU 3550CO 0.12 -0.19 0.00 0.49 -0.34 0.00 0.00 178.44 178.52 1mx9 n PHE 3551N -5.33 0.00 -1.55 1.25 0.99 -0.17 -2.79 117.46 109.87 1mx9 n PHE 3551Ca 0.17 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 57.28 1mx9 n PHE 3551Cb 0.58 -0.19 0.06 0.00 -1.00 0.00 0.00 39.48 38.93 1mx9 n PHE 3551CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1mx9 n ALA 3552N -1.19 6.20 -0.85 4.37 0.00 0.22 -5.09 120.51 124.18 1mx9 n ALA 3552Ca 0.04 -3.66 0.00 0.00 0.00 0.00 0.00 53.44 49.82 1mx9 n ALA 3552Cb 0.04 -1.63 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1mx9 n ALA 3552CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13