#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pdw s SER 3003N 0.00 2.91 0.43 0.00 1.04 -1.26 -5.04 113.70 111.78 1pdw s SER 3003Ca 0.00 0.56 -0.16 0.00 0.48 0.00 0.00 55.95 56.84 1pdw s SER 3003Cb 0.00 -0.82 -0.08 0.00 0.10 0.00 0.00 66.02 65.21 1pdw s SER 3003CO 0.00 -2.88 0.87 -0.54 0.98 0.00 0.00 173.24 171.67 1pdw s LYS 3004N -5.61 3.98 0.02 4.02 3.01 -1.26 -4.93 119.74 118.96 1pdw s LYS 3004Ca 0.70 0.81 0.07 0.00 -1.01 0.00 0.00 55.97 56.54 1pdw s LYS 3004Cb -0.08 -2.27 -0.02 0.00 -1.01 0.00 0.00 37.83 34.45 1pdw s LYS 3004CO 0.53 -0.08 -0.21 1.03 0.51 0.00 0.00 175.35 177.14 1pdw s ARG 3005N -3.61 1.51 0.05 1.68 0.52 -1.26 -0.82 118.95 117.01 1pdw s ARG 3005Ca 0.57 -0.87 0.05 0.00 -0.52 0.00 0.00 55.73 54.96 1pdw s ARG 3005Cb -0.10 -1.56 -0.02 0.00 0.52 0.00 0.00 34.95 33.79 1pdw s ARG 3005CO 0.25 0.41 -0.14 0.00 0.02 0.00 0.00 175.30 175.83 1pdw s ALA 3006N -0.68 1.20 -0.19 2.13 0.00 0.32 -0.48 121.76 124.06 1pdw s ALA 3006Ca 0.08 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.14 1pdw s ALA 3006Cb -0.08 -0.16 0.03 0.00 0.00 0.00 0.00 23.12 22.91 1pdw s ALA 3006CO 0.01 0.21 -0.15 -1.17 0.00 0.00 0.00 175.76 174.66 1pdw s LEU 3007N -1.38 2.27 -0.32 0.00 2.96 -0.52 -1.15 118.68 120.55 1pdw s LEU 3007Ca 0.01 -0.79 -0.07 0.00 -0.22 0.00 0.00 54.13 53.06 1pdw s LEU 3007Cb -0.09 -1.36 0.02 0.00 0.50 0.00 0.00 46.19 45.27 1pdw s LEU 3007CO 0.02 -0.08 0.09 -0.69 -1.32 0.00 0.00 176.35 174.37 1pdw s VAL 3008N 1.33 3.88 -0.34 1.68 1.01 -0.55 0.81 120.40 128.22 1pdw s VAL 3008Ca 0.01 -0.91 -0.25 0.00 0.00 0.00 0.00 61.98 60.83 1pdw s VAL 3008Cb -0.15 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.14 1pdw s VAL 3008CO -0.10 -0.05 0.87 -0.63 0.00 0.00 0.00 175.10 175.19 1pdw s ILE 3009N 1.45 4.68 -0.35 2.22 1.01 -0.95 -1.63 121.20 127.63 1pdw s ILE 3009Ca 0.00 1.21 -0.11 0.00 0.00 0.00 0.00 60.65 61.76 1pdw s ILE 3009Cb -0.18 -4.25 0.01 0.00 0.01 0.00 0.00 42.46 38.05 1pdw s ILE 3009CO 0.03 -0.40 0.19 -0.22 0.00 0.00 0.00 174.94 174.54 1pdw s LEU 3010N 3.24 4.52 0.22 2.97 2.96 -0.26 -4.41 118.68 127.91 1pdw s LEU 3010Ca 0.36 -0.79 0.08 0.00 -0.22 0.00 0.00 54.13 53.56 1pdw s LEU 3010Cb -0.13 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.49 1pdw s LEU 3010CO 0.16 -0.31 0.01 0.00 -1.32 0.00 0.00 176.35 174.88 1pdw s ALA 3011N 1.59 3.20 0.29 5.97 0.00 -1.26 -1.70 121.76 129.85 1pdw s ALA 3011Ca 0.03 -1.49 -0.30 0.00 0.00 0.00 0.00 51.96 50.20 1pdw s ALA 3011Cb -0.18 -0.92 -0.12 0.00 0.00 0.00 0.00 23.12 21.90 1pdw s ALA 3011CO 0.07 0.37 1.46 1.17 0.00 0.00 0.00 175.76 178.83 1pdw n LYS 3012N -0.52 2.34 -0.92 0.00 4.81 -1.26 -1.39 118.16 121.22 1pdw n LYS 3012Ca -0.08 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 1pdw n LYS 3012Cb 0.57 -2.53 0.00 0.00 0.02 0.00 0.00 35.03 33.09 1pdw n LYS 3012CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1pdw n GLY 3013N 1.76 0.54 3.77 3.14 0.00 -0.54 -2.78 105.19 111.08 1pdw n GLY 3013Ca 0.08 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 1pdw n GLY 3013CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pdw s ALA 3014N -2.00 2.75 -0.25 4.61 0.00 -0.48 -2.28 121.76 124.12 1pdw s ALA 3014Ca 0.00 0.86 -0.29 0.00 0.00 0.00 0.00 51.96 52.53 1pdw s ALA 3014Cb 0.00 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 1pdw s ALA 3014CO 0.00 -0.76 1.30 -2.00 0.00 0.00 0.00 175.76 174.30 1pdw s GLU 3015N -3.15 4.03 0.00 0.00 -6.30 -0.77 -0.55 118.70 111.96 1pdw s GLU 3015Ca 0.71 1.42 0.00 0.00 -2.50 0.00 0.00 54.97 54.59 1pdw s GLU 3015Cb -0.25 -3.84 0.00 0.00 0.00 0.00 0.00 34.13 30.04 1pdw s GLU 3015CO 0.29 -0.97 0.11 -0.85 0.02 0.00 0.00 175.26 173.86 1pdw n GLU 3016N 7.06 0.13 0.00 4.30 0.00 -1.26 -1.78 120.64 129.09 1pdw n GLU 3016Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.31 1pdw n GLU 3016Cb 0.46 -1.32 0.00 0.00 0.00 0.00 0.00 31.44 30.58 1pdw n GLU 3016CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1pdw n GLU 3018N 0.78 0.00 -0.08 3.44 1.02 -1.26 -0.70 120.64 123.84 1pdw n GLU 3018Ca 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1pdw n GLU 3018Cb 0.05 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.42 1pdw n GLU 3018CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1pdw h THR 3019N 0.00 0.44 -0.38 2.62 2.02 -1.75 -3.40 112.91 112.47 1pdw h THR 3019Ca 0.00 -1.50 -0.06 0.00 0.77 0.00 0.00 66.41 65.62 1pdw h THR 3019Cb 0.00 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 1pdw h THR 3019CO 0.00 0.15 0.00 0.58 0.37 0.00 0.00 175.52 176.62 1pdw h VAL 3020N -1.00 1.26 -0.30 3.16 2.07 -1.19 -2.93 116.25 117.31 1pdw h VAL 3020Ca -0.12 -0.99 0.05 0.00 0.82 0.00 0.00 66.70 66.46 1pdw h VAL 3020Cb 0.76 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 1pdw h VAL 3020CO -0.07 0.33 0.04 0.40 0.02 0.00 0.00 177.57 178.29 1pdw h ILE 3021N 0.49 0.83 -0.41 4.57 2.04 -1.81 -0.21 117.51 123.00 1pdw h ILE 3021Ca 0.11 -0.05 -0.09 0.00 1.00 0.00 0.00 64.86 65.83 1pdw h ILE 3021Cb 0.46 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 1pdw h ILE 3021CO 0.02 0.03 -0.13 -0.65 0.00 0.00 0.00 178.15 177.42 1pdw h PRO 3022N 0.14 0.75 -0.34 2.37 0.11 -1.76 -0.28 132.00 132.99 1pdw h PRO 3022Ca 0.14 -0.25 -0.05 0.00 0.11 0.00 0.00 66.00 65.95 1pdw h PRO 3022Cb 0.17 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 1pdw h PRO 3022CO -0.20 0.85 0.01 0.28 -0.21 0.00 0.00 178.00 178.72 1pdw h VAL 3023N 0.68 1.26 -0.18 3.15 2.07 -1.27 -3.21 116.25 118.74 1pdw h VAL 3023Ca 0.11 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 1pdw h VAL 3023Cb 0.60 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1pdw h VAL 3023CO 0.04 0.31 -0.01 -0.78 0.02 0.00 0.00 177.57 177.15 1pdw h ASP 3024N 0.40 0.33 0.00 0.57 1.82 -0.94 -1.84 116.42 116.76 1pdw h ASP 3024Ca 0.10 -0.33 0.00 0.00 -0.39 0.00 0.00 57.03 56.41 1pdw h ASP 3024Cb 0.44 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 40.36 1pdw h ASP 3024CO 0.02 0.58 0.00 0.52 -1.61 0.00 0.00 179.24 178.75 1pdw n VAL 3025N -4.69 0.05 0.00 2.25 0.31 -0.13 -1.68 118.33 114.45 1pdw n VAL 3025Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1pdw n VAL 3025Cb 0.24 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 1pdw n VAL 3025CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1pdw n ARG 3027N 0.62 0.00 0.18 5.55 1.74 -0.69 -2.32 116.66 121.74 1pdw n ARG 3027Ca 0.00 0.00 0.16 0.00 -0.77 0.00 0.00 57.85 57.24 1pdw n ARG 3027Cb 0.05 0.00 0.79 0.00 -1.02 0.00 0.00 32.46 32.27 1pdw n ARG 3027CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pdw h ARG 3028N 0.00 0.00 -0.47 5.56 3.08 -1.59 0.56 114.38 121.52 1pdw h ARG 3028Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1pdw h ARG 3028Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1pdw h ARG 3028CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 1pdw n ALA 3029N -2.41 2.64 -1.13 0.04 0.00 -0.98 -4.88 120.51 113.79 1pdw n ALA 3029Ca 0.02 -0.62 -0.05 0.00 0.00 0.00 0.00 53.44 52.79 1pdw n ALA 3029Cb 0.34 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 1pdw n ALA 3029CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pdw n GLY 3030N 0.77 0.71 3.75 0.00 0.00 0.19 -5.00 105.19 105.61 1pdw n GLY 3030Ca 0.11 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.31 1pdw n GLY 3030CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pdw s ILE 3031N -2.03 4.87 -0.50 -0.61 1.01 -1.25 -4.53 121.20 118.16 1pdw s ILE 3031Ca 0.00 1.39 -0.27 0.00 0.00 0.00 0.00 60.65 61.77 1pdw s ILE 3031Cb 0.00 -4.00 0.03 0.00 0.01 0.00 0.00 42.46 38.50 1pdw s ILE 3031CO 0.00 0.38 1.06 -0.75 0.00 0.00 0.00 174.94 175.63 1pdw s LYS 3032N -0.00 3.58 -0.15 2.79 2.20 0.00 -4.21 119.74 123.95 1pdw s LYS 3032Ca 0.34 0.29 -0.06 0.00 -0.36 0.00 0.00 55.97 56.18 1pdw s LYS 3032Cb -0.19 -3.95 -0.04 0.00 -1.51 0.00 0.00 37.83 32.14 1pdw s LYS 3032CO 0.19 -1.40 0.08 0.08 -0.36 0.00 0.00 175.35 173.94 1pdw s VAL 3033N 4.27 4.96 -0.23 4.02 1.01 -1.26 -0.52 120.40 132.65 1pdw s VAL 3033Ca 0.42 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.40 1pdw s VAL 3033Cb -0.09 -3.19 0.02 0.00 0.00 0.00 0.00 36.38 33.13 1pdw s VAL 3033CO 0.28 0.53 -0.09 -0.89 0.00 0.00 0.00 175.10 174.93 1pdw s THR 3034N -0.29 2.74 -0.56 3.92 2.01 -0.30 -4.97 115.64 118.19 1pdw s THR 3034Ca 0.09 -0.96 -0.20 0.00 0.31 0.00 0.00 61.69 60.93 1pdw s THR 3034Cb -0.12 -2.33 0.07 0.00 0.01 0.00 0.00 72.50 70.13 1pdw s THR 3034CO 0.01 0.29 0.74 -0.69 -0.69 0.00 0.00 174.62 174.29 1pdw s VAL 3035N 1.33 4.70 -0.25 3.82 1.01 -1.26 -1.48 120.40 128.27 1pdw s VAL 3035Ca 0.02 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 1pdw s VAL 3035Cb -0.16 -4.44 -0.05 0.00 0.00 0.00 0.00 36.38 31.73 1pdw s VAL 3035CO -0.06 -1.04 0.18 0.00 0.00 0.00 0.00 175.10 174.18 1pdw s ALA 3036N 3.06 3.58 -0.06 5.51 0.00 -0.65 0.73 121.76 133.94 1pdw s ALA 3036Ca 0.17 -0.95 -0.30 0.00 0.00 0.00 0.00 51.96 50.89 1pdw s ALA 3036Cb -0.19 -2.39 -0.03 0.00 0.00 0.00 0.00 23.12 20.51 1pdw s ALA 3036CO 0.11 -0.32 1.14 0.20 0.00 0.00 0.00 175.76 176.89 1pdw s GLY 3037N 1.30 2.21 0.22 0.00 0.00 0.70 -1.10 107.32 110.65 1pdw s GLY 3037Ca 0.08 0.57 -0.08 0.00 0.00 0.00 0.00 44.72 45.28 1pdw s GLY 3037CO 0.07 2.11 1.80 -2.00 0.00 0.00 0.00 173.10 175.07 1pdw h LEU 3038N 8.03 0.52 -4.02 0.66 5.85 -1.67 -1.28 115.31 123.40 1pdw h LEU 3038Ca -0.34 0.04 -0.68 0.00 0.84 0.00 0.00 57.88 57.74 1pdw h LEU 3038Cb 1.16 -0.05 -0.29 0.00 0.37 0.00 0.00 40.66 41.85 1pdw h LEU 3038CO 0.87 0.32 0.87 0.00 -0.34 0.00 0.00 178.44 180.15 1pdw n ALA 3039N -2.38 6.34 0.00 1.25 0.00 -1.26 -4.67 120.51 119.79 1pdw n ALA 3039Ca 0.10 -3.50 0.00 0.00 0.00 0.00 0.00 53.44 50.04 1pdw n ALA 3039Cb 0.22 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 17.90 1pdw n ALA 3039CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pdw n GLY 3040N -0.91 -1.77 0.31 0.00 0.00 -1.02 -4.51 105.19 97.28 1pdw n GLY 3040Ca 0.63 -1.97 0.14 0.00 0.00 0.00 0.00 46.02 44.82 1pdw n GLY 3040CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pdw n LYS 3041N 0.00 1.15 -1.43 1.61 5.02 -1.26 -3.74 118.16 119.51 1pdw n LYS 3041Ca 0.00 -0.63 -0.35 0.00 -2.02 0.00 0.00 58.31 55.32 1pdw n LYS 3041Cb 0.00 -1.49 0.10 0.00 -0.02 0.00 0.00 35.03 33.62 1pdw n LYS 3041CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1pdw s ASP 3042N -2.28 4.13 0.45 4.39 1.01 -1.26 -4.34 116.67 118.77 1pdw s ASP 3042Ca 0.31 2.43 -0.24 0.00 0.71 0.00 0.00 52.55 55.76 1pdw s ASP 3042Cb 0.20 -2.60 -0.09 0.00 1.01 0.00 0.00 42.92 41.45 1pdw s ASP 3042CO 0.43 -2.31 1.20 -2.65 0.21 0.00 0.00 175.17 172.05 1pdw n PRO 3043N -2.66 1.68 -4.12 8.23 -0.02 -1.26 -4.51 135.00 132.33 1pdw n PRO 3043Ca 0.14 0.60 -0.34 0.00 -2.02 0.00 0.00 63.50 61.88 1pdw n PRO 3043Cb 0.50 -2.31 -0.14 0.00 -0.02 0.00 0.00 33.50 31.52 1pdw n PRO 3043CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pdw s VAL 3044N -1.25 3.22 -0.11 -1.45 1.01 0.21 -4.95 120.40 117.08 1pdw s VAL 3044Ca 0.64 -0.56 -0.26 0.00 0.00 0.00 0.00 61.98 61.81 1pdw s VAL 3044Cb -0.50 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 1pdw s VAL 3044CO 0.56 0.46 0.83 -1.58 0.00 0.00 0.00 175.10 175.36 1pdw s GLN 3045N 1.18 4.39 0.55 2.72 0.74 -1.26 -1.80 119.66 126.17 1pdw s GLN 3045Ca 0.02 1.06 0.01 0.00 0.05 0.00 0.00 55.36 56.50 1pdw s GLN 3045Cb -0.14 -3.52 0.11 0.00 1.10 0.00 0.00 33.01 30.56 1pdw s GLN 3045CO -0.02 -0.17 0.75 0.00 -0.55 0.00 0.00 175.29 175.30 1pdw h SER 3047N -0.40 0.63 -0.82 0.00 4.64 -0.92 -1.14 113.55 115.53 1pdw h SER 3047Ca -0.25 0.08 -0.58 0.00 -0.47 0.00 0.00 61.79 60.57 1pdw h SER 3047Cb 0.94 -0.04 -0.37 0.00 -0.31 0.00 0.00 62.40 62.62 1pdw h SER 3047CO 0.27 0.23 -0.17 0.54 -0.87 0.00 0.00 176.83 176.83 1pdw n ARG 3048N -4.66 3.20 -0.88 4.77 3.00 -1.26 -4.95 116.66 115.89 1pdw n ARG 3048Ca 0.22 -3.81 0.00 0.00 -0.01 0.00 0.00 57.85 54.25 1pdw n ARG 3048Cb 0.64 -2.26 0.00 0.00 0.00 0.00 0.00 32.46 30.84 1pdw n ARG 3048CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1pdw n ASP 3049N -0.80 -4.71 -4.77 0.55 8.00 -0.43 -4.96 116.55 109.43 1pdw n ASP 3049Ca 0.50 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.60 1pdw n ASP 3049Cb 0.86 -3.22 -0.03 0.00 -0.02 0.00 0.00 41.12 38.71 1pdw n ASP 3049CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pdw s VAL 3050N -0.97 3.11 -0.24 2.53 1.01 -1.26 -4.66 120.40 119.91 1pdw s VAL 3050Ca 0.00 1.07 -0.04 0.00 0.00 0.00 0.00 61.98 63.01 1pdw s VAL 3050Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.72 1pdw s VAL 3050CO 0.00 0.22 -0.02 -0.69 0.00 0.00 0.00 175.10 174.61 1pdw s VAL 3051N -1.21 3.36 -0.12 2.92 1.01 -1.26 -1.08 120.40 124.02 1pdw s VAL 3051Ca 0.49 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1pdw s VAL 3051Cb -0.35 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 