#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ofq n ARG 3024N 0.00 1.70 -3.63 7.34 1.74 -1.26 -4.88 116.66 117.67 1ofq n ARG 3024Ca 0.00 -1.66 -0.39 0.00 -0.77 0.00 0.00 57.85 55.03 1ofq n ARG 3024Cb 0.00 -1.28 -0.11 0.00 -1.02 0.00 0.00 32.46 30.04 1ofq n ARG 3024CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ofq s ILE 3025N -1.06 4.58 0.15 0.55 -1.09 -1.26 -4.96 121.20 118.11 1ofq s ILE 3025Ca 0.21 -0.59 0.09 0.00 -2.23 0.00 0.00 60.65 58.12 1ofq s ILE 3025Cb 0.12 -3.42 -0.12 0.00 -1.58 0.00 0.00 42.46 37.46 1ofq s ILE 3025CO 0.17 -0.05 1.41 -0.07 -1.23 0.00 0.00 174.94 175.18 1ofq h LEU 3026N 8.38 0.00 0.00 2.97 3.38 -2.11 -3.49 115.31 124.44 1ofq h LEU 3026Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1ofq h LEU 3026Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1ofq h LEU 3026CO 0.63 0.82 0.00 0.61 0.09 0.00 0.00 178.44 180.60 1ofq n GLY 3027N 0.96 0.26 3.10 0.83 0.00 -1.26 -5.14 105.19 103.93 1ofq n GLY 3027Ca -0.00 -1.11 -0.27 0.00 0.00 0.00 0.00 46.02 44.64 1ofq n GLY 3027CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ofq s TYR 3028N -2.00 1.86 -0.05 1.61 1.51 -1.26 -5.14 117.35 113.88 1ofq s TYR 3028Ca 0.00 -0.72 0.00 0.00 -1.01 0.00 0.00 57.07 55.34 1ofq s TYR 3028Cb 0.00 -1.30 -0.03 0.00 -0.11 0.00 0.00 41.96 40.51 1ofq s TYR 3028CO 0.00 -0.33 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.57 1ofq s ASP 3029N 0.55 4.92 0.37 2.29 1.11 -1.26 -5.09 116.67 119.56 1ofq s ASP 3029Ca -0.16 0.02 -0.28 0.00 0.18 0.00 0.00 52.55 52.30 1ofq s ASP 3029Cb -0.17 -1.28 -0.11 0.00 1.07 0.00 0.00 42.92 42.43 1ofq s ASP 3029CO 0.06 0.34 1.41 -0.81 1.18 0.00 0.00 175.17 177.35 1ofq n PRO 3030N 1.93 2.46 -4.15 8.23 -0.04 -1.26 -5.01 135.00 137.15 1ofq n PRO 3030Ca -0.17 0.86 -0.28 0.00 -0.04 0.00 0.00 63.50 63.87 1ofq n PRO 3030Cb 0.53 -2.55 -0.17 0.00 -0.04 0.00 0.00 33.50 31.28 1ofq n PRO 3030CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ofq s LEU 3031N -1.73 1.50 0.30 1.53 2.96 -1.26 -4.93 118.68 117.05 1ofq s LEU 3031Ca 0.54 -0.38 -0.29 0.00 -0.22 0.00 0.00 54.13 53.79 1ofq s LEU 3031Cb -0.51 -0.98 -0.10 0.00 0.50 0.00 0.00 46.19 45.10 1ofq s LEU 3031CO 0.63 -0.05 1.39 0.00 -1.32 0.00 0.00 176.35 177.00 1ofq s ALA 3032N 1.34 3.56 0.72 5.97 0.00 -1.26 -4.98 121.76 127.12 1ofq s ALA 3032Ca -0.00 1.34 -0.11 0.00 0.00 0.00 0.00 51.96 53.18 1ofq s ALA 3032Cb -0.14 -3.53 0.03 0.00 0.00 0.00 0.00 23.12 19.48 1ofq s ALA 3032CO -0.06 -0.74 1.07 -1.54 0.00 0.00 0.00 175.76 174.49 1ofq s SER 3033N -0.07 5.03 0.16 0.00 1.04 -1.26 -4.85 113.70 113.75 1ofq s SER 3033Ca 0.54 1.71 -0.15 0.00 0.48 0.00 0.00 55.95 58.53 1ofq s SER 3033Cb -0.42 -2.51 0.06 0.00 0.10 0.00 0.00 66.02 63.26 1ofq s SER 3033CO 0.50 -1.68 1.80 -0.65 0.98 0.00 0.00 173.24 174.20 1ofq h PRO 3034N -0.84 0.51 -0.83 4.02 0.11 -1.89 -1.29 132.00 131.79 1ofq h PRO 3034Ca -0.44 -0.03 0.16 0.00 0.11 0.00 0.00 66.00 65.80 1ofq h PRO 3034Cb 1.22 -0.12 -0.10 0.00 0.11 0.00 0.00 31.00 32.11 1ofq h PRO 3034CO 0.55 0.34 0.39 0.00 -0.21 0.00 0.00 178.00 179.06 1ofq h ALA 3035N 1.20 1.24 -0.34 -0.75 0.00 -1.91 0.43 119.26 119.13 1ofq h ALA 3035Ca 0.18 0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 1ofq h ALA 3035Cb 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ofq h ALA 3035CO -0.08 -0.17 -0.08 1.25 0.00 0.00 0.00 179.25 180.17 1ofq h LEU 3036N 0.53 0.66 -0.73 0.00 5.85 -1.77 -2.73 115.31 117.12 1ofq h LEU 3036Ca 0.47 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1ofq h LEU 3036Cb 0.73 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1ofq h LEU 3036CO -0.41 0.87 0.29 0.25 -0.34 0.00 0.00 178.44 179.10 1ofq h LEU 3037N 0.44 1.01 -2.05 2.25 7.12 0.12 -1.88 115.31 122.31 1ofq h LEU 3037Ca 0.09 -0.17 -0.02 0.00 0.13 0.00 0.00 57.88 57.91 1ofq h LEU 3037Cb 0.58 -0.26 -0.00 0.00 -0.53 0.00 0.00 40.66 40.44 1ofq h LEU 3037CO 0.03 0.91 -0.08 1.56 -0.13 0.00 0.00 178.44 180.73 1ofq h GLN 3038N 1.04 0.00 0.23 1.25 4.20 -0.13 -0.06 115.11 121.65 1ofq h GLN 3038Ca 0.24 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.64 1ofq h GLN 3038Cb 0.22 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.03 1ofq h GLN 3038CO -0.02 0.08 -1.39 0.28 -0.67 0.00 0.00 178.83 177.11 1ofq h VAL 3039N 0.00 1.30 -0.30 -0.54 2.07 -1.09 -2.95 116.25 114.74 1ofq h VAL 3039Ca -0.00 -2.66 -0.16 0.00 0.82 0.00 0.00 66.70 64.70 1ofq h VAL 3039Cb 0.18 3.06 -0.00 0.00 -1.52 0.00 0.00 31.29 33.00 1ofq h VAL 3039CO 0.01 0.80 -0.47 1.56 0.02 0.00 0.00 177.57 179.49 1ofq h GLN 3040N 0.05 0.80 -2.73 1.57 4.20 -0.87 -3.34 115.11 114.79 1ofq h GLN 3040Ca -0.25 -0.46 -0.61 0.00 0.06 0.00 0.00 58.65 57.40 1ofq h GLN 3040Cb 2.08 0.03 -0.41 0.00 0.30 0.00 0.00 27.48 29.48 1ofq h GLN 3040CO 0.25 1.09 -0.65 -0.89 -0.67 0.00 0.00 178.83 177.96 1ofq n ILE 3041N -4.02 1.37 -2.24 2.54 5.41 -0.08 -5.10 119.36 117.24 1ofq n ILE 3041Ca -0.03 -4.75 -0.37 0.00 1.00 0.00 0.00 62.75 58.60 1ofq n ILE 3041Cb 0.58 -2.09 -0.01 0.00 -0.71 0.00 0.00 39.64 37.41 1ofq n ILE 3041CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1ofq s PRO 3042N -1.53 3.72 -0.19 0.38 0.04 -1.11 -4.60 135.00 131.71 1ofq s PRO 3042Ca 0.30 1.78 -0.22 0.00 0.04 0.00 0.00 61.00 62.90 1ofq s PRO 3042Cb 0.03 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 1ofq s PRO 3042CO -0.13 -0.59 0.69 0.00 0.04 0.00 0.00 177.00 177.02 1ofq s ALA 3043N -1.55 3.54 0.66 8.56 0.00 -1.26 -5.02 121.76 126.68 1ofq s ALA 3043Ca 0.64 -0.17 -0.15 0.00 0.00 0.00 0.00 51.96 52.28 1ofq s ALA 3043Cb -0.29 -3.05 -0.00 0.00 0.00 0.00 0.00 23.12 19.78 1ofq s ALA 3043CO 0.35 -0.59 1.12 0.95 0.00 0.00 0.00 175.76 177.59 1ofq s THR 3044N 1.99 3.16 0.31 0.00 -4.23 -1.26 -4.81 115.64 110.80 1ofq s THR 3044Ca 0.32 0.55 0.08 0.00 -1.18 0.00 0.00 61.69 61.46 1ofq s THR 3044Cb -0.16 -3.08 0.31 0.00 1.34 0.00 0.00 72.50 70.90 1ofq s THR 3044CO 0.11 -0.32 1.76 -0.65 -0.54 0.00 0.00 174.62 174.98 1ofq h PRO 3045N 0.09 0.67 -0.38 3.99 0.11 -2.00 0.20 132.00 134.70 1ofq h PRO 3045Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1ofq h PRO 3045Cb 1.25 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1ofq h PRO 3045CO 0.54 0.45 0.25 1.15 -0.21 0.00 0.00 178.00 180.17 1ofq h THR 3046N 0.69 1.10 -0.34 -1.15 2.02 -1.92 -0.33 112.91 112.99 1ofq h THR 3046Ca 0.60 -0.17 0.04 0.00 0.77 0.00 0.00 66.41 67.64 1ofq h THR 3046Cb 1.02 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 67.94 1ofq h THR 3046CO -0.40 0.09 0.12 0.28 0.37 0.00 0.00 175.52 175.98 1ofq h SER 3047N 0.51 0.14 -0.46 4.18 0.02 -1.10 0.12 113.55 116.95 1ofq h SER 3047Ca 0.14 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 1ofq h SER 3047Cb -0.06 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1ofq h SER 3047CO -0.03 0.12 0.26 -0.07 -1.14 0.00 0.00 176.83 175.96 1ofq h LEU 3048N 0.27 0.57 -0.72 5.07 4.07 -1.06 -0.58 115.31 122.92 1ofq h LEU 3048Ca 0.15 -0.08 -0.07 0.00 0.08 0.00 0.00 57.88 57.95 1ofq h LEU 3048Cb 0.12 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.68 1ofq h LEU 3048CO -0.15 0.49 0.13 -0.33 -1.08 0.00 0.00 178.44 177.50 1ofq h GLU 3049N 0.61 1.11 -0.22 1.13 3.07 -0.71 -1.50 114.58 118.07 1ofq h GLU 3049Ca 0.16 -0.28 -0.01 0.00 -0.50 0.00 0.00 59.36 58.74 1ofq h GLU 3049Cb 0.04 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 1ofq h GLU 3049CO -0.03 1.00 0.12 1.15 -1.40 0.00 0.00 179.01 179.84 1ofq h THR 3050N 1.04 1.12 -0.55 1.13 2.02 -0.44 0.13 112.91 117.36 1ofq h THR 3050Ca 0.21 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 1ofq h THR 3050Cb 0.41 0.95 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 1ofq h THR 3050CO 0.01 0.12 0.32 0.00 0.37 0.00 0.00 175.52 176.34 1ofq h ALA 3051N 0.99 0.71 -0.47 6.16 0.00 -0.95 -0.59 119.26 125.10 1ofq h ALA 3051Ca 0.08 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ofq h ALA 3051Cb 0.09 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1ofq h ALA 3051CO -0.01 0.20 0.31 1.57 0.00 0.00 0.00 179.25 181.32 1ofq h LYS 3052N 0.74 0.61 -0.48 0.00 -0.00 -1.01 -2.21 116.57 114.23 1ofq h LYS 3052Ca 0.20 -0.04 -0.02 0.00 -0.00 0.00 0.00 60.65 60.79 1ofq h LYS 3052Cb 0.01 -0.14 -0.02 0.00 -0.00 0.00 0.00 32.23 32.08 1ofq h LYS 3052CO -0.03 0.40 0.23 -0.09 -0.00 0.00 0.00 179.45 179.96 1ofq h ARG 3053N 0.63 0.69 -0.97 0.07 2.43 -0.57 -2.49 114.38 114.17 1ofq h ARG 3053Ca 0.18 -0.10 0.07 0.00 -0.81 0.00 0.00 59.98 59.32 1ofq h ARG 3053Cb -0.06 -0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 29.30 1ofq h ARG 3053CO -0.04 0.58 0.63 0.78 -1.51 0.00 0.00 179.97 180.40 1ofq h GLY 3054N 0.63 1.46 0.87 2.80 0.00 -0.80 -1.87 103.07 106.16 1ofq h GLY 3054Ca 0.16 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1ofq h GLY 3054CO -0.02 0.30 -0.12 3.21 0.00 0.00 0.00 176.54 179.91 1ofq h ARG 3055N 1.10 -0.33 -0.40 4.80 3.08 -1.00 -1.42 114.38 120.21 1ofq h ARG 3055Ca 0.42 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.58 1ofq h ARG 3055Cb 0.22 0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.27 1ofq h ARG 3055CO -0.17 -0.13 -0.08 0.00 -1.07 0.00 0.00 179.97 178.52 1ofq h ARG 3056N -0.47 0.02 -0.81 0.04 3.08 -1.05 0.50 114.38 115.68 1ofq h ARG 3056Ca -0.04 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1ofq h ARG 3056Cb 0.36 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 1ofq h ARG 3056CO 0.06 0.01 0.35 0.93 -1.07 0.00 0.00 179.97 180.25 1ofq h GLU 3057N 0.02 1.20 -0.52 0.04 5.08 -1.31 -1.57 114.58 117.53 1ofq h GLU 3057Ca 0.19 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 1ofq h GLU 3057Cb 0.29 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1ofq h GLU 3057CO -0.40 0.95 -0.04 0.00 -1.00 0.00 0.00 179.01 178.53 1ofq h ALA 3058N 1.19 0.70 0.50 3.43 0.00 -0.49 -2.54 119.26 122.04 1ofq h ALA 3058Ca 0.27 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1ofq h ALA 3058Cb 0.19 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ofq h ALA 3058CO -0.03 0.55 -0.24 0.82 0.00 0.00 0.00 179.25 180.36 1ofq h ILE 3059N 0.81 0.51 -0.46 0.00 2.04 -0.66 -1.19 117.51 118.55 1ofq h ILE 3059Ca 0.14 -0.03 0.12 0.00 1.00 0.00 0.00 64.86 66.09 1ofq h ILE 3059Cb 0.58 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1ofq h ILE 3059CO 0.03 0.01 0.33 0.44 0.00 0.00 0.00 178.15 178.96 1ofq h ASP 3060N -0.69 0.06 0.01 1.72 3.32 -1.26 -1.33 116.42 118.25 1ofq h ASP 3060Ca -0.07 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 1ofq h ASP 3060Cb 0.52 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1ofq h ASP 3060CO 0.11 0.04 -0.08 0.40 -1.72 0.00 0.00 179.24 177.99 1ofq h ILE 3061N 0.07 1.72 0.00 0.35 2.04 -1.13 0.23 117.51 120.79 1ofq h ILE 3061Ca 0.22 -2.23 -0.02 0.00 1.00 0.00 0.00 64.86 63.82 1ofq h ILE 3061Cb 0.78 3.23 -0.00 0.00 -0.74 0.00 0.00 36.82 40.09 1ofq h ILE 3061CO -0.02 0.59 -0.11 0.16 0.00 0.00 0.00 178.15 178.77 1ofq h ILE 3062N -0.87 0.42 -0.22 -0.67 3.07 -0.90 -1.84 117.51 116.49 1ofq h ILE 3062Ca -0.01 -0.59 0.00 0.00 1.55 0.00 0.00 64.86 65.80 1ofq h ILE 3062Cb 1.01 1.42 0.00 0.00 -0.27 0.00 0.00 36.82 38.97 1ofq h ILE 3062CO 0.02 0.11 0.00 0.35 -1.05 0.00 0.00 178.15 177.57 1ofq n THR 3063N -3.45 0.28 -0.28 0.16 -2.24 -0.53 -0.70 114.28 107.52 1ofq n THR 3063Ca -0.01 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1ofq n THR 3063Cb 0.27 0.66 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 1ofq n THR 3063CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ofq n GLY 3064N 1.27 2.22 0.31 3.38 0.00 -0.69 -4.88 105.19 106.79 1ofq n GLY 3064Ca 0.17 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.38 1ofq n GLY 3064CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ofq h LYS 3065N 2.46 0.00 -5.63 1.61 1.79 -0.88 -3.42 116.57 112.50 1ofq h LYS 3065Ca 0.00 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.93 1ofq h LYS 3065Cb 0.00 0.00 -0.29 0.00 -1.58 0.00 0.00 32.23 30.36 1ofq h LYS 3065CO 0.00 0.03 -0.83 0.34 -1.08 0.00 0.00 179.45 177.91 1ofq s ASP 3066N -5.63 2.01 0.00 0.86 2.15 -0.08 -4.97 116.67 111.01 1ofq s ASP 3066Ca -0.04 -0.33 0.22 0.00 0.43 0.00 0.00 52.55 52.83 1ofq s ASP 3066Cb 0.13 -0.21 0.52 0.00 -0.30 0.00 0.00 42.92 43.06 1ofq s ASP 3066CO 0.49 0.20 1.44 -0.90 -0.17 0.00 0.00 175.17 176.23 1ofq n ASP 3067N 2.55 2.98 -4.86 -0.34 5.68 -1.26 -4.54 116.55 116.76 1ofq n ASP 3067Ca -0.15 -1.93 -0.29 0.00 -0.50 0.00 0.00 54.79 51.91 1ofq n ASP 3067Cb 0.54 -0.25 0.08 0.00 -1.14 0.00 0.00 41.12 40.36 1ofq n ASP 3067CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1ofq s ARG 3068N -1.51 2.12 -0.08 0.11 0.52 -1.26 -4.99 118.95 113.86 1ofq s ARG 3068Ca 0.37 0.32 -0.04 0.00 -0.52 0.00 0.00 55.73 55.87 1ofq s ARG 3068Cb 0.21 -1.95 -0.04 0.00 0.52 0.00 0.00 34.95 33.69 1ofq s ARG 3068CO 0.29 -1.53 0.09 0.08 0.02 0.00 0.00 175.30 174.26 1ofq s VAL 3069N -3.40 5.00 -0.19 3.52 1.01 -0.93 -4.92 120.40 120.48 1ofq s VAL 3069Ca 0.61 -0.05 -0.22 0.00 0.00 0.00 0.00 61.98 62.32 1ofq s VAL 3069Cb -0.12 -3.18 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 1ofq s VAL 3069CO 0.51 0.56 0.69 -0.22 0.00 0.00 0.00 175.10 176.64 1ofq s LEU 3070N -1.14 4.15 -0.18 3.92 2.96 0.11 -1.29 118.68 127.21 1ofq s LEU 3070Ca 0.16 0.92 0.01 0.00 -0.22 0.00 0.00 54.13 55.00 1ofq s LEU 3070Cb -0.12 -2.98 0.01 0.00 0.50 0.00 0.00 46.19 43.60 1ofq s LEU 3070CO 0.06 -0.31 -0.18 -0.69 -1.32 0.00 0.00 176.35 173.90 1ofq s VAL 3071N 2.02 2.26 -0.46 1.68 1.01 0.14 -1.05 120.40 125.99 1ofq s VAL 3071Ca 0.31 -0.88 -0.12 0.00 0.00 0.00 0.00 61.98 61.29 1ofq s VAL 3071Cb -0.16 -1.95 0.09 0.00 0.00 0.00 0.00 36.38 34.36 1ofq s VAL 3071CO 0.11 0.52 0.35 -0.63 0.00 0.00 0.00 175.10 175.46 1ofq s ILE 3072N 1.23 4.71 -0.03 2.22 -1.09 -0.60 -0.17 121.20 127.47 1ofq s ILE 3072Ca 0.03 -1.36 0.06 0.00 -2.23 0.00 0.00 60.65 57.15 1ofq s ILE 3072Cb -0.14 -3.91 -0.01 0.00 -1.58 0.00 0.00 42.46 36.82 1ofq s ILE 3072CO -0.10 -0.63 -0.21 -0.69 -1.23 0.00 0.00 174.94 172.09 1ofq s VAL 3073N 1.51 1.67 -4.84 2.92 1.01 -0.49 -0.59 120.40 121.60 1ofq s VAL 3073Ca 0.04 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1ofq s VAL 3073Cb -0.25 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1ofq s VAL 3073CO 0.03 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1ofq n GLY 3074N 2.81 -2.85 3.73 4.51 0.00 -0.82 0.48 105.19 113.06 1ofq n GLY 3074Ca -0.17 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.19 1ofq n GLY 3074CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ofq s PRO 3075N -2.00 2.41 0.26 1.61 0.02 -0.13 -0.36 135.00 136.82 1ofq s PRO 3075Ca 0.00 1.85 -0.03 0.00 0.02 0.00 0.00 61.00 62.85 1ofq s PRO 3075Cb 0.00 -1.85 0.42 0.00 0.02 0.00 0.00 34.50 33.09 1ofq s PRO 3075CO 0.00 -1.65 1.86 0.00 -0.33 0.00 0.00 177.00 176.87 1ofq s SER 3077N -5.79 -0.45 -0.27 0.00 1.04 -1.26 -4.60 113.70 102.36 1ofq s SER 3077Ca -0.12 0.32 -0.10 0.00 0.48 0.00 0.00 55.95 56.52 1ofq s SER 3077Cb 0.20 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.75 1ofq s SER 3077CO 0.80 -0.63 0.15 -0.63 0.98 0.00 0.00 173.24 173.91 1ofq s ILE 3078N -1.86 5.01 0.00 -1.02 -1.09 -0.65 -4.83 121.20 116.76 1ofq s ILE 3078Ca -0.09 0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.40 1ofq s ILE 3078Cb -0.01 -3.38 0.00 0.00 -1.58 0.00 0.00 42.46 37.49 1ofq s ILE 3078CO 0.03 0.28 0.29 0.00 -1.23 0.00 0.00 174.94 174.30 1ofq n HIS 3079N 5.02 0.00 -3.64 3.97 1.44 -1.26 -4.47 115.22 116.29 1ofq n HIS 3079Ca -0.15 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.32 1ofq n HIS 3079Cb 0.52 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.46 1ofq n HIS 3079CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1ofq s ASP 3080N -0.32 2.12 0.18 4.39 -1.08 -1.26 -5.01 116.67 115.71 1ofq s ASP 3080Ca 0.00 -0.47 -0.08 0.00 -0.52 0.00 0.00 52.55 51.47 1ofq s ASP 3080Cb 0.00 -0.25 0.08 0.00 -1.46 0.00 0.00 42.92 41.29 1ofq s ASP 3080CO 0.00 -0.32 1.62 -0.07 0.52 0.00 0.00 175.17 176.92 1ofq h LEU 3081N 8.41 1.01 0.17 -1.34 3.38 -1.98 -1.68 115.31 123.27 1ofq h LEU 3081Ca -0.15 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 1ofq h LEU 3081Cb 1.14 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1ofq h LEU 3081CO 0.26 1.10 -0.08 -0.33 0.09 0.00 0.00 178.44 179.49 1ofq h GLU 3082N 0.91 -0.22 -0.41 1.13 3.07 -1.99 -0.44 114.58 116.64 1ofq h GLU 3082Ca 0.15 0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 59.02 1ofq h GLU 3082Cb 0.63 0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.57 1ofq h GLU 3082CO 0.04 -0.05 0.24 0.00 -1.40 0.00 0.00 179.01 177.84 1ofq h ALA 3083N 0.48 1.66 -0.49 3.43 0.00 -1.99 -1.59 119.26 120.76 1ofq h ALA 3083Ca -0.02 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1ofq h ALA 3083Cb 0.26 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1ofq h ALA 3083CO 0.04 0.30 -0.17 0.00 0.00 0.00 0.00 179.25 179.41 1ofq h ALA 3084N 1.71 0.77 -0.57 0.00 0.00 -0.94 -1.98 119.26 118.25 1ofq h ALA 3084Ca 0.15 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 1ofq h ALA 3084Cb -0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1ofq h ALA 3084CO -0.03 0.66 -0.03 0.37 0.00 0.00 0.00 179.25 180.23 1ofq h GLN 3085N 0.84 1.03 -0.37 0.00 5.75 -0.23 0.20 115.11 122.33 1ofq h GLN 3085Ca 0.12 -0.34 -0.04 0.00 -0.15 0.00 0.00 58.65 58.24 1ofq h GLN 3085Cb 0.73 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.18 1ofq h GLN 3085CO 0.06 1.03 0.10 1.49 -2.65 0.00 0.00 178.83 178.86 1ofq h GLU 3086N 0.92 0.60 -0.34 1.69 4.81 -1.22 -1.05 114.58 119.98 1ofq h GLU 3086Ca 0.16 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1ofq h GLU 3086Cb 0.59 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1ofq h GLU 3086CO 0.03 0.63 0.21 -0.92 -0.73 0.00 0.00 179.01 178.23 1ofq h TYR 3087N 0.46 0.45 -0.45 0.92 3.20 -1.10 -2.39 116.97 118.06 1ofq h TYR 3087Ca 0.12 0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.05 1ofq h TYR 3087Cb 0.29 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.36 1ofq h TYR 3087CO 0.02 0.32 0.15 0.00 -1.64 0.00 0.00 178.16 177.01 1ofq h ALA 3088N 1.09 0.53 -0.84 1.82 0.00 -0.36 -0.46 119.26 121.05 1ofq h ALA 3088Ca 0.12 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.14 1ofq h ALA 3088Cb -0.00 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 1ofq h ALA 3088CO -0.02 -0.24 0.55 -0.07 0.00 0.00 0.00 179.25 179.46 1ofq h LEU 3089N 0.32 0.86 -0.20 0.00 4.07 -0.87 0.16 115.31 119.64 1ofq h LEU 3089Ca 0.21 -0.00 -0.06 0.00 0.08 0.00 0.00 57.88 58.11 1ofq h LEU 3089Cb 0.22 -0.19 -0.00 0.00 1.08 0.00 0.00 40.66 41.76 1ofq h LEU 3089CO -0.22 0.57 -0.12 0.03 -1.08 0.00 0.00 178.44 177.61 1ofq h ARG 3090N 0.98 0.44 -0.50 1.13 3.08 -0.79 -2.63 114.38 116.10 1ofq h ARG 3090Ca 0.35 -0.20 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 1ofq h ARG 3090Cb 0.12 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1ofq h ARG 3090CO -0.11 0.74 0.09 1.25 -1.07 0.00 0.00 179.97 180.87 1ofq h LEU 3091N 0.12 0.72 0.16 3.04 5.85 -0.59 -2.00 115.31 122.61 1ofq h LEU 3091Ca 0.04 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1ofq h LEU 3091Cb 0.63 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1ofq h LEU 3091CO 0.03 0.73 -0.08 0.50 -0.34 0.00 0.00 178.44 179.29 1ofq h LYS 3092N 0.74 -0.20 -0.38 1.25 1.63 -0.64 0.17 116.57 119.14 1ofq h LYS 3092Ca 0.16 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 60.03 1ofq h LYS 3092Cb 0.32 0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.95 1ofq h LYS 3092CO 0.00 -0.13 0.11 -0.22 -3.45 0.00 0.00 179.45 175.76 1ofq h LYS 3093N -0.22 0.25 0.00 1.90 3.64 -1.25 -1.38 116.57 119.52 1ofq h LYS 3093Ca -0.02 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1ofq h LYS 3093Cb 0.17 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1ofq h LYS 3093CO 0.04 0.16 -0.18 1.25 -2.27 0.00 0.00 179.45 178.45 1ofq h LEU 3094N 0.25 0.00 -0.20 5.20 6.46 -1.12 -2.74 115.31 123.16 1ofq h LEU 3094Ca 0.18 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.89 1ofq h LEU 3094Cb 0.18 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.11 1ofq h LEU 3094CO -0.20 0.18 -0.06 0.28 -0.62 0.00 0.00 178.44 178.01 1ofq h SER 3095N 0.00 0.39 -0.32 1.25 0.02 0.42 -2.34 113.55 112.98 1ofq h SER 3095Ca -0.00 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 1ofq h SER 3095Cb 0.58 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1ofq h SER 3095CO 0.02 0.69 0.21 0.44 -1.14 0.00 0.00 176.83 177.05 1ofq h ASP 3096N 0.10 0.37 0.04 3.07 3.45 -1.14 0.23 116.42 122.54 1ofq h ASP 3096Ca 0.05 -0.01 -0.12 0.00 0.43 0.00 0.00 57.03 57.38 1ofq h ASP 3096Cb 0.52 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 1ofq h ASP 3096CO 0.02 0.28 -0.37 -0.08 -1.57 0.00 0.00 179.24 177.52 1ofq h GLU 3097N 0.44 0.45 -0.26 3.56 4.81 -1.22 -3.28 114.58 119.08 1ofq h GLU 3097Ca 0.12 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1ofq h GLU 3097Cb -0.04 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1ofq h GLU 3097CO -0.02 0.75 0.00 1.28 -0.73 0.00 0.00 179.01 180.29 1ofq n LEU 3098N -4.05 3.19 -0.27 1.64 4.77 -0.68 -4.72 117.00 116.88 1ofq n LEU 3098Ca -0.01 -2.48 0.23 0.00 -0.03 0.00 0.00 56.01 53.71 1ofq n LEU 3098Cb 0.48 -0.35 0.55 0.00 -2.33 0.00 0.00 43.42 41.77 1ofq n LEU 3098CO 0.43 0.69 1.23 0.11 -1.33 0.00 0.00 177.39 178.52 1ofq h LYS 3099N 1.63 0.32 0.00 3.23 1.57 -0.64 0.16 116.57 122.84 1ofq h LYS 3099Ca 0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1ofq h LYS 3099Cb 1.02 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.25 1ofq h LYS 3099CO 0.09 0.21 -0.08 0.78 -0.57 0.00 0.00 179.45 179.88 1ofq h GLY 3100N 0.33 0.00 0.00 3.86 0.00 -1.86 -3.26 103.07 102.13 1ofq h GLY 3100Ca 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.84 1ofq h GLY 3100CO -0.18 0.00 -1.17 1.22 0.00 0.00 0.00 176.54 176.41 1ofq n ASP 3101N -3.75 4.22 -4.07 0.19 8.00 -0.02 -4.86 116.55 116.28 1ofq n ASP 3101Ca -0.02 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.34 1ofq n ASP 3101Cb 0.18 1.07 -0.12 0.00 -0.02 0.00 0.00 41.12 42.23 1ofq n ASP 3101CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ofq s LEU 3102N -3.39 2.23 -0.34 0.64 1.43 0.35 -2.18 118.68 117.42 1ofq s LEU 3102Ca -0.01 -0.51 -0.01 0.00 -1.03 0.00 0.00 54.13 52.58 1ofq s LEU 3102Cb 0.02 -0.24 0.08 0.00 0.03 0.00 0.00 46.19 46.08 1ofq s LEU 3102CO 0.14 -0.15 0.06 -0.55 0.23 0.00 0.00 176.35 176.08 1ofq s SER 3103N -1.42 4.94 -0.17 2.29 0.15 -0.41 -4.11 113.70 114.97 1ofq s SER 3103Ca -0.07 -1.67 -0.12 0.00 0.70 0.00 0.00 55.95 54.78 1ofq s SER 3103Cb -0.09 -1.72 -0.05 0.00 -1.71 0.00 0.00 66.02 62.45 1ofq s SER 3103CO 0.01 -0.36 0.23 -0.63 1.20 0.00 0.00 173.24 173.69 1ofq s ILE 3104N 1.14 5.35 -0.11 6.45 1.01 -1.26 -0.69 121.20 133.09 1ofq s ILE 3104Ca 0.01 0.41 0.03 0.00 0.00 0.00 0.00 60.65 61.10 1ofq s ILE 3104Cb -0.21 -3.56 0.01 0.00 0.01 0.00 0.00 42.46 38.71 1ofq s ILE 3104CO -0.04 0.43 -0.19 -0.63 0.00 0.00 0.00 174.94 174.51 1ofq s ILE 3105N 0.27 1.74 0.22 2.92 1.01 0.76 -4.57 121.20 123.55 1ofq s ILE 3105Ca 0.14 -0.81 -0.30 0.00 0.00 0.00 0.00 60.65 59.68 1ofq s ILE 3105Cb -0.12 -1.54 -0.09 0.00 0.01 0.00 0.00 42.46 40.72 1ofq s ILE 3105CO 0.02 0.49 1.17 -0.32 0.00 0.00 0.00 174.94 176.30 1ofq s MET 3106N 0.71 4.54 -0.30 2.79 -2.45 0.54 -1.39 119.30 123.73 1ofq s MET 3106Ca -0.11 1.86 -0.29 0.00 -1.25 0.00 0.00 55.69 55.90 1ofq s MET 3106Cb -0.16 -3.22 0.00 0.00 1.25 0.00 0.00 34.83 32.71 1ofq s MET 3106CO 0.02 0.02 1.30 0.50 1.05 0.00 0.00 175.02 177.91 1ofq s ARG 3107N -0.74 3.91 -0.54 4.11 3.52 0.18 -0.35 118.95 129.03 1ofq s ARG 3107Ca 0.50 1.24 0.07 0.00 -0.13 0.00 0.00 55.73 57.40 1ofq s ARG 3107Cb -0.33 -3.88 0.32 0.00 -1.56 0.00 0.00 34.95 29.50 1ofq s ARG 