#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hwc s ARG 3002N 0.00 3.39 0.30 0.03 3.52 -1.26 -5.02 118.95 119.91 3hwc s ARG 3002Ca 0.00 2.22 -0.01 0.00 -0.13 0.00 0.00 55.73 57.81 3hwc s ARG 3002Cb 0.00 -2.40 -0.04 0.00 -1.56 0.00 0.00 34.95 30.95 3hwc s ARG 3002CO 0.00 -0.98 0.51 0.95 -0.81 0.00 0.00 175.30 174.97 3hwc s THR 3003N -1.30 5.11 0.23 4.11 -4.23 -1.26 -4.59 115.64 113.70 3hwc s THR 3003Ca 0.67 -0.30 -0.06 0.00 -1.18 0.00 0.00 61.69 60.81 3hwc s THR 3003Cb -0.40 -3.80 0.19 0.00 1.34 0.00 0.00 72.50 69.84 3hwc s THR 3003CO 0.48 -0.40 1.83 1.23 -0.54 0.00 0.00 174.62 177.23 3hwc h GLY 3004N 1.30 1.20 0.91 3.99 0.00 -1.86 -0.53 103.07 108.09 3hwc h GLY 3004Ca -0.49 -0.34 0.03 0.00 0.00 0.00 0.00 47.33 46.53 3hwc h GLY 3004CO 0.64 0.22 0.52 1.70 0.00 0.00 0.00 176.54 179.62 3hwc h LYS 3005N 0.87 1.00 -0.67 4.80 3.64 -1.95 0.18 116.57 124.45 3hwc h LYS 3005Ca 0.36 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.65 3hwc h LYS 3005Cb 0.19 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 3hwc h LYS 3005CO -0.18 0.66 0.31 1.96 -2.27 0.00 0.00 179.45 179.93 3hwc h GLN 3006N 1.03 0.97 0.23 1.90 4.20 -1.73 -1.59 115.11 120.13 3hwc h GLN 3006Ca 0.32 -0.15 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 3hwc h GLN 3006Cb -0.02 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.59 3hwc h GLN 3006CO -0.10 0.78 -0.11 -0.92 -0.67 0.00 0.00 178.83 177.81 3hwc h TYR 3007N 0.93 -0.29 -0.75 2.96 3.20 -0.43 -2.23 116.97 120.37 3hwc h TYR 3007Ca 0.23 -0.01 0.15 0.00 3.14 0.00 0.00 58.73 62.24 3hwc h TYR 3007Cb 0.14 0.10 -0.10 0.00 1.54 0.00 0.00 36.73 38.41 3hwc h TYR 3007CO 0.01 -0.07 0.26 -0.07 -1.64 0.00 0.00 178.16 176.65 3hwc h LEU 3008N -0.46 0.20 -0.88 2.82 4.07 -0.56 -1.49 115.31 119.01 3hwc h LEU 3008Ca -0.03 0.12 -0.10 0.00 0.08 0.00 0.00 57.88 57.95 3hwc h LEU 3008Cb 0.35 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.19 3hwc h LEU 3008CO 0.05 0.06 -0.23 -0.33 -1.08 0.00 0.00 178.44 176.91 3hwc h GLU 3009N 0.38 0.57 0.00 1.13 5.08 -1.18 -2.65 114.58 117.92 3hwc h GLU 3009Ca 0.42 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 3hwc h GLU 3009Cb 0.66 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.88 3hwc h GLU 3009CO -0.44 0.76 0.00 0.66 -1.00 0.00 0.00 179.01 178.99 3hwc h SER 3010N 0.50 0.00 0.96 1.42 4.64 -0.64 -2.19 113.55 118.25 3hwc h SER 3010Ca 0.07 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.35 3hwc h SER 3010Cb 0.67 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.75 3hwc h SER 3010CO 0.05 0.00 -0.22 -0.07 -0.87 0.00 0.00 176.83 175.72 3hwc h LEU 3011N 0.00 0.00 -7.19 5.97 4.07 -1.27 -3.38 115.31 113.51 3hwc h LEU 3011Ca 0.00 0.00 -0.75 0.00 0.08 0.00 0.00 57.88 57.21 3hwc h LEU 3011Cb 0.26 0.00 -0.17 0.00 1.08 0.00 0.00 40.66 41.82 3hwc h LEU 3011CO 0.00 0.22 1.57 -3.20 -1.08 0.00 0.00 178.44 175.94 3hwc n ASN 3012N -3.37 5.22 -0.46 -0.43 5.15 -0.82 -4.53 115.26 116.03 3hwc n ASN 3012Ca 0.00 -3.05 0.03 0.00 -0.60 0.00 0.00 54.58 50.97 3hwc n ASN 3012Cb 0.43 -1.52 0.04 0.00 -0.53 0.00 0.00 39.78 38.21 3hwc n ASN 3012CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 3hwc n ASP 3013N 4.70 0.72 -0.29 1.20 3.85 -1.26 -4.99 116.55 120.48 3hwc n ASP 3013Ca 0.37 -2.33 -0.04 0.00 -0.71 0.00 0.00 54.79 52.08 3hwc n ASP 3013Cb 0.40 -0.28 -0.02 0.00 -1.35 0.00 0.00 41.12 39.88 3hwc n ASP 3013CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3hwc n GLY 3014N -0.37 0.66 3.71 6.12 0.00 -1.26 -4.90 105.19 109.15 3hwc n GLY 3014Ca 0.05 -0.45 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 3hwc n GLY 3014CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3hwc n ARG 3015N -2.39 1.40 -3.35 1.61 1.85 -1.26 -4.95 116.66 109.56 3hwc n ARG 3015Ca -0.04 0.52 -0.45 0.00 -1.00 0.00 0.00 57.85 56.89 3hwc n ARG 3015Cb 0.19 -2.46 -0.07 0.00 -1.05 0.00 0.00 32.46 29.07 3hwc n ARG 3015CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3hwc s VAL 3016N -1.35 5.20 -0.08 8.89 1.01 -1.26 -4.98 120.40 127.83 3hwc s VAL 3016Ca 0.74 -1.10 0.03 0.00 0.00 0.00 0.00 61.98 61.65 3hwc s VAL 3016Cb -0.42 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 31.79 3hwc s VAL 3016CO 0.47 -0.66 -0.17 -0.69 0.00 0.00 0.00 175.10 174.06 3hwc s VAL 3017N 1.72 1.51 -0.11 2.92 1.01 -1.26 -1.50 120.40 124.69 3hwc s VAL 3017Ca 0.05 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 3hwc s VAL 3017Cb -0.25 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 3hwc s VAL 3017CO 0.06 0.44 -0.02 0.26 0.00 0.00 0.00 175.10 175.84 3hwc s TRP 3018N 0.48 3.07 -0.33 5.22 0.52 0.04 -0.11 118.94 127.83 3hwc s TRP 3018Ca -0.15 -0.02 0.00 0.00 0.02 0.00 0.00 56.10 55.95 3hwc s TRP 3018Cb -0.16 -1.85 0.08 0.00 -1.15 0.00 0.00 33.47 30.38 3hwc s TRP 3018CO 0.06 0.24 0.05 0.08 0.02 0.00 0.00 176.95 177.39 3hwc s VAL 3019N -0.34 2.74 0.00 4.03 1.01 0.12 0.01 120.40 127.98 3hwc s VAL 3019Ca 0.06 -1.86 0.00 0.00 0.00 0.00 0.00 61.98 60.18 3hwc s VAL 3019Cb -0.12 -2.78 0.00 0.00 0.00 0.00 0.00 36.38 33.48 3hwc s VAL 3019CO 0.02 -0.38 0.00 0.61 0.00 0.00 0.00 175.10 175.36 3hwc n GLY 3020N 4.48 3.13 0.00 4.51 0.00 -0.81 -1.75 105.19 114.75 3hwc n GLY 3020Ca -0.06 -0.20 0.14 0.00 0.00 0.00 0.00 46.02 45.90 3hwc n GLY 3020CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hwc n ASN 3021N 5.05 0.00 -4.68 1.61 3.02 -1.26 -4.83 115.26 114.17 3hwc n ASN 3021Ca 0.00 0.37 -0.39 0.00 -0.03 0.00 0.00 54.58 54.53 3hwc n ASN 3021Cb 0.00 -0.46 -0.06 0.00 -0.61 0.00 0.00 39.78 38.65 3hwc n ASN 3021CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hwc s GLU 3022N -2.91 4.25 0.03 3.52 0.41 -0.72 -5.06 118.70 118.22 3hwc s GLU 3022Ca 0.17 0.45 -0.27 0.00 -0.41 0.00 0.00 54.97 54.91 3hwc s GLU 3022Cb 0.19 -3.52 -0.05 0.00 -1.78 0.00 0.00 34.13 28.97 3hwc s GLU 3022CO 0.51 -0.05 0.86 0.21 -0.49 0.00 0.00 175.26 176.29 3hwc s LYS 3023N 1.31 4.55 -0.29 1.61 2.47 -1.26 0.13 119.74 128.26 3hwc s LYS 3023Ca 0.25 1.22 -0.14 0.00 -1.56 0.00 0.00 55.97 55.74 3hwc s LYS 3023Cb -0.15 -3.40 -0.03 0.00 -1.46 0.00 0.00 37.83 32.78 3hwc s LYS 3023CO 0.10 0.15 0.31 0.42 0.16 0.00 0.00 175.35 176.49 3hwc s ILE 3024N 0.36 5.22 0.06 5.43 -1.09 0.85 -4.94 121.20 127.08 3hwc s ILE 3024Ca 0.44 0.29 -0.17 0.00 -2.23 0.00 0.00 60.65 58.99 3hwc s ILE 3024Cb -0.21 -3.68 -0.15 0.00 -1.58 0.00 0.00 42.46 36.84 3hwc s ILE 3024CO 0.25 0.12 1.29 -2.24 -1.23 0.00 0.00 174.94 173.13 3hwc h ASP 3025N 8.31 0.68 -2.59 3.58 2.03 -1.94 -3.40 116.42 123.10 3hwc h ASP 3025Ca -0.32 -0.59 -0.23 0.00 -0.73 0.00 0.00 57.03 55.16 3hwc h ASP 3025Cb 1.17 -0.20 -0.33 0.00 -0.83 0.00 0.00 39.33 39.14 3hwc h ASP 3025CO 0.63 1.15 -0.54 0.21 -1.03 0.00 0.00 179.24 179.66 3hwc s ASN 3026N -6.67 0.58 0.53 4.15 3.04 -1.26 -4.80 114.94 110.50 3hwc s ASN 3026Ca -0.12 0.34 0.20 0.00 0.04 0.00 0.00 52.86 53.31 3hwc s ASN 3026Cb 0.07 0.72 1.35 0.00 -1.54 0.00 0.00 41.25 41.85 3hwc s ASN 3026CO 0.83 -0.27 2.10 0.58 -3.04 0.00 0.00 177.10 177.31 3hwc h VAL 3027N 6.27 0.88 0.00 -5.21 2.07 -1.84 -1.45 116.25 116.97 3hwc h VAL 3027Ca -0.16 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.29 3hwc h VAL 3027Cb 1.13 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 3hwc h VAL 3027CO 0.20 0.00 -0.32 0.00 0.02 0.00 0.00 177.57 177.47 3hwc h ALA 3028N 1.91 1.06 0.00 1.67 0.00 -1.87 -3.20 119.26 118.83 3hwc h ALA 3028Ca 0.08 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3hwc h ALA 3028Cb 0.33 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hwc h ALA 3028CO -0.00 0.40 -0.22 0.25 0.00 0.00 0.00 179.25 179.68 3hwc n THR 3029N -3.56 0.00 -2.17 0.00 -2.24 -0.88 -4.44 114.28 101.00 3hwc n THR 3029Ca -0.00 -0.37 -0.41 0.00 -2.27 0.00 0.00 64.05 61.00 3hwc n THR 3029Cb 0.45 0.88 -0.03 0.00 -2.10 0.00 0.00 70.33 69.54 3hwc n THR 3029CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3hwc s HIS 3030N -1.17 3.19 0.43 4.78 2.46 -0.60 -4.72 115.29 119.66 3hwc s HIS 3030Ca 0.00 1.23 0.24 0.00 0.47 0.00 0.00 55.06 57.00 3hwc s HIS 3030Cb 0.00 -3.64 1.25 0.00 -0.13 0.00 0.00 32.58 30.05 3hwc s HIS 3030CO 0.00 -1.98 1.74 -1.35 -2.47 0.00 0.00 174.74 170.69 3hwc h PRO 3031N 4.93 0.26 0.00 2.88 0.11 -1.94 0.45 132.00 138.70 3hwc h PRO 3031Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3hwc h PRO 3031Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3hwc h PRO 3031CO 0.75 0.17 0.00 -0.07 -0.21 0.00 0.00 178.00 178.64 3hwc h LEU 3032N 0.26 0.00 0.00 2.35 4.07 -1.96 -3.40 115.31 116.64 3hwc h LEU 3032Ca 0.64 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.60 3hwc h LEU 3032Cb 1.87 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.61 3hwc h LEU 3032CO -0.28 0.00 -0.16 0.35 -1.08 0.00 0.00 178.44 177.28 3hwc n THR 3033N -2.73 0.00 0.06 0.22 -2.24 -0.00 -4.83 114.28 104.76 3hwc n THR 3033Ca 0.04 -0.05 0.07 0.00 -2.27 0.00 0.00 64.05 61.85 3hwc n THR 3033Cb 0.44 0.46 0.52 0.00 -2.10 0.00 0.00 70.33 69.64 3hwc n THR 3033CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 3hwc h ARG 3034N 0.00 0.32 -0.13 -0.78 0.11 -0.19 -2.29 114.38 111.42 3hwc h ARG 3034Ca 0.00 -0.02 -0.08 0.00 0.10 0.00 0.00 59.98 59.98 3hwc h ARG 3034Cb 0.00 -0.07 -0.00 0.00 1.11 0.00 0.00 29.97 31.01 3hwc h ARG 3034CO 0.00 0.21 -0.22 -0.44 0.10 0.00 0.00 179.97 179.62 3hwc h ASP 3035N 0.33 0.43 -0.54 0.08 3.45 -1.85 0.58 116.42 118.91 3hwc h ASP 3035Ca 0.13 -0.54 -0.08 0.00 0.43 0.00 0.00 57.03 56.98 3hwc h ASP 3035Cb 0.12 -0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 38.75 3hwc h ASP 3035CO -0.03 0.89 0.02 0.22 -1.57 0.00 0.00 179.24 178.77 3hwc h TYR 3036N -0.01 1.01 -0.93 4.55 5.03 -1.62 -2.08 116.97 122.92 3hwc h TYR 3036Ca 0.01 -0.17 0.15 0.00 2.58 0.00 0.00 58.73 61.30 3hwc h TYR 3036Cb 0.80 -0.27 -0.09 0.00 1.55 0.00 0.00 36.73 38.72 3hwc h TYR 3036CO 0.10 0.92 0.53 0.00 -1.32 0.00 0.00 178.16 178.39 3hwc h ALA 3037N 0.96 1.43 0.00 1.82 0.00 -1.23 0.11 119.26 122.35 3hwc h ALA 3037Ca 0.15 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3hwc h ALA 3037Cb 0.50 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3hwc h ALA 3037CO 0.02 0.01 -0.00 0.93 0.00 0.00 0.00 179.25 180.21 3hwc h GLU 3038N 0.76 0.00 -0.20 0.00 5.08 -0.51 -1.95 114.58 117.76 3hwc h GLU 3038Ca 0.50 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.66 3hwc h GLU 3038Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3hwc h GLU 3038CO -0.34 0.00 -0.66 0.00 -1.00 0.00 0.00 179.01 177.02 3hwc h ARG 3039N 0.00 0.75 -0.18 2.33 2.47 -0.13 0.70 114.38 120.33 3hwc h ARG 3039Ca -0.00 -0.54 -0.10 0.00 -1.26 0.00 0.00 59.98 58.08 3hwc h ARG 3039Cb 0.73 0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 29.12 3hwc h ARG 3039CO 0.00 1.16 -0.33 0.28 0.56 0.00 0.00 179.97 181.64 3hwc h VAL 3040N 0.54 1.28 -0.39 2.04 2.07 -1.14 -0.47 116.25 120.18 3hwc h VAL 3040Ca -0.02 -1.36 -0.04 0.00 0.82 0.00 0.00 66.70 66.10 3hwc h VAL 3040Cb 1.26 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 32.52 3hwc h VAL 3040CO 0.13 0.42 0.09 0.00 0.02 0.00 0.00 177.57 178.24 3hwc h ALA 3041N 1.35 0.52 -0.55 1.67 0.00 -1.23 -2.61 119.26 118.40 3hwc h ALA 3041Ca 0.04 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.80 3hwc h ALA 3041Cb 0.73 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 3hwc h ALA 3041CO 0.06 0.20 0.29 0.37 0.00 0.00 0.00 179.25 180.16 3hwc h GLN 3042N 0.49 0.55 -0.70 0.00 4.15 -0.56 -0.35 115.11 118.70 3hwc h GLN 3042Ca 0.12 -0.03 0.15 0.00 0.77 0.00 0.00 58.65 59.66 3hwc h GLN 3042Cb 0.31 -0.12 -0.11 0.00 0.21 0.00 0.00 27.48 27.77 3hwc h GLN 3042CO 0.00 0.36 0.10 0.35 -1.93 0.00 0.00 178.83 177.71 3hwc h PHE 3043N 0.56 0.13 -0.10 3.99 3.57 -0.90 0.43 116.94 124.62 3hwc h PHE 3043Ca 0.24 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.73 3hwc h PHE 3043Cb 0.13 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 38.92 3hwc h PHE 3043CO -0.09 -0.13 -0.17 1.88 -2.23 0.00 0.00 178.31 177.57 3hwc h TYR 3044N 0.20 0.37 -0.10 0.41 -1.99 -0.96 -3.21 116.97 111.68 3hwc h TYR 3044Ca 0.38 -0.13 -0.01 0.00 2.00 0.00 0.00 58.73 60.97 3hwc h TYR 3044Cb 0.65 -0.07 -0.01 0.00 2.00 0.00 0.00 36.73 39.30 3hwc h TYR 3044CO -0.32 0.76 0.01 -0.44 -0.00 0.00 0.00 178.16 178.18 3hwc h ASP 3045N -0.13 0.13 -1.00 3.88 3.45 -0.69 -1.97 116.42 120.09 3hwc h ASP 3045Ca 0.01 -0.01 0.14 0.00 0.43 0.00 0.00 57.03 57.60 3hwc h ASP 3045Cb 0.73 -0.03 -0.09 0.00 -0.56 0.00 0.00 39.33 39.38 3hwc h ASP 3045CO 0.04 0.15 0.63 0.25 -1.57 0.00 0.00 179.24 178.73 3hwc h LEU 3046N 0.14 0.88 -0.66 1.55 5.85 -0.92 -0.70 115.31 121.45 3hwc h LEU 3046Ca 0.04 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.81 3hwc h LEU 3046Cb 0.09 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.01 3hwc h LEU 3046CO 0.00 0.43 0.00 1.41 -0.34 0.00 0.00 178.44 179.94 3hwc n HIS 3047N -4.65 0.72 1.07 1.25 8.25 -0.74 -1.97 115.22 119.15 3hwc n HIS 3047Ca 0.20 0.29 0.12 0.00 -0.26 0.00 0.00 57.72 58.06 3hwc n HIS 3047Cb 0.41 -0.96 0.13 0.00 1.12 0.00 0.00 29.99 30.70 3hwc n HIS 3047CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3hwc n HIS 3048N -2.16 0.00 -1.87 4.41 8.25 -0.28 -4.82 115.22 118.76 3hwc n HIS 3048Ca 0.02 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.05 3hwc n HIS 3048Cb 0.21 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.21 3hwc n HIS 3048CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3hwc s ARG 3049N -2.70 3.76 0.21 -0.41 1.81 -0.83 -4.89 118.95 115.90 3hwc s ARG 3049Ca 0.17 2.04 -0.11 0.00 -1.72 0.00 0.00 55.73 56.11 3hwc s ARG 3049Cb 0.18 -4.14 0.28 0.00 -0.45 0.00 0.00 34.95 30.82 3hwc s ARG 3049CO 0.64 -1.36 1.65 -1.35 -0.68 0.00 0.00 175.30 174.21 3hwc h PRO 3050N 11.62 0.08 0.00 3.54 0.11 -1.90 0.23 132.00 145.68 3hwc h PRO 3050Ca -0.40 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3hwc h PRO 3050Cb 1.20 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3hwc h PRO 3050CO 0.97 0.05 0.00 0.38 -0.21 0.00 0.00 178.00 179.19 3hwc h ASP 3051N 0.08 0.00 -0.46 -2.05 -0.00 -1.96 -2.21 116.42 109.81 3hwc h ASP 3051Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.35 3hwc h ASP 3051Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.84 3hwc h ASP 3051CO -0.57 0.00 0.00 0.18 -0.00 0.00 0.00 179.24 178.85 3hwc n LEU 3052N -2.62 3.33 -0.29 0.15 4.32 0.05 -4.67 117.00 117.28 3hwc n LEU 3052Ca -0.00 -1.81 -0.03 0.00 -0.02 0.00 0.00 56.01 54.15 3hwc n LEU 3052Cb 0.16 -0.31 0.09 0.00 -1.62 0.00 0.00 43.42 41.74 3hwc n LEU 3052CO 0.19 0.80 1.19 -0.61 -1.22 0.00 0.00 177.39 177.73 3hwc h GLN 3053N 3.38 0.97 0.01 3.23 4.15 -1.12 -2.07 115.11 123.65 3hwc h GLN 3053Ca 0.00 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 3hwc h GLN 3053Cb 0.86 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.33 3hwc h GLN 3053CO 0.00 0.64 -0.00 -0.44 -1.93 0.00 0.00 178.83 177.10 3hwc h ASP 3054N 1.00 -0.01 1.70 -0.69 3.32 -1.82 -1.29 116.42 118.63 3hwc h ASP 3054Ca 0.31 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 3hwc h ASP 3054Cb -0.