1pdw s VAL 3051CO 0.45 0.30 -0.07 -0.63 0.00 0.00 0.00 175.10 175.15 1pdw s ILE 3052N 1.44 3.63 -0.40 2.22 1.01 -0.74 -4.90 121.20 123.47 1pdw s ILE 3052Ca 0.04 -0.47 -0.16 0.00 0.00 0.00 0.00 60.65 60.05 1pdw s ILE 3052Cb -0.15 -2.53 0.01 0.00 0.01 0.00 0.00 42.46 39.79 1pdw s ILE 3052CO -0.03 0.54 0.39 0.00 0.00 0.00 0.00 174.94 175.84 1pdw n PRO 3054N 5.45 -0.15 0.15 0.00 -0.04 -1.26 -4.91 135.00 134.23 1pdw n PRO 3054Ca -0.09 0.02 0.06 0.00 -0.04 0.00 0.00 63.50 63.46 1pdw n PRO 3054Cb 0.48 -2.23 0.05 0.00 -0.04 0.00 0.00 33.50 31.76 1pdw n PRO 3054CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1pdw h ASP 3055N -1.37 0.00 -5.25 3.54 3.32 -0.05 -3.48 116.42 113.12 1pdw h ASP 3055Ca -0.44 0.00 0.11 0.00 0.02 0.00 0.00 57.03 56.72 1pdw h ASP 3055Cb 1.29 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.80 1pdw h ASP 3055CO 0.41 0.31 0.45 0.00 -1.72 0.00 0.00 179.24 178.69 1pdw s ALA 3056N -3.07 -1.36 0.24 3.45 0.00 -1.01 -4.97 121.76 115.04 1pdw s ALA 3056Ca 0.04 -0.32 -0.07 0.00 0.00 0.00 0.00 51.96 51.61 1pdw s ALA 3056Cb 0.07 0.72 -0.06 0.00 0.00 0.00 0.00 23.12 23.84 1pdw s ALA 3056CO 0.73 -1.04 0.53 -1.54 0.00 0.00 0.00 175.76 174.45 1pdw s SER 3057N -3.16 6.54 0.39 0.00 1.04 -1.26 -0.21 113.70 117.03 1pdw s SER 3057Ca 0.17 0.80 0.13 0.00 0.48 0.00 0.00 55.95 57.52 1pdw s SER 3057Cb -0.03 -2.18 0.78 0.00 0.10 0.00 0.00 66.02 64.69 1pdw s SER 3057CO 0.06 -0.11 1.86 0.25 0.98 0.00 0.00 173.24 176.29 1pdw h LEU 3058N 2.23 0.03 -0.75 2.42 5.85 -1.49 0.71 115.31 124.30 1pdw h LEU 3058Ca -0.47 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.32 1pdw h LEU 3058Cb 1.18 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.13 1pdw h LEU 3058CO 0.68 0.34 0.42 -0.08 -0.34 0.00 0.00 178.44 179.46 1pdw h GLU 3059N 0.02 0.71 0.10 1.25 4.57 -1.87 0.30 114.58 119.66 1pdw h GLU 3059Ca 0.00 -0.04 -0.26 0.00 -1.18 0.00 0.00 59.36 57.88 1pdw h GLU 3059Cb 0.57 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 1pdw h GLU 3059CO 0.04 0.47 -1.35 -0.44 -1.18 0.00 0.00 179.01 176.55 1pdw h ASP 3060N 0.73 0.32 -0.40 1.04 3.32 -1.85 -3.38 116.42 116.20 1pdw h ASP 3060Ca 0.35 -0.82 -0.00 0.00 0.02 0.00 0.00 57.03 56.58 1pdw h ASP 3060Cb 0.29 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1pdw h ASP 3060CO -0.22 1.58 0.25 0.00 -1.72 0.00 0.00 179.24 179.13 1pdw h ALA 3061N -0.09 1.67 -0.02 3.45 0.00 -0.80 -1.78 119.26 121.68 1pdw h ALA 3061Ca -0.30 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.57 1pdw h ALA 3061Cb 1.68 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.30 1pdw h ALA 3061CO 0.02 0.29 0.04 1.57 0.00 0.00 0.00 179.25 181.17 1pdw h LYS 3062N 0.56 0.00 0.00 0.00 2.10 -1.10 -1.16 116.57 116.97 1pdw h LYS 3062Ca 0.15 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.73 1pdw h LYS 3062Cb -0.03 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.29 1pdw h LYS 3062CO -0.03 0.00 -1.36 1.63 -2.00 0.00 0.00 179.45 177.69 1pdw n LYS 3063N -3.63 0.62 -1.24 0.07 5.02 -0.68 -4.70 118.16 113.62 1pdw n LYS 3063Ca -0.02 0.10 -0.43 0.00 -2.02 0.00 0.00 58.31 55.94 1pdw n LYS 3063Cb 0.12 -1.76 -0.05 0.00 -0.02 0.00 0.00 35.03 33.32 1pdw n LYS 3063CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1pdw n GLU 3064N -2.69 1.63 -1.10 1.97 -0.58 -0.44 -4.86 120.64 114.57 1pdw n GLU 3064Ca -0.05 -1.94 0.09 0.00 -0.42 0.00 0.00 57.16 54.84 1pdw n GLU 3064Cb 0.68 -2.98 -0.05 0.00 -0.57 0.00 0.00 31.44 28.52 1pdw n GLU 3064CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1pdw n GLY 3065N 4.54 -2.02 3.69 0.62 0.00 -1.26 -4.86 105.19 105.90 1pdw n GLY 3065Ca 0.50 -0.58 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1pdw n GLY 3065CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1pdw n PRO 3066N -3.66 1.11 -4.23 1.61 -0.02 -1.26 -5.01 135.00 123.54 1pdw n PRO 3066Ca -0.05 0.43 -0.30 0.00 -2.02 0.00 0.00 63.50 61.56 1pdw n PRO 3066Cb 0.40 -2.42 -0.10 0.00 -0.02 0.00 0.00 33.50 31.35 1pdw n PRO 3066CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1pdw s TYR 3067N -1.41 2.72 -0.35 6.00 1.51 -1.26 -4.92 117.35 119.63 1pdw s TYR 3067Ca 0.79 -0.17 0.23 0.00 -1.01 0.00 0.00 57.07 56.92 1pdw s TYR 3067Cb -0.40 -1.42 0.42 0.00 -0.11 0.00 0.00 41.96 40.45 1pdw s TYR 3067CO 0.43 0.43 1.63 -0.44 -1.11 0.00 0.00 175.55 176.49 1pdw h ASP 3068N 3.59 0.00 -4.11 2.29 3.32 -1.15 -3.44 116.42 116.92 1pdw h ASP 3068Ca -0.49 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.50 1pdw h ASP 3068Cb 1.17 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.50 1pdw h ASP 3068CO 0.52 0.05 0.04 0.54 -1.72 0.00 0.00 179.24 178.67 1pdw s VAL 3069N -3.24 0.00 -0.14 -1.35 0.11 -1.12 -2.50 120.40 112.17 1pdw s VAL 3069Ca 0.06 -0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.11 1pdw s VAL 3069Cb 0.06 -0.89 0.00 0.00 -1.53 0.00 0.00 36.38 34.02 1pdw s VAL 3069CO 0.66 -0.01 -0.19 -0.69 -3.33 0.00 0.00 175.10 171.55 1pdw s VAL 3070N 0.12 2.35 -0.11 2.04 1.01 -0.66 -1.44 120.40 123.71 1pdw s VAL 3070Ca -0.02 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.06 1pdw s VAL 3070Cb -0.04 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 1pdw s VAL 3070CO 0.02 0.53 -0.03 -0.69 0.00 0.00 0.00 175.10 174.94 1pdw s VAL 3071N 0.77 4.03 -0.33 2.92 1.01 0.24 -0.96 120.40 128.07 1pdw s VAL 3071Ca -0.07 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.61 1pdw s VAL 3071Cb -0.16 -2.72 0.10 0.00 0.00 0.00 0.00 36.38 33.60 1pdw s VAL 3071CO -0.00 0.55 0.04 -0.76 0.00 0.00 0.00 175.10 174.93 1pdw s LEU 3072N -0.30 4.65 1.11 3.92 1.43 0.15 -2.24 118.68 127.40 1pdw s LEU 3072Ca 0.05 -2.11 -0.12 0.00 -1.03 0.00 0.00 54.13 50.92 1pdw s LEU 3072Cb -0.12 -1.61 0.25 0.00 0.03 0.00 0.00 46.19 44.73 1pdw s LEU 3072CO 0.02 -0.37 1.05 -2.84 0.23 0.00 0.00 176.35 174.44 1pdw s PRO 3073N 0.92 -0.46 0.00 1.29 0.02 -1.26 -2.40 135.00 133.11 1pdw s PRO 3073Ca 0.10 0.86 0.00 0.00 0.02 0.00 0.00 61.00 61.98 1pdw s PRO 3073Cb -0.19 -1.61 0.00 0.00 0.02 0.00 0.00 34.50 32.72 1pdw s PRO 3073CO -0.08 -3.42 0.00 0.41 -0.33 0.00 0.00 177.00 173.58 1pdw n GLY 3074N 0.37 1.44 0.00 0.52 0.00 -1.15 -3.89 105.19 102.48 1pdw n GLY 3074Ca 0.04 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1pdw n GLY 3074CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pdw n GLY 3075N 5.00 1.57 0.11 -0.02 0.00 -1.26 -1.84 105.19 108.76 1pdw n GLY 3075Ca 0.00 -1.27 -0.08 0.00 0.00 0.00 0.00 46.02 44.66 1pdw n GLY 3075CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1pdw h ASN 3076N 0.00 -0.04 -0.28 1.61 2.35 -1.96 0.19 115.58 117.45 1pdw h ASN 3076Ca 0.00 0.04 -0.18 0.00 -0.55 0.00 0.00 56.30 55.61 1pdw h ASN 3076Cb 0.00 0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1pdw h ASN 3076CO 0.00 0.01 -0.54 0.25 -1.65 0.00 0.00 177.43 175.50 1pdw h LEU 3077N 0.10 0.97 -0.13 1.61 5.85 -1.87 -2.51 115.31 119.33 1pdw h LEU 3077Ca 0.10 -0.52 0.02 0.00 0.84 0.00 0.00 57.88 58.33 1pdw h LEU 3077Cb 0.11 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 1pdw h LEU 3077CO -0.15 1.32 -0.02 1.23 -0.34 0.00 0.00 178.44 180.47 1pdw h GLY 3078N 0.71 0.10 1.02 3.75 0.00 -1.15 0.03 103.07 107.53 1pdw h GLY 3078Ca 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1pdw h GLY 3078CO 0.12 -0.04 0.53 0.00 0.00 0.00 0.00 176.54 177.15 1pdw h ALA 3079N 1.12 1.14 -0.10 3.60 0.00 -0.64 0.01 119.26 124.39 1pdw h ALA 3079Ca 0.06 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1pdw h ALA 3079Cb 0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1pdw h ALA 3079CO -0.13 0.61 0.06 1.96 0.00 0.00 0.00 179.25 181.75 1pdw h GLN 3080N 1.24 0.14 -0.73 0.00 4.20 -0.99 0.46 115.11 119.43 1pdw h GLN 3080Ca 0.32 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.05 1pdw h GLN 3080Cb -0.04 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.67 1pdw h GLN 3080CO -0.06 0.18 0.48 -0.91 -0.67 0.00 0.00 178.83 177.85 1pdw h ASN 3081N 0.08 0.75 -0.42 1.46 -0.26 -0.57 -1.06 115.58 115.56 1pdw h ASN 3081Ca 0.04 -0.01 -0.12 0.00 -0.56 0.00 0.00 56.30 55.65 1pdw h ASN 3081Cb 0.07 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.15 1pdw h ASN 3081CO -0.01 0.51 -0.22 -0.07 -1.06 0.00 0.00 177.43 176.58 1pdw h LEU 3082N 0.86 0.93 -2.10 1.61 3.38 -0.25 -3.02 115.31 116.73 1pdw h LEU 3082Ca 0.30 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1pdw h LEU 3082Cb 0.10 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 1pdw h LEU 3082CO -0.09 1.13 -0.07 0.28 0.09 0.00 0.00 178.44 179.79 1pdw h SER 3083N 0.72 0.00 0.73 -0.43 0.02 0.11 -2.79 113.55 111.92 1pdw h SER 3083Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1pdw h SER 3083Cb 0.79 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1pdw h SER 3083CO 0.07 0.07 -0.70 -0.62 -1.14 0.00 0.00 176.83 174.50 1pdw n GLU 3084N -3.99 0.26 -2.63 3.45 1.02 -0.73 -4.74 120.64 113.29 1pdw n GLU 3084Ca -0.03 0.06 -0.43 0.00 -0.02 0.00 0.00 57.16 56.75 1pdw n GLU 3084Cb 0.16 -1.65 -0.02 0.00 -0.02 0.00 0.00 31.44 29.90 1pdw n GLU 3084CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1pdw s SER 3085N -4.04 7.15 0.39 1.62 0.15 -1.05 -4.89 113.70 113.02 1pdw s SER 3085Ca 0.06 1.53 0.20 0.00 0.70 0.00 0.00 55.95 58.44 1pdw s SER 3085Cb 0.14 -2.55 0.67 0.00 -1.71 0.00 0.00 66.02 62.57 1pdw s SER 3085CO 0.74 -0.56 1.72 0.00 1.20 0.00 0.00 173.24 176.34 1pdw h ALA 3086N 7.35 0.96 -0.40 5.45 0.00 -1.91 -2.74 119.26 127.97 1pdw h ALA 3086Ca -0.27 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.20 1pdw h ALA 3086Cb 1.12 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1pdw h ALA 3086CO 0.91 0.42 -0.29 0.00 0.00 0.00 0.00 179.25 180.29 1pdw h ALA 3087N 1.66 0.73 -0.62 0.00 0.00 -1.96 -2.67 119.26 116.40 1pdw h ALA 3087Ca -0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 1pdw h ALA 3087Cb 0.91 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1pdw h ALA 3087CO 0.04 0.66 0.02 0.28 0.00 0.00 0.00 179.25 180.25 1pdw h VAL 3088N 0.73 1.27 -0.28 0.00 2.07 -1.81 -2.61 116.25 115.62 1pdw h VAL 3088Ca 0.08 -1.14 0.04 0.00 0.82 0.00 0.00 66.70 66.50 1pdw h VAL 3088Cb 0.85 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 1pdw h VAL 3088CO 0.07 0.42 0.04 0.50 0.02 0.00 0.00 177.57 178.62 1pdw h LYS 3089N 1.00 0.13 -0.46 1.57 3.64 -1.26 -0.47 116.57 120.71 1pdw h LYS 3089Ca 0.18 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1pdw h LYS 3089Cb 0.55 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.32 1pdw h LYS 3089CO 0.03 0.08 0.29 0.93 -2.27 0.00 0.00 179.45 178.51 1pdw h GLU 3090N 0.13 0.62 -0.33 1.90 5.08 -1.39 -0.26 114.58 120.32 1pdw h GLU 3090Ca 0.13 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1pdw h GLU 3090Cb 0.15 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1pdw h GLU 3090CO -0.19 0.45 0.17 0.82 -1.00 0.00 0.00 179.01 179.27 1pdw h ILE 3091N 0.62 1.00 -0.59 3.13 2.04 -1.04 -1.00 117.51 121.66 1pdw h ILE 3091Ca 0.17 -0.12 -0.10 0.00 1.00 0.00 0.00 64.86 65.81 1pdw h ILE 3091Cb -0.02 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1pdw h ILE 3091CO -0.03 0.07 -0.01 -0.07 0.00 0.00 0.00 178.15 178.11 1pdw h LEU 3092N 0.36 1.02 -0.63 1.44 3.38 -0.83 0.55 115.31 120.60 1pdw h LEU 3092Ca 0.14 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1pdw h LEU 3092Cb 0.04 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 1pdw h LEU 3092CO -0.09 1.08 0.35 0.11 0.09 0.00 0.00 178.44 179.98 1pdw h LYS 3093N 0.95 0.87 -0.48 1.13 1.57 -0.80 0.56 116.57 120.37 1pdw h LYS 3093Ca 0.17 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 1pdw h LYS 3093Cb 0.56 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 1pdw h LYS 3093CO 0.03 0.65 0.14 1.49 -0.57 0.00 0.00 179.45 181.19 1pdw h GLU 3094N 0.85 0.75 -0.26 3.15 4.81 -0.87 0.17 114.58 123.18 1pdw h GLU 3094Ca 0.22 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1pdw h GLU 3094Cb 0.03 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1pdw h GLU 3094CO -0.04 0.72 0.16 0.37 -0.73 0.00 0.00 179.01 179.49 1pdw h GLN 3095N 0.64 0.31 -0.29 1.92 5.75 -0.48 0.88 115.11 123.84 1pdw h GLN 3095Ca 0.15 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.60 1pdw h GLN 3095Cb 0.29 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 1pdw h GLN 3095CO -0.00 0.21 0.06 1.49 -2.65 0.00 0.00 178.83 177.94 1pdw h GLU 3096N 0.32 0.47 -0.22 1.69 4.81 -0.70 0.64 114.58 121.60 1pdw h GLU 3096Ca 0.10 -0.12 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 1pdw h GLU 3096Cb -0.02 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1pdw h GLU 3096CO -0.04 0.56 -0.19 -0.91 -0.73 0.00 0.00 179.01 177.70 1pdw h ASN 3097N 0.31 0.37 -0.53 1.04 -0.26 -0.36 -2.65 115.58 113.49 1pdw h ASN 3097Ca 0.09 -0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1pdw h ASN 3097Cb 0.31 