3107CO 0.39 -1.13 0.85 0.00 -0.81 0.00 0.00 175.30 174.61 1ofq n ALA 3108N 7.65 4.00 -2.19 6.12 0.00 0.47 -4.02 120.51 132.54 1ofq n ALA 3108Ca 0.15 -4.43 -0.40 0.00 0.00 0.00 0.00 53.44 48.76 1ofq n ALA 3108Cb 0.47 -0.80 -0.05 0.00 0.00 0.00 0.00 19.45 19.06 1ofq n ALA 3108CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1ofq s TYR 3109N -3.00 3.83 -0.22 0.00 1.51 -1.26 -4.50 117.35 113.71 1ofq s TYR 3109Ca 0.45 1.61 0.20 0.00 -1.01 0.00 0.00 57.07 58.33 1ofq s TYR 3109Cb 0.26 -2.85 0.01 0.00 -0.11 0.00 0.00 41.96 39.28 1ofq s TYR 3109CO -0.10 0.36 1.09 -0.07 -1.11 0.00 0.00 175.55 175.72 1ofq h LEU 3110N 5.07 0.00 -7.00 -1.29 -0.00 -1.89 -1.74 115.31 108.46 1ofq h LEU 3110Ca -0.45 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.42 1ofq h LEU 3110Cb 1.21 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 41.74 1ofq h LEU 3110CO 0.69 0.21 0.25 -1.83 -0.00 0.00 0.00 178.44 177.76 1ofq s GLU 3111N -3.18 1.20 -0.24 1.13 -1.05 -1.26 -1.12 118.70 114.18 1ofq s GLU 3111Ca 0.00 -0.39 -0.09 0.00 -0.15 0.00 0.00 54.97 54.34 1ofq s GLU 3111Cb 0.08 0.56 -0.04 0.00 -0.44 0.00 0.00 34.13 34.29 1ofq s GLU 3111CO 0.78 -0.52 0.11 0.21 0.95 0.00 0.00 175.26 176.79 1ofq s LYS 3112N -3.47 3.85 0.25 -4.83 2.20 -1.26 -4.96 119.74 111.52 1ofq s LYS 3112Ca 0.01 -0.38 -0.30 0.00 -0.36 0.00 0.00 55.97 54.93 1ofq s LYS 3112Cb -0.01 -3.41 -0.10 0.00 -1.51 0.00 0.00 37.83 32.80 1ofq s LYS 3112CO -0.11 -0.06 1.38 -1.25 -0.36 0.00 0.00 175.35 174.96 1ofq s PRO 3113N 1.32 4.31 0.00 4.03 0.04 -1.26 -4.96 135.00 138.49 1ofq s PRO 3113Ca 0.06 2.23 0.00 0.00 0.04 0.00 0.00 61.00 63.33 1ofq s PRO 3113Cb -0.15 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1ofq s PRO 3113CO 0.05 -0.34 0.00 0.54 0.04 0.00 0.00 177.00 177.29 1ofq n ARG 3114N 2.10 0.00 -1.52 4.56 1.74 -1.26 -5.19 116.66 117.09 1ofq n ARG 3114Ca 0.05 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.84 1ofq n ARG 3114Cb 0.41 0.00 0.13 0.00 -1.02 0.00 0.00 32.46 31.98 1ofq n ARG 3114CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1ofq s VAL 3117N 3.67 2.27 0.00 1.55 -7.23 -1.26 -5.24 120.40 114.16 1ofq s VAL 3117Ca 0.00 0.09 0.00 0.00 -1.81 0.00 0.00 61.98 60.26 1ofq s VAL 3117Cb 0.00 -2.82 0.00 0.00 0.56 0.00 0.00 36.38 34.12 1ofq s VAL 3117CO 0.00 -0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.28 1ofq n GLY 3118N -2.12 1.48 3.72 2.32 0.00 -1.26 -5.05 105.19 104.28 1ofq n GLY 3118Ca 0.07 -2.18 -0.61 0.00 0.00 0.00 0.00 46.02 43.30 1ofq n GLY 3118CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1ofq n TRP 3119N -1.25 1.96 1.70 1.61 -0.00 -1.26 -4.83 117.44 115.36 1ofq n TRP 3119Ca 0.00 0.71 0.00 0.00 -0.00 0.00 0.00 57.50 58.21 1ofq n TRP 3119Cb 0.00 -2.39 0.00 0.00 -0.00 0.00 0.00 31.31 28.92 1ofq n TRP 3119CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 177.69 178.05 1ofq n LYS 3120N 5.07 0.87 0.00 5.87 2.85 -1.26 -4.78 118.16 126.78 1ofq n LYS 3120Ca 0.28 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.54 1ofq n LYS 3120Cb 0.07 -1.02 0.00 0.00 -0.65 0.00 0.00 35.03 33.43 1ofq n LYS 3120CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ofq n GLY 3121N 0.35 0.91 0.25 2.58 0.00 -1.26 -4.30 105.19 103.72 1ofq n GLY 3121Ca 0.00 -1.93 0.03 0.00 0.00 0.00 0.00 46.02 44.12 1ofq n GLY 3121CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ofq h LEU 3122N 0.00 0.23 0.04 0.99 5.85 -1.34 0.11 115.31 121.19 1ofq h LEU 3122Ca 0.00 -0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.55 1ofq h LEU 3122Cb 0.00 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 40.98 1ofq h LEU 3122CO 0.00 0.34 -0.54 0.40 -0.34 0.00 0.00 178.44 178.30 1ofq h ILE 3123N 0.24 1.51 0.05 4.05 2.04 -1.79 -2.87 117.51 120.73 1ofq h ILE 3123Ca 0.05 -2.19 -0.24 0.00 1.00 0.00 0.00 64.86 63.48 1ofq h ILE 3123Cb 0.28 2.86 -0.02 0.00 -0.74 0.00 0.00 36.82 39.21 1ofq h ILE 3123CO 0.01 0.62 -1.12 0.78 0.00 0.00 0.00 178.15 178.44 1ofq h ASN 3124N -0.33 0.16 -1.87 1.72 4.21 -1.73 -3.29 115.58 114.45 1ofq h ASN 3124Ca -0.08 -0.18 -0.52 0.00 1.21 0.00 0.00 56.30 56.73 1ofq h ASN 3124Cb 1.31 -0.05 -0.38 0.00 -1.12 0.00 0.00 38.32 38.08 1ofq h ASN 3124CO 0.10 1.14 -1.09 -0.67 -1.29 0.00 0.00 177.43 175.62 1ofq n ASP 3125N -3.41 0.14 0.06 5.81 2.03 0.39 -1.77 116.55 119.80 1ofq n ASP 3125Ca -0.04 -2.82 0.12 0.00 0.52 0.00 0.00 54.79 52.57 1ofq n ASP 3125Cb 0.98 -0.47 0.59 0.00 -0.72 0.00 0.00 41.12 41.49 1ofq n ASP 3125CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1ofq h PRO 3126N 3.73 0.18 -0.00 -0.67 0.13 -1.62 -0.69 132.00 133.06 1ofq h PRO 3126Ca 0.06 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1ofq h PRO 3126Cb 0.91 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1ofq h PRO 3126CO 0.46 0.12 -0.16 -0.25 -0.23 0.00 0.00 178.00 177.94 1ofq n ASP 3127N -4.47 0.29 -3.59 1.44 8.00 -1.26 -4.95 116.55 112.01 1ofq n ASP 3127Ca 0.05 -0.09 -0.28 0.00 0.71 0.00 0.00 54.79 55.18 1ofq n ASP 3127Cb 0.31 -0.15 0.05 0.00 -0.02 0.00 0.00 41.12 41.30 1ofq n ASP 3127CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1ofq n VAL 3128N -1.30 -6.54 -2.06 2.53 0.31 -0.27 -4.68 118.33 106.33 1ofq n VAL 3128Ca 0.10 -1.01 0.00 0.00 -0.01 0.00 0.00 64.34 63.42 1ofq n VAL 3128Cb 0.31 -4.79 -0.00 0.00 -0.91 0.00 0.00 33.84 28.45 1ofq n VAL 3128CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1ofq n ASN 3129N -2.75 0.07 0.00 4.52 2.04 -1.26 -4.27 115.26 113.62 1ofq n ASN 3129Ca -0.09 -1.79 0.00 0.00 -0.44 0.00 0.00 54.58 52.26 1ofq n ASN 3129Cb 0.59 -0.15 0.00 0.00 -2.53 0.00 0.00 39.78 37.69 1ofq n ASN 3129CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1ofq n ASN 3130N 0.06 -3.37 -4.86 0.53 3.02 -1.26 -5.02 115.26 104.36 1ofq n ASN 3130Ca -0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.33 1ofq n ASN 3130Cb 0.71 -1.67 0.07 0.00 -0.61 0.00 0.00 39.78 38.27 1ofq n ASN 3130CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ofq s THR 3131N -1.80 2.37 -0.14 3.41 -4.23 -1.26 -5.09 115.64 108.90 1ofq s THR 3131Ca 0.00 -0.72 0.03 0.00 -1.18 0.00 0.00 61.69 59.82 1ofq s THR 3131Cb 0.00 -2.65 0.01 0.00 1.34 0.00 0.00 72.50 71.20 1ofq s THR 3131CO 0.00 0.00 -0.22 -0.36 -0.54 0.00 0.00 174.62 173.50 1ofq s PHE 3132N -2.88 2.67 -0.43 3.99 0.40 -1.26 -4.40 117.98 116.07 1ofq s PHE 3132Ca 0.62 -1.34 0.08 0.00 -0.60 0.00 0.00 56.93 55.68 1ofq s PHE 3132Cb -0.07 -1.81 0.27 0.00 0.51 0.00 0.00 43.02 41.92 1ofq s PHE 3132CO 0.41 -0.61 0.76 -1.71 0.70 0.00 0.00 175.22 174.77 1ofq n ASN 3133N 4.05 -1.09 -0.25 1.36 2.85 -0.73 -5.00 115.26 116.46 1ofq n ASN 3133Ca -0.20 -3.09 0.11 0.00 -0.11 0.00 0.00 54.58 51.29 1ofq n ASN 3133Cb 0.52 0.55 0.38 0.00 1.24 0.00 0.00 39.78 42.47 1ofq n ASN 3133CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1ofq h ILE 3134N 2.31 0.87 -0.47 -1.44 2.04 -1.74 0.29 117.51 119.37 1ofq h ILE 3134Ca -0.02 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.54 1ofq h ILE 3134Cb 0.98 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1ofq h ILE 3134CO 0.38 0.13 0.06 0.78 0.00 0.00 0.00 178.15 179.49 1ofq h ASN 3135N 0.69 0.76 0.42 1.72 2.35 -1.92 0.18 115.58 119.77 1ofq h ASN 3135Ca 0.42 -0.27 -0.14 0.00 -0.55 0.00 0.00 56.30 55.75 1ofq h ASN 3135Cb 0.64 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 1ofq h ASN 3135CO -0.18 0.84 -0.60 0.50 -1.65 0.00 0.00 177.43 176.34 1ofq h LYS 3136N 0.65 0.18 -0.33 0.81 3.64 -1.63 -2.76 116.57 117.13 1ofq h LYS 3136Ca 0.14 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 1ofq h LYS 3136Cb 0.41 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1ofq h LYS 3136CO 0.01 0.72 0.02 0.78 -2.27 0.00 0.00 179.45 178.72 1ofq h GLY 3137N 1.55 0.62 1.66 5.01 0.00 0.03 -1.68 103.07 110.26 1ofq h GLY 3137Ca -0.01 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 1ofq h GLY 3137CO 0.09 0.40 0.07 1.41 0.00 0.00 0.00 176.54 178.51 1ofq h LEU 3138N 0.39 0.40 -0.35 3.11 3.38 -0.60 -0.13 115.31 121.51 1ofq h LEU 3138Ca 0.10 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1ofq h LEU 3138Cb 0.41 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1ofq h LEU 3138CO 0.01 0.42 -0.09 1.56 0.09 0.00 0.00 178.44 180.43 1ofq h GLN 3139N 0.44 0.67 -0.31 1.13 4.20 -1.18 -1.32 115.11 118.74 1ofq h GLN 3139Ca 0.10 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.52 1ofq h GLN 3139Cb 0.18 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1ofq h GLN 3139CO -0.00 0.84 0.08 0.77 -0.67 0.00 0.00 178.83 179.84 1ofq h SER 3140N 0.46 0.47 -0.81 1.46 0.02 -0.86 0.24 113.55 114.53 1ofq h SER 3140Ca 0.09 -0.23 0.01 0.00 -0.84 0.00 0.00 61.79 60.82 1ofq h SER 3140Cb 0.60 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.97 1ofq h SER 3140CO 0.04 0.58 0.54 0.00 -1.14 0.00 0.00 176.83 176.84 1ofq h ALA 3141N 0.91 1.03 -0.19 3.77 0.00 -0.98 0.12 119.26 123.93 1ofq h ALA 3141Ca 0.10 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 1ofq h ALA 3141Cb 0.29 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ofq h ALA 3141CO 0.00 0.43 -0.63 -0.09 0.00 0.00 0.00 179.25 178.96 1ofq h ARG 3142N 1.10 0.76 -0.73 0.00 2.43 -1.09 -1.75 114.38 115.10 1ofq h ARG 3142Ca 0.30 -0.57 0.01 0.00 -0.81 0.00 0.00 59.98 58.91 1ofq h ARG 3142Cb -0.12 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.49 1ofq h ARG 3142CO -0.07 1.19 0.49 0.37 -1.51 0.00 0.00 179.97 180.44 1ofq h GLN 3143N 0.49 0.96 0.53 0.20 5.75 -0.67 -0.48 115.11 121.90 1ofq h GLN 3143Ca -0.03 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.40 1ofq h GLN 3143Cb 1.26 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 29.57 1ofq h GLN 3143CO 0.13 0.64 -0.45 1.25 -2.65 0.00 0.00 178.83 177.75 1ofq h LEU 3144N 0.99 -1.22 -0.79 -2.39 5.85 -0.66 0.18 115.31 117.28 1ofq h LEU 3144Ca 0.27 0.09 0.13 0.00 0.84 0.00 0.00 57.88 59.21 1ofq h LEU 3144Cb -0.11 0.39 -0.09 0.00 0.37 0.00 0.00 40.66 41.22 1ofq h LEU 3144CO -0.06 -0.64 0.38 -0.26 -0.34 0.00 0.00 178.44 177.52 1ofq h PHE 3145N -0.98 0.66 -0.04 1.25 -1.00 -1.02 -0.74 116.94 115.07 1ofq h PHE 3145Ca -0.06 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.75 1ofq h PHE 3145Cb 0.83 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 40.22 1ofq h PHE 3145CO -0.20 0.16 0.01 0.28 -1.61 0.00 0.00 178.31 176.94 1ofq h VAL 3146N 0.57 1.22 -0.64 -0.55 2.07 -0.86 -2.19 116.25 115.87 1ofq h VAL 3146Ca 0.42 -0.66 0.13 0.00 0.82 0.00 0.00 66.70 67.41 1ofq h VAL 3146Cb 0.58 1.59 -0.11 0.00 -1.52 0.00 0.00 31.29 31.84 1ofq h VAL 3146CO -0.36 0.18 0.03 0.78 0.02 0.00 0.00 177.57 178.22 1ofq h ASN 3147N -0.19 -0.24 0.10 0.57 2.35 0.51 0.15 115.58 118.83 1ofq h ASN 3147Ca 0.01 0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1ofq h ASN 3147Cb 0.28 0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.92 1ofq h ASN 3147CO 0.00 -0.10 -0.05 -0.07 -1.65 0.00 0.00 177.43 175.56 1ofq h LEU 3148N 0.14 -0.11 -1.51 1.61 3.38 -1.16 -3.24 115.31 114.42 1ofq h LEU 3148Ca 0.34 -0.40 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1ofq h LEU 3148Cb 0.55 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1ofq h LEU 3148CO -0.53 0.37 -0.24 0.71 0.09 0.00 0.00 178.44 178.84 1ofq h THR 3149N -0.63 0.87 0.00 0.22 1.35 -1.23 -2.63 112.91 110.86 1ofq h THR 3149Ca -0.01 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.91 1ofq h THR 3149Cb 0.50 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1ofq h THR 3149CO 0.02 0.24 0.00 -3.20 -0.25 0.00 0.00 175.52 172.33 1ofq n ASN 3150N -3.82 0.00 -0.87 5.36 2.85 0.50 -1.68 115.26 117.61 1ofq n ASN 3150Ca -0.02 0.41 0.07 0.00 -0.11 0.00 0.00 54.58 54.94 1ofq n ASN 3150Cb 0.34 -0.45 0.21 0.00 1.24 0.00 0.00 39.78 41.12 1ofq n ASN 3150CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1ofq n ILE 3151N -1.45 1.08 -0.49 -1.44 -5.35 -0.99 -4.74 119.36 105.98 1ofq n ILE 3151Ca 0.03 -1.04 0.00 0.00 -0.27 0.00 