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 3hwc h ASP 3054CO -0.10 0.17 -0.13 -0.37 -1.72 0.00 0.00 179.24 177.08 3hwc h VAL 3055N -0.18 0.24 0.00 -1.35 -1.51 -1.88 -3.36 116.25 108.22 3hwc h VAL 3055Ca -0.00 -1.24 -0.07 0.00 -1.23 0.00 0.00 66.70 64.15 3hwc h VAL 3055Cb 0.18 2.03 -0.01 0.00 -2.13 0.00 0.00 31.29 31.36 3hwc h VAL 3055CO 0.00 0.13 -1.82 0.18 -1.23 0.00 0.00 177.57 174.83 3hwc n LEU 3056N -3.15 0.00 -4.28 4.19 4.32 -0.79 -4.39 117.00 112.91 3hwc n LEU 3056Ca 0.03 0.00 -0.17 0.00 -0.02 0.00 0.00 56.01 55.85 3hwc n LEU 3056Cb 0.55 0.10 -0.11 0.00 -1.62 0.00 0.00 43.42 42.34 3hwc n LEU 3056CO 0.35 0.10 -0.44 0.42 -1.22 0.00 0.00 177.39 176.59 3hwc s THR 3057N -2.94 1.44 0.10 -5.08 -4.23 -0.49 -0.21 115.64 104.24 3hwc s THR 3057Ca -0.06 -1.96 -0.08 0.00 -1.18 0.00 0.00 61.69 58.41 3hwc s THR 3057Cb 0.09 -1.78 -0.01 0.00 1.34 0.00 0.00 72.50 72.15 3hwc s THR 3057CO 0.66 -0.54 0.18 0.72 -0.54 0.00 0.00 174.62 175.10 3hwc s PHE 3058N -2.67 0.27 -0.30 3.99 -0.12 0.44 -4.66 117.98 114.94 3hwc s PHE 3058Ca 0.15 -0.70 -0.24 0.00 -0.05 0.00 0.00 56.93 56.10 3hwc s PHE 3058Cb -0.02 -0.11 -0.00 0.00 -0.63 0.00 0.00 43.02 42.26 3hwc s PHE 3058CO 0.04 -0.56 0.80 0.08 -0.05 0.00 0.00 175.22 175.53 3hwc s VAL 3059N -3.90 4.79 1.07 -2.49 1.01 -1.26 -0.83 120.40 118.80 3hwc s VAL 3059Ca 0.08 1.27 -0.17 0.00 0.00 0.00 0.00 61.98 63.16 3hwc s VAL 3059Cb 0.05 -4.15 0.23 0.00 0.00 0.00 0.00 36.38 32.51 3hwc s VAL 3059CO -0.08 -0.23 1.17 -0.62 0.00 0.00 0.00 175.10 175.35 3hwc s ASP 3060N 1.57 2.07 0.00 3.32 3.68 0.98 -4.86 116.67 123.43 3hwc s ASP 3060Ca 0.33 0.61 0.16 0.00 2.13 0.00 0.00 52.55 55.78 3hwc s ASP 3060Cb -0.14 -0.88 0.70 0.00 -1.45 0.00 0.00 42.92 41.15 3hwc s ASP 3060CO 0.12 -3.41 1.51 0.00 0.13 0.00 0.00 175.17 173.52 3hwc n ALA 3061N -4.28 1.75 0.06 3.66 0.00 -1.26 -1.29 120.51 119.15 3hwc n ALA 3061Ca 0.12 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.62 3hwc n ALA 3061Cb 0.59 -1.26 0.25 0.00 0.00 0.00 0.00 19.45 19.03 3hwc n ALA 3061CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3hwc n ASP 3062N -1.49 3.62 0.00 0.00 3.85 -1.26 -4.95 116.55 116.33 3hwc n ASP 3062Ca 0.04 -1.99 0.00 0.00 -0.71 0.00 0.00 54.79 52.13 3hwc n ASP 3062Cb 0.18 -0.33 0.00 0.00 -1.35 0.00 0.00 41.12 39.62 3hwc n ASP 3062CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3hwc n GLY 3063N 1.52 1.20 3.80 6.12 0.00 -0.41 -5.03 105.19 112.39 3hwc n GLY 3063Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 3hwc n GLY 3063CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hwc s VAL 3064N -2.99 4.92 -0.11 1.61 1.01 -1.26 -4.74 120.40 118.84 3hwc s VAL 3064Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.73 3hwc s VAL 3064Cb 0.00 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 3hwc s VAL 3064CO 0.00 0.52 1.03 -0.60 0.00 0.00 0.00 175.10 176.05 3hwc s ARG 3065N -0.79 4.40 0.27 2.72 3.52 -1.26 -0.01 118.95 127.79 3hwc s ARG 3065Ca 0.27 1.42 0.02 0.00 -0.13 0.00 0.00 55.73 57.31 3hwc s ARG 3065Cb -0.18 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.62 3hwc s ARG 3065CO 0.16 -0.36 0.13 1.03 -0.81 0.00 0.00 175.30 175.45 3hwc s ARG 3066N 2.16 1.45 0.43 5.12 0.52 -0.01 -4.50 118.95 124.11 3hwc s ARG 3066Ca 0.49 -1.80 -0.25 0.00 -0.52 0.00 0.00 55.73 53.65 3hwc s ARG 3066Cb -0.19 -0.06 -0.08 0.00 0.52 0.00 0.00 34.95 35.15 3hwc s ARG 3066CO 0.17 -0.39 1.27 0.45 0.02 0.00 0.00 175.30 176.82 3hwc s SER 3067N -3.30 6.21 0.00 0.23 0.15 -1.26 -0.42 113.70 115.31 3hwc s SER 3067Ca 0.37 2.57 0.12 0.00 0.70 0.00 0.00 55.95 59.71 3hwc s SER 3067Cb 0.06 -2.63 0.63 0.00 -1.71 0.00 0.00 66.02 62.37 3hwc s SER 3067CO 0.15 -0.91 1.28 0.54 1.20 0.00 0.00 173.24 175.50 3hwc n ARG 3068N -0.09 0.20 0.33 5.44 1.74 0.71 -2.01 116.66 122.99 3hwc n ARG 3068Ca 0.05 0.15 0.21 0.00 -0.77 0.00 0.00 57.85 57.49 3hwc n ARG 3068Cb 0.45 -1.50 1.14 0.00 -1.02 0.00 0.00 32.46 31.53 3hwc n ARG 3068CO 0.00 0.00 0.00 -0.56 -1.52 0.00 0.00 177.63 175.55 3hwc h GLN 3069N 0.00 0.00 -0.01 5.56 3.07 -1.91 -1.57 115.11 120.25 3hwc h GLN 3069Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3hwc h GLN 3069Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.66 3hwc h GLN 3069CO 0.00 0.00 -0.60 0.91 0.09 0.00 0.00 178.83 179.24 3hwc n TRP 3070N -3.20 0.00 -2.67 0.06 7.02 -0.85 -4.74 117.44 113.07 3hwc n TRP 3070Ca -0.03 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.06 3hwc n TRP 3070Cb 0.09 -0.05 -0.05 0.00 -2.42 0.00 0.00 31.31 28.88 3hwc n TRP 3070CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 3hwc s GLN 3071N -2.69 4.73 -0.16 -0.99 0.74 -0.59 -5.05 119.66 115.65 3hwc s GLN 3071Ca 0.16 1.56 -0.08 0.00 0.05 0.00 0.00 55.36 57.05 3hwc s GLN 3071Cb 0.18 -3.15 -0.04 0.00 1.10 0.00 0.00 33.01 31.09 3hwc s GLN 3071CO 0.66 0.37 0.11 -0.51 -0.55 0.00 0.00 175.29 175.37 3hwc s ASP 3072N -1.17 6.05 0.10 6.67 -0.00 -1.26 -5.06 116.67 122.00 3hwc s ASP 3072Ca 0.44 0.27 -0.24 0.00 -0.00 0.00 0.00 52.55 53.03 3hwc s ASP 3072Cb -0.27 -1.99 -0.07 0.00 -0.00 0.00 0.00 42.92 40.59 3hwc s ASP 3072CO 0.33 0.28 0.72 -2.16 -0.00 0.00 0.00 175.17 174.34 3hwc s PRO 3073N -0.25 4.46 0.00 8.23 0.05 -1.26 -4.96 135.00 141.26 3hwc s PRO 3073Ca 0.10 1.02 0.01 0.00 0.05 0.00 0.00 61.00 62.17 3hwc s PRO 3073Cb -0.12 -3.29 0.00 0.00 0.05 0.00 0.00 34.50 31.15 3hwc s PRO 3073CO 0.01 0.50 0.47 1.63 0.05 0.00 0.00 177.00 179.66 3hwc n LYS 3074N 2.01 -0.19 -3.89 4.56 5.02 -1.26 -0.93 118.16 123.48 3hwc n LYS 3074Ca -0.06 -0.49 -0.03 0.00 -2.02 0.00 0.00 58.31 55.71 3hwc n LYS 3074Cb 0.50 -0.97 0.02 0.00 -0.02 0.00 0.00 35.03 34.56 3hwc n LYS 3074CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 3hwc s ASP 3075N -0.15 0.00 0.24 4.39 3.84 -1.26 -4.60 116.67 119.14 3hwc s ASP 3075Ca 0.01 -0.64 -0.05 0.00 -0.00 0.00 0.00 52.55 51.87 3hwc s ASP 3075Cb 0.01 0.47 0.37 0.00 -1.38 0.00 0.00 42.92 42.39 3hwc s ASP 3075CO 0.01 -0.94 1.82 0.00 -0.00 0.00 0.00 175.17 176.06 3hwc h ALA 3076N 2.00 1.16 -0.91 2.11 0.00 -1.96 0.64 119.26 122.30 3hwc h ALA 3076Ca -0.27 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3hwc h ALA 3076Cb 1.22 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 3hwc h ALA 3076CO 0.35 0.14 0.53 0.00 0.00 0.00 0.00 179.25 180.28 3hwc h ALA 3077N 1.44 1.21 -0.26 0.00 0.00 -1.96 -2.12 119.26 117.56 3hwc h ALA 3077Ca 0.39 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 3hwc h ALA 3077Cb 0.30 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3hwc h ALA 3077CO -0.22 0.66 -0.21 0.78 0.00 0.00 0.00 179.25 180.26 3hwc h GLY 3078N 1.27 0.52 1.26 0.00 0.00 -1.34 -2.36 103.07 102.42 3hwc h GLY 3078Ca 0.32 -0.40 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 3hwc h GLY 3078CO -0.06 0.37 -0.02 -2.00 0.00 0.00 0.00 176.54 174.83 3hwc h LEU 3079N 0.43 0.87 -0.59 3.11 6.46 -0.56 -2.20 115.31 122.83 3hwc h LEU 3079Ca 0.07 -0.23 -0.03 0.00 -0.12 0.00 0.00 57.88 57.57 3hwc h LEU 3079Cb 0.60 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 40.28 3hwc h LEU 3079CO 0.04 0.94 0.25 0.03 -0.62 0.00 0.00 178.44 179.08 3hwc h ARG 3080N 0.82 0.87 -0.88 1.25 3.08 -0.93 0.42 114.38 119.01 3hwc h ARG 3080Ca 0.15 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3hwc h ARG 3080Cb 0.52 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.38 3hwc h ARG 3080CO 0.03 0.73 0.51 0.28 -1.07 0.00 0.00 179.97 180.45 3hwc h VAL 3081N 0.81 1.25 0.05 2.04 2.07 -1.29 0.20 116.25 121.38 3hwc h VAL 3081Ca 0.20 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 3hwc h VAL 3081Cb 0.18 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.98 3hwc h VAL 3081CO -0.02 0.27 -0.03 0.50 0.02 0.00 0.00 177.57 178.32 3hwc h LYS 3082N 1.22 -0.07 -0.86 1.57 3.64 -0.92 -2.10 116.57 119.06 3hwc h LYS 3082Ca 0.31 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.69 3hwc h LYS 3082Cb -0.01 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 3hwc h LYS 3082CO -0.05 0.10 0.52 -0.09 -2.27 0.00 0.00 179.45 177.66 3hwc h ARG 3083N -0.22 1.16 -0.09 1.90 2.43 -0.68 -0.90 114.38 117.98 3hwc h ARG 3083Ca -0.01 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3hwc h ARG 3083Cb 0.20 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.50 3hwc h ARG 3083CO 0.01 0.81 0.05 -0.22 -1.51 0.00 0.00 179.97 179.11 3hwc h LYS 3084N 1.18 0.12 0.02 0.20 3.64 -0.88 0.26 116.57 121.11 3hwc h LYS 3084Ca 0.31 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.68 3hwc h LYS 3084Cb -0.06 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 3hwc h LYS 3084CO -0.06 0.09 -0.01 -0.92 -2.27 0.00 0.00 179.45 176.28 3hwc h TYR 3085N 0.12 -0.02 -0.20 1.91 3.20 -0.49 -2.63 116.97 118.85 3hwc h TYR 3085Ca 0.03 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 3hwc h TYR 3085Cb 0.01 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 3hwc h TYR 3085CO 0.00 0.37 0.12 0.45 -1.64 0.00 0.00 178.16 177.46 3hwc h HIS 3086N -0.42 0.27 -0.74 -3.82 3.86 -0.31 -2.67 115.15 111.32 3hwc h HIS 3086Ca -0.00 -0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.22 3hwc h HIS 3086Cb 0.40 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.75 3hwc h HIS 3086CO 0.06 0.23 0.49 0.93 0.86 0.00 0.00 177.93 180.49 3hwc h GLU 3087N 0.24 0.96 -0.35 2.45 5.08 -0.60 -0.80 114.58 121.56 3hwc h GLU 3087Ca 0.07 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 3hwc h GLU 3087Cb 0.04 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 3hwc h GLU 3087CO -0.01 0.63 -0.12 1.15 -1.00 0.00 0.00 179.01 179.66 3hwc h THR 3088N 0.99 1.24 0.27 1.13 2.02 -1.25 0.20 112.91 117.52 3hwc h THR 3088Ca 0.27 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 3hwc h THR 3088Cb -0.10 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 3hwc h THR 3088CO -0.06 0.36 -0.13 0.40 0.37 0.00 0.00 175.52 176.46 3hwc h ILE 3089N 0.56 0.74 -0.58 3.11 1.08 -1.02 -2.79 117.51 118.61 3hwc h ILE 3089Ca 0.10 -0.68 0.10 0.00 -0.39 0.00 0.00 64.86 64.00 3hwc h ILE 3089Cb 0.53 1.09 -0.08 0.00 -3.07 0.00 0.00 36.82 35.29 3hwc h ILE 3089CO 0.03 0.13 0.15 -0.07 -0.69 0.00 0.00 178.15 177.70 3hwc h LEU 3090N -0.75 0.05 -1.42 1.44 4.07 -0.97 -1.49 115.31 116.25 3hwc h LEU 3090Ca -0.04 0.10 -0.06 0.00 0.08 0.00 0.00 57.88 57.96 3hwc h LEU 3090Cb 0.50 0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.36 3hwc h LEU 3090CO 0.06 0.04 -0.29 0.03 -1.08 0.00 0.00 178.44 177.20 3hwc h ARG 3091N 0.29 0.00 0.11 1.13 3.08 -0.65 -0.79 114.38 117.54 3hwc h ARG 3091Ca 0.30 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 60.09 3hwc h ARG 3091Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 3hwc h ARG 3091CO -0.37 0.29 -1.22 0.93 -1.07 0.00 0.00 179.97 178.53 3hwc h GLU 3092N 0.00 0.23 -4.38 0.04 4.39 -1.02 -3.41 114.58 110.42 3hwc h GLU 3092Ca -0.00 -0.39 -0.72 0.00 0.34 0.00 0.00 59.36 58.59 3hwc h GLU 3092Cb 0.52 0.15 -0.28 0.00 -0.10 0.00 0.00 28.75 29.04 3hwc h GLU 3092CO 0.04 1.18 -0.43 0.42 -1.16 0.00 0.00 179.01 179.06 3hwc s ILE 3093N -2.66 4.34 -1.19 3.13 1.01 -0.66 -4.77 121.20 120.40 3hwc s ILE 3093Ca -0.03 -1.48 -0.17 0.00 0.00 0.00 0.00 60.65 58.96 3hwc s ILE 3093Cb 0.07 -3.71 -0.01 0.00 0.01 0.00 0.00 42.46 38.83 3hwc s ILE 3093CO 0.87 -0.60 0.73 0.00 0.00 0.00 0.00 174.94 175.94 3hwc n ALA 3094N 4.95 -2.44 -2.79 9.38 0.00 -1.26 -2.31 120.51 126.04 3hwc n ALA 3094Ca -0.10 -0.25 -0.16 0.00 0.00 0.00 0.00 53.44 52.93 3hwc n ALA 3094Cb 0.42 -3.57 -0.00 0.00 0.00 0.00 0.00 19.45 16.30 3hwc n ALA 3094CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hwc n ALA 3095N -4.25 -0.90 -2.22 0.00 0.00 -1.26 -0.73 120.51 111.15 3hwc n ALA 3095Ca -0.14 0.10 -0.17 0.00 0.00 0.00 0.00 53.44 53.23 3hwc n ALA 3095Cb 0.61 -2.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.02 3hwc n ALA 3095CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hwc n GLY 3096N -0.95 -0.08 0.21 0.00 0.00 -0.31 -4.90 105.19 99.15 3hwc n GLY 3096Ca -0.09 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 45.90 3hwc n GLY 3096CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3hwc h SER 3097N 0.00 0.00 -3.50 1.61 0.02 -1.05 -3.45 113.55 107.18 3hwc h SER 3097Ca -0.41 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 59.93 3hwc h SER 3097Cb 1.28 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.70 3hwc h SER 3097CO 0.49 0.00 -0.36 -0.31 -1.14 0.00 0.00 176.83 175.51 3hwc s TYR 3098N -3.24 3.36 -1.86 3.45 2.02 -1.26 -4.97 117.35 114.84 3hwc s TYR 3098Ca 0.07 0.43 0.15 0.00 -0.37 0.00 0.00 57.07 57.35 3hwc s TYR 3098Cb 0.06 -2.38 0.13 0.00 -0.40 0.00 0.00 41.96 39.38 3hwc s TYR 3098CO 0.64 0.06 0.99 0.41 -1.57 0.00 0.00 175.55 176.09 3hwc n GLY 3099N 4.01 0.19 2.14 0.71 0.00 -1.26 -4.54 105.19 106.44 3hwc n GLY 3099Ca -0.12 -0.44 -0.03 0.00 0.00 0.00 0.00 46.02 45.43 3hwc n GLY 3099CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hwc n ARG 3100N 0.85 1.69 -0.88 1.61 5.12 -1.26 -4.87 116.66 118.92 3hwc n ARG 3100Ca 0.09 -3.27 -0.30 0.00 -1.93 0.00 0.00 57.85 52.44 3hwc n ARG 3100Cb 0.38 -1.37 0.17 0.00 -1.16 0.00 0.00 32.46 30.48 3hwc n ARG 3100CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3hwc s LEU 3101N -2.82 2.15 0.33 0.55 1.43 -1.26 -4.82 118.68 114.23 3hwc s LEU 3101Ca 0.35 1.75 0.05 0.00 -1.03 0.00 0.00 54.13 55.25 3hwc s LEU 3101Cb 0.36 -4.05 0.70 0.00 0.03 0.00 0.00 46.19 43.22 3hwc s LEU 3101CO -0.06 -3.14 1.90 -0.65 0.23 0.00 0.00 176.35 174.63 3hwc h PRO 3102N -1.89 0.80 0.00 1.29 0.11 -1.97 -0.72 132.00 129.63 3hwc h PRO 3102Ca -0.50 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.52 3hwc h PRO 3102Cb 1.29 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3hwc h PRO 3102CO 0.49 0.53 -0.18 0.38 -0.21 0.00 0.00 178.00 179.01 3hwc h ASP 3103N 0.83 0.00 -0.05 -2.05 -0.00 -1.97 -0.94 116.42 112.23 3hwc h ASP 3103Ca 0.41 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.43 3hwc h ASP 3103Cb 0.45 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.78 3hwc h ASP 3103CO -0.17 0.18 -0.01 0.00 -0.00 0.00 0.00 179.24 179.24 3hwc h ALA 3104N 1.82 0.07 0.00 4.15 0.00 -1.46 -3.36 119.26 120.48 3hwc h ALA 3104Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3hwc h ALA 3104Cb 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3hwc h ALA 3104CO 0.02 -0.23 -1.35 -2.39 0.00 0.00 0.00 179.25 175.30 3hwc n HIS 3105N -4.85 0.00 -0.19 0.00 1.44 -1.17 -4.43 115.22 106.01 3hwc n HIS 3105Ca -0.07 0.00 -0.06 0.00 -2.01 0.00 0.00 57.72 55.58 3hwc n HIS 3105Cb 0.20 -0.22 0.09 0.00 0.12 0.00 0.00 29.99 30.19 3hwc n HIS 3105CO 0.00 0.00 0.00 -0.91 -2.81 0.00 0.00 176.34 172.62 3hwc h ASN 3106N 0.00 0.95 0.65 4.39 2.35 -1.33 -3.08 115.58 119.51 3hwc h ASN 3106Ca 0.00 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.53 3hwc h ASN 3106Cb 0.63 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.74 3hwc h ASN 3106CO 0.00 0.96 0.00 0.22 -1.65 0.00 0.00 177.43 176.96 3hwc h TYR 3107N 0.93 0.00 0.00 1.19 5.03 -1.78 -2.28 116.97 120.07 3hwc h TYR 3107Ca 0.19 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.50 3hwc h TYR 3107Cb 0.42 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.70 3hwc h TYR 3107CO 0.03 0.00 0.00 1.79 -1.32 0.00 0.00 178.16 178.66 3hwc h THR 3108N 0.00 0.00 0.00 1.81 1.35 -1.80 -1.85 112.91 112.42 3hwc h THR 3108Ca 0.00 -0.13 -0.03 0.00 -0.55 0.00 0.00 66.41 65.69 3hwc h THR 3108Cb 0.32 0.98 -0.00 0.00 -1.73 0.00 0.00 68.15 67.72 3hwc h THR 3108CO 0.00 0.00 -0.16 -0.26 -0.25 0.00 0.00 175.52 174.85 3hwc h PHE 3109N 0.00 0.00 0.00 4.73 0.04 -1.62 -2.13 116.94 117.96 3hwc h PHE 3109Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3hwc h PHE 3109Cb 0.15 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.30 3hwc h PHE 3109CO 0.00 0.16 0.00 1.79 -0.60 0.00 0.00 178.31 179.66 3hwc h THR 3110N 0.00 0.00 -0.78 -1.55 1.35 -1.56 0.69 112.91 111.06 3hwc h THR 3110Ca -0.00 -0.02 0.04 0.00 -0.55 0.00 0.00 66.41 65.88 3hwc h THR 3110Cb 0.54 0.56 -0.05 0.00 -1.73 0.00 0.00 68.15 67.47 3hwc h THR 3110CO 0.02 0.00 0.49 0.74 -0.25 0.00 0.00 175.52 176.52 3hwc h THR 3111N 0.00 1.08 -0.53 6.82 2.02 -1.58 -1.75 112.91 118.97 3hwc h THR 3111Ca 0.00 -0.32 -0.10 0.00 0.77 0.00 0.00 66.41 66.76 3hwc h THR 3111Cb 0.02 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.49 3hwc h THR 3111CO 0.00 0.17 -0.06 1.88 0.37 0.00 0.00 175.52 177.88 3hwc h TYR 3112N 0.93 1.05 -0.15 3.16 -1.99 -1.06 -3.12 116.97 115.79 3hwc h TYR 3112Ca 0.32 -0.19 -0.06 0.00 2.00 0.00 0.00 58.73 60.80 3hwc h TYR 3112Cb 0.06 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 38.51 3hwc h TYR 3112CO -0.04 0.96 -0.18 0.00 -0.00 0.00 0.00 178.16 178.91 3hwc h ALA 3113N 1.06 1.42 -0.05 3.88 0.00 -1.35 -1.02 119.26 123.20 3hwc h ALA 3113Ca 0.15 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3hwc h ALA 3113Cb 0.59 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3hwc h ALA 3113CO 0.04 0.41 0.07 -0.44 0.00 0.00 0.00 179.25 179.32 3hwc h ASP 3114N 0.24 0.00 -0.08 0.00 3.32 -1.27 -3.39 116.42 115.24 3hwc h ASP 3114Ca 0.04 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.18 3hwc h ASP 3114Cb 0.46 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.85 3hwc h ASP 3114CO 0.03 0.00 -0.07 -0.62 -1.72 0.00 0.00 179.24 176.86 3hwc s ASP 3115N -5.75 -0.12 0.17 6.45 3.68 -0.91 -3.83 116.67 116.35 3hwc s ASP 3115Ca -0.05 -0.11 -0.00 0.00 2.13 0.00 0.00 52.55 54.52 3hwc s ASP 3115Cb 0.14 0.15 0.03 0.00 -1.45 0.00 0.00 42.92 41.80 3hwc s ASP 3115CO 0.50 -0.01 1.41 -0.65 0.13 0.00 0.00 175.17 176.55 3hwc h PRO 3116N 4.48 0.33 -0.61 4.34 0.11 -1.40 -3.33 132.00 135.93 3hwc h PRO 3116Ca -0.03 -0.30 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 3hwc h PRO 3116Cb 1.20 0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.36 3hwc h PRO 3116CO -0.12 0.97 0.18 0.93 -0.21 0.00 0.00 178.00 179.75 3hwc h GLU 3117N 0.21 0.93 -0.90 1.05 3.07 -1.94 -2.93 114.58 114.07 3hwc h GLU 3117Ca -0.04 -0.19 0.11 0.00 -0.50 0.00 0.00 59.36 58.74 3hwc h GLU 3117Cb 1.39 -0.14 -0.07 0.00 -0.84 0.00 0.00 28.75 29.09 3hwc h GLU 3117CO 0.13 0.81 0.58 -0.24 -1.40 0.00 0.00 179.01 178.90 3hwc h VAL 3118N 0.90 0.93 -0.56 3.13 3.04 -1.97 0.19 116.25 121.92 3hwc h VAL 3118Ca 0.20 -0.29 -0.05 0.00 -1.01 0.00 0.00 66.70 65.55 3hwc h VAL 3118Cb 0.28 0.00 -0.03 0.00 -2.01 0.00 0.00 31.29 29.54 3hwc h VAL 3118CO -0.01 0.16 0.16 -0.50 -1.01 0.00 0.00 177.57 176.37 3hwc h TRP 3119N 0.86 0.87 0.21 3.17 4.06 -1.73 -1.87 115.95 121.52 3hwc h TRP 3119Ca 0.43 -0.07 -0.01 0.00 2.06 0.00 0.00 58.89 61.30 3hwc h TRP 3119Cb 0.48 -0.26 0.00 0.00 -1.00 0.00 0.00 29.16 28.39 3hwc h TRP 3119CO -0.00 0.71 -0.10 0.93 -3.56 0.00 0.00 178.44 176.42 3hwc h GLU 3120N 0.82 -0.27 0.00 0.49 4.39 -0.80 -3.23 114.58 115.98 3hwc h GLU 3120Ca 0.18 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.90 3hwc h GLU 3120Cb 0.27 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 3hwc h GLU 3120CO -0.01 -0.18 0.00 0.36 -1.16 0.00 0.00 179.01 178.02 3hwc n LYS 3121N -2.92 0.11 0.00 2.33 -0.00 0.22 -1.49 118.16 116.41 3hwc n LYS 3121Ca -0.03 0.45 0.11 0.00 -0.00 0.00 0.00 58.31 58.83 3hwc n LYS 3121Cb 0.11 -1.76 -0.05 0.00 -0.00 0.00 0.00 35.03 33.33 3hwc n LYS 3121CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 3hwc n GLN 3122N -1.97 0.69 -2.00 -1.58 1.13 -0.71 -4.96 117.38 107.98 3hwc n GLN 3122Ca 0.01 -0.57 -0.36 0.00 -1.94 0.00 0.00 57.00 54.15 3hwc n GLN 3122Cb 0.14 -1.49 0.03 0.00 0.11 0.00 0.00 30.24 29.03 3hwc n GLN 3122CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 3hwc s SER 3123N -2.70 5.19 -0.18 1.08 0.01 -0.55 -4.58 113.70 111.95 3hwc s SER 3123Ca 0.14 2.41 0.01 0.00 1.31 0.00 0.00 55.95 59.82 3hwc s SER 3123Cb 0.17 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.83 3hwc s SER 3123CO 0.70 -1.60 -0.18 -0.63 0.41 0.00 0.00 173.24 171.94 3hwc s ILE 3124N -1.57 1.99 0.00 1.44 1.01 -0.06 -4.67 121.20 119.34 3hwc s ILE 3124Ca 0.77 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 60.46 3hwc s ILE 3124Cb -0.31 -1.84 0.00 0.00 0.01 0.00 0.00 42.46 40.32 3hwc s ILE 3124CO 0.34 0.46 0.00 0.61 0.00 0.00 0.00 174.94 176.35 3hwc n GLY 3125N 4.63 0.80 0.41 6.18 0.00 -1.26 -4.30 105.19 111.64 3hwc n GLY 3125Ca -0.20 -0.39 0.07 0.00 0.00 0.00 0.00 46.02 45.50 3hwc n GLY 3125CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwc n ALA 3126N -0.94 2.58 -1.65 4.61 0.00 -1.26 -5.07 120.51 118.77 3hwc n ALA 3126Ca 0.00 -2.49 -0.55 0.00 0.00 0.00 0.00 53.44 50.40 3hwc n ALA 3126Cb 0.01 -0.43 -0.07 0.00 0.00 0.00 0.00 19.45 18.96 3hwc n ALA 3126CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3hwc n GLU 3127N -0.93 1.16 -2.01 0.00 0.00 -1.26 -2.15 120.64 115.46 3hwc n GLU 3127Ca 0.13 0.42 -0.07 0.00 0.00 0.00 0.00 57.16 57.64 3hwc n GLU 3127Cb 0.71 -2.09 -0.01 0.00 0.00 0.00 0.00 31.44 30.05 3hwc n GLU 3127CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3hwc n GLY 3128N 3.36 0.19 0.71 -1.84 0.00 -1.26 -4.93 105.19 101.42 3hwc n GLY 3128Ca 0.22 -0.59 0.07 0.00 0.00 0.00 0.00 46.02 45.72 3hwc n GLY 3128CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hwc n ARG 3129N -1.88 2.25 -2.86 1.61 5.12 -0.91 -5.03 116.66 114.97 3hwc n ARG 3129Ca -0.09 -1.91 -0.14 0.00 -1.93 0.00 0.00 57.85 53.78 3hwc n ARG 3129Cb 0.52 -1.31 0.01 0.00 -1.16 0.00 0.00 32.46 30.52 3hwc n ARG 3129CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 3hwc n ASN 3130N 0.75 -2.37 0.24 0.55 6.94 -1.26 -4.81 115.26 115.30 3hwc n ASN 3130Ca 0.12 -0.36 0.15 0.00 -0.02 0.00 0.00 54.58 54.47 3hwc n ASN 3130Cb 0.43 -0.76 0.50 0.00 -2.36 0.00 0.00 39.78 37.59 3hwc n ASN 3130CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 3hwc h LEU 3131N 0.56 0.00 -0.13 -4.53 3.38 -1.89 -3.00 115.31 109.70 3hwc h LEU 3131Ca -0.30 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 3hwc h LEU 3131Cb 0.67 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 3hwc h LEU 3131CO 0.16 0.00 -0.02 0.74 0.09 0.00 0.00 178.44 179.40 3hwc h THR 3132N 0.00 1.28 -0.38 0.22 2.02 -1.87 -0.43 112.91 113.75 3hwc h THR 3132Ca 0.00 -0.94 -0.04 0.00 0.77 0.00 0.00 66.41 66.20 3hwc h THR 3132Cb 0.66 1.65 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 3hwc h THR 3132CO 0.00 0.27 0.08 1.56 0.37 0.00 0.00 175.52 177.80 3hwc h GLN 3133N -0.05 0.56 -0.18 6.66 1.08 -1.92 -1.35 115.11 119.91 3hwc h GLN 3133Ca 0.03 -0.10 0.04 0.00 -1.45 0.00 0.00 58.65 57.18 3hwc h GLN 3133Cb 0.43 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.73 3hwc h GLN 3133CO 0.01 0.53 -0.07 -0.91 -0.95 0.00 0.00 178.83 177.44 3hwc h ASN 3134N 0.55 -0.23 0.39 1.46 -0.26 -1.34 0.12 115.58 116.27 3hwc h ASN 3134Ca 0.13 0.06 -0.01 0.00 -0.56 0.00 0.00 56.30 55.93 3hwc h ASN 3134Cb 0.23 0.14 -0.03 0.00 -1.06 0.00 0.00 38.32 37.60 3hwc h ASN 3134CO -0.00 -0.09 -0.50 0.40 -1.06 0.00 0.00 177.43 176.18 3hwc h ILE 3135N -0.03 0.03 -0.84 2.81 2.04 -0.45 -1.93 117.51 119.13 3hwc h ILE 3135Ca 0.09 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.07 3hwc h ILE 3135Cb 0.18 0.03 -0.08 0.00 -0.74 0.00 0.00 36.82 36.20 3hwc h ILE 3135CO -0.21 0.00 0.46 0.45 0.00 0.00 0.00 178.15 178.85 3hwc h HIS 3136N -0.92 0.82 -0.04 1.37 3.86 -1.09 -1.34 115.15 117.81 3hwc h HIS 3136Ca -0.04 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 3hwc h HIS 3136Cb 0.83 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 29.06 3hwc h HIS 3136CO -0.31 0.27 0.02 -0.91 0.86 0.00 0.00 177.93 177.86 3hwc h ASN 3137N 0.71 0.05 -0.44 2.45 -0.26 -0.57 -2.48 115.58 115.03 3hwc h ASN 3137Ca 0.43 -0.05 -0.08 0.00 -0.56 0.00 0.00 56.30 56.04 3hwc h ASN 3137Cb 0.51 -0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 37.74 3hwc h ASN 3137CO -0.30 0.08 -0.04 0.15 -1.06 0.00 0.00 177.43 176.26 3hwc h PHE 3138N 0.00 0.90 -1.00 1.19 3.57 -0.91 -1.11 116.94 119.58 3hwc h PHE 3138Ca 0.01 -0.17 0.14 0.00 3.53 0.00 0.00 57.97 61.49 3hwc h PHE 3138Cb 0.05 -0.23 -0.09 0.00 2.79 0.00 0.00 35.95 38.47 3hwc h PHE 3138CO -0.06 0.89 0.62 -0.07 -2.23 0.00 0.00 178.31 177.46 3hwc h LEU 3139N 0.65 0.86 -0.17 0.59 3.38 -1.23 0.84 115.31 120.24 3hwc h LEU 3139Ca 0.12 0.06 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 3hwc h LEU 3139Cb 0.56 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3hwc h LEU 3139CO 0.03 0.41 -0.39 0.11 0.09 0.00 0.00 178.44 178.69 3hwc h LYS 3140N 0.90 0.56 0.12 1.13 6.56 -1.14 -2.71 116.57 121.98 3hwc h LYS 3140Ca 0.52 -0.38 0.00 0.00 -1.06 0.00 0.00 60.65 59.73 3hwc h LYS 3140Cb 0.64 0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 32.34 3hwc h LYS 3140CO -0.29 1.00 -0.10 1.25 -2.06 0.00 0.00 179.45 179.25 3hwc h LEU 3141N 0.21 -0.25 -0.70 2.94 6.46 -0.24 0.26 115.31 123.99 3hwc h LEU 3141Ca -0.00 0.02 0.13 0.00 -0.12 0.00 0.00 57.88 57.91 3hwc h LEU 3141Cb 1.00 0.08 -0.13 0.00 -0.73 0.00 0.00 40.66 40.88 3hwc h LEU 3141CO 0.09 -0.15 -0.24 0.25 -0.62 0.00 0.00 178.44 177.77 3hwc h LEU 3142N -0.22 -0.85 0.01 2.25 6.46 0.64 -0.67 115.31 122.92 3hwc h LEU 3142Ca -0.00 0.23 -0.00 0.00 -0.12 0.00 0.00 57.88 57.98 3hwc h LEU 3142Cb 0.21 0.50 0.00 0.00 -0.73 0.00 0.00 40.66 40.64 3hwc h LEU 3142CO -0.01 -0.26 -0.00 -0.09 -0.62 0.00 0.00 178.44 177.45 3hwc h ARG 3143N -0.05 -0.01 -0.40 1.25 2.43 -1.22 -0.26 114.38 116.12 3hwc h ARG 3143Ca 0.31 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.34 3hwc h ARG 3143Cb 0.54 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 3hwc h ARG 3143CO -0.74 0.83 -0.34 0.93 -1.51 0.00 0.00 179.97 179.14 3hwc h GLU 3144N -0.96 0.93 -0.00 0.20 5.08 -0.89 -1.90 114.58 117.04 3hwc h GLU 3144Ca -0.00 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 3hwc h GLU 3144Cb 0.84 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.09 3hwc h GLU 3144CO 0.00 1.12 -0.05 1.63 -1.00 0.00 0.00 179.01 180.72 3hwc n LYS 3145N -4.10 0.34 -3.66 2.33 4.76 -0.26 -4.94 118.16 112.64 3hwc n LYS 3145Ca -0.02 -0.04 -0.22 0.00 -2.87 0.00 0.00 58.31 55.16 3hwc n LYS 3145Cb 0.52 -1.50 0.05 0.00 -1.84 0.00 0.00 35.03 32.26 3hwc n LYS 3145CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3hwc n ASP 3146N -1.29 -2.15 -4.91 4.39 2.03 -0.71 -4.87 116.55 109.04 3hwc n ASP 3146Ca 0.12 -0.75 -0.28 0.00 0.52 0.00 0.00 54.79 54.40 3hwc n ASP 3146Cb 0.28 -4.36 0.07 0.00 -0.72 0.00 0.00 41.12 36.39 3hwc n ASP 3146CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3hwc s LEU 3147N -6.72 2.75 -0.25 -2.67 1.43 -0.18 -4.84 118.68 108.21 3hwc s LEU 3147Ca 0.12 0.73 -0.00 0.00 -1.03 0.00 0.00 54.13 53.95 3hwc s LEU 3147Cb -0.06 -3.36 0.03 0.00 0.03 0.00 0.00 46.19 42.83 3hwc s LEU 3147CO 0.79 -1.62 -0.08 0.21 0.23 0.00 0.00 176.35 175.88 3hwc s ASN 3148N -4.49 4.22 -0.53 2.29 3.04 -1.26 -4.94 114.94 113.27 3hwc s ASN 3148Ca 0.60 -0.97 0.04 0.00 0.04 0.00 0.00 52.86 52.57 3hwc s ASN 3148Cb -0.11 -1.62 0.15 0.00 -1.54 0.00 0.00 41.25 38.12 3hwc s ASN 3148CO 0.48 -0.13 0.32 0.00 -3.04 0.00 0.00 177.10 174.72 3hwc s PRO 3150N -0.31 1.68 0.14 0.00 0.02 -1.22 -4.50 135.00 130.81 3hwc s PRO 3150Ca 0.21 1.60 -0.28 0.00 0.02 0.00 0.00 61.00 62.55 3hwc s PRO 3150Cb -0.17 -1.80 -0.07 0.00 0.02 0.00 0.00 34.50 32.48 3hwc s PRO 3150CO -0.06 -2.15 0.87 -0.51 -0.33 0.00 0.00 177.00 174.82 3hwc s LEU 3151N -5.86 4.55 -0.46 -5.54 1.43 -1.26 0.15 118.68 111.69 3hwc s LEU 3151Ca 0.69 1.72 0.08 0.00 -1.03 0.00 0.00 54.13 55.59 3hwc s LEU 3151Cb -0.25 -3.44 0.25 0.00 0.03 0.00 0.00 46.19 42.78 3hwc s LEU 3151CO 0.52 0.08 0.59 -3.20 0.23 0.00 0.00 176.35 174.57 3hwc n ASN 3152N 2.17 1.19 -0.10 2.29 4.05 0.28 -4.26 115.26 120.89 3hwc n ASN 3152Ca -0.02 -2.91 -0.12 0.00 0.45 0.00 0.00 54.58 51.98 3hwc n ASN 3152Cb 0.49 -0.65 -0.11 0.00 1.23 0.00 0.00 39.78 40.74 3hwc n ASN 3152CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 3hwc n PHE 3153N 1.21 0.00 -1.90 1.20 3.01 -1.26 -2.83 117.46 116.89 3hwc n PHE 3153Ca 0.24 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.30 3hwc n PHE 3153Cb 0.50 -0.81 0.01 0.00 -0.01 0.00 0.00 39.48 39.17 3hwc n PHE 3153CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3hwc s VAL 3154N -2.41 2.29 0.20 -4.37 1.01 -1.26 -4.29 120.40 111.56 3hwc s VAL 3154Ca -0.22 0.26 0.09 0.00 0.00 0.00 0.00 61.98 62.11 3hwc s VAL 3154Cb 0.06 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3hwc s VAL 3154CO 0.55 0.03 -0.05 -1.81 0.00 0.00 0.00 175.10 173.82 3hwc s ASP 3155N -0.66 4.44 0.53 3.32 1.01 -1.26 -2.01 116.67 122.03 3hwc s ASP 3155Ca 0.61 -0.55 -0.20 0.00 0.71 0.00 0.00 52.55 53.12 3hwc s ASP 3155Cb -0.41 -0.82 -0.09 0.00 1.01 0.00 0.00 42.92 42.62 3hwc s ASP 3155CO 0.52 0.08 0.75 -2.65 0.21 0.00 0.00 175.17 174.08 3hwc n PRO 3156N -0.18 0.80 -1.73 8.23 -0.02 -1.26 -4.77 135.00 136.07 3hwc n PRO 3156Ca -0.10 0.30 -0.42 0.00 -2.02 0.00 0.00 63.50 61.26 3hwc n PRO 3156Cb 0.56 -1.87 -0.02 0.00 -0.02 0.00 0.00 33.50 32.15 3hwc n PRO 3156CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3hwc n GLN 3157N -0.18 2.69 -1.67 -0.52 6.02 -1.26 -4.85 117.38 117.60 3hwc n GLN 3157Ca 0.12 0.96 -0.32 0.00 -0.01 0.00 0.00 57.00 57.75 3hwc n GLN 3157Cb 0.45 -2.77 -0.04 0.00 1.02 0.00 0.00 30.24 28.90 3hwc n GLN 3157CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3hwc s THR 3158N 0.54 3.09 -0.12 5.09 -1.32 -1.26 -4.94 115.64 116.72 3hwc s THR 3158Ca 0.70 0.02 -0.01 0.00 -1.21 0.00 0.00 61.69 61.18 3hwc s THR 3158Cb -0.51 -3.24 -0.02 0.00 -1.51 0.00 0.00 72.50 67.22 3hwc s THR 3158CO 0.41 -0.23 -0.08 -1.81 -2.21 0.00 0.00 174.62 170.70 3hwc s ASP 3159N 11.01 4.46 -1.19 8.08 1.01 -1.26 -5.04 116.67 133.73 3hwc s ASP 3159Ca 0.90 -0.17 -0.08 0.00 0.71 0.00 0.00 52.55 53.91 3hwc s ASP 3159Cb -0.15 -1.51 0.22 0.00 1.01 0.00 0.00 42.92 42.50 3hwc s ASP 3159CO 0.20 0.23 1.62 -2.11 0.21 0.00 0.00 175.17 175.32 3hwc n ARG 3160N 3.11 3.86 0.00 8.23 0.00 -1.26 -4.88 116.66 125.72 3hwc n ARG 3160Ca -0.18 -3.99 0.00 0.00 -0.00 0.00 0.00 57.85 53.69 3hwc n ARG 3160Cb 0.53 -2.77 0.00 0.00 -0.00 0.00 0.00 32.46 30.21 3hwc n ARG 3160CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 3hwc n SER 3161N 3.18 -0.36 -0.09 2.89 7.64 -1.26 -4.87 113.62 120.74 3hwc n SER 3161Ca 0.34 -0.02 -0.06 0.00 1.01 0.00 0.00 58.87 60.13 3hwc n SER 3161Cb 0.36 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.57 3hwc n SER 3161CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3hwc h SER 3162N -0.36 -0.13 -2.04 6.43 0.02 -2.03 -3.39 113.55 112.06 3hwc h SER 3162Ca 0.00 0.08 -0.32 0.00 -0.84 0.00 0.00 61.79 60.71 3hwc h SER 3162Cb 0.00 0.13 -0.32 0.00 0.14 0.00 0.00 62.40 62.35 3hwc h SER 3162CO 0.00 -0.03 -0.64 1.51 -1.14 0.00 0.00 176.83 176.54 3hwc s ASP 3163N -5.26 1.38 -0.03 3.07 1.47 -1.26 -4.98 116.67 111.06 3hwc s ASP 3163Ca -0.13 -0.91 0.02 0.00 1.18 0.00 0.00 52.55 52.70 3hwc s ASP 3163Cb 0.13 0.60 0.09 0.00 -0.34 0.00 0.00 42.92 43.40 3hwc s ASP 3163CO 0.70 -0.35 0.67 0.00 0.68 0.00 0.00 175.17 176.87 3hwc n ALA 3164N 5.05 2.65 0.00 2.11 0.00 -1.26 -2.45 120.51 126.61 3hwc n ALA 3164Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.24 3hwc n ALA 3164Cb 0.46 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.90 3hwc n ALA 3164CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hwc n ALA 3165N 0.05 1.89 0.09 0.00 0.00 -1.26 -4.80 120.51 116.49 3hwc n ALA 3165Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.40 3hwc n ALA 3165Cb 0.34 0.17 0.01 0.00 0.00 0.00 0.00 19.45 19.97 3hwc n ALA 3165CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3hwc h GLN 3166N 0.00 0.14 -6.40 0.00 5.75 -1.97 -3.45 115.11 109.18 3hwc h GLN 3166Ca 0.00 -0.15 -0.62 0.00 -0.15 0.00 0.00 58.65 57.73 3hwc h GLN 3166Cb 0.36 0.04 -0.14 0.00 1.07 0.00 0.00 27.48 28.81 3hwc h GLN 3166CO 0.00 0.90 -0.73 0.00 -2.65 0.00 0.00 178.83 176.35 3hwc s ALA 3167N -3.21 2.88 0.34 3.38 0.00 -1.03 -5.12 121.76 119.01 3hwc s ALA 3167Ca -0.02 -1.60 -0.02 0.00 0.00 0.00 0.00 51.96 50.33 3hwc s ALA 3167Cb 0.11 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 3hwc s ALA 3167CO 0.82 0.40 0.58 -0.98 0.00 0.00 0.00 175.76 176.57 3hwc s ARG 3168N -3.05 3.54 0.82 0.00 1.70 -1.26 -4.57 118.95 116.12 3hwc s ARG 3168Ca 0.26 -0.17 -0.06 0.00 -0.47 0.00 0.00 55.73 55.30 3hwc s ARG 3168Cb -0.08 -2.63 0.17 0.00 -0.57 0.00 0.00 34.95 31.84 3hwc s ARG 3168CO 0.15 0.13 1.12 -1.54 -1.08 0.00 0.00 175.30 174.08 3hwc s SER 3169N -3.76 3.79 0.00 -2.89 1.04 -1.26 -5.00 113.70 105.62 3hwc s SER 3169Ca 0.42 -0.26 0.28 0.00 0.48 0.00 0.00 55.95 56.87 3hwc s SER 3169Cb -0.10 0.07 1.03 0.00 0.10 0.00 0.00 66.02 67.12 3hwc s SER 3169CO 0.35 -2.25 1.73 -2.65 0.98 0.00 0.00 173.24 171.40 3hwc n PRO 3170N -3.19 1.49 -1.67 4.02 -0.02 -1.26 -4.97 135.00 129.41 3hwc n PRO 3170Ca 0.16 -0.85 -0.40 0.00 -2.02 0.00 0.00 63.50 60.39 3hwc n PRO 3170Cb 0.60 -1.48 0.02 0.00 -0.02 0.00 0.00 33.50 32.62 3hwc n PRO 3170CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3hwc n ASN 3171N -0.02 2.04 -4.73 2.55 3.02 -1.26 0.13 115.26 116.99 3hwc n ASN 3171Ca 0.18 1.05 -0.42 0.00 -0.03 0.00 0.00 54.58 55.36 3hwc n ASN 3171Cb 0.34 -1.46 -0.03 0.00 -0.61 0.00 0.00 39.78 38.03 3hwc n ASN 3171CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3hwc s LEU 3172N -1.57 4.39 0.05 3.41 2.96 -1.22 -4.28 118.68 122.42 3hwc s LEU 3172Ca 0.64 2.39 -0.08 0.00 -0.22 0.00 0.00 54.13 56.85 3hwc s LEU 3172Cb -0.50 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 42.59 3hwc s LEU 3172CO 0.56 -0.61 0.17 0.00 -1.32 0.00 0.00 176.35 175.14 3hwc s ARG 3173N 0.53 0.70 -0.12 1.98 1.70 -0.70 -4.45 118.95 118.59 3hwc s ARG 3173Ca 0.61 -0.74 -0.29 0.00 -0.47 0.00 0.00 55.73 54.84 3hwc s ARG 3173Cb -0.37 0.28 -0.03 0.00 -0.57 0.00 0.00 34.95 34.27 3hwc s ARG 3173CO 0.34 -0.20 1.33 0.42 -1.08 0.00 0.00 175.30 176.11 3hwc s ILE 3174N -2.88 4.11 -0.19 4.99 1.01 0.41 -1.70 121.20 126.94 3hwc s ILE 3174Ca -0.03 1.37 0.11 0.00 0.00 0.00 0.00 60.65 62.11 3hwc s ILE 3174Cb 0.00 -3.88 -0.23 0.00 0.01 0.00 0.00 42.46 38.36 3hwc s ILE 3174CO -0.06 -0.10 0.07 0.52 0.00 0.00 0.00 174.94 175.38 3hwc n VAL 3175N 5.24 1.47 -3.60 2.92 0.31 0.51 -4.96 118.33 120.22 3hwc n VAL 3175Ca 0.14 -0.76 -0.14 0.00 -0.01 0.00 0.00 64.34 63.58 3hwc n VAL 3175Cb 0.45 -0.87 -0.05 0.00 -0.91 0.00 0.00 33.84 32.45 3hwc n VAL 3175CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 3hwc s GLU 3176N -2.52 1.01 -0.03 5.55 2.12 -1.14 -5.02 118.70 118.68 3hwc s GLU 3176Ca -0.17 -0.27 0.02 0.00 0.36 0.00 0.00 54.97 54.92 3hwc s GLU 3176Cb 0.07 0.46 0.00 0.00 0.26 0.00 0.00 34.13 34.92 3hwc s GLU 3176CO 0.76 -0.36 -0.09 0.21 -0.54 0.00 0.00 175.26 175.24 3hwc s LYS 3177N -2.46 1.02 0.29 4.30 2.20 -1.26 -0.97 119.74 122.85 3hwc s LYS 3177Ca -0.05 -0.31 0.03 0.00 -0.36 0.00 0.00 55.97 55.27 3hwc s LYS 3177Cb -0.01 -0.94 -0.01 0.00 -1.51 0.00 0.00 37.83 35.36 3hwc s LYS 3177CO -0.02 0.10 0.09 0.25 -0.36 0.00 0.00 175.35 175.42 3hwc n THR 3178N 3.35 0.00 0.81 3.43 -2.24 -0.62 -5.02 114.28 113.99 3hwc n THR 3178Ca -0.19 -1.66 0.13 0.00 -2.27 0.00 0.00 64.05 60.06 3hwc n THR 3178Cb 0.54 0.57 0.52 0.00 -2.10 0.00 0.00 70.33 69.86 3hwc n THR 3178CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3hwc n ASP 3179N -1.64 0.36 -0.07 3.42 4.64 -1.26 -3.57 116.55 118.44 3hwc n ASP 3179Ca -0.05 0.54 -0.11 0.00 -1.38 0.00 0.00 54.79 53.79 3hwc n ASP 3179Cb 0.43 -0.63 -0.15 0.00 -1.04 0.00 0.00 41.12 39.73 3hwc n ASP 3179CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 3hwc n ASP 3180N -1.84 0.66 0.00 1.67 10.43 -1.26 -4.96 116.55 