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.47 1pdw h ASN 3097CO 0.00 0.58 0.00 -2.11 -1.06 0.00 0.00 177.43 174.84 1pdw n ARG 3098N -4.18 4.33 -3.58 0.81 1.85 0.28 -4.93 116.66 111.24 1pdw n ARG 3098Ca -0.00 -2.80 -0.20 0.00 -1.00 0.00 0.00 57.85 53.85 1pdw n ARG 3098Cb 0.34 -2.13 0.06 0.00 -1.05 0.00 0.00 32.46 29.68 1pdw n ARG 3098CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1pdw n LYS 3099N 0.65 -5.24 -4.07 2.89 4.76 -1.00 -5.01 118.16 111.14 1pdw n LYS 3099Ca 0.25 0.71 -0.28 0.00 -2.87 0.00 0.00 58.31 56.12 1pdw n LYS 3099Cb 1.05 -5.42 -0.06 0.00 -1.84 0.00 0.00 35.03 28.76 1pdw n LYS 3099CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1pdw s GLY 3100N -4.28 1.81 0.36 0.72 0.00 0.22 -5.03 107.32 101.13 1pdw s GLY 3100Ca 0.04 -1.15 -0.26 0.00 0.00 0.00 0.00 44.72 43.35 1pdw s GLY 3100CO 0.78 -1.15 1.10 -2.27 0.00 0.00 0.00 173.10 171.56 1pdw s LEU 3101N -2.88 4.28 -0.11 0.66 2.96 -1.04 -4.45 118.68 118.10 1pdw s LEU 3101Ca 0.30 2.19 0.02 0.00 -0.22 0.00 0.00 54.13 56.42 1pdw s LEU 3101Cb -0.11 -3.97 0.01 0.00 0.50 0.00 0.00 46.19 42.63 1pdw s LEU 3101CO 0.23 -0.44 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.03 1pdw s ILE 3102N -1.44 1.56 -0.16 6.68 1.01 -0.43 -1.65 121.20 126.77 1pdw s ILE 3102Ca 0.54 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 60.51 1pdw s ILE 3102Cb -0.27 -1.42 0.03 0.00 0.01 0.00 0.00 42.46 40.80 1pdw s ILE 3102CO 0.35 0.45 -0.13 0.00 0.00 0.00 0.00 174.94 175.61 1pdw s ALA 3103N 0.99 1.88 -0.03 9.38 0.00 -0.14 -0.70 121.76 133.15 1pdw s ALA 3103Ca -0.06 -0.95 0.04 0.00 0.00 0.00 0.00 51.96 50.99 1pdw s ALA 3103Cb -0.15 -1.09 -0.01 0.00 0.00 0.00 0.00 23.12 21.87 1pdw s ALA 3103CO -0.02 -0.47 -0.16 0.00 0.00 0.00 0.00 175.76 175.12 1pdw s ALA 3104N 1.47 1.37 0.12 0.00 0.00 -0.42 0.29 121.76 124.59 1pdw s ALA 3104Ca 0.04 -0.65 0.08 0.00 0.00 0.00 0.00 51.96 51.43 1pdw s ALA 3104Cb -0.13 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.54 1pdw s ALA 3104CO -0.10 0.29 -0.20 -1.50 0.00 0.00 0.00 175.76 174.25 1pdw s ILE 3105N -0.14 1.69 0.00 0.00 2.07 -1.01 -2.21 121.20 121.61 1pdw s ILE 3105Ca 0.01 -1.64 0.00 0.00 -1.41 0.00 0.00 60.65 57.62 1pdw s ILE 3105Cb -0.09 -1.61 0.00 0.00 0.13 0.00 0.00 42.46 40.90 1pdw s ILE 3105CO 0.01 -0.15 0.00 0.00 -1.91 0.00 0.00 174.94 172.89 1pdw h ALA 3107N -0.90 0.60 -0.91 0.00 0.00 -1.88 -1.82 119.26 114.35 1pdw h ALA 3107Ca 0.00 0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.13 1pdw h ALA 3107Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 1pdw h ALA 3107CO 0.00 0.00 0.61 0.78 0.00 0.00 0.00 179.25 180.64 1pdw h GLY 3108N 4.07 0.69 1.97 0.00 0.00 -0.81 -1.63 103.07 107.37 1pdw h GLY 3108Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1pdw h GLY 3108CO 0.00 -0.02 0.01 -2.55 0.00 0.00 0.00 176.54 173.99 1pdw h PRO 3109N 0.31 0.00 0.00 4.80 0.11 -1.73 -1.36 132.00 134.13 1pdw h PRO 3109Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 1pdw h PRO 3109Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1pdw h PRO 3109CO -0.15 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 179.43 1pdw h THR 3110N 0.00 0.00 0.00 -1.15 1.35 -1.60 -0.84 112.91 110.67 1pdw h THR 3110Ca 0.00 -0.32 -0.08 0.00 -0.55 0.00 0.00 66.41 65.46 1pdw h THR 3110Cb 0.03 1.19 -0.01 0.00 -1.73 0.00 0.00 68.15 67.63 1pdw h THR 3110CO -0.00 0.00 -0.39 0.00 -0.25 0.00 0.00 175.52 174.88 1pdw h ALA 3111N 2.08 1.05 -0.38 6.62 0.00 -1.43 -2.55 119.26 124.66 1pdw h ALA 3111Ca 0.00 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 1pdw h ALA 3111Cb 0.36 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1pdw h ALA 3111CO 0.00 0.49 0.00 -0.07 0.00 0.00 0.00 179.25 179.67 1pdw h LEU 3112N 0.00 0.66 0.31 0.00 3.38 -1.29 -2.48 115.31 115.89 1pdw h LEU 3112Ca -0.00 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1pdw h LEU 3112Cb 0.87 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1pdw h LEU 3112CO 0.05 0.81 -0.15 0.25 0.09 0.00 0.00 178.44 179.49 1pdw h LEU 3113N 0.50 -0.35 -1.74 1.67 5.85 -1.55 0.38 115.31 120.07 1pdw h LEU 3113Ca 0.11 -0.06 0.21 0.00 0.84 0.00 0.00 57.88 58.98 1pdw h LEU 3113Cb 0.47 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 1pdw h LEU 3113CO 0.02 -0.16 0.57 0.00 -0.34 0.00 0.00 178.44 178.53 1pdw h ALA 3114N 0.15 2.44 -0.61 1.25 0.00 -1.44 0.40 119.26 121.45 1pdw h ALA 3114Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1pdw h ALA 3114Cb 0.39 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1pdw h ALA 3114CO 0.07 -0.69 0.00 0.72 0.00 0.00 0.00 179.25 179.35 1pdw n HIS 3115N -4.41 0.99 -3.84 0.00 8.25 -0.94 -4.97 115.22 110.30 1pdw n HIS 3115Ca 0.17 -0.54 -0.35 0.00 -0.26 0.00 0.00 57.72 56.74 1pdw n HIS 3115Cb 0.75 -0.08 0.03 0.00 1.12 0.00 0.00 29.99 31.81 1pdw n HIS 3115CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1pdw n GLU 3116N 1.19 -1.16 -4.64 -0.41 1.02 0.14 -4.96 120.64 111.82 1pdw n GLU 3116Ca 0.22 0.33 -0.33 0.00 -0.02 0.00 0.00 57.16 57.36 1pdw n GLU 3116Cb 0.66 -3.70 -0.12 0.00 -0.02 0.00 0.00 31.44 28.26 1pdw n GLU 3116CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1pdw s ILE 3117N -3.56 3.52 -1.49 -3.67 -1.09 0.11 -4.65 121.20 110.37 1pdw s ILE 3117Ca 0.42 -0.52 -0.00 0.00 -2.23 0.00 0.00 60.65 58.31 1pdw s ILE 3117Cb -0.18 -2.46 0.00 0.00 -1.58 0.00 0.00 42.46 38.24 1pdw s ILE 3117CO 0.90 0.56 0.05 0.61 -1.23 0.00 0.00 174.94 175.83 1pdw n GLY 3118N 2.84 -0.36 3.68 6.18 0.00 -1.26 -4.61 105.19 111.65 1pdw n GLY 3118Ca -0.18 -0.13 -0.44 0.00 0.00 0.00 0.00 46.02 45.28 1pdw n GLY 3118CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1pdw n PHE 3119N -4.05 2.13 -0.05 1.61 0.99 -1.26 -1.91 117.46 114.92 1pdw n PHE 3119Ca -0.20 0.52 0.00 0.00 -0.00 0.00 0.00 57.45 57.77 1pdw n PHE 3119Cb 0.65 -2.42 0.00 0.00 -1.00 0.00 0.00 39.48 36.72 1pdw n PHE 3119CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1pdw n GLY 3120N 1.42 1.00 3.84 1.37 0.00 0.13 -5.01 105.19 107.95 1pdw n GLY 3120Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 1pdw n GLY 3120CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pdw s SER 3121N -2.74 4.86 -0.20 1.61 0.01 -0.80 -4.71 113.70 111.73 1pdw s SER 3121Ca 0.00 1.20 -0.17 0.00 1.31 0.00 0.00 55.95 58.29 1pdw s SER 3121Cb 0.00 -1.94 -0.04 0.00 0.21 0.00 0.00 66.02 64.25 1pdw s SER 3121CO 0.00 -1.73 0.44 -0.75 0.41 0.00 0.00 173.24 171.61 1pdw s LYS 3122N -5.26 4.19 0.12 12.44 2.20 -1.26 -1.88 119.74 130.27 1pdw s LYS 3122Ca 0.60 0.28 -0.00 0.00 -0.36 0.00 0.00 55.97 56.48 1pdw s LYS 3122Cb -0.13 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.61 1pdw s LYS 3122CO 0.53 -0.06 0.02 0.14 -0.36 0.00 0.00 175.35 175.62 1pdw s VAL 3123N 1.38 0.25 0.20 4.02 -7.23 0.64 -4.43 120.40 115.23 1pdw s VAL 3123Ca 0.21 -1.90 0.02 0.00 -1.81 0.00 0.00 61.98 58.50 1pdw s VAL 3123Cb -0.15 -1.91 -0.05 0.00 0.56 0.00 0.00 36.38 34.84 1pdw s VAL 3123CO 0.09 -0.62 0.03 0.28 -0.31 0.00 0.00 175.10 174.57 1pdw s THR 3124N -3.94 0.65 0.06 5.32 -1.32 -1.26 0.00 115.64 115.15 1pdw s THR 3124Ca 0.19 -1.99 -0.02 0.00 -1.21 0.00 0.00 61.69 58.66 1pdw s THR 3124Cb 0.07 -2.29 0.01 0.00 -1.51 0.00 0.00 72.50 68.78 1pdw s THR 3124CO -0.01 -0.32 0.12 0.35 -2.21 0.00 0.00 174.62 172.54 1pdw n THR 3125N -0.32 0.00 -2.40 5.08 -2.24 -1.26 -4.42 114.28 108.72 1pdw n THR 3125Ca -0.04 -0.19 -0.39 0.00 -2.27 0.00 0.00 64.05 61.17 1pdw n THR 3125Cb 0.64 0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.00 1pdw n THR 3125CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1pdw s HIS 3126N -7.27 3.26 0.55 4.78 2.46 -0.68 -4.42 115.29 113.97 1pdw s HIS 3126Ca 0.03 1.61 0.33 0.00 0.47 0.00 0.00 55.06 57.50 1pdw s HIS 3126Cb -0.01 -3.31 1.49 0.00 -0.13 0.00 0.00 32.58 30.62 1pdw s HIS 3126CO 0.02 -0.95 1.86 -1.35 -2.47 0.00 0.00 174.74 171.85 1pdw h PRO 3127N 2.98 0.00 -0.18 2.88 0.11 -1.93 0.15 132.00 136.01 1pdw h PRO 3127Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1pdw h PRO 3127Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1pdw h PRO 3127CO 0.64 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.71 1pdw n LEU 3128N -4.17 1.43 0.00 2.35 4.77 -1.26 -3.50 117.00 116.63 1pdw n LEU 3128Ca 0.19 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.54 1pdw n LEU 3128Cb 1.01 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.98 1pdw n LEU 3128CO 0.38 0.32 0.33 0.00 -1.33 0.00 0.00 177.39 177.08 1pdw n ALA 3129N 0.20 2.30 0.25 -1.18 0.00 0.52 -4.76 120.51 117.84 1pdw n ALA 3129Ca 0.14 -0.65 -0.16 0.00 0.00 0.00 0.00 53.44 52.77 1pdw n ALA 3129Cb 0.27 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.64 1pdw n ALA 3129CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1pdw h LYS 3130N 0.00 -0.64 -0.07 0.00 3.64 -1.57 -3.09 116.57 114.83 1pdw h LYS 3130Ca 0.00 0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1pdw h LYS 3130Cb 0.17 0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 32.08 1pdw h LYS 3130CO 0.00 -0.43 -0.52 -0.44 -2.27 0.00 0.00 179.45 175.80 1pdw h ASP 3131N -0.67 -1.61 0.00 4.20 5.19 -1.85 -3.40 116.42 118.28 1pdw h ASP 3131Ca -0.05 0.19 -0.14 0.00 -0.62 0.00 0.00 57.03 56.41 1pdw h ASP 3131Cb 0.55 0.63 0.04 0.00 0.18 0.00 0.00 39.33 40.72 1pdw h ASP 3131CO 0.05 -0.49 0.67 1.17 -3.12 0.00 0.00 179.24 177.51 1pdw n LYS 3132N -5.45 0.00 0.00 3.56 3.00 -1.17 -4.91 118.16 113.19 1pdw n LYS 3132Ca -0.06 -0.31 0.00 0.00 -0.00 0.00 0.00 58.31 57.94 1pdw n LYS 3132Cb 0.39 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.92 1pdw n LYS 3132CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1pdw n ASN 3135N 4.81 0.00 0.00 3.14 5.15 -1.26 -5.08 115.26 122.02 1pdw n ASN 3135Ca 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1pdw n ASN 3135Cb 0.20 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.45 1pdw n ASN 3135CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1pdw n GLY 3136N 0.24 0.53 3.86 8.20 0.00 -1.26 -4.67 105.19 112.09 1pdw n GLY 3136Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1pdw n GLY 3136CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pdw n GLY 3137N -1.45 -0.53 1.14 -0.02 0.00 -1.26 -4.88 105.19 98.19 1pdw n GLY 3137Ca 0.00 0.27 0.11 0.00 0.00 0.00 0.00 46.02 46.40 1pdw n GLY 3137CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1pdw n HIS 3138N -4.36 0.55 -4.05 1.61 8.25 -1.26 -4.96 115.22 110.99 1pdw n HIS 3138Ca -0.22 -0.29 -0.10 0.00 -0.26 0.00 0.00 57.72 56.85 1pdw n HIS 3138Cb 0.65 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.69 1pdw n HIS 3138CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1pdw s TYR 3139N -1.38 0.61 -0.19 4.41 2.02 -1.26 0.21 117.35 121.77 1pdw s TYR 3139Ca 0.39 -0.93 -0.01 0.00 -0.37 0.00 0.00 57.07 56.15 1pdw s TYR 3139Cb 0.22 -0.00 0.01 0.00 -0.40 0.00 0.00 41.96 41.79 1pdw s TYR 3139CO 0.31 -0.93 -0.14 0.99 -1.57 0.00 0.00 175.55 174.21 1pdw s THR 3140N -3.95 2.60 0.45 -0.71 2.01 -0.79 -4.96 115.64 110.30 1pdw s THR 3140Ca 0.27 -0.76 -0.22 0.00 0.31 0.00 0.00 61.69 61.29 1pdw s THR 3140Cb 0.01 -2.13 -0.08 0.00 0.01 0.00 0.00 72.50 70.31 1pdw s THR 3140CO 0.11 0.50 1.07 -0.47 -0.69 0.00 0.00 174.62 175.13 1pdw s TYR 3141N 1.24 3.06 0.21 4.92 5.04 -1.26 -0.26 117.35 130.29 1pdw s TYR 3141Ca 0.03 1.59 0.06 0.00 -2.44 0.00 0.00 57.07 56.31 1pdw s TYR 3141Cb -0.14 -3.15 -0.05 0.00 0.35 0.00 0.00 41.96 38.97 1pdw s TYR 3141CO -0.07 -0.90 -0.09 0.45 -1.34 0.00 0.00 175.55 173.60 1pdw s SER 3142N -1.72 2.26 -0.01 4.32 0.15 0.10 -4.79 113.70 114.01 1pdw s SER 3142Ca 0.64 -1.09 0.10 0.00 0.70 0.00 0.00 55.95 56.30 1pdw s SER 3142Cb -0.21 -0.08 -0.13 0.00 -1.71 0.00 0.00 66.02 63.89 1pdw s SER 3142CO 0.25 -0.31 0.36 1.21 1.20 0.00 0.00 173.24 175.96 1pdw n GLU 3143N -0.38 2.38 -1.63 5.44 4.07 -1.26 -4.58 120.64 124.68 1pdw n GLU 3143Ca -0.08 -0.04 -0.41 0.00 -0.06 0.00 0.00 57.16 56.58 1pdw n GLU 3143Cb 0.62 -1.09 0.02 0.00 -0.06 0.00 0.00 31.44 30.93 1pdw n GLU 3143CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1pdw n ASN 3144N -1.48 1.43 -0.35 4.31 4.13 -1.26 -4.88 115.26 117.16 1pdw n ASN 3144Ca 0.01 1.03 0.02 0.00 1.68 0.00 0.00 54.58 57.32 1pdw n ASN 3144Cb 0.20 -1.38 0.19 0.00 -1.54 0.00 0.00 39.78 37.25 1pdw n ASN 3144CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 1pdw h ARG 3145N 1.53 1.12 -4.39 3.52 3.08 -1.95 -3.40 114.38 113.90 1pdw h ARG 3145Ca -0.45 -0.07 -0.46 0.00 0.07 0.00 0.00 59.98 59.07 1pdw h ARG 3145Cb 1.33 -0.25 -0.33 0.00 0.08 0.00 0.00 29.97 30.80 1pdw h ARG 3145CO 0.57 0.74 -0.80 0.08 -1.07 0.00 0.00 179.97 179.50 1pdw s VAL 3146N -6.01 0.87 -0.09 2.04 1.01 -1.26 -1.79 120.40 115.17 1pdw s VAL 3146Ca -0.12 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1pdw s VAL 3146Cb 0.20 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.78 1pdw s VAL 3146CO 0.81 