0.00 62.75 61.47 1ofq n ILE 3151Cb 0.12 0.46 0.00 0.00 -1.74 0.00 0.00 39.64 38.47 1ofq n ILE 3151CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ofq n GLY 3152N 0.80 0.72 3.28 3.28 0.00 -0.67 -5.06 105.19 107.53 1ofq n GLY 3152Ca 0.16 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 1ofq n GLY 3152CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ofq s LEU 3153N 0.00 3.63 0.58 0.99 2.96 -1.21 -5.02 118.68 120.61 1ofq s LEU 3153Ca 0.00 -0.82 -0.19 0.00 -0.22 0.00 0.00 54.13 52.90 1ofq s LEU 3153Cb 0.00 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 1ofq s LEU 3153CO 0.00 -0.18 1.21 -2.84 -1.32 0.00 0.00 176.35 173.22 1ofq s PRO 3154N 1.42 3.08 0.18 0.98 0.02 -1.26 -3.43 135.00 135.98 1ofq s PRO 3154Ca 0.01 1.83 0.08 0.00 0.02 0.00 0.00 61.00 62.94 1ofq s PRO 3154Cb -0.17 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.32 1ofq s PRO 3154CO -0.00 -1.12 -0.17 0.96 -0.33 0.00 0.00 177.00 176.33 1ofq s ILE 3155N -1.59 1.80 -0.01 2.83 -4.36 -1.26 -0.34 121.20 118.27 1ofq s ILE 3155Ca 0.76 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 59.18 1ofq s ILE 3155Cb -0.30 -1.90 -0.01 0.00 1.25 0.00 0.00 42.46 41.51 1ofq s ILE 3155CO 0.33 -0.40 -0.12 -0.83 0.24 0.00 0.00 174.94 174.17 1ofq s GLY 3156N -2.85 0.59 0.05 6.27 0.00 0.53 -1.57 107.32 110.34 1ofq s GLY 3156Ca 0.18 -0.50 -0.00 0.00 0.00 0.00 0.00 44.72 44.40 1ofq s GLY 3156CO 0.07 -0.37 -0.04 -0.45 0.00 0.00 0.00 173.10 172.30 1ofq s SER 3157N -0.20 0.59 -0.04 1.64 0.15 -0.72 -0.40 113.70 114.72 1ofq s SER 3157Ca 0.03 -0.89 -0.21 0.00 0.70 0.00 0.00 55.95 55.58 1ofq s SER 3157Cb -0.05 0.15 -0.05 0.00 -1.71 0.00 0.00 66.02 64.36 1ofq s SER 3157CO -0.00 -0.50 0.62 -0.70 1.20 0.00 0.00 173.24 173.86 1ofq s GLU 3158N -3.35 4.37 -0.67 5.44 2.12 -1.26 -2.22 118.70 123.12 1ofq s GLU 3158Ca 0.03 0.75 -0.26 0.00 0.36 0.00 0.00 54.97 55.85 1ofq s GLU 3158Cb 0.03 -3.40 0.04 0.00 0.26 0.00 0.00 34.13 31.06 1ofq s GLU 3158CO -0.07 0.22 1.19 -1.64 -0.54 0.00 0.00 175.26 174.42 1ofq s MET 3159N 0.30 3.27 0.03 4.30 -1.94 0.86 -4.87 119.30 121.25 1ofq s MET 3159Ca 0.33 -0.19 -0.18 0.00 -1.71 0.00 0.00 55.69 53.93 1ofq s MET 3159Cb -0.18 -4.13 -0.24 0.00 2.01 0.00 0.00 34.83 32.29 1ofq s MET 3159CO 0.17 -1.93 1.11 1.37 -0.01 0.00 0.00 175.02 175.73 1ofq h LEU 3160N 12.35 0.67 0.00 -0.03 -0.00 -1.95 -3.34 115.31 123.02 1ofq h LEU 3160Ca -0.27 -0.77 0.00 0.00 -0.00 0.00 0.00 57.88 56.83 1ofq h LEU 3160Cb 1.06 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 41.51 1ofq h LEU 3160CO 1.23 1.36 0.00 -0.90 -0.00 0.00 0.00 178.44 180.13 1ofq n ASP 3161N -4.07 0.46 -0.22 0.17 5.68 -1.26 -4.94 116.55 112.38 1ofq n ASP 3161Ca -0.11 -0.64 0.09 0.00 -0.50 0.00 0.00 54.79 53.62 1ofq n ASP 3161Cb 0.77 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.70 1ofq n ASP 3161CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1ofq n THR 3162N 0.00 0.00 -0.13 2.12 -2.24 -1.26 -4.58 114.28 108.19 1ofq n THR 3162Ca 0.00 -0.19 -0.25 0.00 -2.27 0.00 0.00 64.05 61.34 1ofq n THR 3162Cb 0.00 1.11 -0.11 0.00 -2.10 0.00 0.00 70.33 69.23 1ofq n THR 3162CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1ofq n ILE 3163N -0.73 1.52 0.10 2.28 5.41 -1.26 -4.54 119.36 122.14 1ofq n ILE 3163Ca 0.06 -0.46 0.10 0.00 1.00 0.00 0.00 62.75 63.44 1ofq n ILE 3163Cb 0.34 -1.69 0.58 0.00 -0.71 0.00 0.00 39.64 38.16 1ofq n ILE 3163CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1ofq h SER 3164N -0.56 0.16 -0.07 4.38 4.64 -2.01 -1.82 113.55 118.27 1ofq h SER 3164Ca -0.64 -0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.70 1ofq h SER 3164Cb 1.74 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.79 1ofq h SER 3164CO -0.27 0.11 0.07 -0.65 -0.87 0.00 0.00 176.83 175.22 1ofq h PRO 3165N 0.19 0.00 0.00 4.77 0.11 -1.81 -0.32 132.00 134.94 1ofq h PRO 3165Ca 0.12 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 1ofq h PRO 3165Cb 0.26 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 1ofq h PRO 3165CO -0.02 0.00 -0.04 1.96 -0.21 0.00 0.00 178.00 179.69 1ofq h GLN 3166N 0.00 0.00 0.00 1.05 1.08 -1.59 0.25 115.11 115.90 1ofq h GLN 3166Ca 0.03 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1ofq h GLN 3166Cb 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1ofq h GLN 3166CO -0.00 0.04 -1.11 0.66 -0.95 0.00 0.00 178.83 177.46 1ofq n TYR 3167N -4.02 0.58 0.00 2.96 4.02 -0.14 -4.66 117.16 115.90 1ofq n TYR 3167Ca -0.03 0.17 0.00 0.00 -0.01 0.00 0.00 57.90 58.03 1ofq n TYR 3167Cb 0.12 -0.71 0.00 0.00 -0.02 0.00 0.00 39.34 38.73 1ofq n TYR 3167CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1ofq n LEU 3168N -2.35 0.00 -0.31 7.72 4.77 -0.92 -4.87 117.00 121.03 1ofq n LEU 3168Ca 0.00 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.18 1ofq n LEU 3168Cb 0.51 0.00 0.37 0.00 -2.33 0.00 0.00 43.42 41.97 1ofq n LEU 3168CO 0.41 0.00 0.83 0.00 -1.33 0.00 0.00 177.39 177.29 1ofq n ALA 3169N -1.44 0.65 0.27 -1.18 0.00 0.83 -0.68 120.51 118.97 1ofq n ALA 3169Ca 0.00 0.97 0.15 0.00 0.00 0.00 0.00 53.44 54.57 1ofq n ALA 3169Cb 0.25 -0.81 0.83 0.00 0.00 0.00 0.00 19.45 19.72 1ofq n ALA 3169CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1ofq h ASP 3170N 0.00 0.00 -0.15 0.00 2.03 -1.90 -0.42 116.42 115.99 1ofq h ASP 3170Ca 0.64 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.94 1ofq h ASP 3170Cb 1.50 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.00 1ofq h ASP 3170CO -0.81 0.00 0.00 0.18 -1.03 0.00 0.00 179.24 177.58 1ofq n LEU 3171N -2.68 2.51 -4.88 0.15 4.77 0.15 -4.86 117.00 112.15 1ofq n LEU 3171Ca -0.02 -1.30 -0.35 0.00 -0.03 0.00 0.00 56.01 54.31 1ofq n LEU 3171Cb 0.20 -0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.15 1ofq n LEU 3171CO 0.13 0.52 -0.09 -0.69 -1.33 0.00 0.00 177.39 175.93 1ofq s VAL 3172N -1.15 5.36 -0.24 4.08 1.01 -0.17 -4.50 120.40 124.78 1ofq s VAL 3172Ca 0.21 0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.45 1ofq s VAL 3172Cb 0.13 -3.53 -0.08 0.00 0.00 0.00 0.00 36.38 32.91 1ofq s VAL 3172CO 0.19 0.46 0.25 -1.20 0.00 0.00 0.00 175.10 174.80 1ofq n SER 3173N 1.43 1.04 -3.70 3.32 7.64 -0.61 -4.88 113.62 117.84 1ofq n SER 3173Ca -0.14 -0.51 -0.12 0.00 1.01 0.00 0.00 58.87 59.11 1ofq n SER 3173Cb 0.53 1.07 -0.10 0.00 -1.01 0.00 0.00 64.21 64.71 1ofq n SER 3173CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1ofq s PHE 3174N -1.83 -0.58 0.10 1.43 2.19 -1.19 -4.27 117.98 113.84 1ofq s PHE 3174Ca 0.01 1.34 0.06 0.00 0.33 0.00 0.00 56.93 58.67 1ofq s PHE 3174Cb 0.05 0.23 -0.03 0.00 -1.31 0.00 0.00 43.02 41.96 1ofq s PHE 3174CO 0.28 -0.30 -0.16 0.20 1.83 0.00 0.00 175.22 177.07 1ofq s GLY 3175N 0.65 1.05 0.04 13.12 0.00 -0.78 -1.75 107.32 119.65 1ofq s GLY 3175Ca -0.03 -1.18 0.05 0.00 0.00 0.00 0.00 44.72 43.56 1ofq s GLY 3175CO -0.04 -1.21 -0.15 0.00 0.00 0.00 0.00 173.10 171.69 1ofq s ALA 3176N -1.57 1.28 -0.16 3.20 0.00 -0.94 -1.08 121.76 122.48 1ofq s ALA 3176Ca 0.04 -0.87 -0.08 0.00 0.00 0.00 0.00 51.96 51.06 1ofq s ALA 3176Cb -0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 1ofq s ALA 3176CO 0.03 0.25 0.10 0.42 0.00 0.00 0.00 175.76 176.56 1ofq s ILE 3177N -0.85 5.12 0.49 0.00 -1.09 -0.43 -0.10 121.20 124.34 1ofq s ILE 3177Ca 0.03 0.08 -0.22 0.00 -2.23 0.00 0.00 60.65 58.30 1ofq s ILE 3177Cb -0.08 -3.28 -0.08 0.00 -1.58 0.00 0.00 42.46 37.43 1ofq s ILE 3177CO 0.01 0.51 1.01 0.61 -1.23 0.00 0.00 174.94 175.85 1ofq n GLY 3178N 3.03 -0.20 0.29 6.18 0.00 -1.25 -4.47 105.19 108.77 1ofq n GLY 3178Ca -0.17 0.04 0.01 0.00 0.00 0.00 0.00 46.02 45.89 1ofq n GLY 3178CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ofq h ALA 3179N 1.21 1.45 0.00 4.61 0.00 -1.97 -1.98 119.26 122.58 1ofq h ALA 3179Ca -0.46 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1ofq h ALA 3179Cb 1.34 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ofq h ALA 3179CO 0.55 0.41 0.00 0.54 0.00 0.00 0.00 179.25 180.75 1ofq n ARG 3180N -4.34 0.06 -0.09 0.00 1.74 -1.26 -2.90 116.66 109.87 1ofq n ARG 3180Ca 0.03 0.35 0.06 0.00 -0.77 0.00 0.00 57.85 57.52 1ofq n ARG 3180Cb 0.17 -1.63 0.09 0.00 -1.02 0.00 0.00 32.46 30.07 1ofq n ARG 3180CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ofq n THR 3181N -1.75 1.45 -0.20 0.55 -2.24 -0.76 -4.73 114.28 106.60 1ofq n THR 3181Ca 0.02 -1.69 -0.02 0.00 -2.27 0.00 0.00 64.05 60.09 1ofq n THR 3181Cb 0.16 0.04 0.19 0.00 -2.10 0.00 0.00 70.33 68.62 1ofq n THR 3181CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1ofq h THR 3182N 0.71 1.22 -0.00 4.28 2.02 -1.39 -2.23 112.91 117.52 1ofq h THR 3182Ca 0.00 -0.61 0.00 0.00 0.77 0.00 0.00 66.41 66.57 1ofq h THR 3182Cb 0.91 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1ofq h THR 3182CO 0.00 0.26 -0.14 -0.62 0.37 0.00 0.00 175.52 175.39 1ofq n GLU 3183N -4.34 0.20 -2.37 6.66 1.02 -1.26 -4.71 120.64 115.85 1ofq n GLU 3183Ca 0.06 -0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.73 1ofq n GLU 3183Cb 0.13 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.03 1ofq n GLU 3183CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ofq s SER 3184N -2.84 6.95 0.38 1.62 0.15 -0.84 -4.91 113.70 114.21 1ofq s SER 3184Ca 0.18 1.89 0.05 0.00 0.70 0.00 0.00 55.95 58.77 1ofq s SER 3184Cb 0.19 -2.55 0.75 0.00 -1.71 0.00 0.00 66.02 62.70 1ofq s SER 3184CO 0.55 -0.68 2.03 1.56 1.20 0.00 0.00 173.24 177.91 1ofq h GLN 3185N 7.83 0.68 -0.85 5.44 1.08 -1.90 -1.33 115.11 126.06 1ofq h GLN 3185Ca -0.34 -0.04 0.03 0.00 -1.45 0.00 0.00 58.65 56.85 1ofq h GLN 3185Cb 1.15 -0.15 -0.05 0.00 -0.05 0.00 0.00 27.48 28.38 1ofq h GLN 3185CO 0.91 0.45 0.55 -0.07 -0.95 0.00 0.00 178.83 179.72 1ofq h LEU 3186N 0.69 0.91 -0.04 1.46 3.38 -1.93 0.21 115.31 119.98 1ofq h LEU 3186Ca 0.19 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.00 1ofq h LEU 3186Cb -0.07 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1ofq h LEU 3186CO -0.04 0.62 -0.72 0.45 0.09 0.00 0.00 178.44 178.85 1ofq h HIS 3187N 1.06 0.00 -0.30 1.13 3.86 -1.64 -1.80 115.15 117.46 1ofq h HIS 3187Ca 0.34 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.37 1ofq h HIS 3187Cb 0.01 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.48 1ofq h HIS 3187CO -0.02 0.72 -0.52 0.00 0.86 0.00 0.00 177.93 178.97 1ofq h ARG 3188N 0.00 0.86 -0.33 2.45 3.08 -0.70 -0.18 114.38 119.56 1ofq h ARG 3188Ca -0.01 -0.52 -0.02 0.00 0.07 0.00 0.00 59.98 59.49 1ofq h ARG 3188Cb 1.53 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.62 1ofq h ARG 3188CO 0.09 1.16 0.11 0.93 -1.07 0.00 0.00 179.97 181.20 1ofq h GLU 3189N 0.66 0.50 -0.00 0.04 5.08 -0.58 -1.71 114.58 118.57 1ofq h GLU 3189Ca 0.02 -0.10 0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1ofq h GLU 3189Cb 1.12 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.25 1ofq h GLU 3189CO 0.12 0.52 -0.20 1.25 -1.00 0.00 0.00 179.01 179.70 1ofq h LEU 3190N 0.37 -0.59 -0.70 1.33 5.85 -1.15 -2.39 115.31 118.02 1ofq h LEU 3190Ca 0.11 0.08 0.12 0.00 0.84 0.00 0.00 57.88 59.03 1ofq h LEU 3190Cb 0.22 0.25 -0.09 0.00 0.37 0.00 0.00 40.66 41.42 1ofq h LEU 3190CO -0.01 -0.27 0.27 0.00 -0.34 0.00 0.00 178.44 178.10 1ofq h ALA 3191N 0.57 0.96 0.00 1.25 0.00 -0.83 -0.30 119.26 120.90 1ofq h ALA 3191Ca 0.06 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ofq h ALA 3191Cb 0.40 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1ofq h ALA 3191CO -0.19 -0.20 0.08 0.66 0.00 0.00 0.00 179.25 179.60 1ofq h SER 3192N 0.43 0.00 -0.01 0.00 4.64 -0.78 -2.11 113.55 115.72 1ofq h SER 3192Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1ofq h SER 3192Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1ofq h SER 3192CO -0.37 0.00 -0.08 0.61 -0.87 0.00 0.00 176.83 176.12 1ofq n GLY 3193N -1.25 -0.26 3.76 -0.77 0.00 -0.14 -2.04 105.19 104.49 1ofq n GLY 3193Ca -0.02 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 