121.24 3hwc n ASP 3180Ca 0.06 0.16 0.00 0.00 2.57 0.00 0.00 54.79 57.58 3hwc n ASP 3180Cb 0.37 0.34 0.00 0.00 1.84 0.00 0.00 41.12 43.67 3hwc n ASP 3180CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3hwc n GLY 3181N 1.74 -0.74 3.04 0.44 0.00 -1.23 -1.42 105.19 107.01 3hwc n GLY 3181Ca -0.28 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.67 3hwc n GLY 3181CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hwc s ILE 3182N -2.31 0.22 -0.17 -0.61 -4.36 -0.19 -1.59 121.20 112.18 3hwc s ILE 3182Ca 0.00 -1.33 -0.02 0.00 -0.26 0.00 0.00 60.65 59.04 3hwc s ILE 3182Cb 0.00 -0.86 -0.01 0.00 1.25 0.00 0.00 42.46 42.84 3hwc s ILE 3182CO 0.00 -0.71 -0.08 -0.63 0.24 0.00 0.00 174.94 173.76 3hwc s ILE 3183N -2.54 3.30 0.05 8.37 1.01 -0.14 -0.46 121.20 130.78 3hwc s ILE 3183Ca -0.05 -0.55 0.07 0.00 0.00 0.00 0.00 60.65 60.12 3hwc s ILE 3183Cb -0.02 -2.44 -0.03 0.00 0.01 0.00 0.00 42.46 39.97 3hwc s ILE 3183CO -0.05 0.48 -0.18 0.68 0.00 0.00 0.00 174.94 175.88 3hwc s VAL 3184N 0.79 2.82 -0.01 2.92 -7.23 0.40 -0.36 120.40 119.73 3hwc s VAL 3184Ca -0.03 -1.22 0.00 0.00 -1.81 0.00 0.00 61.98 58.92 3hwc s VAL 3184Cb -0.15 -2.20 0.01 0.00 0.56 0.00 0.00 36.38 34.60 3hwc s VAL 3184CO 0.01 0.30 0.00 0.21 -0.31 0.00 0.00 175.10 175.32 3hwc s ASN 3185N -1.54 0.21 0.00 4.85 3.04 -0.69 -0.44 114.94 120.37 3hwc s ASN 3185Ca 0.15 -0.01 0.00 0.00 0.04 0.00 0.00 52.86 53.04 3hwc s ASN 3185Cb -0.11 -0.09 0.00 0.00 -1.54 0.00 0.00 41.25 39.52 3hwc s ASN 3185CO 0.06 -0.05 0.00 0.61 -3.04 0.00 0.00 177.10 174.68 3hwc n GLY 3186N 3.64 0.95 3.04 1.21 0.00 -0.81 -1.72 105.19 111.51 3hwc n GLY 3186Ca -0.20 -1.91 -0.19 0.00 0.00 0.00 0.00 46.02 43.72 3hwc n GLY 3186CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hwc s VAL 3187N -2.61 0.77 -0.19 1.61 1.01 0.12 -0.40 120.40 120.72 3hwc s VAL 3187Ca 0.00 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 3hwc s VAL 3187Cb 0.00 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 3hwc s VAL 3187CO 0.00 0.15 0.05 -0.54 0.00 0.00 0.00 175.10 174.75 3hwc s LYS 3188N -0.42 3.89 0.22 2.72 -0.14 -0.28 -3.37 119.74 122.36 3hwc s LYS 3188Ca 0.03 -0.39 0.05 0.00 -1.36 0.00 0.00 55.97 54.29 3hwc s LYS 3188Cb -0.05 -3.18 -0.03 0.00 -1.68 0.00 0.00 37.83 32.89 3hwc s LYS 3188CO -0.00 0.21 0.33 0.00 -0.76 0.00 0.00 175.35 175.13 3hwc s ALA 3189N 0.52 3.92 -1.26 5.17 0.00 -0.85 -0.31 121.76 128.95 3hwc s ALA 3189Ca 0.02 -1.20 -0.26 0.00 0.00 0.00 0.00 51.96 50.53 3hwc s ALA 3189Cb -0.13 -1.71 0.03 0.00 0.00 0.00 0.00 23.12 21.30 3hwc s ALA 3189CO 0.01 0.31 0.60 0.28 0.00 0.00 0.00 175.76 176.96 3hwc n VAL 3190N -1.20 -3.16 -3.48 0.00 0.31 -0.96 -4.26 118.33 105.57 3hwc n VAL 3190Ca -0.09 -0.66 -0.31 0.00 -0.01 0.00 0.00 64.34 63.28 3hwc n VAL 3190Cb 0.56 -2.57 -0.05 0.00 -0.91 0.00 0.00 33.84 30.88 3hwc n VAL 3190CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 3hwc s GLY 3191N -3.68 2.16 -0.16 2.92 0.00 0.12 -4.77 107.32 103.90 3hwc s GLY 3191Ca 0.40 -0.44 0.02 0.00 0.00 0.00 0.00 44.72 44.70 3hwc s GLY 3191CO 0.95 -0.33 -0.21 -1.59 0.00 0.00 0.00 173.10 171.92 3hwc s THR 3192N -1.83 2.06 -0.04 0.90 2.01 -1.26 0.49 115.64 117.96 3hwc s THR 3192Ca 0.44 -0.96 0.00 0.00 0.31 0.00 0.00 61.69 61.49 3hwc s THR 3192Cb -0.11 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.56 3hwc s THR 3192CO 0.24 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.33 3hwc n GLY 3193N 4.34 0.47 0.26 4.40 0.00 -0.33 -4.62 105.19 109.70 3hwc n GLY 3193Ca -0.20 -0.19 0.01 0.00 0.00 0.00 0.00 46.02 45.63 3hwc n GLY 3193CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hwc h ILE 3194N 0.00 0.82 0.00 -0.61 1.08 -1.83 -0.75 117.51 116.21 3hwc h ILE 3194Ca -0.01 -0.18 0.00 0.00 -0.39 0.00 0.00 64.86 64.28 3hwc h ILE 3194Cb 0.09 0.24 0.00 0.00 -3.07 0.00 0.00 36.82 34.08 3hwc h ILE 3194CO 0.01 0.10 0.00 0.00 -0.69 0.00 0.00 178.15 177.57 3hwc n ALA 3195N -2.43 1.42 0.35 1.87 0.00 -1.26 -2.31 120.51 118.15 3hwc n ALA 3195Ca 0.10 -0.03 0.05 0.00 0.00 0.00 0.00 53.44 53.56 3hwc n ALA 3195Cb 0.28 -1.14 0.05 0.00 0.00 0.00 0.00 19.45 18.64 3hwc n ALA 3195CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3hwc n PHE 3196N -1.46 0.04 -3.10 0.00 3.72 -0.30 -4.95 117.46 111.41 3hwc n PHE 3196Ca 0.02 -0.05 -0.25 0.00 -0.05 0.00 0.00 57.45 57.12 3hwc n PHE 3196Cb 0.09 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 3hwc n PHE 3196CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3hwc s GLY 3197N -0.82 1.41 0.00 1.37 0.00 -0.98 -4.96 107.32 103.35 3hwc s GLY 3197Ca 0.12 -0.75 -0.17 0.00 0.00 0.00 0.00 44.72 43.93 3hwc s GLY 3197CO 0.12 -0.65 0.93 -0.55 0.00 0.00 0.00 173.10 172.96 3hwc h ASP 3198N 0.58 0.75 -3.17 1.64 3.32 -0.93 -3.43 116.42 115.18 3hwc h ASP 3198Ca -0.49 -0.93 -0.46 0.00 0.02 0.00 0.00 57.03 55.18 3hwc h ASP 3198Cb 1.21 -0.24 -0.14 0.00 0.22 0.00 0.00 39.33 40.38 3hwc h ASP 3198CO 0.62 1.66 -0.71 -0.31 -1.72 0.00 0.00 179.24 178.78 3hwc s TYR 3199N -2.56 1.78 -0.07 4.55 1.51 -1.12 -1.83 117.35 119.60 3hwc s TYR 3199Ca -0.11 -0.64 0.03 0.00 -1.01 0.00 0.00 57.07 55.34 3hwc s TYR 3199Cb 0.04 -0.91 -0.02 0.00 -0.11 0.00 0.00 41.96 40.95 3hwc s TYR 3199CO 0.91 0.30 -0.15 0.00 -1.11 0.00 0.00 175.55 175.50 3hwc s MET 3200N -3.69 2.68 -0.78 -0.62 0.23 -0.19 -3.37 119.30 113.55 3hwc s MET 3200Ca 0.25 -0.72 -0.20 0.00 -1.03 0.00 0.00 55.69 54.00 3hwc s MET 3200Cb 0.01 -2.40 0.11 0.00 -1.53 0.00 0.00 34.83 31.02 3hwc s MET 3200CO 0.09 0.52 0.99 -1.58 -2.03 0.00 0.00 175.02 173.00 3hwc s HIS 3201N -0.45 2.97 0.07 3.16 2.46 0.12 -2.58 115.29 121.04 3hwc s HIS 3201Ca 0.06 -1.06 -0.30 0.00 0.47 0.00 0.00 55.06 54.23 3hwc s HIS 3201Cb -0.12 -4.23 -0.05 0.00 -0.13 0.00 0.00 32.58 28.05 3hwc s HIS 3201CO 0.02 -1.50 0.96 0.42 -2.47 0.00 0.00 174.74 172.18 3hwc s ILE 3202N 3.07 4.62 0.29 0.89 1.01 0.89 -0.55 121.20 131.41 3hwc s ILE 3202Ca 0.25 2.06 -0.16 0.00 0.00 0.00 0.00 60.65 62.80 3hwc s ILE 3202Cb -0.12 -4.32 0.06 0.00 0.01 0.00 0.00 42.46 38.09 3hwc s ILE 3202CO -0.00 0.27 0.82 0.61 0.00 0.00 0.00 174.94 176.64 3hwc n GLY 3203N 2.46 0.89 3.31 6.18 0.00 -1.13 -1.27 105.19 115.63 3hwc n GLY 3203Ca 0.03 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.76 3hwc n GLY 3203CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwc s LEU 3205N -2.83 3.52 0.69 0.00 1.43 -1.26 -4.73 118.68 115.50 3hwc s LEU 3205Ca 0.05 -0.23 -0.16 0.00 -1.03 0.00 0.00 54.13 52.76 3hwc s LEU 3205Cb 0.02 -2.19 0.02 0.00 0.03 0.00 0.00 46.19 44.07 3hwc s LEU 3205CO -0.10 0.12 1.23 -0.47 0.23 0.00 0.00 176.35 177.36 3hwc s TYR 3206N -1.56 2.10 -0.24 0.29 6.14 -0.94 -5.03 117.35 118.12 3hwc s TYR 3206Ca 0.28 1.56 -0.15 0.00 0.64 0.00 0.00 57.07 59.40 3hwc s TYR 3206Cb -0.11 -3.52 0.07 0.00 0.42 0.00 0.00 41.96 38.82 3hwc s TYR 3206CO 0.20 -2.63 0.59 0.50 0.64 0.00 0.00 175.55 174.85 3hwc s ARG 3207N -3.71 0.62 -0.41 4.97 3.52 -1.26 -5.04 118.95 117.64 3hwc s ARG 3207Ca 0.77 1.02 -0.43 0.00 -0.13 0.00 0.00 55.73 56.96 3hwc s ARG 3207Cb -0.31 0.14 -0.17 0.00 -1.56 0.00 0.00 34.95 33.04 3hwc s ARG 3207CO 0.42 -0.14 1.82 -2.30 -0.81 0.00 0.00 175.30 174.29 3hwc n PRO 3208N 3.97 0.50 -2.05 5.12 -0.02 -1.26 -0.77 135.00 140.50 3hwc n PRO 3208Ca -0.20 0.17 -0.04 0.00 -2.02 0.00 0.00 63.50 61.42 3hwc n PRO 3208Cb 0.57 -1.80 -0.00 0.00 -0.02 0.00 0.00 33.50 32.25 3hwc n PRO 3208CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hwc n GLY 3209N 5.02 0.23 3.71 -1.23 0.00 -1.26 -5.02 105.19 106.64 3hwc n GLY 3209Ca 0.35 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 3hwc n GLY 3209CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3hwc s ILE 3210N -2.19 4.12 0.44 -0.61 2.07 0.05 -5.01 121.20 120.06 3hwc s ILE 3210Ca 0.00 1.52 -0.24 0.00 -1.41 0.00 0.00 60.65 60.52 3hwc s ILE 3210Cb 0.00 -3.97 -0.08 0.00 0.13 0.00 0.00 42.46 38.54 3hwc s ILE 3210CO 0.00 0.11 1.20 -2.84 -1.91 0.00 0.00 174.94 171.50 3hwc s PRO 3211N 1.11 3.85 0.46 3.50 0.02 -1.26 -4.75 135.00 137.93 3hwc s PRO 3211Ca 0.58 1.89 0.13 0.00 0.02 0.00 0.00 61.00 63.62 3hwc s PRO 3211Cb -0.28 -2.55 1.07 0.00 0.02 0.00 0.00 34.50 32.76 3hwc s PRO 3211CO 0.29 -0.51 2.06 0.78 -0.33 0.00 0.00 177.00 179.29 3hwc h GLY 3212N 2.31 0.35 2.00 0.52 0.00 -1.96 -0.19 103.07 106.11 3hwc h GLY 3212Ca -0.49 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 46.72 3hwc h GLY 3212CO 0.61 0.10 0.00 1.05 0.00 0.00 0.00 176.54 178.31 3hwc h GLU 3213N 0.31 0.00 0.00 4.80 4.11 -1.91 -1.35 114.58 120.53 3hwc h GLU 3213Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.57 3hwc h GLU 3213Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3hwc h GLU 3213CO -0.03 0.00 -0.88 1.04 0.07 0.00 0.00 179.01 179.21 3hwc n GLN 3214N -2.58 0.07 -2.73 1.06 6.02 -0.09 -0.45 117.38 118.68 3hwc n GLN 3214Ca -0.00 -0.01 -0.42 0.00 -0.01 0.00 0.00 57.00 56.55 3hwc n GLN 3214Cb 0.14 -1.52 -0.03 0.00 1.02 0.00 0.00 30.24 29.85 3hwc n GLN 3214CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3hwc s VAL 3215N -3.05 4.15 -0.03 5.09 1.01 -0.53 -4.85 120.40 122.19 3hwc s VAL 3215Ca 0.08 0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.33 3hwc s VAL 3215Cb 0.16 -4.69 0.03 0.00 0.00 0.00 0.00 36.38 31.88 3hwc s VAL 3215CO 0.81 -1.40 0.05 -0.63 0.00 0.00 0.00 175.10 173.92 3hwc s ILE 3216N 4.57 -0.08 -0.12 2.22 1.01 -1.26 -1.32 121.20 126.21 3hwc s ILE 3216Ca 0.32 0.33 0.01 0.00 0.00 0.00 0.00 60.65 61.31 3hwc s ILE 3216Cb -0.12 -0.12 0.02 0.00 0.01 0.00 0.00 42.46 42.25 3hwc s ILE 3216CO 0.17 0.14 -0.15 -0.36 0.00 0.00 0.00 174.94 174.74 3hwc s PHE 3217N 1.65 2.07 0.25 3.97 0.40 -0.45 -3.45 117.98 122.42 3hwc s PHE 3217Ca -0.02 -1.03 -0.22 0.00 -0.60 0.00 0.00 56.93 55.07 3hwc s PHE 3217Cb -0.12 -1.49 0.04 0.00 0.51 0.00 0.00 43.02 41.95 3hwc s PHE 3217CO -0.03 -0.54 0.80 0.00 0.70 0.00 0.00 175.22 176.16 3hwc s ALA 3218N 1.11 -1.31 -0.13 5.36 0.00 -0.40 -0.19 121.76 126.20 3hwc s ALA 3218Ca -0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 51.96 51.67 3hwc s ALA 3218Cb -0.14 0.77 0.05 0.00 0.00 0.00 0.00 23.12 23.79 3hwc s ALA 3218CO -0.04 -1.04 0.04 0.00 0.00 0.00 0.00 175.76 174.72 3hwc s ALA 3219N -3.54 0.70 0.10 0.00 0.00 -0.86 -0.08 121.76 118.08 3hwc s ALA 3219Ca 0.12 -0.32 0.08 0.00 0.00 0.00 0.00 51.96 51.84 3hwc s ALA 3219Cb -0.05 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 22.10 3hwc s ALA 3219CO 0.06 -0.85 -0.21 0.96 0.00 0.00 0.00 175.76 175.73 3hwc s ILE 3220N 1.99 1.69 0.54 0.00 -4.36 -1.07 -4.79 121.20 115.19 3hwc s ILE 3220Ca 0.02 -1.52 -0.21 0.00 -0.26 0.00 0.00 60.65 58.68 3hwc s ILE 3220Cb -0.15 -1.53 -0.06 0.00 1.25 0.00 0.00 42.46 41.96 3hwc s ILE 3220CO -0.07 -0.06 1.07 -2.65 0.24 0.00 0.00 174.94 173.47 3hwc n PRO 3221N 1.12 1.22 0.09 0.37 -0.02 -1.26 -1.02 135.00 135.50 3hwc n PRO 3221Ca -0.19 0.45 0.01 0.00 -2.02 0.00 0.00 63.50 61.75 3hwc n PRO 3221Cb 0.54 -2.23 0.33 0.00 -0.02 0.00 0.00 33.50 32.12 3hwc n PRO 3221CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3hwc h THR 3222N 1.00 1.22 -0.28 3.45 2.02 -1.63 -2.33 112.91 116.35 3hwc h THR 3222Ca -0.48 -0.98 0.00 0.00 0.77 0.00 0.00 66.41 65.72 3hwc h THR 3222Cb 1.34 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 3hwc h THR 3222CO 0.54 0.30 0.00 -0.46 0.37 0.00 0.00 175.52 176.27 3hwc n ASN 3223N -4.21 2.69 -4.66 4.18 2.04 -1.26 -4.75 115.26 109.29 3hwc n ASN 3223Ca -0.01 -2.29 -0.48 0.00 -0.44 0.00 0.00 54.58 51.37 3hwc n ASN 3223Cb 0.32 -0.47 -0.05 0.00 -2.53 0.00 0.00 39.78 37.05 3hwc n ASN 3223CO 0.00 0.00 0.00 0.41 -0.44 0.00 0.00 177.26 177.23 3hwc n THR 3224N 0.33 0.16 -1.69 5.53 -1.04 -0.88 -4.82 114.28 111.88 3hwc n THR 3224Ca 0.12 -0.03 -0.44 0.00 -2.04 0.00 0.00 64.05 61.66 3hwc n THR 3224Cb 0.55 -1.49 -0.02 0.00 -1.82 0.00 0.00 70.33 67.55 3hwc n THR 3224CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3hwc n PRO 3225N 4.18 2.10 -0.10 -2.82 -0.02 -1.26 -1.93 135.00 135.15 3hwc n PRO 3225Ca 0.19 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 3hwc n PRO 3225Cb 0.26 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 3hwc n PRO 3225CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hwc n GLY 3226N 1.49 0.85 3.70 -1.23 0.00 -1.26 -4.53 105.19 104.21 3hwc n GLY 3226Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 3hwc n GLY 3226CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hwc s VAL 3227N -2.41 5.32 -0.09 1.61 1.01 -0.81 -0.75 120.40 124.28 3hwc s VAL 3227Ca 0.00 0.43 0.01 0.00 0.00 0.00 0.00 61.98 62.42 3hwc s VAL 3227Cb 0.00 -3.59 0.02 0.00 0.00 0.00 0.00 36.38 32.81 3hwc s VAL 3227CO 0.00 0.37 -0.11 -0.89 0.00 0.00 0.00 175.10 174.47 3hwc s THR 3228N 0.71 1.13 -0.41 3.92 2.01 -0.34 -4.36 115.64 118.29 3hwc s THR 3228Ca 0.13 -0.42 -0.16 0.00 0.31 0.00 0.00 61.69 61.56 3hwc s THR 3228Cb -0.13 -1.08 0.02 0.00 0.01 0.00 0.00 72.50 71.32 3hwc s THR 3228CO 0.03 0.37 0.36 -0.69 -0.69 0.00 0.00 174.62 174.00 3hwc s VAL 3229N 1.16 5.18 -0.47 3.82 1.01 -0.56 -0.78 120.40 129.76 3hwc s VAL 3229Ca -0.05 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.26 3hwc s VAL 3229Cb -0.14 -3.97 0.06 0.00 0.00 0.00 0.00 36.38 32.32 3hwc s VAL 3229CO -0.02 -0.35 0.43 -0.36 0.00 0.00 0.00 175.10 174.79 3hwc s PHE 3230N 1.89 3.20 0.19 5.22 0.08 0.16 -0.78 117.98 127.93 3hwc s PHE 3230Ca 0.08 -0.78 -0.11 0.00 0.12 0.00 0.00 56.93 56.25 3hwc s PHE 3230Cb -0.18 -3.15 -0.07 0.00 -0.57 0.00 0.00 43.02 39.05 3hwc s PHE 3230CO 0.12 -0.81 0.52 0.00 -0.10 0.00 0.00 175.22 174.95 3hwc s ARG 3232N -2.49 -0.35 0.49 0.00 1.70 -0.86 -1.92 118.95 115.52 3hwc s ARG 3232Ca 0.43 1.05 -0.23 0.00 -0.47 0.00 0.00 55.73 56.51 3hwc s ARG 3232Cb -0.13 -1.60 -0.06 0.00 -0.57 0.00 0.00 34.95 32.59 3hwc s ARG 3232CO 0.20 -3.40 1.26 -1.83 -1.08 0.00 0.00 175.30 170.45 3hwc s GLU 3233N -4.52 3.53 0.27 3.89 -1.05 -1.26 -3.98 118.70 115.58 3hwc s GLU 3233Ca 0.68 2.01 -0.25 0.00 -0.15 0.00 0.00 54.97 57.26 3hwc s GLU 3233Cb -0.24 -2.39 -0.09 0.00 -0.44 0.00 0.00 34.13 30.97 3hwc s GLU 3233CO 0.63 -0.80 0.86 0.45 0.95 0.00 0.00 175.26 177.35 3hwc s SER 3234N -1.12 7.29 -0.02 0.83 0.15 -1.26 -4.98 113.70 114.59 3hwc s SER 3234Ca 0.66 1.71 0.10 0.00 0.70 0.00 0.00 55.95 59.12 3hwc s SER 3234Cb -0.34 -2.53 0.30 0.00 -1.71 0.00 0.00 66.02 61.74 3hwc s SER 3234CO 0.42 0.01 1.25 0.35 1.20 0.00 0.00 173.24 176.47 3hwc n THR 3235N 0.80 1.14 -1.97 6.45 -2.24 -1.26 -5.03 114.28 112.17 3hwc n THR 3235Ca -0.00 -1.10 -0.40 0.00 -2.27 0.00 0.00 64.05 60.27 3hwc n THR 3235Cb 0.50 0.41 -0.00 0.00 -2.10 0.00 0.00 70.33 69.14 3hwc n THR 3235CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3hwc s VAL 3236N -1.21 2.41 0.20 2.28 0.11 -1.26 -4.42 120.40 118.52 3hwc s VAL 3236Ca 0.23 0.39 -0.05 0.00 -2.93 0.00 0.00 61.98 59.62 3hwc s VAL 3236Cb 0.13 -3.24 -0.06 0.00 -1.53 0.00 0.00 36.38 31.69 3hwc s VAL 3236CO 0.14 0.08 0.45 -0.54 -3.33 0.00 0.00 175.10 171.89 3hwc s LYS 3237N -2.13 3.64 0.00 1.54 -0.14 -0.31 -4.95 119.74 117.39 3hwc s LYS 3237Ca 0.55 -0.04 0.24 0.00 -1.36 0.00 0.00 55.97 55.36 3hwc s LYS 3237Cb -0.41 -2.76 0.35 0.00 -1.68 0.00 0.00 37.83 33.33 3hwc s LYS 3237CO 0.55 0.37 1.31 0.09 -0.76 0.00 0.00 175.35 176.90 3hwc n ASN 3238N -0.32 1.19 -3.89 2.83 3.02 -1.26 -4.36 115.26 112.47 3hwc n ASN 3238Ca -0.02 -0.95 -0.30 0.00 -0.03 0.00 0.00 54.58 53.28 3hwc n ASN 3238Cb 0.53 0.38 -0.14 0.00 -0.61 0.00 0.00 39.78 39.94 3hwc n ASN 3238CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hwc s ASP 3239N -2.67 4.27 0.53 6.41 -1.08 -1.26 -4.97 116.67 117.90 3hwc s ASP 3239Ca 0.18 -2.47 0.19 0.00 -0.52 0.00 0.00 52.55 49.93 3hwc s ASP 3239Cb 0.18 -1.39 1.34 0.00 -1.46 0.00 0.00 42.92 41.59 3hwc s ASP 3239CO 0.62 -0.31 2.13 -0.65 0.52 0.00 0.00 175.17 177.48 3hwc h PRO 3240N 7.12 0.00 -0.13 4.34 0.11 -1.85 -0.70 132.00 140.90 3hwc h PRO 3240Ca -0.06 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.96 3hwc h PRO 3240Cb 0.96 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 3hwc h PRO 3240CO 0.56 0.00 -0.33 0.00 -0.21 0.00 0.00 178.00 178.02 3hwc h ALA 3241N 1.95 1.20 0.00 -0.75 0.00 -1.97 -2.90 119.26 116.79 3hwc h ALA 3241Ca 0.04 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3hwc h ALA 3241Cb 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3hwc h ALA 3241CO -0.00 0.53 -1.75 0.39 0.00 0.00 0.00 179.25 178.42 3hwc n GLU 3242N -4.09 0.59 -3.41 0.00 -0.58 -0.83 -4.70 120.64 107.62 3hwc n GLU 3242Ca -0.01 -0.13 -0.27 0.00 -0.42 0.00 0.00 57.16 56.33 3hwc n GLU 3242Cb 0.42 -1.56 -0.10 0.00 -0.57 0.00 0.00 31.44 29.63 3hwc n GLU 3242CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 3hwc n HIS 3243N -2.24 -0.41 0.31 -0.32 8.25 -0.33 -4.94 115.22 115.53 3hwc n HIS 3243Ca -0.03 -3.44 0.18 0.00 -0.26 0.00 0.00 57.72 54.17 3hwc n HIS 3243Cb 0.54 0.09 1.02 0.00 1.12 0.00 0.00 