0.29 -0.13 -0.70 0.00 0.00 0.00 175.10 175.37 1pdw s GLU 3147N 0.64 1.89 -0.20 2.72 2.56 -0.05 -5.00 118.70 121.25 1pdw s GLU 3147Ca -0.11 -0.45 0.01 0.00 0.00 0.00 0.00 54.97 54.41 1pdw s GLU 3147Cb -0.14 -1.62 0.04 0.00 2.00 0.00 0.00 34.13 34.41 1pdw s GLU 3147CO 0.02 -0.04 -0.10 0.21 -0.56 0.00 0.00 175.26 174.79 1pdw s LYS 3148N 0.91 2.01 -0.47 4.30 2.20 -1.26 -0.79 119.74 126.65 1pdw s LYS 3148Ca -0.09 -0.88 0.03 0.00 -0.36 0.00 0.00 55.97 54.67 1pdw s LYS 3148Cb -0.15 -2.45 0.12 0.00 -1.51 0.00 0.00 37.83 33.84 1pdw s LYS 3148CO 0.00 -0.45 0.21 0.34 -0.36 0.00 0.00 175.35 175.09 1pdw s ASP 3149N 1.38 4.58 1.73 1.43 -1.08 -0.08 -5.00 116.67 119.63 1pdw s ASP 3149Ca -0.02 -2.68 0.00 0.00 -0.52 0.00 0.00 52.55 49.33 1pdw s ASP 3149Cb -0.17 -1.67 0.00 0.00 -1.46 0.00 0.00 42.92 39.63 1pdw s ASP 3149CO -0.08 -0.31 0.00 0.61 0.52 0.00 0.00 175.17 175.92 1pdw n GLY 3150N 3.57 2.91 1.42 2.66 0.00 -1.26 -2.09 105.19 112.40 1pdw n GLY 3150Ca 0.05 -0.22 0.01 0.00 0.00 0.00 0.00 46.02 45.86 1pdw n GLY 3150CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pdw n LEU 3151N 0.00 4.12 -4.07 0.99 4.77 -1.26 -4.71 117.00 116.83 1pdw n LEU 3151Ca 0.00 -2.10 -0.32 0.00 -0.03 0.00 0.00 56.01 53.55 1pdw n LEU 3151Cb 0.00 -0.63 -0.15 0.00 -2.33 0.00 0.00 43.42 40.31 1pdw n LEU 3151CO 0.00 0.53 -0.41 -0.63 -1.33 0.00 0.00 177.39 175.56 1pdw s ILE 3152N -2.07 2.34 -0.12 -0.08 -1.09 -0.89 -1.32 121.20 117.97 1pdw s ILE 3152Ca 0.34 -1.79 0.01 0.00 -2.23 0.00 0.00 60.65 56.98 1pdw s ILE 3152Cb 0.26 -2.47 -0.01 0.00 -1.58 0.00 0.00 42.46 38.66 1pdw s ILE 3152CO 0.09 -0.20 -0.16 -0.22 -1.23 0.00 0.00 174.94 173.22 1pdw s LEU 3153N 1.07 2.52 0.17 2.97 0.20 0.12 -0.91 118.68 124.83 1pdw s LEU 3153Ca -0.03 -0.40 0.01 0.00 0.69 0.00 0.00 54.13 54.39 1pdw s LEU 3153Cb -0.20 -1.55 -0.04 0.00 -0.43 0.00 0.00 46.19 43.97 1pdw s LEU 3153CO -0.05 0.16 0.04 0.42 -0.29 0.00 0.00 176.35 176.63 1pdw s THR 3154N 0.36 0.43 0.18 3.68 -4.23 0.03 -1.30 115.64 114.79 1pdw s THR 3154Ca -0.13 -1.96 -0.10 0.00 -1.18 0.00 0.00 61.69 58.32 1pdw s THR 3154Cb -0.17 -2.20 -0.01 0.00 1.34 0.00 0.00 72.50 71.46 1pdw s THR 3154CO 0.07 -0.37 0.33 -0.55 -0.54 0.00 0.00 174.62 173.56 1pdw s SER 3155N -3.16 0.00 -0.10 3.99 0.15 -0.94 -0.87 113.70 112.78 1pdw s SER 3155Ca 0.27 -0.89 -0.12 0.00 0.70 0.00 0.00 55.95 55.91 1pdw s SER 3155Cb 0.07 0.47 -0.10 0.00 -1.71 0.00 0.00 66.02 64.75 1pdw s SER 3155CO 0.05 -0.95 0.36 0.03 1.20 0.00 0.00 173.24 173.94 1pdw h ARG 3156N 2.47 -0.05 0.00 5.44 2.47 -1.56 0.39 114.38 123.53 1pdw h ARG 3156Ca -0.31 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.42 1pdw h ARG 3156Cb 1.24 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.57 1pdw h ARG 3156CO 0.45 0.30 0.00 0.41 0.56 0.00 0.00 179.97 181.70 1pdw n GLY 3157N 1.52 2.53 0.27 0.04 0.00 -1.26 -3.13 105.19 105.17 1pdw n GLY 3157Ca -0.04 -1.04 0.02 0.00 0.00 0.00 0.00 46.02 44.96 1pdw n GLY 3157CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1pdw h PRO 3158N 0.00 0.57 0.00 1.61 0.11 -1.98 0.09 132.00 132.40 1pdw h PRO 3158Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1pdw h PRO 3158Cb 0.00 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 30.98 1pdw h PRO 3158CO 0.00 0.38 0.00 0.41 -0.21 0.00 0.00 178.00 178.58 1pdw n GLY 3159N -1.31 -0.53 0.41 -0.55 0.00 -1.26 -1.11 105.19 100.84 1pdw n GLY 3159Ca 0.12 -0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.17 1pdw n GLY 3159CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pdw n THR 3160N -1.46 0.72 -0.29 2.61 -2.24 0.01 -4.71 114.28 108.92 1pdw n THR 3160Ca 0.01 -0.86 0.03 0.00 -2.27 0.00 0.00 64.05 60.96 1pdw n THR 3160Cb 0.02 0.69 0.16 0.00 -2.10 0.00 0.00 70.33 69.10 1pdw n THR 3160CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1pdw h SER 3161N 1.46 0.66 0.22 3.42 0.02 -0.98 0.14 113.55 118.48 1pdw h SER 3161Ca 0.00 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1pdw h SER 3161Cb 0.57 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1pdw h SER 3161CO 0.00 0.37 -0.10 -0.26 -1.14 0.00 0.00 176.83 175.70 1pdw h PHE 3162N 0.77 -0.27 -0.90 3.45 -1.00 -1.84 0.32 116.94 117.48 1pdw h PHE 3162Ca 0.39 -0.01 0.06 0.00 2.81 0.00 0.00 57.97 61.22 1pdw h PHE 3162Cb 0.36 0.09 -0.06 0.00 3.61 0.00 0.00 35.95 39.95 1pdw h PHE 3162CO -0.06 -0.04 0.59 0.93 -1.61 0.00 0.00 178.31 178.11 1pdw h GLU 3163N -0.46 1.03 0.44 1.51 5.08 -1.84 0.38 114.58 120.71 1pdw h GLU 3163Ca -0.03 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1pdw h GLU 3163Cb 0.35 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1pdw h GLU 3163CO 0.05 0.68 -0.21 0.35 -1.00 0.00 0.00 179.01 178.88 1pdw h PHE 3164N 1.06 -0.54 -0.61 4.33 3.57 -0.44 -0.13 116.94 124.18 1pdw h PHE 3164Ca 0.38 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.87 1pdw h PHE 3164Cb 0.14 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 1pdw h PHE 3164CO -0.00 -0.31 0.39 0.00 -2.23 0.00 0.00 178.31 176.17 1pdw h ALA 3165N -0.09 0.77 -0.28 2.41 0.00 0.43 -1.77 119.26 120.73 1pdw h ALA 3165Ca -0.06 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1pdw h ALA 3165Cb 0.48 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1pdw h ALA 3165CO 0.10 0.22 -0.16 -0.07 0.00 0.00 0.00 179.25 179.34 1pdw h LEU 3166N 0.83 0.48 -0.65 0.00 3.38 -0.21 -1.03 115.31 118.10 1pdw h LEU 3166Ca 0.22 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1pdw h LEU 3166Cb -0.07 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1pdw h LEU 3166CO -0.05 0.66 0.24 0.00 0.09 0.00 0.00 178.44 179.39 1pdw h ALA 3167N 1.39 0.85 -0.05 1.53 0.00 -0.48 -0.67 119.26 121.83 1pdw h ALA 3167Ca 0.08 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1pdw h ALA 3167Cb 0.54 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1pdw h ALA 3167CO 0.03 0.49 0.03 0.82 0.00 0.00 0.00 179.25 180.62 1pdw h ILE 3168N 0.93 1.07 -0.64 0.00 2.04 -0.77 -1.46 117.51 118.68 1pdw h ILE 3168Ca 0.22 -0.21 0.06 0.00 1.00 0.00 0.00 64.86 65.92 1pdw h ILE 3168Cb 0.24 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 1pdw h ILE 3168CO -0.01 0.06 0.35 0.58 0.00 0.00 0.00 178.15 179.13 1pdw h VAL 3169N -0.01 0.96 -0.23 1.67 2.07 -0.95 -1.52 116.25 118.24 1pdw h VAL 3169Ca 0.02 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1pdw h VAL 3169Cb 0.08 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1pdw h