1ofq n GLY 3193CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ofq s LEU 3194N -1.20 4.57 -0.03 0.99 1.43 -0.79 -4.95 118.68 118.69 1ofq s LEU 3194Ca 0.11 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 55.12 1ofq s LEU 3194Cb 0.09 -3.70 0.04 0.00 0.03 0.00 0.00 46.19 42.65 1ofq s LEU 3194CO 0.19 0.10 1.24 -1.20 0.23 0.00 0.00 176.35 176.91 1ofq n SER 3195N 1.25 3.52 -3.67 2.29 7.64 -1.26 -4.86 113.62 118.52 1ofq n SER 3195Ca -0.01 -2.18 -0.08 0.00 1.01 0.00 0.00 58.87 57.60 1ofq n SER 3195Cb 0.48 -0.64 -0.02 0.00 -1.01 0.00 0.00 64.21 63.02 1ofq n SER 3195CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1ofq s PHE 3196N -0.23 -0.32 0.57 1.43 -0.12 -1.26 -5.02 117.98 113.03 1ofq s PHE 3196Ca 0.04 -0.02 -0.21 0.00 -0.05 0.00 0.00 56.93 56.69 1ofq s PHE 3196Cb 0.03 0.64 -0.04 0.00 -0.63 0.00 0.00 43.02 43.02 1ofq s PHE 3196CO 0.01 -1.01 1.35 -2.30 -0.05 0.00 0.00 175.22 173.22 1ofq n PRO 3197N -0.42 1.59 -4.27 1.99 -0.02 -1.26 -4.84 135.00 127.78 1ofq n PRO 3197Ca -0.09 0.59 -0.18 0.00 -2.02 0.00 0.00 63.50 61.80 1ofq n PRO 3197Cb 0.61 -2.58 -0.15 0.00 -0.02 0.00 0.00 33.50 31.37 1ofq n PRO 3197CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ofq s VAL 3198N -1.30 0.59 0.01 -1.45 1.01 -0.92 -1.87 120.40 116.47 1ofq s VAL 3198Ca 0.74 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 62.47 1ofq s VAL 3198Cb -0.41 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.42 1ofq s VAL 3198CO 0.47 0.18 -0.07 -0.83 0.00 0.00 0.00 175.10 174.85 1ofq s GLY 3199N 0.07 1.75 -0.05 4.51 0.00 -0.24 -1.63 107.32 111.74 1ofq s GLY 3199Ca -0.01 -1.05 0.06 0.00 0.00 0.00 0.00 44.72 43.73 1ofq s GLY 3199CO -0.00 -0.92 -0.24 -1.36 0.00 0.00 0.00 173.10 170.58 1ofq s PHE 3200N -1.01 2.32 0.29 1.90 0.40 0.03 -1.32 117.98 120.60 1ofq s PHE 3200Ca 0.17 -0.64 -0.18 0.00 -0.60 0.00 0.00 56.93 55.68 1ofq s PHE 3200Cb -0.11 -1.52 -0.09 0.00 0.51 0.00 0.00 43.02 41.81 1ofq s PHE 3200CO 0.08 -0.18 0.76 0.15 0.70 0.00 0.00 175.22 176.74 1ofq s LYS 3201N -0.22 4.16 0.79 0.44 1.02 -1.26 -0.13 119.74 124.54 1ofq s LYS 3201Ca -0.01 0.84 -0.13 0.00 0.02 0.00 0.00 55.97 56.69 1ofq s LYS 3201Cb -0.13 -2.62 0.07 0.00 -0.52 0.00 0.00 37.83 34.64 1ofq s LYS 3201CO 0.03 0.25 1.16 0.54 -0.92 0.00 0.00 175.35 176.40 1ofq s ASN 3202N -1.97 3.96 1.01 2.83 4.22 -1.00 -4.34 114.94 119.65 1ofq s ASN 3202Ca 0.50 2.17 -0.12 0.00 -2.14 0.00 0.00 52.86 53.26 1ofq s ASN 3202Cb -0.13 -2.57 0.14 0.00 1.28 0.00 0.00 41.25 39.97 1ofq s ASN 3202CO 0.19 -2.41 0.76 0.61 -2.04 0.00 0.00 177.10 174.21 1ofq n GLY 3203N -0.06 -1.46 0.25 0.45 0.00 0.05 -4.87 105.19 99.55 1ofq n GLY 3203Ca 0.12 -0.83 0.13 0.00 0.00 0.00 0.00 46.02 45.44 1ofq n GLY 3203CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ofq h THR 3204N -2.00 0.41 -0.00 2.61 1.35 -1.91 -2.01 112.91 111.37 1ofq h THR 3204Ca -0.48 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 1ofq h THR 3204Cb 1.30 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 69.26 1ofq h THR 3204CO 0.40 0.13 -0.00 -0.90 -0.25 0.00 0.00 175.52 174.91 1ofq n ASP 3205N -3.39 0.10 0.00 5.36 5.75 -1.26 -0.60 116.55 122.51 1ofq n ASP 3205Ca -0.01 -0.94 0.00 0.00 -0.01 0.00 0.00 54.79 53.84 1ofq n ASP 3205Cb 0.33 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.39 1ofq n ASP 3205CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ofq n GLY 3206N 1.04 3.25 3.80 6.12 0.00 -0.75 -4.19 105.19 114.45 1ofq n GLY 3206Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 1ofq n GLY 3206CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ofq s THR 3207N -2.80 3.20 -2.34 2.61 -4.23 -1.26 -4.74 115.64 106.08 1ofq s THR 3207Ca 0.00 0.39 0.19 0.00 -1.18 0.00 0.00 61.69 61.09 1ofq s THR 3207Cb 0.00 -3.10 0.19 0.00 1.34 0.00 0.00 72.50 70.92 1ofq s THR 3207CO 0.00 -0.51 1.14 0.18 -0.54 0.00 0.00 174.62 174.89 1ofq n LEU 3208N -3.42 2.70 -0.07 4.79 4.32 -1.26 -0.77 117.00 123.28 1ofq n LEU 3208Ca 0.07 -1.09 -0.12 0.00 -0.02 0.00 0.00 56.01 54.85 1ofq n LEU 3208Cb 0.56 -0.04 -0.08 0.00 -1.62 0.00 0.00 43.42 42.24 1ofq n LEU 3208CO 0.56 0.49 0.50 0.78 -1.22 0.00 0.00 177.39 178.50 1ofq h ASN 3209N 3.76 -1.51 -0.96 -1.43 4.21 -1.94 0.11 115.58 117.82 1ofq h ASN 3209Ca 0.00 0.19 0.14 0.00 1.21 0.00 0.00 56.30 57.84 1ofq h ASN 3209Cb 0.81 0.61 -0.08 0.00 -1.12 0.00 0.00 38.32 38.54 1ofq h ASN 3209CO 0.00 -0.36 0.61 -0.37 -1.29 0.00 0.00 177.43 176.02 1ofq h VAL 3210N -0.39 0.86 -0.35 2.81 -1.51 -1.93 0.42 116.25 116.16 1ofq h VAL 3210Ca 0.05 -0.29 -0.16 0.00 -1.23 0.00 0.00 66.70 65.07 1ofq h VAL 3210Cb 0.52 -0.06 -0.00 0.00 -2.13 0.00 0.00 31.29 29.62 1ofq h VAL 3210CO -0.45 0.15 -0.40 0.00 -1.23 0.00 0.00 177.57 175.65 1ofq h ALA 3211N 1.58 0.52 -0.19 5.19 0.00 -1.60 0.36 119.26 125.11 1ofq h ALA 3211Ca 0.48 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1ofq h ALA 3211Cb 0.63 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1ofq h ALA 3211CO -0.25 0.63 -0.01 0.28 0.00 0.00 0.00 179.25 179.90 1ofq h VAL 3212N 0.69 1.26 -0.40 0.00 2.07 0.50 -1.06 116.25 119.30 1ofq h VAL 3212Ca 0.05 -0.89 0.04 0.00 0.82 0.00 0.00 66.70 66.72 1ofq h VAL 3212Cb 0.99 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 1ofq h VAL 3212CO 0.10 0.27 0.17 0.44 0.02 0.00 0.00 177.57 178.56 1ofq h ASP 3213N 0.09 0.21 -0.45 0.57 3.32 -0.17 -1.36 116.42 118.63 1ofq h ASP 3213Ca 0.05 0.03 0.07 0.00 0.02 0.00 0.00 57.03 57.21 1ofq h ASP 3213Cb 0.41 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.90 1ofq h ASP 3213CO 0.01 0.16 0.12 0.00 -1.72 0.00 0.00 179.24 177.81 1ofq h ALA 3214N 1.24 0.52 -0.81 3.45 0.00 -0.73 0.36 119.26 123.29 1ofq h ALA 3214Ca 0.18 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1ofq h ALA 3214Cb 0.13 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1ofq h ALA 3214CO -0.16 -0.28 0.53 0.00 0.00 0.00 0.00 179.25 179.34 1ofq h GLN 3216N 1.07 0.58 -0.31 0.00 4.20 -0.39 -2.49 115.11 117.77 1ofq h GLN 3216Ca 0.31 -0.25 0.01 0.00 0.06 0.00 0.00 58.65 58.78 1ofq h GLN 3216Cb -0.08 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 1ofq h GLN 3216CO -0.08 0.81 0.20 0.00 -0.67 0.00 0.00 178.83 179.09 1ofq h ALA 3217N 0.75 0.39 0.00 3.87 0.00 0.03 -2.38 119.26 121.93 1ofq h ALA 3217Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ofq h ALA 3217Cb 0.63 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ofq h ALA 3217CO 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.14 1ofq h ALA 3218N 1.12 1.00 0.00 0.00 0.00 -0.77 -2.00 119.26 118.61 1ofq h ALA 3218Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ofq h ALA 3218Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ofq h ALA 3218CO -0.03 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.22 1ofq h ALA 3219N 2.00 1.00 -2.30 0.00 0.00 -0.95 0.30 119.26 119.31 1ofq h ALA 3219Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1ofq h ALA 3219Cb 0.22 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.04 1ofq h ALA 3219CO 0.00 0.00 0.03 -1.01 0.00 0.00 0.00 179.25 178.27 1ofq s HIS 3220N -3.43 3.53 0.42 0.00 3.76 -0.75 -3.85 115.29 114.96 1ofq s HIS 3220Ca 0.04 0.74 -0.23 0.00 -0.15 0.00 0.00 55.06 55.46 1ofq s HIS 3220Cb 0.08 -2.23 -0.09 0.00 1.11 0.00 0.00 32.58 31.46 1ofq s HIS 3220CO 0.56 -0.14 1.05 0.45 -0.85 0.00 0.00 174.74 175.81 1ofq s SER 3221N -3.89 6.65 0.08 1.40 0.15 -1.26 -3.79 113.70 113.05 1ofq s SER 3221Ca 0.46 2.03 0.04 0.00 0.70 0.00 0.00 55.95 59.18 1ofq s SER 3221Cb -0.10 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.59 1ofq s SER 3221CO 0.40 -0.56 -0.10 -1.00 1.20 0.00 0.00 173.24 173.17 1ofq s HIS 3222N -1.71 1.01 -0.12 3.44 3.76 -1.21 -4.94 115.29 115.52 1ofq s HIS 3222Ca 0.60 -0.59 0.00 0.00 -0.15 0.00 0.00 55.06 54.92 1ofq s HIS 3222Cb -0.21 -0.56 0.02 0.00 1.11 0.00 0.00 32.58 32.93 1ofq s HIS 3222CO 0.26 -0.01 -0.11 -1.58 -0.85 0.00 0.00 174.74 172.46 1ofq s HIS 3223N -2.00 1.80 0.16 1.40 2.46 -1.26 -0.37 115.29 117.48 1ofq s HIS 3223Ca 0.01 -0.94 -0.25 0.00 0.47 0.00 0.00 55.06 54.36 1ofq s HIS 3223Cb -0.06 -1.38 0.06 0.00 -0.13 0.00 0.00 32.58 31.07 1ofq s HIS 3223CO 0.00 -0.56 0.89 -0.59 -2.47 0.00 0.00 174.74 172.01 1ofq s PHE 3224N 1.50 -0.19 0.10 3.88 -0.12 0.04 -4.97 117.98 118.23 1ofq s PHE 3224Ca 0.03 -0.12 -0.21 0.00 -0.05 0.00 0.00 56.93 56.58 1ofq s PHE 3224Cb -0.13 0.64 -0.07 0.00 -0.63 0.00 0.00 43.02 42.82 1ofq s PHE 3224CO -0.08 -0.87 0.63 -1.64 -0.05 0.00 0.00 175.22 173.21 1ofq s MET 3225N -3.41 4.32 0.08 1.99 -1.94 -1.26 0.13 119.30 119.21 1ofq s MET 3225Ca 0.11 0.87 -0.27 0.00 -1.71 0.00 0.00 55.69 54.68 1ofq s MET 3225Cb -0.02 -3.25 0.08 0.00 2.01 0.00 0.00 34.83 33.66 1ofq s MET 3225CO 0.01 0.62 1.01 0.20 -0.01 0.00 0.00 175.02 176.85 1ofq s GLY 3226N -1.12 -0.31 0.44 -0.03 0.00 -0.02 -4.90 107.32 101.38 1ofq s GLY 3226Ca 0.31 0.45 -0.21 0.00 0.00 0.00 0.00 44.72 45.27 1ofq s GLY 3226CO 0.21 0.11 1.00 0.14 0.00 0.00 0.00 173.10 174.56 1ofq s VAL 3227N -3.08 4.04 0.00 1.40 1.01 -1.26 -0.60 120.40 121.91 1ofq s VAL 3227Ca 0.11 1.33 0.00 0.00 0.00 0.00 0.00 61.98 63.42 1ofq s VAL 3227Cb -0.00 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1ofq s VAL 3227CO -0.01 -0.22 0.00 0.35 0.00 0.00 0.00 175.10 175.22 1ofq n THR 3228N -0.64 0.00 0.00 3.92 -2.24 -0.74 -4.88 114.28 109.70 1ofq n THR 3228Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1ofq n THR 3228Cb 0.53 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 1ofq n THR 3228CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1ofq n HIS 3230N -0.19 0.00 -1.01 4.78 8.25 -1.26 -4.48 115.22 121.31 1ofq n HIS 3230Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ofq n HIS 3230Cb 0.00 -0.47 -0.00 0.00 1.12 0.00 0.00 29.99 30.64 1ofq n HIS 3230CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ofq n GLY 3231N 0.80 0.47 3.62 -1.41 0.00 -1.26 -4.86 105.19 102.55 1ofq n GLY 3231Ca 0.00 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 1ofq n GLY 3231CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ofq s VAL 3232N -1.94 2.86 0.02 1.61 -7.23 -1.26 -5.03 120.40 109.43 1ofq s VAL 3232Ca 0.00 -1.99 -0.22 0.00 -1.81 0.00 0.00 61.98 57.96 1ofq s VAL 3232Cb 0.00 -2.76 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 1ofq s VAL 3232CO 0.00 -0.27 0.67 0.00 -0.31 0.00 0.00 175.10 175.19 1ofq s ALA 3233N -2.46 3.44 0.30 1.32 0.00 -1.26 -1.80 121.76 121.30 1ofq s ALA 3233Ca 0.34 0.14 0.02 0.00 0.00 0.00 0.00 51.96 52.45 1ofq s ALA 3233Cb -0.03 -2.85 -0.02 0.00 0.00 0.00 0.00 23.12 20.22 1ofq s ALA 3233CO 0.19 0.13 0.31 0.00 0.00 0.00 0.00 175.76 176.39 1ofq s ALA 3234N -0.15 1.28 -0.24 0.00 0.00 0.23 -4.95 121.76 117.94 1ofq s ALA 3234Ca 0.34 -1.77 -0.12 0.00 0.00 0.00 0.00 51.96 50.41 1ofq s ALA 3234Cb -0.19 1.35 -0.05 0.00 0.00 0.00 0.00 23.12 24.23 1ofq s ALA 3234CO 0.20 -0.69 0.25 0.42 0.00 0.00 0.00 175.76 175.93 1ofq s ILE 3235N -3.53 5.29 -0.02 0.00 1.01 -1.26 -0.84 121.20 121.86 1ofq s ILE 3235Ca 0.36 0.36 -0.00 0.00 0.00 0.00 0.00 60.65 61.38 1ofq s ILE 3235Cb 0.02 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1ofq s ILE 3235CO 0.21 0.29 0.04 -0.89 0.00 0.00 0.00 174.94 174.59 1ofq s THR 3236N 1.29 4.45 -0.14 2.92 2.01 0.35 -4.92 115.64 121.60 1ofq s THR 3236Ca 0.11 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.67 1ofq s THR 3236Cb -0.14 -2.99 0.02 0.00 0.01 0.00 0.00 72.50 69.41 1ofq s THR 3236CO 0.07 0.41 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.40 1ofq s THR 3237N -1.09 1.39 0.35 -0.82 2.01 -1.26 -0.78 115.64 115.44 1ofq s THR 3237Ca 0.20 -0.54 0.07 0.00 0.31 0.00 0.00 61.69 61.72 1ofq s THR 3237Cb -0.12 -1.35 -0.02 0.00 0.01 0.00 0.00 72.50 71.03 1ofq s THR 3237CO 0.10 0.40 0.40 0.42 -0.69 0.00 0.00 174.62 175.26 1ofq s THR 3238N 1.56 3.70 -0.19 -0.82 -4.23 0.50 -4.94 115.64 111.22 1ofq s THR 3238Ca 0.05 -1.16 0.22 0.00 -1.18 0.00 0.00 61.69 59.61 1ofq s THR 3238Cb -0.13 -3.27 -0.24 0.00 1.34 0.00 0.00 72.50 70.21 1ofq s THR 3238CO -0.10 -0.14 0.69 2.29 -0.54 0.00 0.00 174.62 176.82 1ofq n LYS 3239N -1.55 0.57 0.00 3.99 2.85 -1.26 -3.29 118.16 119.48 1ofq n LYS 3239Ca 0.00 -0.10 0.00 0.00 -1.05 0.00 0.00 58.31 57.16 1ofq n LYS 3239Cb 0.59 -1.59 0.00 0.00 -0.65 0.00 0.00 35.03 33.38 1ofq n LYS 3239CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ofq n GLY 3240N 1.27 2.62 3.10 2.58 0.00 -0.86 -4.00 105.19 109.90 1ofq n GLY 3240Ca -0.02 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 1ofq n GLY 3240CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ofq s ASN 3241N 0.00 3.97 0.00 1.61 3.84 0.11 -4.88 114.94 119.59 1ofq s ASN 3241Ca 0.00 -1.07 0.27 0.00 0.21 0.00 0.00 52.86 52.26 1ofq s ASN 3241Cb 0.00 -1.54 0.83 0.00 -0.55 0.00 0.00 41.25 39.99 1ofq s ASN 3241CO 0.00 -0.12 1.62 -1.84 -2.79 0.00 0.00 177.10 173.98 1ofq n GLU 3242N 4.53 0.33 -1.16 0.43 0.00 -1.26 -3.23 120.64 120.29 1ofq n GLU 3242Ca -0.17 -0.16 -0.28 0.00 0.00 0.00 0.00 57.16 56.56 1ofq n GLU 3242Cb 0.45 -1.50 0.07 0.00 0.00 0.00 0.00 31.44 30.47 1ofq n GLU 3242CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1ofq n HIS 3243N -1.19 2.62 -3.90 -1.84 8.25 -1.26 -4.94 115.22 112.95 1ofq n HIS 3243Ca 0.09 -2.57 -0.34 0.00 -0.26 0.00 0.00 57.72 54.64 1ofq n HIS 3243Cb 0.33 -1.24 -0.05 0.00 1.12 0.00 0.00 29.99 30.14 1ofq n HIS 3243CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ofq s PHE 3245N -1.23 0.88 0.04 0.00 -0.71 -0.64 -4.54 117.98 111.77 1ofq s PHE 3245Ca 0.23 -1.16 -0.14 0.00 -1.04 0.00 0.00 56.93 54.82 1ofq s PHE 3245Cb -0.12 -0.35 -0.06 0.00 -1.21 0.00 0.00 43.02 41.28 1ofq s PHE 3245CO 0.14 -0.70 0.43 0.08 -1.34 0.00 0.00 175.22 173.83 1ofq s VAL 3246N -4.10 5.01 -0.21 -2.49 1.01 -1.26 -0.79 120.40 117.58 1ofq s VAL 3246Ca 0.31 0.75 -0.04 0.00 0.00 0.00 0.00 61.98 63.01 1ofq s VAL 3246Cb 0.05 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 1ofq s VAL 3246CO 0.09 0.47 -0.05 -0.63 0.00 0.00 0.00 175.10 174.98 1ofq s ILE 3247N -1.21 3.42 -0.14 2.22 1.01 0.82 -2.08 121.20 125.24 1ofq s ILE 3247Ca 0.28 -0.48 -0.25 0.00 0.00 0.00 0.00 60.65 60.19 1ofq s ILE 3247Cb -0.16 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.75 1ofq s ILE 3247CO 0.15 0.43 0.82 -0.76 0.00 0.00 0.00 174.94 175.59 1ofq s LEU 3248N 1.31 4.22 -0.04 2.97 1.43 0.52 -2.38 118.68 126.72 1ofq s LEU 3248Ca 0.04 1.22 0.25 0.00 -1.03 0.00 0.00 54.13 54.61 1ofq s LEU 3248Cb -0.14 -3.24 0.43 0.00 0.03 0.00 0.00 46.19 43.26 1ofq s LEU 3248CO -0.02 -0.34 1.16 -2.11 0.23 0.00 0.00 176.35 175.27 1ofq n ARG 3249N 4.88 0.24 -0.39 1.70 1.85 -1.26 -1.45 116.66 122.22 1ofq n ARG 3249Ca 0.04 -2.17 0.05 0.00 -1.00 0.00 0.00 57.85 54.77 1ofq n ARG 3249Cb 0.49 -0.20 -0.01 0.00 -1.05 0.00 0.00 32.46 31.69 1ofq n ARG 3249CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ofq n GLY 3250N 0.33 -1.79 0.00 2.89 0.00 -1.26 -4.04 105.19 101.32 1ofq n GLY 3250Ca 0.05 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1ofq n GLY 3250CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ofq n GLY 3251N -1.40 -0.54 0.30 -0.02 0.00 -0.96 -4.73 105.19 97.85 1ofq n GLY 3251Ca 0.00 -0.85 0.17 0.00 0.00 0.00 0.00 46.02 45.35 1ofq n GLY 3251CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ofq h LYS 3252N 0.00 0.00 -0.78 1.61 1.79 -1.07 -1.68 116.57 116.43 1ofq h LYS 3252Ca 0.00 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.18 1ofq h LYS 3252Cb 0.00 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 30.48 1ofq h LYS 3252CO 0.00 0.04 0.35 0.36 -1.08 0.00 0.00 179.45 179.12 1ofq n LYS 3253N -3.42 3.25 0.00 3.15 2.85 -1.26 -5.02 118.16 117.71 1ofq n LYS 3253Ca -0.02 -3.08 0.00 0.00 -1.05 0.00 0.00 58.31 54.16 1ofq n LYS 3253Cb 0.16 -2.18 0.00 0.00 -0.65 0.00 0.00 35.03 32.36 1ofq n LYS 3253CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ofq n GLY 3254N -0.47 -2.85 3.75 2.58 0.00 -0.63 -4.96 105.19 102.61 1ofq n GLY 3254Ca 0.45 -1.84 -0.35 0.00 0.00 0.00 0.00 46.02 44.29 1ofq n GLY 3254CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ofq s THR 3255N -0.61 2.74 -0.23 2.61 -4.23 -1.26 -2.26 115.64 112.41 1ofq s THR 3255Ca 0.00 0.43 0.19 0.00 -1.18 0.00 0.00 61.69 61.12 1ofq s THR 3255Cb 0.00 -3.10 0.48 0.00 1.34 0.00 0.00 72.50 71.23 1ofq s THR 3255CO 0.00 -0.13 1.14 -0.46 -0.54 0.00 0.00 174.62 174.63 1ofq n ASN 3256N -1.85 2.37 0.00 3.99 0.23 -1.26 -4.80 115.26 113.94 1ofq n ASN 3256Ca 0.13 -2.57 0.11 0.00 -0.53 0.00 0.00 54.58 51.72 1ofq n ASN 3256Cb 0.50 -0.42 -0.09 0.00 -2.08 0.00 0.00 39.78 37.69 1ofq n ASN 3256CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ofq n TYR 3257N -0.52 0.06 -1.30 -2.53 0.18 -1.26 -4.34 117.16 107.45 1ofq n TYR 3257Ca 0.17 0.02 -0.31 0.00 1.88 0.00 0.00 57.90 59.66 1ofq n TYR 3257Cb 0.88 -0.23 0.09 0.00 -0.38 0.00 0.00 39.34 39.70 1ofq n TYR 3257CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 1ofq s ASP 3258N -3.59 4.52 0.26 9.48 -4.77 -1.26 -4.70 116.67 116.60 1ofq s ASP 3258Ca 0.03 1.75 -0.03 0.00 -3.30 0.00 0.00 52.55 51.00 1ofq s ASP 3258Cb 0.15 -2.47 0.40 0.00 -1.09 0.00 0.00 42.92 39.91 1ofq s ASP 3258CO 0.86 -2.01 1.86 0.00 0.70 0.00 0.00 175.17 176.57 1ofq h ALA 3259N -1.11 1.32 0.16 2.11 0.00 -1.93 0.22 119.26 120.02 1ofq h ALA 3259Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1ofq h ALA 3259Cb 1.23 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1ofq h ALA 3259CO 0.53 0.32 -0.15 -0.22 0.00 0.00 0.00 179.25 179.73 1ofq h LYS 3260N 1.04 -0.32 -0.82 0.00 3.64 -1.98 0.17 116.57 118.30 1ofq h LYS 3260Ca 0.42 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.78 1ofq h LYS 3260Cb 0.24 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.09 1ofq h LYS 3260CO -0.19 -0.21 0.36 0.77 -2.27 0.00 0.00 179.45 177.90 1ofq h SER 3261N -0.33 1.11 -0.77 4.20 0.02 -1.73 -2.09 113.55 113.95 1ofq h SER 3261Ca 0.00 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 60.78 1ofq h SER 3261Cb 0.31 -0.29 -0.04 0.00 0.14 0.00 0.00 62.40 62.53 1ofq h SER 3261CO -0.03 0.96 0.42 0.58 -1.14 0.00 0.00 176.83 177.61 1ofq h VAL 3262N 1.18 1.23 0.21 2.27 2.07 -0.25 0.81 116.25 123.77 1ofq h VAL 3262Ca 0.28 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1ofq h VAL 3262Cb 0.17 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1ofq h VAL 3262CO -0.03 0.26 -0.10 0.00 0.02 0.00 0.00 177.57 177.72 1ofq h ALA 3263N 1.38 -0.28 -0.77 1.67 0.00 -0.50 -0.82 119.26 119.93 1ofq h ALA 3263Ca 0.27 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.19 1ofq h ALA 3263Cb 0.03 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 1ofq h ALA 3263CO -0.04 -0.57 0.51 0.93 0.00 0.00 0.00 179.25 180.07 1ofq h GLU 3264N -0.44 0.54 -0.02 0.00 5.08 -0.97 0.01 114.58 118.77 1ofq h GLU 3264Ca -0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1ofq h GLU 3264Cb 0.34 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1ofq h GLU 3264CO 0.05 0.36 -0.01 0.00 -1.00 0.00 0.00 179.01 178.41 1ofq h ALA 3265N 1.63 0.03 -0.05 3.43 0.00 -0.45 -2.96 119.26 120.90 1ofq h ALA 3265Ca 0.37 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1ofq h ALA 3265Cb 0.67 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1ofq h ALA 3265CO -0.14 -0.25 -0.09 0.87 0.00 0.00 0.00 179.25 179.65 1ofq h LYS 3266N -0.34 0.07 -0.23 0.00 1.57 -0.49 -1.81 116.57 115.33 1ofq h LYS 3266Ca 0.01 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1ofq h LYS 3266Cb 0.43 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1ofq h LYS 3266CO 0.00 0.16 0.15 0.00 -0.57 0.00 0.00 179.45 179.20 1ofq h ALA 3267N 1.85 1.89 -0.51 3.86 0.00 -0.85 -2.20 119.26 123.30 1ofq h ALA 3267Ca 0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ofq h ALA 3267Cb 0.20 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1ofq h ALA 3267CO 0.01 0.09 0.03 0.00 0.00 0.00 0.00 179.25 179.39 1ofq n GLN 3268N -4.50 4.21 -3.45 0.00 10.64 -0.68 -4.86 117.38 118.73 1ofq n GLN 3268Ca 0.01 -3.08 -0.43 0.00 -1.83 0.00 0.00 57.00 51.66 1ofq n GLN 3268Cb 0.10 -2.15 -0.09 0.00 -0.86 0.00 0.00 30.24 27.25 1ofq n GLN 3268CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1ofq s LEU 3269N -2.83 5.38 0.87 2.61 1.43 -0.83 -4.92 118.68 120.39 1ofq s LEU 3269Ca 0.51 -1.24 -0.14 0.00 -1.03 0.00 0.00 54.13 52.23 1ofq s LEU 3269Cb 0.40 -2.14 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 1ofq s LEU 3269CO 0.14 -0.57 0.31 -0.81 0.23 0.00 0.00 176.35 175.64 1ofq n PRO 3270N 5.14 -0.05 -1.63 1.29 -0.04 -1.26 -4.83 135.00 133.62 1ofq n PRO 3270Ca -0.12 0.03 -0.39 0.00 -0.04 0.00 0.00 63.50 62.98 1ofq n PRO 3270Cb 0.44 -1.74 0.04 0.00 -0.04 0.00 0.00 33.50 32.20 1ofq n PRO 3270CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ofq n ALA 3271N -3.02 0.38 -1.31 0.55 0.00 -1.26 -2.89 120.51 112.96 1ofq n ALA 3271Ca 0.07 0.09 -0.03 0.00 0.00 0.00 0.00 53.44 53.58 1ofq n ALA 3271Cb 0.52 -2.13 -0.01 0.00 0.00 0.00 0.00 19.45 17.83 1ofq n ALA 3271CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ofq n GLY 3272N 1.18 0.51 3.88 0.00 0.00 -1.26 -5.04 105.19 104.46 1ofq n GLY 3272Ca 0.12 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 1ofq n GLY 3272CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ofq s SER 3273N -2.95 6.32 0.64 1.61 0.01 -1.14 -5.08 113.70 113.11 1ofq s SER 3273Ca 0.00 1.18 -0.06 0.00 1.31 0.00 0.00 55.95 58.38 1ofq s SER 3273Cb 0.00 -2.36 0.03 0.00 0.21 0.00 0.00 66.02 63.90 1ofq s SER 3273CO 0.00 -0.66 0.95 0.20 0.41 0.00 0.00 173.24 174.14 1ofq s ASN 3274N -3.91 5.28 0.88 2.44 0.01 -1.26 -5.02 114.94 113.36 1ofq s ASN 3274Ca 0.52 0.60 -0.11 0.00 -0.71 0.00 0.00 52.86 53.16 1ofq s ASN 3274Cb -0.11 -1.45 0.13 0.00 0.41 0.00 0.00 41.25 40.23 1ofq s ASN 3274CO 0.45 -1.28 1.16 -0.83 -1.51 0.00 0.00 177.10 175.09 1ofq s GLY 3275N -4.39 1.81 0.34 0.66 0.00 0.12 -4.81 107.32 101.05 1ofq s GLY 3275Ca 0.57 0.65 -0.12 0.00 0.00 0.00 0.00 44.72 45.81 1ofq s GLY 3275CO 0.45 1.07 0.72 1.08 0.00 0.00 0.00 173.10 176.42 1ofq s LEU 3276N -6.36 3.99 -0.10 0.66 1.43 0.10 -4.44 118.68 113.97 1ofq s LEU 3276Ca 0.68 1.17 0.03 0.00 -1.03 0.00 0.00 54.13 54.98 1ofq s LEU 3276Cb -0.24 -3.99 0.00 0.00 0.03 0.00 0.00 46.19 41.99 1ofq s LEU 3276CO 0.56 -0.26 -0.21 -0.32 0.23 0.00 0.00 176.35 176.35 1ofq s MET 3277N -3.28 2.79 -0.19 1.70 -2.45 -0.88 -0.76 119.30 116.22 1ofq s MET 3277Ca 0.52 -0.78 -0.06 0.00 -1.25 0.00 0.00 55.69 54.11 1ofq s MET 3277Cb -0.10 -2.16 -0.03 0.00 1.25 0.00 0.00 34.83 33.78 1ofq s MET 3277CO 0.23 0.11 0.04 0.42 1.05 0.00 0.00 175.02 176.87 1ofq s ILE 3278N 0.51 4.39 -0.25 10.11 1.01 0.89 -0.35 121.20 137.51 1ofq s ILE 3278Ca -0.16 -0.17 -0.21 0.00 0.00 0.00 0.00 60.65 60.12 1ofq s ILE 3278Cb -0.17 -2.99 -0.02 0.00 0.01 0.00 0.00 42.46 39.29 1ofq s ILE 3278CO 0.06 0.44 0.65 -0.62 0.00 0.00 0.00 174.94 175.46 1ofq s ASP 3279N 0.72 6.62 0.25 3.58 2.15 -0.53 -0.49 116.67 128.97 1ofq s ASP 3279Ca 0.02 0.76 0.12 0.00 0.43 0.00 0.00 52.55 53.88 1ofq s ASP 3279Cb -0.14 -2.35 0.20 0.00 -0.30 0.00 0.00 42.92 40.34 1ofq s ASP 3279CO 0.02 -0.37 1.51 1.88 -0.17 0.00 0.00 175.17 178.03 1ofq h TYR 3280N 7.82 0.00 -2.24 -5.34 -1.99 -1.30 -3.41 116.97 110.52 1ofq h TYR 3280Ca -0.27 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.46 1ofq h TYR 3280Cb 1.12 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.85 1ofq h TYR 3280CO 0.75 0.66 0.00 0.45 -0.00 0.00 0.00 178.16 180.02 1ofq n SER 3281N -3.49 0.00 0.00 3.88 2.88 -1.25 -3.00 113.62 112.64 1ofq n SER 3281Ca 0.00 -0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 1ofq n SER 3281Cb 0.71 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.17 1ofq n SER 3281CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1ofq n HIS 3282N -0.20 0.00 -0.32 0.66 8.25 -1.26 -1.90 115.22 120.46 1ofq n HIS 3282Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.54 1ofq n HIS 3282Cb 0.00 0.00 0.24 0.00 1.12 0.00 0.00 29.99 31.35 1ofq n HIS 3282CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1ofq h GLY 3283N 0.00 1.48 2.00 -1.41 0.00 -1.93 -1.49 103.07 101.72 1ofq h GLY 3283Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1ofq h GLY 3283CO 0.00 0.01 0.00 3.43 0.00 0.00 0.00 176.54 179.98 1ofq h ASN 3284N 0.73 0.00 -0.50 0.19 2.35 -1.52 -2.31 115.58 114.52 1ofq h ASN 3284Ca 0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.23 1ofq h ASN 3284Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 1ofq h ASN 3284CO -0.33 0.00 0.00 -1.54 -1.65 0.00 0.00 177.43 173.91 1ofq n SER 3285N -2.38 3.52 -3.34 5.81 3.41 -0.60 -4.90 113.62 115.14 1ofq n SER 3285Ca 0.02 -1.99 -0.24 0.00 -0.26 0.00 0.00 58.87 56.41 1ofq n SER 3285Cb 0.27 -0.33 0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1ofq n SER 3285CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ofq n ASN 3286N 1.48 -5.37 -3.76 4.04 4.13 -0.87 -2.11 115.26 112.81 1ofq n ASN 3286Ca 0.21 -0.43 -0.25 0.00 1.68 0.00 0.00 54.58 55.79 1ofq n ASN 3286Cb 0.59 -4.33 0.04 0.00 -1.54 0.00 0.00 39.78 34.55 1ofq n ASN 3286CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1ofq n LYS 3287N -4.22 -5.80 -3.47 3.52 5.02 -0.98 -4.98 118.16 107.25 1ofq n LYS 3287Ca -0.04 0.66 -0.13 0.00 -2.02 0.00 0.00 58.31 56.78 1ofq n LYS 3287Cb 0.58 -5.48 -0.11 0.00 -0.02 0.00 0.00 35.03 30.00 1ofq n LYS 3287CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ofq s ASP 3288N -3.75 0.60 0.56 4.39 -1.08 -0.90 -5.03 116.67 111.46 1ofq s ASP 3288Ca 0.38 0.19 0.25 0.00 -0.52 0.00 0.00 52.55 52.85 1ofq s ASP 3288Cb -0.18 0.83 1.50 0.00 -1.46 0.00 0.00 42.92 43.60 1ofq s ASP 3288CO 0.80 -0.29 2.07 2.19 0.52 0.00 0.00 175.17 180.46 1ofq h PHE 3289N 8.24 0.00 0.00 -5.34 -5.15 -1.84 -1.18 116.94 111.67 1ofq h PHE 3289Ca -0.18 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.58 1ofq h PHE 3289Cb 1.14 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.31 1ofq h PHE 3289CO 0.18 0.00 -0.06 0.00 -2.00 0.00 0.00 178.31 176.42 1ofq h ARG 3290N 0.00 0.00 -0.00 6.09 3.08 -1.92 -2.48 114.38 119.16 1ofq h ARG 3290Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1ofq h ARG 3290Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 1ofq h ARG 3290CO -0.00 0.06 -0.24 0.09 -1.07 0.00 0.00 179.97 178.81 1ofq n ASN 3291N -3.68 0.35 -0.16 7.04 5.03 -0.44 -4.03 115.26 119.36 1ofq n ASN 3291Ca -0.02 -0.09 -0.05 0.00 0.87 0.00 0.00 54.58 55.28 1ofq n ASN 3291Cb 0.17 -0.08 0.04 0.00 -1.02 0.00 0.00 39.78 38.89 1ofq n ASN 3291CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 1ofq h GLN 3292N 0.17 0.48 0.00 3.52 4.20 -1.57 0.08 115.11 121.99 1ofq h GLN 3292Ca 0.00 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 1ofq h GLN 3292Cb 0.47 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1ofq h GLN 3292CO 0.00 0.32 -0.25 -1.00 -0.67 0.00 0.00 178.83 177.22 1ofq h PRO 3293N 0.49 0.00 -0.11 1.46 0.13 -1.79 0.71 132.00 132.89 1ofq h PRO 3293Ca 0.21 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.23 1ofq h PRO 3293Cb 0.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.22 1ofq h PRO 3293CO -0.14 0.25 -0.42 0.87 -0.23 0.00 0.00 178.00 178.33 1ofq h LYS 3294N 0.00 0.26 -0.04 0.86 1.57 -1.43 -1.10 116.57 116.68 1ofq h LYS 3294Ca -0.00 -0.12 -0.19 0.00 -1.87 0.00 0.00 60.65 58.47 1ofq h LYS 3294Cb 0.50 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1ofq h LYS 3294CO 0.03 0.64 -0.77 0.28 -0.57 0.00 0.00 179.45 179.05 1ofq h VAL 3295N 0.21 1.41 -0.67 0.50 2.07 -0.07 -2.93 116.25 116.78 1ofq h VAL 3295Ca 0.02 -2.28 0.01 0.00 0.82 0.00 0.00 66.70 65.27 1ofq h VAL 3295Cb 0.84 2.23 -0.03 0.00 -1.52 0.00 0.00 31.29 32.80 1ofq h VAL 3295CO 0.07 0.68 0.44 -1.13 0.02 0.00 0.00 177.57 177.64 1ofq h ASN 3296N 0.21 0.76 0.49 0.57 -1.24 -0.12 -0.71 115.58 115.53 1ofq h ASN 3296Ca -0.04 -0.02 -0.01 0.00 0.71 0.00 0.00 56.30 56.94 1ofq h ASN 3296Cb 1.36 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 40.21 1ofq h ASN 3296CO 0.13 0.55 -0.36 0.44 -1.29 0.00 0.00 177.43 176.89 1ofq h ASP 3297N 0.89 -0.93 -0.81 1.15 3.32 -1.07 0.57 116.42 119.56 1ofq h ASP 3297Ca 0.25 0.06 0.08 0.00 0.02 0.00 0.00 57.03 57.45 1ofq h ASP 3297Cb -0.09 0.29 -0.05 0.00 0.22 0.00 0.00 39.33 39.69 1ofq h ASP 3297CO -0.06 -0.54 0.53 0.58 -1.72 0.00 0.00 179.24 178.03 1ofq h VAL 3298N -0.83 0.98 -0.05 -1.35 2.07 -1.34 -0.65 116.25 115.08 1ofq h VAL 3298Ca -0.05 -0.27 -0.14 0.00 0.82 0.00 0.00 66.70 67.06 1ofq h VAL 3298Cb 0.70 0.12 0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1ofq h VAL 3298CO 0.02 0.15 -0.50 0.58 0.02 0.00 0.00 177.57 177.83 1ofq h VAL 3299N 0.80 1.41 -0.83 2.57 2.07 -0.67 -3.12 116.25 118.48 1ofq h VAL 3299Ca 0.36 -1.92 0.04 0.00 0.82 0.00 0.00 66.70 66.00 1ofq h VAL 3299Cb 0.36 2.42 -0.05 0.00 -1.52 0.00 0.00 31.29 32.50 1ofq h VAL 3299CO -0.14 0.56 0.52 0.00 0.02 0.00 0.00 177.57 178.54 1ofq h GLU 3301N 1.00 -0.21 0.00 0.00 4.81 -1.17 0.36 114.58 119.38 1ofq h GLU 3301Ca 0.34 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.59 1ofq h GLU 3301Cb 0.06 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1ofq h GLU 3301CO -0.13 -0.14 -0.04 1.96 -0.73 0.00 0.00 179.01 179.93 1ofq h GLN 3302N -0.22 -0.07 -0.64 1.92 4.20 -1.38 -1.87 115.11 117.05 1ofq h GLN 3302Ca 0.14 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.92 1ofq h GLN 3302Cb 0.44 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.18 1ofq h GLN 3302CO -0.38 -0.05 0.33 0.82 -0.67 0.00 0.00 178.83 178.88 1ofq h ILE 3303N -0.07 0.93 -0.33 2.54 2.04 -0.80 -1.78 117.51 120.05 1ofq h ILE 3303Ca 0.02 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1ofq h ILE 3303Cb 0.09 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1ofq h ILE 3303CO -0.04 0.11 0.06 0.00 0.00 0.00 0.00 178.15 178.28 1ofq h ALA 3304N 1.35 1.49 -0.10 1.87 0.00 -0.02 -2.31 119.26 121.54 1ofq h ALA 3304Ca 0.29 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ofq h ALA 3304Cb 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1ofq h ALA 3304CO -0.20 0.37 0.00 0.09 0.00 0.00 0.00 179.25 179.51 1ofq n ASN 3305N -4.34 0.57 0.00 0.00 3.02 -0.73 -3.79 115.26 110.00 1ofq n ASN 3305Ca 0.02 -1.90 0.00 0.00 -0.03 0.00 0.00 54.58 52.67 1ofq n ASN 3305Cb 0.19 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 1ofq n ASN 3305CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ofq n GLY 3306N 0.72 0.81 3.61 7.41 0.00 -0.87 -5.03 105.19 111.84 1ofq n GLY 3306Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1ofq n GLY 3306CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ofq s GLU 3307N -0.66 3.42 0.00 1.61 2.56 -0.84 -4.86 118.70 119.92 1ofq s GLU 3307Ca 0.00 1.60 0.23 0.00 0.00 0.00 0.00 54.97 56.80 1ofq s GLU 3307Cb 0.00 -4.19 0.02 0.00 2.00 0.00 0.00 34.13 31.95 1ofq s GLU 3307CO 0.00 -1.76 1.09 0.09 -0.56 0.00 0.00 175.26 174.12 1ofq n ASN 3308N 10.06 1.46 0.19 -1.70 3.02 -1.26 -4.29 115.26 122.74 1ofq n ASN 3308Ca 0.23 -1.19 0.07 0.00 -0.03 0.00 0.00 54.58 53.67 1ofq n ASN 3308Cb 0.46 0.62 0.23 0.00 -0.61 0.00 0.00 39.78 40.48 1ofq n ASN 3308CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ofq h ALA 3309N 3.49 0.87 -1.70 5.41 0.00 -1.96 -3.41 119.26 121.96 1ofq h ALA 3309Ca 0.00 -0.27 -0.60 0.00 0.00 0.00 0.00 54.91 54.05 1ofq h ALA 3309Cb 0.62 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.25 1ofq h ALA 3309CO 0.00 0.37 0.68 0.42 0.00 0.00 0.00 179.25 180.72 1ofq s ILE 3310N -3.28 4.25 -0.99 0.00 1.01 -1.26 0.02 121.20 120.95 1ofq s ILE 3310Ca 0.03 0.29 0.13 0.00 0.00 0.00 0.00 60.65 61.10 1ofq s ILE 3310Cb 0.08 -4.63 -0.05 0.00 0.01 0.00 0.00 42.46 37.87 1ofq s ILE 3310CO 0.69 -1.28 0.67 0.35 0.00 0.00 0.00 174.94 175.36 1ofq n THR 3311N 6.25 0.00 -3.60 2.92 -2.24 0.06 -4.92 114.28 112.75 1ofq n THR 3311Ca 0.02 -0.31 -0.12 0.00 -2.27 0.00 0.00 64.05 61.37 1ofq n THR 3311Cb 0.48 1.10 -0.05 0.00 -2.10 0.00 0.00 70.33 69.76 1ofq n THR 3311CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ofq s GLY 3312N -1.80 -0.34 0.07 3.38 0.00 -0.98 -0.71 107.32 106.94 1ofq s GLY 3312Ca 0.09 0.21 0.00 0.00 0.00 0.00 0.00 44.72 45.02 1ofq s GLY 3312CO 0.39 -0.06 -0.05 -1.34 0.00 0.00 0.00 173.10 172.03 1ofq s VAL 3313N -3.27 0.43 -0.08 1.40 -7.23 -0.22 -0.08 120.40 111.35 1ofq s VAL 3313Ca -0.01 -1.78 0.01 0.00 -1.81 0.00 0.00 61.98 58.40 1ofq s VAL 3313Cb 0.01 -1.48 0.02 0.00 0.56 0.00 0.00 36.38 35.48 1ofq s VAL 3313CO -0.08 -0.89 -0.11 -0.04 -0.31 0.00 0.00 175.10 173.67 1ofq s MET 3314N -3.64 1.71 -0.04 4.82 -1.94 0.36 -1.56 119.30 119.01 1ofq s MET 3314Ca 0.07 -0.39 0.03 0.00 -1.71 0.00 0.00 55.69 53.70 1ofq s MET 3314Cb 0.05 -1.51 0.00 0.00 2.01 0.00 0.00 34.83 35.39 1ofq s MET 3314CO -0.07 -0.06 -0.13 0.42 -0.01 0.00 0.00 175.02 175.17 1ofq s ILE 3315N 0.98 1.12 -0.51 2.53 1.01 0.24 -0.81 121.20 125.77 1ofq s ILE 3315Ca -0.08 -0.53 -0.17 0.00 0.00 0.00 0.00 60.65 59.87 1ofq s ILE 3315Cb -0.15 -0.99 0.09 0.00 0.01 0.00 0.00 42.46 41.42 1ofq s ILE 3315CO -0.00 0.34 0.50 -1.61 0.00 0.00 0.00 174.94 174.17 1ofq s GLU 3316N 0.25 3.02 0.07 2.79 2.02 -1.26 -1.94 118.70 123.66 1ofq s GLU 3316Ca -0.06 -1.33 0.05 0.00 0.02 0.00 0.00 54.97 53.64 1ofq s GLU 3316Cb -0.12 -4.18 -0.03 0.00 0.10 0.00 0.00 34.13 29.91 1ofq s GLU 3316CO 0.02 -1.19 -0.14 0.45 0.02 0.00 0.00 175.26 174.42 1ofq s SER 3317N 2.96 1.65 0.31 -0.19 0.15 0.52 -2.08 113.70 117.02 1ofq s SER 3317Ca 0.07 -0.63 0.05 0.00 0.70 0.00 0.00 55.95 56.14 1ofq s SER 3317Cb -0.24 -0.04 -0.02 0.00 -1.71 0.00 0.00 66.02 64.00 1ofq s SER 3317CO 0.07 -0.09 0.31 -3.20 1.20 0.00 0.00 173.24 171.53 1ofq n ASN 3318N 1.22 -0.81 -0.07 5.45 2.85 -0.57 -0.95 115.26 122.37 1ofq n ASN 3318Ca -0.21 -2.97 -0.10 0.00 -0.11 0.00 0.00 54.58 51.20 1ofq n ASN 3318Cb 0.54 1.76 -0.03 0.00 1.24 0.00 0.00 39.78 43.30 1ofq n ASN 3318CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1ofq h ILE 3319N 1.98 1.11 -3.45 -1.44 2.04 -1.85 -1.52 117.51 114.38 1ofq h ILE 3319Ca -0.23 -0.27 -0.63 0.00 1.00 0.00 0.00 64.86 64.73 1ofq h ILE 3319Cb 1.11 0.82 -0.20 0.00 -0.74 0.00 0.00 36.82 37.81 1ofq h ILE 3319CO 0.32 0.11 -0.83 0.20 0.00 0.00 0.00 178.15 177.95 1ofq s ASN 3320N -5.52 3.19 0.88 1.72 0.01 -0.70 -2.07 114.94 112.44 1ofq s ASN 3320Ca -0.13 -0.82 -0.12 0.00 -0.71 0.00 0.00 52.86 51.08 1ofq s ASN 3320Cb 0.09 -0.22 0.12 0.00 0.41 0.00 0.00 41.25 41.65 1ofq s ASN 3320CO 0.71 0.10 1.15 -1.83 -1.51 0.00 0.00 177.10 175.72 1ofq s GLU 3321N -2.47 1.40 2.70 -0.60 -1.05 -1.26 -4.50 118.70 112.92 1ofq s GLU 3321Ca 0.17 0.26 0.00 0.00 -0.15 0.00 0.00 54.97 55.25 1ofq s GLU 3321Cb -0.08 -1.87 0.00 0.00 -0.44 0.00 0.00 34.13 31.74 1ofq s GLU 3321CO 0.08 -2.01 0.00 0.41 0.95 0.00 0.00 175.26 174.69 1ofq n GLY 3322N -2.49 -0.16 3.50 -3.83 0.00 0.16 -4.81 105.19 97.55 1ofq n GLY 3322Ca 0.07 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 44.91 1ofq n GLY 3322CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ofq s ASN 3323N -4.00 1.02 0.02 1.61 2.20 -1.26 -2.25 114.94 112.28 1ofq s ASN 3323Ca 0.00 -1.53 -0.11 0.00 -0.94 0.00 0.00 52.86 50.27 1ofq s ASN 3323Cb 0.00 0.69 0.01 0.00 -2.00 0.00 0.00 41.25 39.95 1ofq s ASN 3323CO 0.00 -1.35 0.24 0.00 -2.94 0.00 0.00 177.10 173.05 1ofq s GLN 3324N -2.89 0.68 0.61 3.55 -2.07 0.04 -4.92 119.66 114.66 1ofq s GLN 3324Ca 0.30 -0.46 -0.06 0.00 -1.82 0.00 0.00 55.36 53.33 1ofq s GLN 3324Cb -0.01 0.29 0.02 0.00 -1.09 0.00 0.00 33.01 32.22 1ofq s GLN 3324CO 0.21 -0.20 0.92 0.20 -1.32 0.00 0.00 175.29 175.11 1ofq s GLY 3325N -1.79 1.63 -0.39 2.60 0.00 -1.26 -4.39 107.32 103.72 1ofq s GLY 3325Ca -0.09 -0.77 -0.20 0.00 0.00 0.00 0.00 44.72 43.67 1ofq s GLY 3325CO -0.01 -0.46 0.59 -0.42 0.00 0.00 0.00 173.10 172.80 1ofq s ILE 3326N -3.03 4.91 0.94 0.90 1.01 -1.26 -4.97 121.20 119.69 1ofq s ILE 3326Ca 0.55 0.25 -0.11 0.00 0.00 0.00 0.00 60.65 61.34 1ofq s ILE 3326Cb -0.11 -4.10 0.16 0.00 0.01 0.00 0.00 42.46 38.42 1ofq s ILE 3326CO 0.45 -0.42 1.09 -2.16 0.00 0.00 0.00 174.94 173.90 1ofq s PRO 3327N 2.63 0.87 0.41 2.79 0.04 -1.26 -4.87 135.00 135.61 1ofq s PRO 3327Ca 0.21 1.07 0.15 0.00 0.04 0.00 0.00 61.00 62.48 1ofq s PRO 3327Cb -0.15 -1.75 1.03 0.00 0.04 0.00 0.00 34.50 33.68 1ofq s PRO 3327CO 0.16 -2.58 1.89 0.00 0.04 0.00 0.00 177.00 176.51 1ofq h ALA 3328N -1.80 2.11 -0.22 8.56 0.00 -2.00 -1.17 119.26 124.73 1ofq h ALA 3328Ca -0.49 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1ofq h ALA 3328Cb 1.