29.99 32.77 3hwc n HIS 3243CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3hwc h PRO 3244N 5.36 0.00 0.00 -0.41 0.13 -1.78 -2.85 132.00 132.45 3hwc h PRO 3244Ca 0.23 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.21 3hwc h PRO 3244Cb 0.89 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.00 3hwc h PRO 3244CO 0.42 0.00 -1.35 1.28 -0.23 0.00 0.00 178.00 178.12 3hwc n LEU 3245N -3.52 1.00 0.06 1.56 4.77 -1.26 -4.65 117.00 114.96 3hwc n LEU 3245Ca -0.02 0.16 0.05 0.00 -0.03 0.00 0.00 56.01 56.17 3hwc n LEU 3245Cb 0.11 -0.39 0.27 0.00 -2.33 0.00 0.00 43.42 41.08 3hwc n LEU 3245CO 0.24 0.04 0.67 0.00 -1.33 0.00 0.00 177.39 177.01 3hwc n ALA 3246N -3.63 1.19 1.25 -1.18 0.00 -1.24 -0.56 120.51 116.34 3hwc n ALA 3246Ca -0.19 0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.44 3hwc n ALA 3246Cb 0.55 -1.17 0.33 0.00 0.00 0.00 0.00 19.45 19.16 3hwc n ALA 3246CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hwc n SER 3247N -1.79 1.44 0.02 0.00 3.41 -1.08 -1.16 113.62 114.46 3hwc n SER 3247Ca 0.00 -1.21 0.13 0.00 -0.26 0.00 0.00 58.87 57.53 3hwc n SER 3247Cb 0.06 0.15 0.35 0.00 -0.26 0.00 0.00 64.21 64.51 3hwc n SER 3247CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hwc n GLN 3248N -0.22 0.09 0.00 4.33 6.02 0.28 -4.65 117.38 123.22 3hwc n GLN 3248Ca 0.13 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 3hwc n GLN 3248Cb 0.39 -1.57 0.00 0.00 1.02 0.00 0.00 30.24 30.08 3hwc n GLN 3248CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hwc n GLY 3249N 1.45 4.59 3.26 1.08 0.00 -1.26 -3.80 105.19 110.51 3hwc n GLY 3249Ca 0.05 -1.26 -0.37 0.00 0.00 0.00 0.00 46.02 44.45 3hwc n GLY 3249CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hwc s ASP 3250N 0.00 5.11 -0.98 1.61 3.68 -1.26 -4.77 116.67 120.06 3hwc s ASP 3250Ca 0.00 -1.08 -0.25 0.00 2.13 0.00 0.00 52.55 53.35 3hwc s ASP 3250Cb 0.00 -1.82 -0.11 0.00 -1.45 0.00 0.00 42.92 39.54 3hwc s ASP 3250CO 0.00 -0.28 2.07 -0.70 0.13 0.00 0.00 175.17 176.39 3hwc s GLU 3251N 1.38 2.10 0.62 4.34 2.12 -1.26 -4.80 118.70 123.20 3hwc s GLU 3251Ca -0.02 -0.38 -0.18 0.00 0.36 0.00 0.00 54.97 54.75 3hwc s GLU 3251Cb -0.19 -5.04 -0.02 0.00 0.26 0.00 0.00 34.13 29.14 3hwc s GLU 3251CO 0.01 -4.13 1.23 -0.51 -0.54 0.00 0.00 175.26 171.33 3hwc s LEU 3252N 12.51 3.60 0.08 2.70 1.43 -1.26 -4.75 118.68 133.00 3hwc s LEU 3252Ca 0.76 2.45 0.07 0.00 -1.03 0.00 0.00 54.13 56.38 3hwc s LEU 3252Cb -0.06 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.52 3hwc s LEU 3252CO 0.08 -1.77 -0.11 -1.81 0.23 0.00 0.00 176.35 172.97 3hwc s ASP 3253N -1.59 4.33 0.14 2.29 1.01 -1.26 -1.19 116.67 120.40 3hwc s ASP 3253Ca 0.79 -0.36 -0.04 0.00 0.71 0.00 0.00 52.55 53.65 3hwc s ASP 3253Cb -0.32 -0.83 -0.03 0.00 1.01 0.00 0.00 42.92 42.75 3hwc s ASP 3253CO 0.36 0.21 0.13 -0.94 0.21 0.00 0.00 175.17 175.13 3hwc s SER 3254N -1.97 0.23 -0.18 0.27 1.04 0.18 -2.02 113.70 111.25 3hwc s SER 3254Ca 0.20 -1.09 -0.03 0.00 0.48 0.00 0.00 55.95 55.50 3hwc s SER 3254Cb -0.11 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 3hwc s SER 3254CO 0.11 -0.78 -0.06 -0.89 0.98 0.00 0.00 173.24 172.61 3hwc s THR 3255N -4.02 3.49 -0.24 2.02 2.01 1.00 -0.71 115.64 119.19 3hwc s THR 3255Ca 0.21 -0.48 -0.09 0.00 0.31 0.00 0.00 61.69 61.64 3hwc s THR 3255Cb 0.06 -2.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.98 3hwc s THR 3255CO 0.01 0.46 0.13 -0.89 -0.69 0.00 0.00 174.62 173.64 3hwc s THR 3256N 0.90 4.97 -0.21 -0.82 2.01 0.58 -0.67 115.64 122.40 3hwc s THR 3256Ca -0.01 0.05 -0.09 0.00 0.31 0.00 0.00 61.69 61.94 3hwc s THR 3256Cb -0.15 -3.32 -0.05 0.00 0.01 0.00 0.00 72.50 68.99 3hwc s THR 3256CO 0.01 0.33 0.12 -0.69 -0.69 0.00 0.00 174.62 173.70 3hwc s VAL 3257N 1.30 5.16 -0.45 3.82 1.01 0.04 -1.13 120.40 130.16 3hwc s VAL 3257Ca 0.06 0.11 -0.07 0.00 0.00 0.00 0.00 61.98 62.07 3hwc s VAL 3257Cb -0.15 -3.37 0.12 0.00 0.00 0.00 0.00 36.38 32.98 3hwc s VAL 3257CO 0.06 0.40 0.31 -0.36 0.00 0.00 0.00 175.10 175.51 3hwc s PHE 3258N 0.71 3.47 -0.87 5.22 0.40 0.47 -1.20 117.98 126.18 3hwc s PHE 3258Ca 0.06 -2.03 -0.20 0.00 -0.60 0.00 0.00 56.93 54.17 3hwc s PHE 3258Cb -0.13 -3.43 0.12 0.00 0.51 0.00 0.00 43.02 40.09 3hwc s PHE 3258CO 0.02 -0.99 1.09 -0.51 0.70 0.00 0.00 175.22 175.53 3hwc s ASP 3259N 2.44 6.53 -1.29 1.36 1.01 0.07 -1.92 116.67 124.88 3hwc s ASP 3259Ca 0.06 -1.83 -0.16 0.00 0.71 0.00 0.00 52.55 51.34 3hwc s ASP 3259Cb -0.25 -2.40 0.01 0.00 1.01 0.00 0.00 42.92 41.28 3hwc s ASP 3259CO -0.02 -1.14 0.55 0.59 0.21 0.00 0.00 175.17 175.36 3hwc n ASN 3260N 6.80 -2.71 -4.73 0.27 3.02 -1.11 -4.68 115.26 112.12 3hwc n ASN 3260Ca 0.18 -1.13 -0.41 0.00 -0.03 0.00 0.00 54.58 53.19 3hwc n ASN 3260Cb 0.48 -2.56 -0.04 0.00 -0.61 0.00 0.00 39.78 37.05 3hwc n ASN 3260CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3hwc s VAL 3261N -3.75 4.57 -0.25 2.41 1.01 0.42 -4.75 120.40 120.05 3hwc s VAL 3261Ca 0.28 2.06 -0.17 0.00 0.00 0.00 0.00 61.98 64.15 3hwc s VAL 3261Cb -0.13 -4.32 -0.03 0.00 0.00 0.00 0.00 36.38 31.90 3hwc s VAL 3261CO 0.92 0.29 0.46 0.12 0.00 0.00 0.00 175.10 176.90 3hwc s PHE 3262N 0.16 3.28 -0.28 5.22 2.19 -1.26 -0.45 117.98 126.83 3hwc s PHE 3262Ca 0.47 0.58 -0.07 0.00 0.33 0.00 0.00 56.93 58.25 3hwc s PHE 3262Cb -0.23 -2.65 0.00 0.00 -1.31 0.00 0.00 43.02 38.83 3hwc s PHE 3262CO 0.29 -0.23 0.07 0.42 1.83 0.00 0.00 175.22 177.61 3hwc s ILE 3263N 2.09 4.03 0.47 3.12 1.01 0.39 -4.98 121.20 127.33 3hwc s ILE 3263Ca 0.19 -0.57 -0.23 0.00 0.00 0.00 0.00 60.65 60.04 3hwc s ILE 3263Cb -0.16 -3.03 -0.08 0.00 0.01 0.00 0.00 42.46 39.21 3hwc s ILE 3263CO 0.09 0.15 1.20 -2.65 0.00 0.00 0.00 174.94 173.73 3hwc n PRO 3264N 4.88 1.64 -0.17 2.79 -0.02 -1.26 -1.02 135.00 141.83 3hwc n PRO 3264Ca -0.15 0.59 0.24 0.00 -2.02 0.00 0.00 63.50 62.16 3hwc n PRO 3264Cb 0.49 -2.33 0.65 0.00 -0.02 0.00 0.00 33.50 32.28 3hwc n PRO 3264CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 3hwc h TRP 3265N 1.63 0.18 0.00 6.00 4.06 -1.56 -0.83 115.95 125.43 3hwc h TRP 3265Ca -0.48 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.48 3hwc h TRP 3265Cb 1.31 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 29.42 3hwc h TRP 3265CO 0.45 0.05 0.00 -0.85 -3.56 0.00 0.00 178.44 174.53 3hwc n GLU 3266N -4.37 0.35 -0.18 0.49 0.00 -1.26 -2.08 120.64 113.60 3hwc n GLU 3266Ca 0.17 0.08 0.06 0.00 0.00 0.00 0.00 57.16 57.48 3hwc n GLU 3266Cb 0.82 -1.50 0.16 0.00 0.00 0.00 0.00 31.44 30.92 3hwc n GLU 3266CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 3hwc n GLN 3267N -1.22 2.76 -3.93 3.44 6.02 -0.32 -4.77 117.38 119.37 3hwc n GLN 3267Ca 0.10 -2.04 -0.36 0.00 -0.01 0.00 0.00 57.00 54.70 3hwc n GLN 3267Cb 0.13 -1.28 -0.08 0.00 1.02 0.00 0.00 30.24 30.03 3hwc n GLN 3267CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3hwc s VAL 3268N -1.00 5.20 -0.15 5.09 1.01 -0.88 -2.03 120.40 127.63 3hwc s VAL 3268Ca 0.24 0.10 0.10 0.00 0.00 0.00 0.00 61.98 62.42 3hwc s VAL 3268Cb 0.13 -3.29 -0.16 0.00 0.00 0.00 0.00 36.38 33.05 3hwc s VAL 3268CO 0.16 0.55 0.01 0.49 0.00 0.00 0.00 175.10 176.31 3hwc n PHE 3269N 2.65 0.00 -3.58 5.22 3.72 0.73 -4.70 117.46 121.49 3hwc n PHE 3269Ca -0.18 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.10 3hwc n PHE 3269Cb 0.54 -0.70 -0.06 0.00 -0.94 0.00 0.00 39.48 38.32 3hwc n PHE 3269CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3hwc s HIS 3270N -2.35 -0.43 -0.00 1.38 2.46 -1.11 -4.24 115.29 111.01 3hwc s HIS 3270Ca -0.10 0.80 -0.10 0.00 0.47 0.00 0.00 55.06 56.13 3hwc s HIS 3270Cb 0.05 0.43 0.01 0.00 -0.13 0.00 0.00 32.58 32.93 3hwc s HIS 3270CO 0.55 -0.36 0.19 0.96 -2.47 0.00 0.00 174.74 173.61 3hwc s ILE 3271N -0.87 0.07 0.00 0.89 -4.36 -1.26 -1.34 121.20 114.33 3hwc s ILE 3271Ca -0.02 -0.62 0.00 0.00 -0.26 0.00 0.00 60.65 59.75 3hwc s ILE 3271Cb -0.01 -0.49 0.00 0.00 1.25 0.00 0.00 42.46 43.21 3hwc s ILE 3271CO 0.01 -0.34 0.00 0.61 0.24 0.00 0.00 174.94 175.46 3hwc n GLY 3272N 1.41 1.42 3.10 6.27 0.00 -0.44 -0.89 105.19 116.06 3hwc n GLY 3272Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 3hwc n GLY 3272CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hwc s ASN 3273N -2.23 5.16 0.31 1.61 3.84 -1.26 -4.29 114.94 118.09 3hwc s ASN 3273Ca 0.00 -2.28 0.06 0.00 0.21 0.00 0.00 52.86 50.85 3hwc s ASN 3273Cb 0.00 -1.81 0.73 0.00 -0.55 0.00 0.00 41.25 39.62 3hwc s ASN 3273CO 0.00 -0.47 1.81 -0.65 -2.79 0.00 0.00 177.10 174.99 3hwc h PRO 3274N 7.70 0.76 -0.46 0.43 0.11 -1.89 -1.09 132.00 137.56 3hwc h PRO 3274Ca -0.09 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.96 3hwc h PRO 3274Cb 1.02 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 3hwc h PRO 3274CO 0.69 0.51 0.26 0.93 -0.21 0.00 0.00 178.00 180.17 3hwc h GLU 3275N 0.79 0.63 -0.14 1.05 4.39 -1.96 -2.26 114.58 117.09 3hwc h GLU 3275Ca 0.54 -0.06 -0.14 0.00 0.34 0.00 0.00 59.36 60.04 3hwc h GLU 3275Cb 0.81 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 3hwc h GLU 3275CO -0.32 0.46 -0.53 1.25 -1.16 0.00 0.00 179.01 178.71 3hwc h HIS 3276N 0.64 0.48 0.00 4.33 2.76 -1.56 -2.95 115.15 118.85 3hwc h HIS 3276Ca 0.17 -0.16 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3hwc h HIS 3276Cb 0.00 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 28.87 3hwc h HIS 3276CO 0.00 0.83 0.00 0.00 -1.30 0.00 0.00 177.93 177.46 3hwc n ALA 3277N -2.49 2.40 0.09 5.26 0.00 -0.86 -3.13 120.51 121.79 3hwc n ALA 3277Ca -0.02 -0.15 -0.03 0.00 0.00 0.00 0.00 53.44 53.23 3hwc n ALA 3277Cb 0.58 -1.41 -0.06 0.00 0.00 0.00 0.00 19.45 18.56 3hwc n ALA 3277CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3hwc h LYS 3278N 0.00 0.00 0.00 0.00 1.57 -1.45 -2.49 116.57 114.19 3hwc h LYS 3278Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hwc h LYS 3278Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3hwc h LYS 3278CO 0.00 0.80 -0.53 1.47 -0.57 0.00 0.00 179.45 180.62 3hwc n LEU 3279N -3.31 0.00 0.11 2.94 -0.00 -1.23 -4.85 117.00 110.67 3hwc n LEU 3279Ca 0.01 0.00 -0.23 0.00 -0.00 0.00 0.00 56.01 55.79 3hwc n LEU 3279Cb 0.86 0.00 -0.15 0.00 -0.00 0.00 0.00 43.42 44.12 3hwc n LEU 3279CO 0.44 0.00 -0.32 1.88 -0.00 0.00 0.00 177.39 179.39 3hwc h TYR 3280N 0.00 0.81 0.00 1.47 -1.99 -1.78 -3.22 116.97 112.26 3hwc h TYR 3280Ca 0.00 -0.59 -0.01 0.00 2.00 0.00 0.00 58.73 60.13 3hwc h TYR 3280Cb 0.46 -0.03 -0.00 0.00 2.00 0.00 0.00 36.73 39.16 3hwc h TYR 3280CO 0.00 1.56 -0.05 -1.35 -0.00 0.00 0.00 178.16 178.32 3hwc h PRO 3281N 0.12 0.00 -0.38 4.88 0.11 -1.79 -1.75 132.00 133.19 3hwc h PRO 3281Ca -0.27 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.72 3hwc h PRO 3281Cb 2.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 33.22 3hwc h PRO 3281CO 0.23 0.05 -0.25 1.96 -0.21 0.00 0.00 178.00 179.78 3hwc h GLN 3282N 0.00 0.78 -0.23 1.05 7.50 -1.87 -2.36 115.11 119.98 3hwc h GLN 3282Ca -0.00 -0.33 -0.02 0.00 0.50 0.00 0.00 58.65 58.81 3hwc h GLN 3282Cb 0.10 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 27.58 3hwc h GLN 3282CO 0.01 0.94 0.07 0.00 -1.50 0.00 0.00 178.83 178.35 3hwc h ARG 3283N 0.67 0.32 -0.45 1.46 2.47 -1.34 -2.41 114.38 115.10 3hwc h ARG 3283Ca 0.09 -0.04 -0.09 0.00 -1.26 0.00 0.00 59.98 58.68 3hwc h ARG 3283Cb 0.77 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 29.01 3hwc h ARG 3283CO 0.06 0.29 -0.09 0.82 0.56 0.00 0.00 179.97 181.61 3hwc h ILE 3284N 0.32 1.26 -0.00 2.04 2.04 -1.06 -2.63 117.51 119.47 3hwc h ILE 3284Ca 0.08 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 64.79 3hwc h ILE 3284Cb 0.10 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 3hwc h ILE 3284CO -0.01 0.39 -0.12 0.49 0.00 0.00 0.00 178.15 178.90 3hwc n PHE 3285N -4.17 0.00 -0.03 1.37 3.01 -0.94 -4.13 117.46 112.56 3hwc n PHE 3285Ca 0.02 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.39 3hwc n PHE 3285Cb 0.36 -0.41 -0.02 0.00 -0.01 0.00 0.00 39.48 39.39 3hwc n PHE 3285CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 3hwc h ASP 3286N 0.04 -0.77 0.00 4.37 3.32 -1.09 0.28 116.42 122.56 3hwc h ASP 3286Ca 0.00 0.13 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 3hwc h ASP 3286Cb 0.48 0.36 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 3hwc h ASP 3286CO 0.00 -0.28 -0.33 -0.50 -1.72 0.00 0.00 179.24 176.41 3hwc h TRP 3287N -0.27 0.53 -0.33 4.55 4.06 -1.75 -1.89 115.95 120.85 3hwc h TRP 3287Ca 0.13 -0.13 -0.11 0.00 2.06 0.00 0.00 58.89 60.83 3hwc h TRP 3287Cb 0.46 -0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 28.48 3hwc h TRP 3287CO -0.38 0.74 -0.26 -0.24 -3.56 0.00 0.00 178.44 174.74 3hwc h VAL 3288N 0.40 1.27 -0.82 1.49 3.04 -1.69 -1.74 116.25 118.20 3hwc h VAL 3288Ca 0.05 -1.35 -0.04 0.00 -1.01 0.00 0.00 66.70 64.35 3hwc h VAL 3288Cb 0.77 1.30 -0.04 0.00 -2.01 0.00 0.00 31.29 31.32 3hwc h VAL 3288CO 0.06 0.44 0.37 0.45 -1.01 0.00 0.00 177.57 177.88 3hwc h HIS 3289N 0.57 1.21 -0.29 3.17 3.86 -0.53 0.07 115.15 123.22 3hwc h HIS 3289Ca 0.08 -0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 3hwc h HIS 3289Cb 0.74 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.83 3hwc h HIS 3289CO 0.03 0.89 0.10 -0.92 0.86 0.00 0.00 177.93 178.89 3hwc h TYR 3290N 1.18 0.45 -0.63 2.45 5.03 -1.17 -2.54 116.97 121.74 3hwc h TYR 3290Ca 0.28 -0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.54 3hwc h TYR 3290Cb 0.15 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.27 3hwc h TYR 3290CO 0.02 0.46 0.35 1.25 -1.32 0.00 0.00 178.16 178.92 3hwc h HIS 3291N 0.31 0.84 -0.23 -3.82 2.76 -0.98 -2.25 115.15 111.78 3hwc h HIS 3291Ca 0.09 -0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.28 3hwc h HIS 3291Cb 0.21 -0.27 -0.03 0.00 1.55 0.00 0.00 27.41 28.87 3hwc h HIS 3291CO -0.00 0.58 0.07 0.82 -1.30 0.00 0.00 177.93 178.10 3hwc h ILE 3292N 0.87 0.93 -0.35 6.26 2.04 -0.76 -1.81 117.51 124.69 3hwc h ILE 3292Ca 0.22 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 66.04 3hwc h ILE 3292Cb 0.01 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 3hwc h ILE 3292CO -0.04 0.03 0.19 0.25 0.00 0.00 0.00 178.15 178.58 3hwc h LEU 3293N 0.17 0.29 -0.76 1.44 5.85 -1.01 -0.01 115.31 121.28 3hwc h LEU 3293Ca 0.10 0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.97 3hwc h LEU 3293Cb 0.08 -0.05 -0.10 0.00 0.37 0.00 0.00 40.66 40.96 3hwc h LEU 3293CO -0.11 0.21 0.31 0.40 -0.34 0.00 0.00 178.44 178.91 3hwc h ILE 3294N 0.39 0.65 -0.21 4.05 2.04 -1.20 0.96 117.51 124.20 3hwc h ILE 3294Ca 0.14 -0.15 -0.10 0.00 1.00 0.00 0.00 64.86 65.75 3hwc h ILE 3294Cb 0.03 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.26 3hwc h ILE 3294CO -0.08 0.08 -0.30 -0.09 0.00 0.00 0.00 178.15 177.76 3hwc h ARG 3295N 0.45 0.41 -0.25 2.37 2.43 -0.60 -2.43 114.38 116.76 3hwc h ARG 3295Ca 0.42 -0.16 -0.18 0.00 -0.81 0.00 0.00 59.98 59.24 3hwc h ARG 3295Cb 0.64 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 3hwc h ARG 3295CO -0.41 0.67 -0.56 1.96 -1.51 0.00 0.00 179.97 180.12 3hwc h GLN 3296N 0.36 0.79 -0.51 0.20 4.20 0.70 -1.21 115.11 119.63 3hwc h GLN 3296Ca 0.05 -0.51 -0.04 0.00 0.06 0.00 0.00 58.65 58.21 3hwc h GLN 3296Cb 0.71 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 3hwc h GLN 3296CO 0.05 1.14 0.15 0.28 -0.67 0.00 0.00 178.83 179.79 3hwc h VAL 3297N 0.60 1.23 -0.22 -0.54 2.07 -0.80 -1.23 116.25 117.37 3hwc h VAL 3297Ca 0.01 -0.79 0.04 0.00 0.82 0.00 0.00 66.70 66.77 3hwc h VAL 3297Cb 1.16 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 3hwc h VAL 3297CO 0.12 0.29 0.00 -0.07 0.02 0.00 0.00 177.57 177.93 3hwc h LEU 3298N 0.70 -0.08 -0.91 2.57 4.07 -1.37 -1.50 115.31 118.80 3hwc h LEU 3298Ca 0.17 0.05 0.03 0.00 0.08 0.00 0.00 57.88 58.20 3hwc h LEU 3298Cb 0.29 0.08 -0.05 0.00 1.08 0.00 0.00 40.66 42.06 3hwc h LEU 3298CO -0.00 -0.01 0.59 -0.09 -1.08 0.00 0.00 178.44 177.85 3hwc h ARG 3299N 0.07 1.12 -0.72 1.13 9.65 -0.97 0.77 114.38 125.44 3hwc h ARG 3299Ca 0.10 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.92 3hwc h ARG 3299Cb 0.13 -0.25 -0.04 0.00 -1.39 0.00 0.00 29.97 28.42 3hwc h ARG 3299CO -0.17 0.74 0.47 0.00 2.80 0.00 0.00 179.97 183.81 3hwc h ALA 3300N 1.37 1.47 -0.43 2.80 0.00 -0.88 -0.96 119.26 122.63 3hwc h ALA 3300Ca 0.36 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.07 3hwc h ALA 3300Cb -0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3hwc h ALA 3300CO -0.12 0.48 -0.30 1.49 0.00 0.00 0.00 179.25 180.81 3hwc h GLU 3301N 0.98 0.95 -0.13 0.00 4.81 -0.06 -2.27 114.58 118.86 3hwc h GLU 3301Ca 0.26 -0.45 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 3hwc h GLU 3301Cb -0.10 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 3hwc h GLU 3301CO -0.06 1.11 0.07 1.25 -0.73 0.00 0.00 179.01 180.66 3hwc h LEU 3302N 0.80 0.12 -0.48 1.64 6.46 -0.40 -2.28 115.31 121.17 3hwc h LEU 3302Ca 0.09 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.84 