VAL 3169CO -0.00 0.12 0.12 -0.08 0.02 0.00 0.00 177.57 177.74 1pdw h GLU 3170N 0.65 0.32 -0.88 1.57 4.81 -0.88 0.22 114.58 120.40 1pdw h GLU 3170Ca 0.29 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.53 1pdw h GLU 3170Cb 0.19 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 1pdw h GLU 3170CO -0.18 0.32 0.57 0.00 -0.73 0.00 0.00 179.01 178.98 1pdw h ALA 3171N 0.99 1.50 0.00 2.92 0.00 -0.79 0.19 119.26 124.07 1pdw h ALA 3171Ca 0.08 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1pdw h ALA 3171Cb 0.09 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1pdw h ALA 3171CO -0.01 0.39 -0.63 -0.07 0.00 0.00 0.00 179.25 178.92 1pdw h LEU 3172N 1.03 0.00 -2.09 0.00 4.07 -1.04 -3.42 115.31 113.87 1pdw h LEU 3172Ca 0.36 -0.74 0.00 0.00 0.08 0.00 0.00 57.88 57.59 1pdw h LEU 3172Cb 0.13 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.87 1pdw h LEU 3172CO -0.12 1.24 0.00 0.59 -1.08 0.00 0.00 178.44 179.07 1pdw n ASN 3173N -4.52 2.41 0.00 -0.43 3.02 0.76 -5.00 115.26 111.50 1pdw n ASN 3173Ca -0.21 -1.71 0.00 0.00 -0.03 0.00 0.00 54.58 52.63 1pdw n ASN 3173Cb 0.58 -0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1pdw n ASN 3173CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pdw n GLY 3174N 0.61 0.14 0.33 7.41 0.00 0.66 -4.37 105.19 109.97 1pdw n GLY 3174Ca 0.09 -1.78 -0.03 0.00 0.00 0.00 0.00 46.02 44.30 1pdw n GLY 3174CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pdw h LYS 3175N 0.00 1.02 0.15 1.61 1.57 -1.90 -2.51 116.57 116.50 1pdw h LYS 3175Ca 0.00 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1pdw h LYS 3175Cb 0.00 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.14 1pdw h LYS 3175CO 0.00 0.82 -0.07 0.93 -0.57 0.00 0.00 179.45 180.56 1pdw h GLU 3176N 1.00 -0.19 -0.99 3.15 5.08 -1.97 0.32 114.58 120.98 1pdw h GLU 3176Ca 0.24 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.68 1pdw h GLU 3176Cb 0.18 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 1pdw h GLU 3176CO -0.02 0.05 0.64 0.28 -1.00 0.00 0.00 179.01 178.96 1pdw h VAL 3177N -0.42 1.07 -0.55 3.13 2.07 -1.75 -0.87 116.25 118.93 1pdw h VAL 3177Ca -0.02 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 1pdw h VAL 3177Cb 0.33 -0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 1pdw h VAL 3177CO 0.03 0.21 0.20 0.00 0.02 0.00 0.00 177.57 178.03 1pdw h ALA 3178N 1.47 0.71 -0.55 1.67 0.00 -1.18 -2.05 119.26 119.34 1pdw h ALA 3178Ca 0.43 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1pdw h ALA 3178Cb 0.20 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1pdw h ALA 3178CO -0.18 0.35 0.20 0.00 0.00 0.00 0.00 179.25 179.62 1pdw h ALA 3179N 1.06 0.72 -0.51 0.00 0.00 -0.01 -1.07 119.26 119.45 1pdw h ALA 3179Ca 0.18 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1pdw h ALA 3179Cb 0.23 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1pdw h ALA 3179CO -0.01 0.35 0.05 1.96 0.00 0.00 0.00 179.25 181.60 1pdw h GLN 3180N 0.76 0.82 -0.12 0.00 7.50 -1.05 -2.74 115.11 120.28 1pdw h GLN 3180Ca 0.18 -0.20 -0.19 0.00 0.50 0.00 0.00 58.65 58.94 1pdw h GLN 3180Cb 0.23 -0.11 -0.00 0.00 0.05 0.00 0.00 27.48 27.65 1pdw h GLN 3180CO -0.01 0.79 -0.71 0.28 -1.50 0.00 0.00 178.83 177.68 1pdw h VAL 3181N 0.77 1.34 -0.49 -0.54 2.07 -1.17 -3.32 116.25 114.91 1pdw h VAL 3181Ca 0.16 -2.04 -0.05 0.00 0.82 0.00 0.00 66.70 65.59 1pdw h VAL 3181Cb 0.39 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 1pdw h VAL 3181CO 0.01 0.62 0.13 0.50 0.02 0.00 0.00 177.57 178.86 1pdw h LYS 3182N 0.37 0.78 -0.46 1.57 3.64 -0.98 -3.33 116.57 118.16 1pdw h LYS 3182Ca -0.03 -0.18 0.09 0.00 -1.27 0.00 0.00 60.65 59.26 1pdw h LYS 3182Cb 1.29 -0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.92 1pdw h LYS 3182CO 0.13 0.75 -0.13 0.00 -2.27 0.00 0.00 179.45 177.93 1pdw h ALA 3183N 1.00 0.28 0.00 5.00 0.00 -1.59 -2.03 119.26 121.92 1pdw h ALA 3183Ca 0.16 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1pdw h ALA 3183Cb 0.31 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1pdw h ALA 3183CO -0.00 -0.46 0.00 -1.35 0.00 0.00 0.00 179.25 177.44 1pdw h PRO 3184N -0.02 0.00 0.00 0.00 0.11 -1.75 -3.10 132.00 127.24 1pdw h PRO 3184Ca 0.22 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.28 1pdw h PRO 3184Cb 0.36 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 1pdw h PRO 3184CO -0.49 0.00 -0.26 -0.07 -0.21 0.00 0.00 178.00 176.98 1pdw h LEU 3185N 0.00 0.00 -1.04 2.35 3.38 -1.51 -3.47 115.31 115.02 1pdw h LEU 3185Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1pdw h LEU 3185Cb 0.27 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.08 1pdw h LEU 3185CO 0.00 0.26 -0.29 0.52 0.09 0.00 0.00 178.44 179.02 1pdw n VAL 3186N -3.76 -1.39 -1.66 1.22 0.31 -1.17 -5.04 118.33 106.85 1pdw n VAL 3186Ca -0.01 -0.02 -0.29 0.00 -0.01 0.00 0.00 64.34 64.00 1pdw n VAL 3186Cb 0.36 -2.65 0.15 0.00 -0.91 0.00 0.00 33.84 30.78 1pdw n VAL 3186CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1pdw s LEU 3187N -3.64 2.14 0.24 7.52 1.43 -1.26 -4.98 118.68 120.13 1pdw s LEU 3187Ca 0.22 0.74 0.13 0.00 -1.03 0.00 0.00 54.13 54.19 1pdw s LEU 3187Cb -0.10 -2.99 0.03 0.00 0.03 0.00 0.00 46.19 43.17 1pdw s LEU 3187CO 0.30 -2.60 1.42 0.50 0.23 0.00 0.00 176.35 176.20 1pdw h LYS 3188N -1.54 0.00 -6.51 1.70 3.64 -1.98 -3.46 116.57 108.41 1pdw h LYS 3188Ca -0.48 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.30 1pdw h LYS 3188Cb 1.31 0.00 0.10 0.00 -0.41 0.00 0.00 32.23 33.23 1pdw h LYS 3188CO 0.55 0.63 0.29 -0.25 -2.27 0.00 0.00 179.45 178.40 1pdw n ASP 3189N -3.28 1.78 -4.89 4.20 9.92 -1.26 -4.97 116.55 118.05 1pdw n ASP 3189Ca 0.01 1.17 -0.31 0.00 -0.53 0.00 0.00 54.79 55.14 1pdw n ASP 3189Cb 0.78 -1.33 -0.04 0.00 -0.64 0.00 0.00 41.12 39.88 1pdw n ASP 3189CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1pdw s LEU 3190N 0.18 4.09 -0.13 0.64 1.43 -1.26 -5.08 118.68 118.54 1pdw s LEU 3190Ca 0.62 0.87 -0.05 0.00 -1.03 0.00 0.00 54.13 54.53 1pdw s LEU 3190Cb -0.70 -3.66 -0.04 0.00 0.03 0.00 0.00 46.19 41.82 1pdw s LEU 3190CO 0.58 -0.15 0.06 -0.70 0.23 0.00 0.00 176.35 176.37 1pdw s GLU 3191N -3.19 3.50 0.00 1.70 2.12 -1.26 -5.20 118.70 116.37 1pdw s GLU 3191Ca 0.47 -0.30 0.00 0.00 0.36 0.00 0.00 54.97 55.49 1pdw s GLU 3191Cb -0.11 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.21 1pdw s GLU 3191CO 0.25 0.56 0.00 0.72 -0.54 0.00 0.00 175.26 176.25