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1ofq h ALA 3328CO 0.50 -0.35 -0.04 0.93 0.00 0.00 0.00 179.25 180.28 1ofq h GLU 3329N 0.45 0.34 0.00 0.00 3.07 -1.99 -3.49 114.58 112.96 1ofq h GLU 3329Ca 0.42 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 1ofq h GLU 3329Cb 0.96 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 1ofq h GLU 3329CO -0.16 0.41 0.00 0.41 -1.40 0.00 0.00 179.01 178.27 1ofq n GLY 3330N -0.97 -1.36 0.35 -3.84 0.00 -0.44 -4.48 105.19 94.44 1ofq n GLY 3330Ca 0.00 -1.92 0.32 0.00 0.00 0.00 0.00 46.02 44.42 1ofq n GLY 3330CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ofq h LYS 3331N 0.00 0.05 -0.52 1.61 1.57 -1.83 0.27 116.57 117.72 1ofq h LYS 3331Ca 0.00 -0.00 0.15 0.00 -1.87 0.00 0.00 60.65 58.93 1ofq h LYS 3331Cb 0.00 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1ofq h LYS 3331CO 0.00 0.03 0.38 0.00 -0.57 0.00 0.00 179.45 179.29 1ofq h ALA 3332N 1.89 2.47 -0.39 3.86 0.00 -1.97 -1.62 119.26 123.50 1ofq h ALA 3332Ca 0.84 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.73 1ofq h ALA 3332Cb 2.28 0.04 0.00 0.00 0.00 0.00 0.00 17.79 20.11 1ofq h ALA 3332CO -0.68 -0.64 0.00 0.41 0.00 0.00 0.00 179.25 178.34 1ofq n GLY 3333N -1.63 1.64 3.75 0.00 0.00 0.08 -4.97 105.19 104.05 1ofq n GLY 3333Ca 0.09 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.99 1ofq n GLY 3333CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ofq s LEU 3334N -1.47 4.55 0.13 0.99 2.01 -0.61 -4.87 118.68 119.42 1ofq s LEU 3334Ca 0.39 2.05 -0.30 0.00 0.01 0.00 0.00 54.13 56.28 1ofq s LEU 3334Cb 0.22 -3.61 -0.07 0.00 0.01 0.00 0.00 46.19 42.75 1ofq s LEU 3334CO 0.31 -0.07 1.18 -0.54 1.01 0.00 0.00 176.35 178.24 1ofq s LYS 3335N -0.82 4.49 0.36 1.70 3.01 -1.26 -4.97 119.74 122.24 1ofq s LYS 3335Ca 0.45 1.80 -0.28 0.00 -1.01 0.00 0.00 55.97 56.93 1ofq s LYS 3335Cb -0.28 -3.29 -0.11 0.00 -1.01 0.00 0.00 37.83 33.14 1ofq s LYS 3335CO 0.35 -0.12 1.44 -0.47 0.51 0.00 0.00 175.35 177.06 1ofq s TYR 3336N 0.37 2.74 -1.81 3.18 5.04 -1.26 -3.23 117.35 122.38 1ofq s TYR 3336Ca 0.55 1.21 0.00 0.00 -2.44 0.00 0.00 57.07 56.39 1ofq s TYR 3336Cb -0.31 -3.92 0.00 0.00 0.35 0.00 0.00 41.96 38.08 1ofq s TYR 3336CO 0.33 -2.70 0.00 0.41 -1.34 0.00 0.00 175.55 172.25 1ofq n GLY 3337N 0.70 1.04 3.17 8.97 0.00 -1.26 -4.81 105.19 113.01 1ofq n GLY 3337Ca 0.01 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 1ofq n GLY 3337CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ofq s VAL 3338N -2.76 2.03 0.36 1.61 1.01 -1.20 -1.72 120.40 119.73 1ofq s VAL 3338Ca 0.00 -0.97 -0.26 0.00 0.00 0.00 0.00 61.98 60.75 1ofq s VAL 3338Cb 0.00 -1.79 -0.12 0.00 0.00 0.00 0.00 36.38 34.47 1ofq s VAL 3338CO 0.00 0.55 1.05 -0.24 0.00 0.00 0.00 175.10 176.46 1ofq n SER 3339N 3.97 1.50 -0.78 3.32 2.88 -1.25 -4.69 113.62 118.56 1ofq n SER 3339Ca -0.20 1.12 0.08 0.00 -1.33 0.00 0.00 58.87 58.54 1ofq n SER 3339Cb 0.52 -1.35 0.13 0.00 -0.75 0.00 0.00 64.21 62.76 1ofq n SER 3339CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1ofq n ILE 3340N -0.09 0.36 0.00 2.46 -5.35 -1.26 -0.78 119.36 114.69 1ofq n ILE 3340Ca 0.09 -0.68 0.00 0.00 -0.27 0.00 0.00 62.75 61.89 1ofq n ILE 3340Cb 0.36 1.05 0.00 0.00 -1.74 0.00 0.00 39.64 39.31 1ofq n ILE 3340CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1ofq n THR 3341N 0.98 0.00 -2.12 7.28 -2.24 -1.26 -4.81 114.28 112.12 1ofq n THR 3341Ca 0.13 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.58 1ofq n THR 3341Cb 0.46 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.69 1ofq n THR 3341CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ofq s ASP 3342N 0.85 5.81 0.38 3.42 1.01 -1.26 -4.79 116.67 122.08 1ofq s ASP 3342Ca 0.00 1.88 -0.26 0.00 0.71 0.00 0.00 52.55 54.88 1ofq s ASP 3342Cb 0.00 -2.54 -0.09 0.00 1.01 0.00 0.00 42.92 41.30 1ofq s ASP 3342CO 0.00 -1.15 1.11 0.00 0.21 0.00 0.00 175.17 175.34 1ofq s ALA 3343N -2.32 3.17 0.33 5.23 0.00 -1.26 -4.68 121.76 122.23 1ofq s ALA 3343Ca 0.65 0.85 0.08 0.00 0.00 0.00 0.00 51.96 53.54 1ofq s ALA 3343Cb -0.17 -3.33 -0.06 0.00 0.00 0.00 0.00 23.12 19.56 1ofq s ALA 3343CO 0.34 -0.33 -0.07 0.00 0.00 0.00 0.00 175.76 175.69 1ofq s ILE 3345N -2.77 4.80 0.93 0.00 -4.36 -0.88 0.35 121.20 119.28 1ofq s ILE 3345Ca 0.32 0.55 -0.15 0.00 -0.26 0.00 0.00 60.65 61.11 1ofq s ILE 3345Cb 0.04 -3.77 0.17 0.00 1.25 0.00 0.00 42.46 40.16 1ofq s ILE 3345CO 0.15 -0.62 1.29 -0.83 0.24 0.00 0.00 174.94 175.17 1ofq s GLY 3346N -3.40 1.73 0.08 6.27 0.00 -1.26 -1.51 107.32 109.24 1ofq s GLY 3346Ca 0.51 -1.07 -0.24 0.00 0.00 0.00 0.00 44.72 43.92 1ofq s GLY 3346CO 0.35 -0.36 1.69 -0.25 0.00 0.00 0.00 173.10 174.54 1ofq h TRP 3347N -1.53 -0.11 -0.56 1.90 2.91 -0.69 -1.30 115.95 116.58 1ofq h TRP 3347Ca -0.45 -0.00 0.08 0.00 1.13 0.00 0.00 58.89 59.65 1ofq h TRP 3347Cb 1.26 0.04 -0.06 0.00 -0.51 0.00 0.00 29.16 29.88 1ofq h TRP 3347CO -0.83 -0.04 0.22 0.93 -1.03 0.00 0.00 178.44 177.69 1ofq h GLU 3348N -0.15 0.39 -0.56 2.65 3.07 -1.89 -0.20 114.58 117.90 1ofq h GLU 3348Ca -0.01 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.79 1ofq h GLU 3348Cb 0.12 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 1ofq h GLU 3348CO 0.02 0.26 0.21 1.15 -1.40 0.00 0.00 179.01 179.25 1ofq h THR 3349N 0.41 1.21 -0.75 1.13 2.02 -1.90 -2.28 112.91 112.75 1ofq h THR 3349Ca 0.27 -0.67 -0.04 0.00 0.77 0.00 0.00 66.41 66.74 1ofq h THR 3349Cb 0.30 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1ofq h THR 3349CO -0.26 0.26 0.29 0.74 0.37 0.00 0.00 175.52 176.92 1ofq h THR 3350N 0.80 1.25 -0.47 3.16 2.02 0.11 0.00 112.91 119.77 1ofq h THR 3350Ca 0.19 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.56 1ofq h THR 3350Cb 0.18 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 1ofq h THR 3350CO -0.02 0.32 0.24 -0.33 0.37 0.00 0.00 175.52 176.11 1ofq h GLU 3351N 1.08 0.67 0.04 6.66 5.08 -0.59 -0.12 114.58 127.41 1ofq h GLU 3351Ca 0.25 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1ofq h GLU 3351Cb 0.21 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1ofq h GLU 3351CO -0.02 0.55 -0.02 -0.44 -1.00 0.00 0.00 179.01 178.08 1ofq h ASP 3352N 0.62 -0.04 -0.41 1.42 3.45 -1.06 -0.32 116.42 120.07 1ofq h ASP 3352Ca 0.16 -0.05 0.05 0.00 0.43 0.00 0.00 57.03 57.63 1ofq h ASP 3352Cb 0.09 0.01 -0.04 0.00 -0.56 0.00 0.00 39.33 38.83 1ofq h ASP 3352CO -0.02 0.02 0.16 0.58 -1.57 0.00 0.00 179.24 178.40 1ofq h VAL 3353N -0.10 0.90 -0.33 -1.35 2.07 -0.79 -1.64 116.25 115.00 1ofq h VAL 3353Ca -0.01 -0.11 -0.16 0.00 0.82 0.00 0.00 66.70 67.24 1ofq h VAL 3353Cb 0.09 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1ofq h VAL 3353CO 0.01 0.06 -0.43 -0.07 0.02 0.00 0.00 177.57 177.16 1ofq h LEU 3354N 0.33 0.90 -0.46 2.57 3.38 -0.87 -1.61 115.31 119.55 1ofq h LEU 3354Ca 0.19 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 1ofq h LEU 3354Cb 0.16 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1ofq h LEU 3354CO -0.18 1.20 0.18 0.03 0.09 0.00 0.00 178.44 179.77 1ofq h ARG 3355N 0.67 0.69 -0.71 1.13 3.08 -0.90 -0.14 114.38 118.21 1ofq h ARG 3355Ca 0.04 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1ofq h ARG 3355Cb 1.01 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.92 1ofq h ARG 3355CO 0.10 0.63 0.45 0.87 -1.07 0.00 0.00 179.97 180.95 1ofq h LYS 3356N 0.61 0.94 -0.72 0.04 1.57 -1.23 -0.89 116.57 116.88 1ofq h LYS 3356Ca 0.15 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 1ofq h LYS 3356Cb 0.20 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 1ofq h LYS 3356CO -0.01 0.64 0.36 1.25 -0.57 0.00 0.00 179.45 181.12 1ofq h LEU 3357N 0.96 0.93 -0.94 2.94 6.46 -0.92 -1.17 115.31 123.56 1ofq h LEU 3357Ca 0.26 -0.12 -0.03 0.00 -0.12 0.00 0.00 57.88 57.87 1ofq h LEU 3357Cb -0.08 -0.24 -0.04 0.00 -0.73 0.00 0.00 40.66 39.57 1ofq h LEU 3357CO -0.05 0.79 0.37 0.00 -0.62 0.00 0.00 178.44 178.93 1ofq h ALA 3358N 1.18 1.17 -0.55 1.25 0.00 -0.47 -1.13 119.26 120.72 1ofq h ALA 3358Ca 0.25 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1ofq h ALA 3358Cb 0.09 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ofq h ALA 3358CO -0.03 0.62 0.20 0.00 0.00 0.00 0.00 179.25 180.04 1ofq h ALA 3359N 1.29 0.71 -0.64 0.00 0.00 -0.54 -1.75 119.26 118.33 1ofq h ALA 3359Ca 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ofq h ALA 3359Cb 0.12 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1ofq h ALA 3359CO -0.03 0.35 0.41 0.00 0.00 0.00 0.00 179.25 179.97 1ofq h ALA 3360N 1.05 1.50 -0.07 0.00 0.00 -0.60 0.63 119.26 121.78 1ofq h ALA 3360Ca 0.18 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1ofq h ALA 3360Cb 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ofq h ALA 3360CO -0.01 0.44 -0.43 0.28 0.00 0.00 0.00 179.25 179.53 1ofq h VAL 3361N 0.88 1.32 -0.11 0.00 2.07 -0.66 -1.53 116.25 118.22 1ofq h VAL 3361Ca 0.23 -1.55 -0.23 0.00 0.82 0.00 0.00 66.70 65.97 1ofq h VAL 3361Cb -0.07 1.75 0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1ofq h VAL 3361CO -0.05 0.46 -0.84 0.03 0.02 0.00 0.00 177.57 177.19 1ofq h ARG 3362N 0.13 0.73 -0.12 1.57 3.08 -0.34 -2.71 114.38 116.72 1ofq h ARG 3362Ca 0.01 -0.63 -0.07 0.00 0.07 0.00 0.00 59.98 59.36 1ofq h ARG 3362Cb 0.82 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 1ofq h ARG 3362CO 0.06 1.24 -0.23 1.96 -1.07 0.00 0.00 179.97 181.93 1ofq h GLN 3363N 0.48 0.22 -0.32 0.04 4.20 -0.71 -2.73 115.11 116.28 1ofq h GLN 3363Ca -0.07 -0.07 -0.16 0.00 0.06 0.00 0.00 58.65 58.42 1ofq h GLN 3363Cb 1.47 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.22 1ofq h GLN 3363CO 0.17 0.44 -0.43 -0.09 -0.67 0.00 0.00 178.83 178.25 1ofq h ARG 3364N 0.20 0.82 -0.93 1.46 2.43 -1.20 -2.76 114.38 114.40 1ofq h ARG 3364Ca 0.03 -0.45 0.11 0.00 -0.81 0.00 0.00 59.98 58.87 1ofq h ARG 3364Cb 0.52 0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 30.01 1ofq h ARG 3364CO 0.04 1.08 0.56 0.00 -1.51 0.00 0.00 179.97 180.14 1ofq h ARG 3365N 0.66 0.88 -0.22 0.20 3.08 -1.16 -1.70 114.38 116.11 1ofq h ARG 3365Ca 0.05 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1ofq h ARG 3365Cb 1.00 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.84 1ofq h ARG 3365CO 0.10 0.58 0.08 0.93 -1.07 0.00 0.00 179.97 180.59 1ofq h GLU 3366N 0.90 0.34 0.00 0.04 4.39 -1.44 -2.24 114.58 116.57 1ofq h GLU 3366Ca 0.46 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 60.09 1ofq h GLU 3366Cb 0.45 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1ofq h GLU 3366CO -0.26 0.40 0.00 0.28 -1.16 0.00 0.00 179.01 178.27 1ofq h VAL 3367N 0.20 0.00 -0.68 3.13 2.07 -1.06 -1.82 116.25 118.09 1ofq h VAL 3367Ca 0.07 -0.07 -0.23 0.00 0.82 0.00 0.00 66.70 67.29 1ofq h VAL 3367Cb 0.20 0.95 -0.14 0.00 -1.52 0.00 0.00 31.29 30.78 1ofq h VAL 3367CO -0.00 0.00 0.25 0.59 0.02 0.00 0.00 177.57 178.43 1ofq n ASN 3368N -2.88 4.31 -0.51 0.57 3.02 -0.78 -4.98 115.26 114.01 1ofq n ASN 3368Ca -0.02 -3.33 0.14 0.00 -0.03 0.00 0.00 54.58 51.34 1ofq n ASN 3368Cb 0.10 -0.73 0.50 0.00 -0.61 0.00 0.00 39.78 39.04 1ofq n ASN 3368CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93