3hwc h LEU 3302Cb 0.88 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.76 3hwc h LEU 3302CO 0.08 0.09 0.27 0.40 -0.62 0.00 0.00 178.44 178.66 3hwc h ILE 3303N 0.16 1.16 -0.59 4.05 2.04 -1.12 0.30 117.51 123.50 3hwc h ILE 3303Ca 0.05 -0.40 0.06 0.00 1.00 0.00 0.00 64.86 65.56 3hwc h ILE 3303Cb -0.00 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.57 3hwc h ILE 3303CO -0.02 0.17 0.30 0.58 0.00 0.00 0.00 178.15 179.18 3hwc h VAL 3304N 0.64 0.94 -0.60 1.67 2.07 -1.35 -1.55 116.25 118.08 3hwc h VAL 3304Ca 0.17 -0.20 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 3hwc h VAL 3304Cb 0.03 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 3hwc h VAL 3304CO -0.03 0.10 0.09 1.23 0.02 0.00 0.00 177.57 178.98 3hwc h GLY 3305N 0.57 1.04 1.01 2.17 0.00 -0.72 -1.54 103.07 105.60 3hwc h GLY 3305Ca 0.27 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 3hwc h GLY 3305CO -0.19 0.63 0.19 1.41 0.00 0.00 0.00 176.54 178.58 3hwc h LEU 3306N 0.91 0.90 -0.62 3.11 3.38 -0.60 -1.04 115.31 121.35 3hwc h LEU 3306Ca 0.18 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 3hwc h LEU 3306Cb 0.41 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3hwc h LEU 3306CO 0.01 0.87 0.15 0.00 0.09 0.00 0.00 178.44 179.56 3hwc h ALA 3307N 1.06 0.82 -0.49 1.53 0.00 -0.99 -1.36 119.26 119.83 3hwc h ALA 3307Ca 0.20 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3hwc h ALA 3307Cb 0.30 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3hwc h ALA 3307CO -0.01 0.53 -0.07 0.82 0.00 0.00 0.00 179.25 180.52 3hwc h ILE 3308N 0.91 1.27 0.09 0.00 2.04 -1.17 -1.86 117.51 118.79 3hwc h ILE 3308Ca 0.20 -1.19 -0.00 0.00 1.00 0.00 0.00 64.86 64.86 3hwc h ILE 3308Cb 0.35 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 3hwc h ILE 3308CO 0.00 0.41 -0.04 -0.07 0.00 0.00 0.00 178.15 178.45 3hwc h LEU 3309N 0.77 -0.10 -0.55 1.44 3.38 -1.01 -1.56 115.31 117.68 3hwc h LEU 3309Ca 0.13 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 3hwc h LEU 3309Cb 0.61 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 3hwc h LEU 3309CO 0.04 0.14 0.01 -0.29 0.09 0.00 0.00 178.44 178.42 3hwc h ILE 3310N -0.34 1.26 -0.07 1.22 6.09 -1.28 0.51 117.51 124.90 3hwc h ILE 3310Ca -0.01 -1.10 -0.12 0.00 -1.37 0.00 0.00 64.86 62.25 3hwc h ILE 3310Cb 0.29 0.89 -0.01 0.00 0.47 0.00 0.00 36.82 38.45 3hwc h ILE 3310CO 0.02 0.39 -0.50 0.71 -3.07 0.00 0.00 178.15 175.70 3hwc h THR 3311N 0.84 1.35 0.00 2.19 1.35 -1.37 -1.50 112.91 115.77 3hwc h THR 3311Ca 0.16 -1.73 -0.26 0.00 -0.55 0.00 0.00 66.41 64.02 3hwc h THR 3311Cb 0.53 1.85 0.02 0.00 -1.73 0.00 0.00 68.15 68.82 3hwc h THR 3311CO 0.03 0.51 -1.02 -0.33 -0.25 0.00 0.00 175.52 174.46 3hwc h GLU 3312N 0.15 0.63 -0.56 4.72 5.08 -1.11 0.92 114.58 124.41 3hwc h GLU 3312Ca 0.01 -0.68 -0.07 0.00 -1.00 0.00 0.00 59.36 57.62 3hwc h GLU 3312Cb 0.94 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 3hwc h GLU 3312CO 0.07 1.27 0.06 1.25 -1.00 0.00 0.00 179.01 180.67 3hwc h HIS 3313N 0.35 0.97 0.07 4.33 2.76 -0.75 -2.90 115.15 119.98 3hwc h HIS 3313Ca -0.12 -0.13 -0.26 0.00 -2.20 0.00 0.00 60.37 57.67 3hwc h HIS 3313Cb 1.67 -0.27 0.01 0.00 1.55 0.00 0.00 27.41 30.37 3hwc h HIS 3313CO 0.09 0.84 -1.12 0.82 -1.30 0.00 0.00 177.93 177.27 3hwc h ILE 3314N 0.86 1.40 0.00 6.26 2.04 -1.32 -3.35 117.51 123.40 3hwc h ILE 3314Ca 0.17 -2.65 0.00 0.00 1.00 0.00 0.00 64.86 63.39 3hwc h ILE 3314Cb 0.42 2.66 0.00 0.00 -0.74 0.00 0.00 36.82 39.16 3hwc h ILE 3314CO 0.01 0.79 0.00 0.61 0.00 0.00 0.00 178.15 179.56 3hwc n GLY 3315N 1.24 1.20 0.71 5.37 0.00 0.10 -4.61 105.19 109.20 3hwc n GLY 3315Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.05 3hwc n GLY 3315CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hwc n THR 3316N -1.58 0.00 0.29 2.61 -2.24 0.06 -4.54 114.28 108.88 3hwc n THR 3316Ca 0.00 -0.37 0.16 0.00 -2.27 0.00 0.00 64.05 61.57 3hwc n THR 3316Cb 0.00 1.18 0.91 0.00 -2.10 0.00 0.00 70.33 70.32 3hwc n THR 3316CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3hwc h SER 3317N 3.49 0.00 0.58 3.42 4.64 -1.81 -1.45 113.55 122.42 3hwc h SER 3317Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hwc h SER 3317Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 3hwc h SER 3317CO 0.00 0.03 -0.99 2.29 -0.87 0.00 0.00 176.83 177.29 3hwc n LYS 3318N -3.68 0.35 -1.69 4.77 -0.00 -1.26 -4.15 118.16 112.50 3hwc n LYS 3318Ca -0.03 0.02 -0.44 0.00 -0.00 0.00 0.00 58.31 57.86 3hwc n LYS 3318Cb 0.12 -1.64 -0.04 0.00 -0.00 0.00 0.00 35.03 33.47 3hwc n LYS 3318CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 3hwc n LEU 3319N -2.11 3.64 0.16 -5.58 4.32 -0.55 -4.84 117.00 112.05 3hwc n LEU 3319Ca 0.02 1.04 0.10 0.00 -0.02 0.00 0.00 56.01 57.14 3hwc n LEU 3319Cb 0.46 -1.49 0.61 0.00 -1.62 0.00 0.00 43.42 41.38 3hwc n LEU 3319CO 0.40 -0.01 1.11 -0.65 -1.22 0.00 0.00 177.39 177.02 3hwc h PRO 3320N 7.32 0.09 0.00 3.23 0.11 -1.89 0.11 132.00 140.97 3hwc h PRO 3320Ca -0.45 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 3hwc h PRO 3320Cb 1.23 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3hwc h PRO 3320CO 0.93 0.06 -0.32 1.79 -0.21 0.00 0.00 178.00 180.25 3hwc h THR 3321N 0.09 0.63 0.05 -1.15 1.35 -1.93 -2.45 112.91 109.50 3hwc h THR 3321Ca 0.08 -1.60 -0.17 0.00 -0.55 0.00 0.00 66.41 64.18 3hwc h THR 3321Cb 0.21 2.09 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 3hwc h THR 3321CO -0.01 0.32 -0.86 0.58 -0.25 0.00 0.00 175.52 175.30 3hwc h VAL 3322N 0.00 1.29 -0.96 6.82 2.07 -1.32 -3.17 116.25 120.99 3hwc h VAL 3322Ca -0.00 -2.34 0.19 0.00 0.82 0.00 0.00 66.70 65.37 3hwc h VAL 3322Cb 1.06 2.85 -0.11 0.00 -1.52 0.00 0.00 31.29 33.57 3hwc h VAL 3322CO 0.04 0.56 0.54 0.28 0.02 0.00 0.00 177.57 179.02 3hwc h SER 3323N -0.73 0.66 -0.54 0.57 0.02 -0.91 0.22 113.55 112.85 3hwc h SER 3323Ca -0.20 0.11 -0.09 0.00 -0.84 0.00 0.00 61.79 60.76 3hwc h SER 3323Cb 1.38 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.89 3hwc h SER 3323CO -0.03 0.22 -0.01 0.00 -1.14 0.00 0.00 176.83 175.87 3hwc h ALA 3324N 1.64 0.91 -0.48 3.77 0.00 -1.56 -0.59 119.26 122.95 3hwc h ALA 3324Ca 0.56 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 55.04 3hwc h ALA 3324Cb 0.89 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3hwc h ALA 3324CO -0.40 0.65 -0.19 0.00 0.00 0.00 0.00 179.25 179.30 3hwc h ARG 3325N 0.90 0.97 -0.30 0.00 3.08 -1.06 -2.83 114.38 115.15 3hwc h ARG 3325Ca 0.16 -0.40 -0.11 0.00 0.07 0.00 0.00 59.98 59.71 3hwc h ARG 3325Cb 0.54 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 3hwc h ARG 3325CO 0.03 1.07 -0.27 0.28 -1.07 0.00 0.00 179.97 180.01 3hwc h VAL 3326N 0.85 1.28 -0.95 2.04 2.07 -0.86 -2.55 116.25 118.12 3hwc h VAL 3326Ca 0.12 -1.36 0.10 0.00 0.82 0.00 0.00 66.70 66.37 3hwc h VAL 3326Cb 0.76 1.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.79 3hwc h VAL 3326CO 0.06 0.44 0.61 0.00 0.02 0.00 0.00 177.57 178.70 3hwc h ALA 3327N 1.18 1.55 -0.99 1.67 0.00 -0.97 -1.21 119.26 120.49 3hwc h ALA 3327Ca 0.07 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3hwc h ALA 3327Cb 0.74 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 3hwc h ALA 3327CO 0.06 0.26 0.66 0.87 0.00 0.00 0.00 179.25 181.09 3hwc h LYS 3328N 0.98 1.27 -0.35 0.00 1.57 -1.21 0.30 116.57 119.13 3hwc h LYS 3328Ca 0.44 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 59.02 3hwc h LYS 3328Cb 0.37 -0.29 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 3hwc h LYS 3328CO -0.20 0.84 -0.24 -0.07 -0.57 0.00 0.00 179.45 179.21 3hwc h LEU 3329N 1.31 0.83 -0.80 2.94 4.07 -1.20 -1.75 115.31 120.70 3hwc h LEU 3329Ca 0.38 -0.43 -0.06 0.00 0.08 0.00 0.00 57.88 57.84 3hwc h LEU 3329Cb -0.09 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.39 3hwc h LEU 3329CO -0.10 1.08 0.22 0.58 -1.08 0.00 0.00 178.44 179.14 3hwc h VAL 3330N 0.57 1.26 -0.90 1.22 2.07 -0.88 -1.82 116.25 117.77 3hwc h VAL 3330Ca 0.07 -0.90 0.04 0.00 0.82 0.00 0.00 66.70 66.73 3hwc h VAL 3330Cb 0.81 0.48 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 3hwc h VAL 3330CO 0.07 0.35 0.58 0.00 0.02 0.00 0.00 177.57 178.59 3hwc h ALA 3331N 1.16 1.21 -0.29 1.67 0.00 -0.22 -1.20 119.26 121.58 3hwc h ALA 3331Ca 0.23 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 3hwc h ALA 3331Cb 0.31 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3hwc h ALA 3331CO -0.01 0.41 -0.13 0.35 0.00 0.00 0.00 179.25 179.88 3hwc h PHE 3332N 1.11 0.70 -0.23 0.00 3.57 -0.80 -1.62 116.94 119.66 3hwc h PHE 3332Ca 0.37 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.70 3hwc h PHE 3332Cb 0.05 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 3hwc h PHE 3332CO -0.02 0.83 0.15 1.25 -2.23 0.00 0.00 178.31 178.29 3hwc h HIS 3333N 0.36 0.30 -0.11 0.41 2.76 -1.11 -1.06 115.15 116.70 3hwc h HIS 3333Ca 0.07 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.20 3hwc h HIS 3333Cb 0.64 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.50 3hwc h HIS 3333CO 0.06 0.21 -0.10 -0.07 -1.30 0.00 0.00 177.93 176.72 3hwc h LEU 3334N 0.30 0.16 -0.16 0.26 3.38 -1.17 0.23 115.31 118.31 3hwc h LEU 3334Ca 0.08 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 3hwc h LEU 3334Cb -0.01 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3hwc h LEU 3334CO -0.02 0.29 -0.32 0.00 0.09 0.00 0.00 178.44 178.48 3hwc h ALA 3335N 1.74 0.26 -0.23 1.53 0.00 -0.98 0.15 119.26 121.72 3hwc h ALA 3335Ca 0.04 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 3hwc h ALA 3335Cb 0.29 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3hwc h ALA 3335CO 0.02 0.29 0.14 0.52 0.00 0.00 0.00 179.25 180.21 3hwc h MET 3336N 0.13 0.31 -0.86 0.00 2.86 -0.69 -2.65 114.93 114.03 3hwc h MET 3336Ca 0.01 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 3hwc h MET 3336Cb 0.91 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.47 3hwc h MET 3336CO 0.07 0.26 0.46 0.37 1.06 0.00 0.00 176.91 179.13 3hwc h GLN 3337N 0.28 1.22 -0.50 1.72 4.15 -0.56 -2.12 115.11 119.30 3hwc h GLN 3337Ca 0.08 -0.15 -0.00 0.00 0.77 0.00 0.00 58.65 59.35 3hwc h GLN 3337Cb 0.03 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.46 3hwc h GLN 3337CO -0.01 0.90 0.30 0.00 -1.93 0.00 0.00 178.83 178.09 3hwc h ALA 3338N 1.28 0.64 -0.79 3.38 0.00 -0.79 0.51 119.26 123.50 3hwc h ALA 3338Ca 0.30 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 3hwc h ALA 3338Cb 0.05 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 3hwc h ALA 3338CO -0.05 0.12 0.48 0.45 0.00 0.00 0.00 179.25 180.26 3hwc h HIS 3339N 0.67 1.03 0.74 0.00 3.86 -1.26 0.20 115.15 120.39 3hwc h HIS 3339Ca 0.18 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.36 3hwc h HIS 3339Cb -0.01 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.12 3hwc h HIS 3339CO -0.03 0.69 -0.47 1.25 0.86 0.00 0.00 177.93 180.23 3hwc h LEU 3340N 1.08 -1.21 -0.49 2.43 6.46 -0.71 -1.61 115.31 121.26 3hwc h LEU 3340Ca 0.28 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 58.13 3hwc h LEU 3340Cb -0.05 0.36 -0.03 0.00 -0.73 0.00 0.00 40.66 40.21 3hwc h LEU 3340CO -0.05 -0.72 0.30 0.40 -0.62 0.00 0.00 178.44 177.75 3hwc h ILE 3341N -1.14 1.07 -0.56 4.05 2.04 -0.81 -2.68 117.51 119.47 3hwc h ILE 3341Ca -0.10 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.52 3hwc h ILE 3341Cb 0.92 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 3hwc h ILE 3341CO 0.08 0.11 0.20 0.00 0.00 0.00 0.00 178.15 178.55 3hwc h ALA 3342N 1.21 1.30 -0.11 1.87 0.00 -0.91 -2.36 119.26 120.26 3hwc h ALA 3342Ca 0.19 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 3hwc h ALA 3342Cb -0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3hwc h ALA 3342CO -0.08 0.51 -0.38 0.66 0.00 0.00 0.00 179.25 179.96 3hwc h SER 3343N 0.81 0.23 0.91 0.00 4.64 -0.97 -2.86 113.55 116.32 3hwc h SER 3343Ca 0.19 -0.09 -0.11 0.00 -0.47 0.00 0.00 61.79 61.31 3hwc h SER 3343Cb 0.19 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 3hwc h SER 3343CO -0.01 0.60 -0.51 -0.33 -0.87 0.00 0.00 176.83 175.70 3hwc h GLU 3344N 0.19 0.00 0.00 4.77 5.08 -1.18 0.45 114.58 123.89 3hwc h GLU 3344Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3hwc h GLU 3344Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 3hwc h GLU 3344CO 0.06 0.51 -0.35 0.39 -1.00 0.00 0.00 179.01 178.62 3hwc n GLU 3345N -3.52 0.13 -1.34 2.33 -0.58 -0.95 -4.11 120.64 112.59 3hwc n GLU 3345Ca -0.00 0.06 -0.02 0.00 -0.42 0.00 0.00 57.16 56.78 3hwc n GLU 3345Cb 0.61 -1.61 0.11 0.00 -0.57 0.00 0.00 31.44 29.99 3hwc n GLU 3345CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3hwc n THR 3346N -1.81 1.69 -0.41 2.62 -2.24 -1.11 -5.06 114.28 107.95 3hwc n THR 3346Ca 0.05 -2.93 0.00 0.00 -2.27 0.00 0.00 64.05 58.90 3hwc n THR 3346Cb 0.38 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 3hwc n THR 3346CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hwc n GLY 3347N -0.62 -0.60 3.65 3.38 0.00 -1.21 -4.25 105.19 105.53 3hwc n GLY 3347Ca 0.20 -1.68 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 3hwc n GLY 3347CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hwc s PHE 3348N -0.07 -0.06 -0.13 1.61 -0.12 -0.56 -4.91 117.98 113.75 3hwc s PHE 3348Ca 0.00 -0.32 -0.07 0.00 -0.05 0.00 0.00 56.93 56.48 3hwc s PHE 3348Cb 0.00 0.46 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 3hwc s PHE 3348CO 0.00 -1.04 0.13 -1.01 -0.05 0.00 0.00 175.22 173.25 3hwc s HIS 3349N -3.92 3.56 0.97 3.49 3.76 -1.26 -0.60 115.29 121.30 3hwc s HIS 3349Ca 0.12 0.49 -0.16 0.00 -0.15 0.00 0.00 55.06 55.36 3hwc s HIS 3349Cb -0.03 -1.97 0.20 0.00 1.11 0.00 0.00 32.58 31.90 3hwc s HIS 3349CO 0.03 0.67 1.30 0.95 -0.85 0.00 0.00 174.74 176.84 3hwc s THR 3350N -0.83 1.97 0.33 1.30 -4.23 -0.15 -4.89 115.64 109.13 3hwc s THR 3350Ca 0.14 0.00 0.02 0.00 -1.18 0.00 0.00 61.69 60.67 3hwc s THR 3350Cb -0.12 -2.97 0.28 0.00 1.34 0.00 0.00 72.50 71.03 3hwc s THR 3350CO 0.03 0.00 1.96 0.11 -0.54 0.00 0.00 174.62 176.18 3hwc h LYS 3351N -1.68 0.92 0.00 3.99 1.79 -1.90 -1.00 116.57 118.68 3hwc h LYS 3351Ca -0.45 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 3hwc h LYS 3351Cb 1.24 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 31.68 3hwc h LYS 3351CO 0.39 0.61 0.00 0.41 -1.08 0.00 0.00 179.45 179.78 3hwc n GLY 3352N -1.42 -0.63 1.82 3.86 0.00 -1.25 -4.82 105.19 102.75 3hwc n GLY 3352Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3hwc n GLY 3352CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hwc n GLY 3353N -0.07 0.54 3.73 -0.02 0.00 -0.38 -5.02 105.19 103.96 3hwc n GLY 3353Ca 0.09 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 3hwc n GLY 3353CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hwc s ARG 3354N -0.22 4.45 -0.34 1.61 0.52 -1.26 -4.60 118.95 119.12 3hwc s ARG 3354Ca 0.00 0.96 -0.29 0.00 -0.52 0.00 0.00 55.73 55.88 3hwc s ARG 3354Cb 0.00 -3.42 0.02 0.00 0.52 0.00 0.00 34.95 32.07 3hwc s ARG 3354CO 0.00 0.13 1.08 -0.47 0.02 0.00 0.00 175.30 176.06 3hwc s TYR 3355N 0.53 3.11 -0.05 -0.53 6.14 -0.11 -0.98 117.35 125.46 3hwc s TYR 3355Ca 0.38 1.14 -0.03 0.00 0.64 0.00 0.00 57.07 59.21 3hwc s TYR 3355Cb -0.19 -3.77 -0.04 0.00 0.42 0.00 0.00 41.96 38.39 3hwc s TYR 3355CO 0.20 -0.82 0.10 0.15 0.64 0.00 0.00 175.55 175.82 3hwc s LYS 3356N 3.74 3.21 0.79 4.97 1.02 0.24 -4.81 119.74 128.89 3hwc s LYS 3356Ca 0.46 -0.35 -0.11 0.00 0.02 0.00 0.00 55.97 55.99 3hwc s LYS 3356Cb -0.12 -2.98 0.07 0.00 -0.52 0.00 0.00 37.83 34.28 3hwc s LYS 3356CO 0.17 0.70 1.09 -2.14 -0.92 0.00 0.00 175.35 174.25 3hwc s PRO 3357N -1.43 2.13 -0.27 -1.68 0.02 -1.26 -1.49 135.00 131.01 3hwc s PRO 3357Ca 0.20 1.11 -0.29 0.00 0.02 0.00 0.00 61.00 62.04 3hwc s PRO 3357Cb -0.12 -1.89 -0.02 0.00 0.02 0.00 0.00 34.50 32.49 3hwc s PRO 3357CO 0.10 -1.72 1.67 1.21 -0.33 0.00 0.00 177.00 177.93 3hwc s ASN 3358N -3.41 6.19 0.24 2.53 3.04 0.16 -4.77 114.94 118.91 3hwc s ASN 3358Ca 0.61 1.45 -0.03 0.00 0.04 0.00 0.00 52.86 54.93 3hwc s ASN 3358Cb -0.17 -2.53 0.26 0.00 -1.54 0.00 0.00 41.25 37.27 3hwc s ASN 3358CO 0.56 -1.44 1.70 -0.65 -3.04 0.00 0.00 177.10 174.23 3hwc h PRO 3359N 11.54 0.79 -0.92 0.43 0.11 -1.92 -1.50 132.00 140.52 3hwc h PRO 3359Ca -0.33 -0.26 0.05 0.00 0.11 0.00 0.00 66.00 65.57 3hwc h PRO 3359Cb 1.16 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.14 3hwc h PRO 3359CO 1.02 0.86 0.59 1.25 -0.21 0.00 0.00 178.00 181.51 3hwc h LEU 3360N 0.72 0.96 0.18 2.35 5.85 -1.99 -0.56 115.31 122.82 3hwc h LEU 3360Ca 0.12 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.59 3hwc h LEU 3360Cb 0.57 -0.20 0.02 0.00 0.37 0.00 0.00 40.66 41.42 3hwc h LEU 3360CO 0.04 0.63 -1.17 0.40 -0.34 0.00 0.00 178.44 178.00 3hwc h ILE 3361N 1.11 1.34 0.00 4.05 2.04 -1.85 -2.92 117.51 121.27 3hwc h ILE 3361Ca 0.39 -2.57 -0.06 0.00 1.00 0.00 0.00 64.86 63.62 3hwc h ILE 3361Cb 0.09 3.06 -0.01 0.00 -0.74 0.00 0.00 36.82 39.22 3hwc h ILE 3361CO -0.15 0.75 -0.27 0.10 0.00 0.00 0.00 178.15 178.59 3hwc h TYR 3362N -0.17 0.00 -0.01 1.37 -0.00 -1.28 -1.34 116.97 115.54 3hwc h TYR 3362Ca -0.21 0.00 -0.22 0.00 0.00 0.00 0.00 58.73 58.30 3hwc h TYR 3362Cb 1.85 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 38.58 3hwc h TYR 3362CO 0.16 0.27 -0.91 -0.44 -0.00 0.00 0.00 178.16 177.24 3hwc h ASP 3363N 0.00 0.47 0.63 0.10 3.45 -1.20 -1.38 116.42 118.50 3hwc h ASP 3363Ca -0.00 -0.37 -0.14 0.00 0.43 0.00 0.00 57.03 56.94 3hwc h ASP 3363Cb 1.02 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.62 3hwc h ASP 3363CO 0.03 1.17 -0.66 -0.26 -1.57 0.00 0.00 179.24 177.95 3hwc h PHE 3364N 0.21 0.03 -0.41 4.55 0.04 -1.46 -1.68 116.94 118.22 3hwc h PHE 3364Ca -0.07 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.70 3hwc h PHE 3364Cb 1.54 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 39.65 3hwc h PHE 3364CO 0.05 0.68 0.24 0.78 -0.60 0.00 0.00 178.31 179.46 3hwc h GLY 3365N 1.93 0.57 0.91 -1.45 0.00 -1.12 -0.29 103.07 103.62 3hwc h GLY 3365Ca -0.01 -0.18 0.02 0.00 0.00 0.00 0.00 47.33 47.16 3hwc h GLY 3365CO 0.09 0.16 0.34 3.21 0.00 0.00 0.00 176.54 180.34 3hwc h ARG 3366N 0.49 0.67 -0.45 4.80 3.08 -1.02 -2.28 114.38 119.68 3hwc h ARG 3366Ca 0.16 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 3hwc h ARG 3366Cb 0.00 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 3hwc h ARG 3366CO -0.07 0.44 0.19 0.00 -1.07 0.00 0.00 179.97 179.46 3hwc h ALA 3367N 1.23 1.49 -0.49 0.04 0.00 -0.90 -1.89 119.26 118.75 3hwc h ALA 3367Ca 0.22 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 3hwc h ALA 3367Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3hwc h ALA 3367CO -0.08 0.40 -0.02 1.25 0.00 0.00 0.00 179.25 180.79 3hwc h HIS 3368N 0.63 0.90 -0.26 0.00 -0.00 -0.51 -1.60 115.15 114.31 3hwc h HIS 3368Ca 0.16 -0.14 -0.04 0.00 -0.00 0.00 0.00 60.37 60.35 3hwc h HIS 3368Cb 0.11 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.27 3hwc h HIS 3368CO 0.01 0.84 0.02 0.35 -0.00 0.00 0.00 177.93 179.14 3hwc h PHE 3369N 0.77 0.48 -0.30 5.26 3.57 -0.95 -2.69 116.94 123.08 3hwc h PHE 3369Ca 0.14 -0.08 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 3hwc h PHE 3369Cb 0.50 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 3hwc h PHE 3369CO 0.03 0.58 0.01 -0.07 -2.23 0.00 0.00 178.31 176.63 3hwc h LEU 3370N 0.23 0.42 0.00 0.59 3.38 -1.09 -1.04 115.31 117.81 3hwc h LEU 3370Ca 0.08 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3hwc h LEU 3370Cb 0.38 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3hwc h LEU 3370CO 0.01 0.48 -0.36 0.00 0.09 0.00 0.00 178.44 178.66 3hwc n GLN 3371N -4.31 0.03 0.00 1.13 6.02 -0.63 -4.14 117.38 115.48 3hwc n GLN 3371Ca 0.01 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 3hwc n GLN 3371Cb 0.22 -1.52 0.00 0.00 1.02 0.00 0.00 30.24 29.96 3hwc n GLN 3371CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3hwc n ASN 3372N -1.56 0.58 0.20 1.08 5.03 -1.00 -4.76 115.26 114.83 3hwc n ASN 3372Ca 0.06 -0.82 0.07 0.00 0.87 0.00 0.00 54.58 54.75 3hwc n ASN 3372Cb 0.35 0.26 0.43 0.00 -1.02 0.00 0.00 39.78 39.79 3hwc n ASN 3372CO 0.00 0.00 0.00 0.06 -1.83 0.00 0.00 177.26 175.49 3hwc h GLN 3373N 0.00 0.00 -0.25 3.52 3.07 -1.36 -1.46 115.11 118.63 3hwc h GLN 3373Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 58.55 3hwc h GLN 3373Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.62 3hwc h GLN 3373CO 0.00 0.31 -0.60 0.52 0.09 0.00 0.00 178.83 179.15 3hwc h MET 3374N 0.00 0.85 -0.22 0.06 2.86 -1.85 0.76 114.93 117.38 3hwc h MET 3374Ca -0.00 -0.58 -0.06 0.00 -2.06 0.00 0.00 59.70 57.00 3hwc h MET 3374Cb 0.73 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.46 3hwc h MET 3374CO 0.04 1.21 -0.12 1.03 1.06 0.00 0.00 176.91 180.12 3hwc h SER 3375N 0.62 0.35 0.06 1.22 0.87 -1.79 -0.36 113.55 114.53 3hwc h SER 3375Ca -0.00 -0.08 -0.20 0.00 -1.23 0.00 0.00 61.79 60.27 3hwc h SER 3375Cb 1.22 -0.09 0.02 0.00 -0.44 0.00 0.00 62.40 63.10 3hwc h SER 3375CO 0.13 0.51 -0.82 0.58 -0.53 0.00 0.00 176.83 176.70 3hwc h VAL 3376N 0.34 1.40 -0.28 2.23 2.07 -1.15 -2.12 116.25 118.75 3hwc h VAL 3376Ca 0.07 -2.28 0.05 0.00 0.82 0.00 0.00 66.70 65.36 3hwc h VAL 3376Cb 0.43 2.74 -0.05 0.00 -1.52 0.00 0.00 31.29 32.89 3hwc h VAL 3376CO 0.02 0.67 -0.03 -0.03 0.02 0.00 0.00 177.57 178.23 3hwc h MET 3377N -0.05 0.05 -0.97 1.57 -1.53 -0.72 -1.84 114.93 111.45 3hwc h MET 3377Ca -0.12 -0.00 0.03 0.00 -3.44 0.00 0.00 59.70 56.17 3hwc h MET 3377Cb 1.55 -0.01 -0.06 0.00 -0.55 0.00 0.00 31.60 32.53 3hwc h MET 3377CO 0.16 0.03 0.63 -0.92 0.14 0.00 0.00 176.91 176.95 3hwc h TYR 3378N 0.05 1.19 -0.39 1.39 5.03 -1.08 -1.33 116.97 121.82 3hwc h TYR 3378Ca 0.13 0.03 -0.15 0.00 2.58 0.00 0.00 58.73 61.32 3hwc h TYR 3378Cb 0.19 -0.40 -0.01 0.00 1.55 0.00 0.00 36.73 38.06 3hwc h TYR 3378CO -0.24 0.69 -0.35 1.49 -1.32 0.00 0.00 178.16 178.43 3hwc h GLU 3379N 1.23 0.92 -0.17 1.82 4.57 -0.98 -1.76 114.58 120.21 3hwc h GLU 3379Ca 0.38 -0.46 -0.05 0.00 -1.18 0.00 0.00 59.36 58.05 3hwc h GLU 3379Cb -0.01 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.58 3hwc h GLU 3379CO -0.12 1.12 -0.08 1.25 -1.18 0.00 0.00 179.01 180.00 3hwc h LEU 3380N 0.76 0.36 -1.01 1.64 5.85 -1.02 -2.60 115.31 119.29 3hwc h LEU 3380Ca 0.07 -0.41 0.04 0.00 0.84 0.00 0.00 57.88 58.42 3hwc h LEU 3380Cb 0.93 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.81 3hwc h LEU 3380CO 0.09 0.69 0.66 -0.07 -0.34 0.00 0.00 178.44 179.47 3hwc h LEU 3381N 0.04 1.10 -1.05 2.25 3.38 -1.23 -0.99 115.31 118.81 3hwc h LEU 3381Ca 0.04 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 3hwc h LEU 3381Cb 0.55 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3hwc h LEU 3381CO 0.02 0.76 -0.20 -0.78 0.09 0.00 0.00 178.44 178.33 3hwc h ASP 3382N 1.28 0.43 0.62 -0.43 3.58 -1.25 -1.90 116.42 118.75 3hwc h ASP 3382Ca 0.40 -0.13 -0.22 0.00 0.42 0.00 0.00 57.03 57.50 3hwc h ASP 3382Cb -0.01 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 3hwc h ASP 3382CO -0.12 0.65 -0.99 -0.07 -2.88 0.00 0.00 179.24 175.83 3hwc h LEU 3383N 0.40 0.29 -0.26 2.28 3.38 -1.00 -3.29 115.31 117.11 3hwc h LEU 3383Ca 0.07 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.67 3hwc h LEU 3383Cb 0.58 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3hwc h LEU 3383CO 0.04 1.11 -0.47 0.00 0.09 0.00 0.00 178.44 179.21 3hwc h ALA 3384N 0.86 0.75 -0.94 1.53 0.00 -0.96 -3.45 119.26 117.05 3hwc h ALA 3384Ca -0.06 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3hwc h ALA 3384Cb 1.66 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.37 3hwc h ALA 3384CO 0.15 0.59 0.00 0.41 0.00 0.00 0.00 179.25 180.40 3hwc n GLY 3385N 0.96 3.17 0.19 0.00 0.00 -0.74 -2.55 105.19 106.23 3hwc n GLY 3385Ca 0.01 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 45.93 3hwc n GLY 3385CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3hwc h ARG 3386N 0.00 0.00 0.00 1.61 0.11 -1.93 -3.17 114.38 111.00 3hwc h ARG 3386Ca 0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 3hwc h ARG 3386Cb 0.00 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.08 3hwc h ARG 3386CO 0.00 0.00 -0.05 0.77 0.10 0.00 0.00 179.97 180.79 3hwc h SER 3387N 0.00 0.00 0.32 0.08 0.02 -1.80 0.19 113.55 112.36 3hwc h SER 3387Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3hwc h SER 3387Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 3hwc h SER 3387CO 0.00 0.05 -0.39 -1.54 -1.14 0.00 0.00 176.83 173.81 3hwc n SER 3388N -3.37 0.87 0.03 3.07 3.41 -1.20 -4.39 113.62 112.04 3hwc n SER 3388Ca -0.02 -0.68 -0.01 0.00 -0.26 0.00 0.00 58.87 57.91 3hwc n SER 3388Cb 0.19 0.23 -0.00 0.00 -0.26 0.00 0.00 64.21 64.37 3hwc n SER 3388CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3hwc n LEU 3389N -0.99 1.10 -3.76 1.04 7.94 -0.69 -4.53 117.00 117.11 3hwc n LEU 3389Ca 0.09 0.15 -0.42 0.00 -1.11 0.00 0.00 56.01 54.72 3hwc n LEU 3389Cb 0.35 -0.35 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3hwc n LEU 3389CO 0.30 -0.69 2.62 0.23 -1.11 0.00 0.00 177.39 178.75 3hwc n MET 3390N -3.50 2.91 -3.44 1.96 2.81 0.59 -4.92 117.12 113.53 3hwc n MET 3390Ca -0.01 -2.68 -0.39 0.00 -1.81 0.00 0.00 57.70 52.82 3hwc n MET 3390Cb 0.05 -3.27 -0.09 0.00 -0.71 0.00 0.00 33.22 29.19 3hwc n MET 3390CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3hwc s ILE 3391N 3.06 5.21 0.08 2.02 1.01 -1.26 -4.78 121.20 126.54 3hwc s ILE 3391Ca 0.47 0.51 -0.30 0.00 0.00 0.00 0.00 60.65 61.32 3hwc s ILE 3391Cb 0.13 -3.67 -0.06 0.00 0.01 0.00 0.00 42.46 38.88 3hwc s ILE 3391CO -0.08 0.20 1.13 -2.84 0.00 0.00 0.00 174.94 173.35 3hwc s PRO 3392N 1.85 4.50 1.03 2.79 0.02 -1.26 -5.04 135.00 138.89 3hwc s PRO 3392Ca 0.14 1.69 -0.12 0.00 0.02 0.00 0.00 61.00 62.73 3hwc s PRO 3392Cb -0.15 -3.35 0.21 0.00 0.02 0.00 0.00 34.50 31.22 3hwc s PRO 3392CO 0.09 -0.14 1.07 -1.12 -0.33 0.00 0.00 177.00 176.58 3hwc s SER 3393N 0.78 2.10 0.21 2.53 0.01 -1.26 -4.72 113.70 113.35 3hwc s SER 3393Ca 0.55 1.65 -0.09 0.00 1.31 0.00 0.00 55.95 59.36 3hwc s SER 3393Cb -0.28 -2.31 0.22 0.00 0.21 0.00 0.00 66.02 63.87 3hwc s SER 3393CO 0.30 -3.52 1.83 -0.33 0.41 0.00 0.00 173.24 171.93 3hwc h GLU 3394N -2.16 0.76 -0.36 12.44 4.39 -1.96 -0.44 114.58 127.25 3hwc h GLU 3394Ca -0.54 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.15 3hwc h GLU 3394Cb 1.31 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.75 3hwc h GLU 3394CO 0.50 0.50 0.13 0.78 -1.16 0.00 0.00 179.01 179.77 3hwc h GLY 3395N 0.79 0.46 0.78 -3.84 0.00 -1.97 0.15 103.07 99.45 3hwc h GLY 3395Ca 0.29 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 3hwc h GLY 3395CO -0.14 0.04 0.01 1.46 0.00 0.00 0.00 176.54 177.91 3hwc h GLN 3396N 0.29 0.08 -0.99 4.80 4.20 -1.80 -0.96 115.11 120.74 3hwc h GLN 3396Ca 0.16 -0.02 0.14 0.00 0.06 0.00 0.00 58.65 58.99 3hwc h GLN 3396Cb 0.13 -0.01 -0.09 0.00 0.30 0.00 0.00 27.48 27.81 3hwc h GLN 3396CO -0.16 0.29 0.62 2.35 -0.67 0.00 0.00 178.83 181.26 3hwc h TRP 3397N -0.15 1.08 -0.01 2.96 2.91 -0.88 -2.43 115.95 119.43 3hwc h TRP 3397Ca 0.02 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.07 3hwc h TRP 3397Cb 0.25 -0.34 0.00 0.00 -0.51 0.00 0.00 29.16 28.56 3hwc h TRP 3397CO 0.01 0.37 -0.26 -0.25 -1.03 0.00 0.00 178.44 177.28 3hwc n ASP 3398N -4.64 1.44 -4.62 2.65 8.00 0.02 -4.45 116.55 114.95 3hwc n ASP 3398Ca 0.20 -1.19 -0.47 0.00 0.71 0.00 0.00 54.79 54.04 3hwc n ASP 3398Cb 0.43 0.19 -0.04 0.00 -0.02 0.00 0.00 41.12 41.68 3hwc n ASP 3398CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3hwc n ASP 3399N -0.27 2.00 -0.01 -2.24 4.64 -0.38 -4.84 116.55 115.45 3hwc n ASP 3399Ca 0.13 1.14 -0.08 0.00 -1.38 0.00 0.00 54.79 54.59 3hwc n ASP 3399Cb 0.39 -1.31 0.08 0.00 -1.04 0.00 0.00 41.12 39.25 3hwc n ASP 3399CO 0.00 0.00 0.00 0.77 -0.82 0.00 0.00 177.20 177.15 3hwc h SER 3400N 3.87 0.61 0.31 1.67 4.64 -1.90 -0.20 113.55 122.55 3hwc h SER 3400Ca -0.44 -0.29 -0.33 0.00 -0.47 0.00 0.00 61.79 60.25 3hwc h SER 3400Cb 1.31 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 63.21 3hwc h SER 3400CO 0.73 0.98 -1.79 0.06 -0.87 0.00 0.00 176.83 175.94 3hwc h GLN 3401N 0.46 0.20 -0.00 4.77 3.07 -1.98 -3.41 115.11 118.21 3hwc h GLN 3401Ca 0.03 -0.33 0.00 0.00 0.09 0.00 0.00 58.65 58.43 3hwc h GLN 3401Cb 0.98 0.12 0.00 0.00 0.08 0.00 0.00 27.48 28.66 3hwc h GLN 3401CO 0.09 1.00 -0.13 0.43 0.09 0.00 0.00 178.83 180.30 3hwc n SER 3402N -3.36 0.67 -0.21 0.06 7.64 -1.25 -4.70 113.62 112.47 3hwc n SER 3402Ca -0.24 -0.83 0.10 0.00 1.01 0.00 0.00 58.87 58.91 3hwc n SER 3402Cb 1.05 0.63 0.39 0.00 -1.01 0.00 0.00 64.21 65.26 3hwc n SER 3402CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3hwc h GLY 3403N 1.05 1.00 2.00 0.23 0.00 -1.18 -2.24 103.07 103.93 3hwc h GLY 3403Ca 0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 3hwc h GLY 3403CO 0.00 0.15 -0.02 0.06 0.00 0.00 0.00 176.54 176.73 3hwc h GLN 3404N 0.67 0.00 -0.34 4.80 -0.00 -1.81 -1.93 115.11 116.49 3hwc h GLN 3404Ca 0.37 0.00 -0.07 0.00 -0.00 0.00 0.00 58.65 58.95 3hwc h GLN 3404Cb 0.53 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.99 3hwc h GLN 3404CO -0.14 0.02 -0.07 -1.49 -0.00 0.00 0.00 178.83 177.15 3hwc h TRP 3405N 0.00 0.60 -0.06 0.06 4.06 -1.75 -2.40 115.95 116.46 3hwc h TRP 3405Ca -0.00 -0.08 -0.18 0.00 2.06 0.00 0.00 58.89 60.69 3hwc h TRP 3405Cb 0.29 -0.17 -0.01 0.00 -1.00 0.00 0.00 29.16 28.27 3hwc h TRP 3405CO 0.00 0.63 -0.72 0.74 -3.56 0.00 0.00 178.44 175.52 3hwc h PHE 3406N 0.53 0.46 -0.44 0.49 -1.00 -1.50 0.00 116.94 115.49 3hwc h PHE 3406Ca 0.10 -0.20 -0.00 0.00 2.81 0.00 0.00 57.97 60.68 3hwc h PHE 3406Cb 0.45 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 39.91 3hwc h PHE 3406CO 0.02 0.95 0.27 0.28 -1.61 0.00 0.00 178.31 178.21 3hwc h VAL 3407N 0.23 1.14 -0.20 -0.55 2.07 -1.49 -2.03 116.25 115.42 3hwc h VAL 3407Ca -0.03 -0.30 -0.14 0.00 0.82 0.00 0.00 66.70 67.05 3hwc h VAL 3407Cb 1.29 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 3hwc h VAL 3407CO 0.12 0.14 -0.47 0.11 0.02 0.00 0.00 177.57 177.49 3hwc h LYS 3408N 0.59 0.50 -0.07 1.57 1.57 -1.28 -2.35 116.57 117.10 3hwc h LYS 3408Ca 0.16 -0.28 -0.06 0.00 -1.87 0.00 0.00 60.65 58.59 3hwc h LYS 3408Cb -0.01 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3hwc h LYS 3408CO -0.03 0.87 -0.25 -0.07 -0.57 0.00 0.00 179.45 179.40 3hwc h LEU 3409N 0.40 0.12 -2.73 2.94 3.38 -0.85 -3.15 115.31 115.42 3hwc h LEU 3409Ca 0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3hwc h LEU 3409Cb 0.97 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.69 3hwc h LEU 3409CO 0.09 0.38 0.00 0.59 0.09 0.00 0.00 178.44 179.59 3hwc n ASN 3410N -4.20 3.31 -4.81 -0.43 3.02 -0.78 -5.00 115.26 106.38 3hwc n ASN 3410Ca -0.01 -1.97 -0.33 0.00 -0.03 0.00 0.00 54.58 52.23 3hwc n ASN 3410Cb 0.33 -0.32 -0.03 0.00 -0.61 0.00 0.00 39.78 39.16 3hwc n ASN 3410CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3hwc s ASN 3411N -1.03 6.34 0.26 6.41 2.47 -0.90 -4.39 114.94 124.09 3hwc s ASN 3411Ca 0.33 1.83 -0.09 0.00 0.42 0.00 0.00 52.86 55.35 3hwc s ASN 3411Cb 0.18 -2.54 0.04 0.00 -1.45 0.00 0.00 41.25 37.47 3hwc s ASN 3411CO 0.23 -0.78 0.50 0.61 -3.72 0.00 0.00 177.10 173.94 3hwc n GLY 3412N -0.63 1.40 0.33 1.21 0.00 -1.26 -4.98 105.19 101.27 3hwc n GLY 3412Ca 0.08 -1.19 0.16 0.00 0.00 0.00 0.00 46.02 45.07 3hwc n GLY 3412CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hwc h PRO 3413N 0.00 0.00 -0.59 1.61 0.11 -1.82 -1.12 132.00 130.19 3hwc h PRO 3413Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3hwc h PRO 3413Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 3hwc h PRO 3413CO 0.27 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.69 3hwc n LYS 3414N -4.19 3.80 0.00 1.05 5.02 -1.26 -5.07 118.16 117.52 3hwc n LYS 3414Ca 0.03 -2.89 0.00 0.00 -2.02 0.00 0.00 58.31 53.43 3hwc n LYS 3414Cb 0.36 -1.91 0.00 0.00 -0.02 0.00 0.00 35.03 33.46 3hwc n LYS 3414CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hwc n GLY 3415N 0.89 0.93 3.59 0.72 0.00 -0.43 -4.93 105.19 105.97 3hwc n GLY 3415Ca 0.25 -0.65 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 3hwc n GLY 3415CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hwc n ASN 3416N -3.38 -5.71 -0.14 1.61 3.02 -1.26 -4.55 115.26 104.85 3hwc n ASN 3416Ca 0.00 -0.78 0.15 0.00 -0.03 0.00 0.00 54.58 53.92 3hwc n ASN 3416Cb 0.00 -3.13 0.52 0.00 -0.61 0.00 0.00 39.78 36.56 3hwc n ASN 3416CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3hwc h PRO 3417N -0.77 0.38 -0.13 3.52 0.11 -1.88 -1.93 132.00 131.30 3hwc h PRO 3417Ca -0.49 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.63 3hwc h PRO 3417Cb 1.29 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3hwc h PRO 3417CO 0.40 0.25 0.10 0.00 -0.21 0.00 0.00 178.00 178.53 3hwc h ARG 3418N 0.39 0.00 -0.23 1.05 2.47 -1.89 -2.64 114.38 113.53 3hwc h ARG 3418Ca 0.35 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 59.03 3hwc h ARG 3418Cb 0.81 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.12 3hwc h ARG 3418CO -0.10 0.00 -0.02 0.93 0.56 0.00 0.00 179.97 181.34 3hwc h GLU 3419N 0.00 0.35 -0.79 0.04 5.08 -1.69 -2.33 114.58 115.23 3hwc h GLU 3419Ca 0.06 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3hwc h GLU 3419Cb 0.25 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 3hwc h GLU 3419CO -0.00 0.39 0.36 -0.09 -1.00 0.00 0.00 179.01 178.67 3hwc h ARG 3420N 0.34 1.14 -0.33 2.33 2.43 -1.65 -0.53 114.38 118.12 3hwc h ARG 3420Ca 0.08 -0.17 -0.15 0.00 -0.81 0.00 0.00 59.98 58.93 3hwc h ARG 3420Cb 0.26 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 3hwc h ARG 3420CO 0.01 0.89 -0.38 0.28 -1.51 0.00 0.00 179.97 179.26 3hwc h VAL 3421N 1.13 1.28 -0.15 0.20 2.07 -1.62 -1.42 116.25 117.74 3hwc h VAL 3421Ca 0.27 -1.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.24 3hwc h VAL 3421Cb 0.14 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 3hwc h VAL 3421CO -0.03 0.51 0.09 1.56 0.02 0.00 0.00 177.57 179.72 3hwc h GLN 3422N 0.65 0.20 -0.09 1.57 4.20 -0.92 -0.42 115.11 120.31 3hwc h GLN 3422Ca 0.06 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 3hwc h GLN 3422Cb 0.94 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.67 3hwc h GLN 3422CO 0.09 0.19 0.04 0.82 -0.67 0.00 0.00 178.83 179.29 3hwc h ILE 3423N 0.16 1.13 -0.44 2.54 2.04 -1.11 -2.76 117.51 119.07 3hwc h ILE 3423Ca 0.05 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 65.60 3hwc h ILE 3423Cb 0.04 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 3hwc h ILE 3423CO -0.01 0.11 0.30 1.23 0.00 0.00 0.00 178.15 179.78 3hwc h GLY 3424N -0.00 0.40 1.24 5.37 0.00 -1.08 -1.61 103.07 107.38 3hwc h GLY 3424Ca 0.03 -0.13 -0.18 0.00 0.00 0.00 0.00 47.33 47.05 3hwc h GLY 3424CO -0.00 0.09 -0.56 3.21 0.00 0.00 0.00 176.54 179.28 3hwc h ARG 3425N 0.31 0.80 -0.09 4.80 3.08 -0.87 -0.15 114.38 122.25 3hwc h ARG 3425Ca 0.20 -0.51 -0.00 0.00 0.07 0.00 0.00 59.98 59.73 3hwc h ARG 3425Cb 0.37 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 3hwc h ARG 3425CO -0.04 1.14 0.05 0.28 -1.07 0.00 0.00 179.97 180.33 3hwc h VAL 3426N 0.61 1.09 -0.60 2.04 2.07 -1.10 -1.25 116.25 119.11 3hwc h VAL 3426Ca 0.01 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 3hwc h VAL 3426Cb 1.15 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 3hwc h VAL 3426CO 0.12 0.08 0.34 0.40 0.02 0.00 0.00 177.57 178.52 3hwc h ILE 3427N 0.06 1.19 -0.39 4.57 2.04 -1.26 -0.75 117.51 122.97 3hwc h ILE 3427Ca 0.03 -0.48 0.03 0.00 1.00 0.00 0.00 64.86 65.45 3hwc h ILE 3427Cb 0.08 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 3hwc h ILE 3427CO -0.01 0.21 0.18 -0.09 0.00 0.00 0.00 178.15 178.44 3hwc h ARG 3428N 0.82 0.36 -0.07 2.37 2.43 -0.96 -1.64 114.38 117.68 3hwc h ARG 3428Ca 0.21 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3hwc h ARG 3428Cb 0.03 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.50 3hwc h ARG 3428CO -0.04 0.24 0.04 -0.44 -1.51 0.00 0.00 179.97 178.26 3hwc h ASP 3429N 0.37 0.09 -0.97 -3.80 5.19 -0.80 0.39 116.42 116.89 3hwc h ASP 3429Ca 0.17 -0.09 0.05 0.00 -0.62 0.00 0.00 57.03 56.54 3hwc h ASP 3429Cb 0.09 -0.02 -0.06 0.00 0.18 0.00 0.00 39.33 39.52 3hwc h ASP 3429CO -0.13 0.15 0.62 -0.07 -3.12 0.00 0.00 179.24 176.70 3hwc h LEU 3430N 0.02 1.02 -0.17 1.55 4.07 -0.99 -3.16 115.31 117.65 3hwc h LEU 3430Ca 0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 3hwc h LEU 3430Cb 0.08 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.61 3hwc h LEU 3430CO -0.00 0.67 0.00 -1.22 -1.08 0.00 0.00 178.44 176.81 3hwc n TYR 3431N -4.50 0.00 -2.15 1.13 4.02 -0.63 -4.39 117.16 110.63 3hwc n TYR 3431Ca 0.14 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 58.08 3hwc n TYR 3431Cb 0.14 0.00 0.09 0.00 -0.02 0.00 0.00 39.34 39.55 3hwc n TYR 3431CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3hwc n LEU 3432N -0.53 1.59 -4.30 7.72 4.77 0.14 -4.82 117.00 121.56 3hwc n LEU 3432Ca 0.00 -2.65 -0.16 0.00 -0.03 0.00 0.00 56.01 53.17 3hwc n LEU 3432Cb 0.02 -0.19 -0.10 0.00 -2.33 0.00 0.00 43.42 40.82 3hwc n LEU 3432CO 0.00 0.81 -0.34 0.42 -1.33 0.00 0.00 177.39 176.95 3hwc s THR 3433N -1.17 0.99 0.19 -5.08 -4.23 -1.18 -4.87 115.64 100.28 3hwc s THR 3433Ca 0.34 -2.03 -0.13 0.00 -1.18 0.00 0.00 61.69 58.70 3hwc s THR 3433Cb 0.37 -2.21 0.11 0.00 1.34 0.00 0.00 72.50 72.10 3hwc s THR 3433CO -0.13 -0.43 1.72 0.44 -0.54 0.00 0.00 174.62 175.68 3hwc h ASP 3434N 2.57 0.01 -0.90 3.99 3.45 -1.90 0.20 116.42 123.83 3hwc h ASP 3434Ca -0.38 0.09 0.01 0.00 0.43 0.00 0.00 57.03 57.18 3hwc h ASP 3434Cb 1.21 0.12 -0.04 0.00 -0.56 0.00 0.00 39.33 40.06 3hwc h ASP 3434CO 0.64 0.03 0.59 -0.25 -1.57 0.00 0.00 179.24 178.68 3hwc h TRP 3435N 0.24 1.13 -0.44 4.55 7.01 -1.87 -1.83 115.95 124.75 3hwc h TRP 3435Ca 0.25 0.02 -0.13 0.00 2.11 0.00 0.00 58.89 61.14 3hwc h TRP 3435Cb 0.33 -0.38 -0.01 0.00 -2.10 0.00 0.00 29.16 26.99 3hwc h TRP 3435CO -0.22 0.72 -0.23 0.78 -2.79 0.00 0.00 178.44 176.70 3hwc h GLY 3436N 1.22 0.97 1.51 2.65 0.00 -1.39 -3.18 103.07 104.85 3hwc h GLY 3436Ca 0.33 -0.86 -0.01 0.00 0.00 0.00 0.00 47.33 46.79 3hwc h GLY 3436CO -0.07 0.78 0.24 -1.33 0.00 0.00 0.00 176.54 176.16 3hwc h GLY 3437N 0.91 0.69 2.00 4.60 0.00 -0.16 -1.90 103.07 109.21 3hwc h GLY 3437Ca 0.10 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 3hwc h GLY 3437CO 0.06 0.29 -0.03 0.07 0.00 0.00 0.00 176.54 176.93 3hwc h ARG 3438N 0.65 0.00 0.00 4.80 -0.00 -1.39 -0.92 114.38 117.51 3hwc h ARG 3438Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.15 3hwc h ARG 3438Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.01 3hwc h ARG 3438CO -0.03 0.03 0.00 1.04 -0.00 0.00 0.00 179.97 181.01 3hwc n GLN 3439N -3.14 0.50 -0.10 0.08 6.02 -0.71 -1.05 117.38 118.98 3hwc n GLN 3439Ca 0.00 0.04 -0.20 0.00 -0.01 0.00 0.00 57.00 56.83 3hwc n GLN 3439Cb 0.31 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 29.96 3hwc n GLN 3439CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 3hwc h PHE 3440N 0.00 0.00 0.00 1.08 0.04 -1.25 -3.40 116.94 113.41 3hwc h PHE 3440Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3hwc h PHE 3440Cb 0.14 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.29 3hwc h PHE 3440CO 0.00 1.37 0.00 -1.33 -0.60 0.00 0.00 178.31 177.75 3hwc n MET 3441N -4.45 0.15 -0.28 1.51 2.81 -0.95 -2.58 117.12 113.33 3hwc n MET 3441Ca -0.29 0.50 0.18 0.00 -1.81 0.00 0.00 57.70 56.28 3hwc n MET 3441Cb 0.64 -1.86 0.47 0.00 -0.71 0.00 0.00 33.22 31.76 3hwc n MET 3441CO 0.00 0.00 0.00 0.35 1.51 0.00 0.00 175.97 177.83 3hwc h PHE 3442N 0.00 0.68 0.00 2.03 3.04 -1.30 -2.45 116.94 118.94 3hwc h PHE 3442Ca 0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 3hwc h PHE 3442Cb 0.21 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.51 3hwc h PHE 3442CO 0.00 0.15 0.00 0.39 -2.02 0.00 0.00 178.31 176.83 3hwc n GLU 3443N -4.58 0.62 0.00 1.11 4.71 -1.15 -4.74 120.64 116.61 3hwc n GLU 3443Ca 0.21 -0.34 0.00 0.00 -0.01 0.00 0.00 57.16 57.03 3hwc n GLU 3443Cb 0.70 -0.82 0.00 0.00 -1.01 0.00 0.00 31.44 30.31 3hwc n GLU 3443CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 3hwc n ASN 3444N -0.18 1.69 0.00 1.62 4.05 -0.92 -3.27 115.26 118.25 3hwc n ASN 3444Ca 0.00 -1.53 0.00 0.00 0.45 0.00 0.00 54.58 53.50 3hwc n ASN 3444Cb 0.03 -0.38 0.00 0.00 1.23 0.00 0.00 39.78 40.65 3hwc n ASN 3444CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 177.26 176.43 3hwc n PHE 3445N 0.42 0.00 -0.43 1.20 1.16 -1.26 -4.96 117.46 113.59 3hwc n PHE 3445Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.56 3hwc n PHE 3445Cb 0.31 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.15 3hwc n PHE 3445CO 0.00 0.00 0.00 0.27 -1.87 0.00 0.00 176.76 175.16 3hwc n ASN 3446N -0.57 3.76 0.00 5.98 0.23 -1.20 -4.50 115.26 118.96 3hwc n ASN 3446Ca 0.00 -2.04 0.00 0.00 -0.53 0.00 0.00 54.58 52.01 3hwc n ASN 3446Cb 0.00 -0.84 0.00 0.00 -2.08 0.00 0.00 39.78 36.86 3hwc n ASN 3446CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3hwc n GLY 3447N 1.86 2.01 3.65 4.83 0.00 -1.26 -5.13 105.19 111.14 3hwc n GLY 3447Ca 0.07 0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.92 3hwc n GLY 3447CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3hwc n THR 3448N 0.00 3.25 0.00 2.61 5.66 -1.26 -4.84 114.28 119.70 3hwc n THR 3448Ca 0.00 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.50 3hwc n THR 3448Cb 0.00 -1.29 0.00 0.00 -1.55 0.00 0.00 70.33 67.49 3hwc n THR 3448CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 3hwc n PRO 3449N -0.58 0.00 -0.12 1.09 -0.02 -1.26 -3.37 135.00 130.74 3hwc n PRO 3449Ca 0.11 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.69 3hwc n PRO 3449Cb 0.44 0.00 0.15 0.00 -0.02 0.00 0.00 33.50 34.07 3hwc n PRO 3449CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3hwc n LEU 3450N 0.00 2.47 0.02 2.45 7.99 -1.26 -4.58 117.00 124.09 3hwc n LEU 3450Ca 0.00 -3.12 0.07 0.00 -0.01 0.00 0.00 56.01 52.95 3hwc n LEU 3450Cb 0.00 -0.44 0.32 0.00 -0.11 0.00 0.00 43.42 43.18 3hwc n LEU 3450CO 0.00 0.73 0.73 0.33 -1.51 0.00 0.00 177.39 177.68 3hwc n PHE 3451N -1.37 0.10 -2.67 -1.77 7.35 -1.22 -3.06 117.46 114.82 3hwc n PHE 3451Ca 0.17 0.04 -0.08 0.00 -0.76 0.00 0.00 57.45 56.81 3hwc n PHE 3451Cb 0.66 -0.56 0.04 0.00 0.35 0.00 0.00 39.48 39.96 3hwc n PHE 3451CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3hwc n ALA 3452N -1.53 3.20 0.00 3.13 0.00 -1.25 -4.54 120.51 119.53 3hwc n ALA 3452Ca 0.03 -2.96 0.00 0.00 0.00 0.00 0.00 53.44 50.51 3hwc n ALA 3452Cb 0.17 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3hwc n ALA 3452CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hwc n VAL 3453N -0.14 0.00 -0.01 0.00 0.31 -1.17 -4.53 118.33 112.78 3hwc n VAL 3453Ca 0.08 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.43 3hwc n VAL 3453Cb 0.82 -0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.70 3hwc n VAL 3453CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 3hwc n PHE 3454N -0.19 0.00 0.37 3.52 7.35 -1.25 -3.13 117.46 124.13 3hwc n PHE 3454Ca 0.00 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.83 3hwc n PHE 3454Cb 0.00 -0.18 0.51 0.00 0.35 0.00 0.00 39.48 40.17 3hwc n PHE 3454CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3hwc h ALA 3455N 0.50 1.00 -0.41 3.13 0.00 -1.80 0.75 119.26 122.43 3hwc h ALA 3455Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hwc h ALA 3455Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3hwc h ALA 3455CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 3hwc n ALA 3456N -1.92 2.38 0.05 0.00 0.00 -1.26 -4.23 120.51 115.53 3hwc n ALA 3456Ca 0.02 -1.04 0.00 0.00 0.00 0.00 0.00 53.44 52.43 3hwc n ALA 3456Cb 0.32 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 18.99 3hwc n ALA 3456CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3hwc n THR 3457N 1.32 0.58 0.25 0.00 -1.04 -0.85 -4.38 114.28 110.15 3hwc n THR 3457Ca 0.18 0.19 0.09 0.00 -2.04 0.00 0.00 64.05 62.47 3hwc n THR 3457Cb 0.56 -1.29 0.66 0.00 -1.82 0.00 0.00 70.33 68.44 3hwc n THR 3457CO 0.00 0.00 0.00 -0.03 -0.64 0.00 0.00 175.07 174.40 3hwc h MET 3458N 0.00 0.00 0.00 -2.82 4.05 0.23 1.24 114.93 117.63 3hwc h MET 3458Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3hwc h MET 3458Cb 0.28 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.08 3hwc h MET 3458CO 0.00 0.00 -1.39 2.41 0.23 0.00 0.00 176.91 178.16 3hwc n THR 3459N -4.50 0.33 0.83 -0.77 -1.04 -1.25 -4.03 114.28 103.85 3hwc n THR 3459Ca -0.03 -0.50 0.10 0.00 -2.04 0.00 0.00 64.05 61.59 3hwc n THR 3459Cb 0.11 -0.14 -0.09 0.00 -1.82 0.00 0.00 70.33 68.38 3hwc n THR 3459CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3hwc n ARG 3460N -2.43 0.11 -1.87 -2.82 3.00 -0.71 -4.97 116.66 106.97 3hwc n ARG 3460Ca -0.01 -0.03 0.00 0.00 -0.01 0.00 0.00 57.85 57.80 3hwc n ARG 3460Cb 0.54 -1.51 0.00 0.00 0.00 0.00 0.00 32.46 31.50 3hwc n ARG 3460CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 3hwc n ASP 3461N -1.64 0.98 0.11 0.55 10.43 0.42 -5.00 116.55 122.41 3hwc n ASP 3461Ca 0.03 -0.93 -0.06 0.00 2.57 0.00 0.00 54.79 56.40 3hwc n ASP 3461Cb 0.37 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.30 3hwc n ASP 3461CO 0.00 0.00 0.00 -2.24 -1.07 0.00 0.00 177.20 173.89 3hwc h ASP 3462N 0.00 -0.30 -3.60 -2.24 3.04 -1.79 -3.43 116.42 108.10 3hwc h ASP 3462Ca 0.00 0.01 -0.03 0.00 -3.24 0.00 0.00 57.03 53.77 3hwc h ASP 3462Cb 0.00 0.08 -0.02 0.00 -1.04 0.00 0.00 39.33 38.35 3hwc h ASP 3462CO 0.00 0.13 -0.04 0.23 -2.04 0.00 0.00 179.24 177.53 3hwc n MET 3463N -4.92 -2.12 -4.71 4.15 2.81 -1.26 -4.74 117.12 106.31 3hwc n MET 3463Ca -0.04 0.01 -0.33 0.00 -1.81 0.00 0.00 57.70 55.52 3hwc n MET 3463Cb 0.14 -2.76 -0.07 0.00 -0.71 0.00 0.00 33.22 29.82 3hwc n MET 3463CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3hwc n SER 3464N -0.94 3.33 0.30 7.83 3.41 -1.26 -4.88 113.62 121.41 3hwc n SER 3464Ca 0.01 -3.26 0.19 0.00 -0.26 0.00 0.00 58.87 55.54 3hwc n SER 3464Cb 0.30 0.40 0.94 0.00 -0.26 0.00 0.00 64.21 65.59 3hwc n SER 3464CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hwc h ALA 3465N 1.28 1.08 -0.00 7.33 0.00 -1.97 0.01 119.26 126.99 3hwc h ALA 3465Ca -0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3hwc h ALA 3465Cb 1.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3hwc h ALA 3465CO 0.70 0.03 -0.42 0.00 0.00 0.00 0.00 179.25 179.56 3hwc n ALA 3466N -2.14 3.41 -1.00 0.00 0.00 -1.26 -4.15 120.51 115.37 3hwc n ALA 3466Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.04 3hwc n ALA 3466Cb 0.18 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3hwc n ALA 3466CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hwc n GLY 3467N 1.44 -1.15 0.19 0.00 0.00 -0.01 -4.91 105.19 100.75 3hwc n GLY 3467Ca 0.08 -1.62 0.06 0.00 0.00 0.00 0.00 46.02 44.54 3hwc n GLY 3467CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwc h THR 3468N -0.63 0.82 -0.00 2.61 1.03 -1.91 -2.88 112.91 111.96 3hwc h THR 3468Ca 0.00 -1.47 0.00 0.00 -0.01 0.00 0.00 66.41 64.93 3hwc h THR 3468Cb 0.00 1.91 0.00 0.00 -1.07 0.00 0.00 68.15 68.99 3hwc h THR 3468CO 0.00 0.34 -0.08 -1.22 -0.01 0.00 0.00 175.52 174.56 3hwc n TYR 3469N -3.50 0.00 0.29 0.00 4.02 -1.26 -3.66 117.16 113.04 3hwc n TYR 3469Ca -0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.01 3hwc n TYR 3469Cb 0.50 -0.38 0.14 0.00 -0.02 0.00 0.00 39.34 39.58 3hwc n TYR 3469CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3hwc h GLY 3470N 5.00 0.00 0.77 2.72 0.00 -1.66 -3.38 103.07 106.51 3hwc h GLY 3470Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3hwc h GLY 3470CO 0.00 0.00 -0.37 1.70 0.00 0.00 0.00 176.54 177.87 3hwc h LYS 3471N 0.00 -0.99 -0.02 4.80 3.64 -1.71 -1.51 116.57 120.78 3hwc h LYS 3471Ca 0.00 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3hwc h LYS 3471Cb 0.93 0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.97 3hwc h LYS 3471CO 0.00 -0.66 0.01 0.35 -2.27 0.00 0.00 179.45 176.88 3hwc h PHE 3472N -1.14 0.02 -0.46 1.91 -0.00 -1.83 -1.71 116.94 113.73 3hwc h PHE 3472Ca -0.11 0.00 0.01 0.00 -0.00 0.00 0.00 57.97 57.88 3hwc h PHE 3472Cb 0.79 -0.01 -0.03 0.00 -0.00 0.00 0.00 35.95 36.71 3hwc h PHE 3472CO 0.03 0.04 0.30 0.00 -0.00 0.00 0.00 178.31 178.67 3hwc h ALA 3473N 0.98 0.59 -0.04 2.41 0.00 -1.74 -0.32 119.26 121.15 3hwc h ALA 3473Ca 0.01 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3hwc h ALA 3473Cb 0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 3hwc h ALA 3473CO -0.00 0.01 -0.19 0.77 0.00 0.00 0.00 179.25 179.84 3hwc h SER 3474N 0.60 -0.56 -0.06 0.00 0.02 -1.12 -0.07 113.55 112.36 3hwc h SER 3474Ca 0.18 0.09 0.04 0.00 -0.84 0.00 0.00 61.79 61.25 3hwc h SER 3474Cb -0.04 0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.68 3hwc h SER 3474CO -0.06 -0.25 -0.34 -0.61 -1.14 0.00 0.00 176.83 174.44 3hwc h GLN 3475N -0.28 -0.44 -0.52 3.45 4.15 -0.96 0.28 115.11 120.78 3hwc h GLN 3475Ca 0.07 0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.56 3hwc h GLN 3475Cb 0.38 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.14 3hwc h GLN 3475CO -0.20 -0.30 0.34 0.28 -1.93 0.00 0.00 178.83 177.02 3hwc h VAL 3476N -0.46 1.04 -0.00 2.39 2.07 -0.77 0.69 116.25 121.20 3hwc h VAL 3476Ca 0.07 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.40 3hwc h VAL 3476Cb 0.57 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 3hwc h VAL 3476CO -0.32 0.10 -0.13 0.00 0.02 0.00 0.00 177.57 177.24 3hwc n GLY 3478N 1.37 0.24 3.24 0.00 0.00 0.23 -5.05 105.19 105.23 3hwc n GLY 3478Ca 0.11 -0.26 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 3hwc n GLY 3478CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hwc s ILE 3479N -3.14 1.56 0.00 -0.61 1.01 0.79 -5.01 121.20 115.80 3hwc s ILE 3479Ca 0.16 -1.23 0.00 0.00 0.00 0.00 0.00 60.65 59.58 3hwc s ILE 3479Cb -0.07 -1.38 0.00 0.00 0.01 0.00 0.00 42.46 41.02 3hwc s ILE 3479CO 0.31 0.11 0.00 1.21 0.00 0.00 0.00 174.94 176.57 3hwc n GLU 3480N 1.70 0.00 -1.67 2.79 2.13 -1.26 -4.16 120.64 120.16 3hwc n GLU 3480Ca -0.18 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.64 3hwc n GLU 3480Cb 0.54 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.25 3hwc n GLU 3480CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3hwc n PHE 3481N 0.00 -1.40 0.00 4.31 7.35 -1.26 -4.86 117.46 121.60 3hwc n PHE 3481Ca 0.00 0.84 0.00 0.00 -0.76 0.00 0.00 57.45 57.53 3hwc n PHE 3481Cb 0.00 -1.38 0.00 0.00 0.35 0.00 0.00 39.48 38.45 3hwc n PHE 3481CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41