#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wvi s TYR 3003N 0.00 3.59 -0.25 -1.42 1.51 -1.26 -4.94 117.35 114.58 1wvi s TYR 3003Ca 0.00 1.17 0.22 0.00 -1.01 0.00 0.00 57.07 57.45 1wvi s TYR 3003Cb 0.00 -2.71 -0.28 0.00 -0.11 0.00 0.00 41.96 38.86 1wvi s TYR 3003CO 0.00 0.16 0.62 1.63 -1.11 0.00 0.00 175.55 176.86 1wvi n LYS 3004N 3.51 0.52 -3.98 -0.62 4.76 0.15 -4.99 118.16 117.50 1wvi n LYS 3004Ca -0.04 -0.13 -0.09 0.00 -2.87 0.00 0.00 58.31 55.18 1wvi n LYS 3004Cb 0.51 -1.54 -0.11 0.00 -1.84 0.00 0.00 35.03 32.06 1wvi n LYS 3004CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1wvi s GLY 3005N -4.19 0.25 -0.09 0.72 0.00 -1.07 -4.09 107.32 98.85 1wvi s GLY 3005Ca -0.04 -0.63 0.02 0.00 0.00 0.00 0.00 44.72 44.07 1wvi s GLY 3005CO 0.89 -0.72 -0.14 -0.19 0.00 0.00 0.00 173.10 172.95 1wvi s TYR 3006N -1.80 1.73 -0.20 1.90 1.51 -0.86 -2.40 117.35 117.24 1wvi s TYR 3006Ca -0.13 -0.74 -0.07 0.00 -1.01 0.00 0.00 57.07 55.13 1wvi s TYR 3006Cb -0.07 -1.26 -0.04 0.00 -0.11 0.00 0.00 41.96 40.48 1wvi s TYR 3006CO -0.02 -0.38 0.05 -0.51 -1.11 0.00 0.00 175.55 173.58 1wvi s LEU 3007N 0.86 3.64 -0.04 -1.29 1.43 -0.08 -0.79 118.68 122.42 1wvi s LEU 3007Ca -0.10 -0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.00 1wvi s LEU 3007Cb -0.15 -1.93 0.01 0.00 0.03 0.00 0.00 46.19 44.14 1wvi s LEU 3007CO 0.01 0.12 -0.09 -0.63 0.23 0.00 0.00 176.35 175.99 1wvi s ILE 3008N 0.71 0.82 0.50 -0.59 1.01 0.01 0.62 121.20 124.29 1wvi s ILE 3008Ca 0.03 -0.35 -0.20 0.00 0.00 0.00 0.00 60.65 60.13 1wvi s ILE 3008Cb -0.13 -0.75 -0.08 0.00 0.01 0.00 0.00 42.46 41.50 1wvi s ILE 3008CO 0.02 0.27 1.04 -0.62 0.00 0.00 0.00 174.94 175.64 1wvi s ASP 3009N 0.42 6.28 0.00 3.58 3.68 -0.01 0.24 116.67 130.86 1wvi s ASP 3009Ca -0.07 1.90 0.00 0.00 2.13 0.00 0.00 52.55 56.51 1wvi s ASP 3009Cb -0.11 -2.55 0.00 0.00 -1.45 0.00 0.00 42.92 38.80 1wvi s ASP 3009CO 0.01 -0.82 0.00 0.18 0.13 0.00 0.00 175.17 174.67 1wvi n LEU 3010N -1.12 0.66 -4.71 -1.34 4.77 -1.24 -4.26 117.00 109.76 1wvi n LEU 3010Ca 0.09 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 1wvi n LEU 3010Cb 0.53 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 1wvi n LEU 3010CO 0.41 0.00 1.33 -0.62 -1.33 0.00 0.00 177.39 177.18 1wvi s ASP 3011N -1.00 6.50 0.00 -1.43 2.15 -1.26 -1.75 116.67 119.88 1wvi s ASP 3011Ca 0.00 2.69 0.00 0.00 0.43 0.00 0.00 52.55 55.67 1wvi s ASP 3011Cb 0.00 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1wvi s ASP 3011CO 0.00 -0.91 0.00 0.61 -0.17 0.00 0.00 175.17 174.70 1wvi n GLY 3012N 3.94 2.80 0.52 2.66 0.00 0.28 -4.88 105.19 110.52 1wvi n GLY 3012Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 1wvi n GLY 3012CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wvi n THR 3013N -2.00 1.20 -0.13 2.61 -1.04 -0.71 -3.37 114.28 110.84 1wvi n THR 3013Ca 0.00 0.10 0.11 0.00 -2.04 0.00 0.00 64.05 62.23 1wvi n THR 3013Cb 0.00 -1.91 0.27 0.00 -1.82 0.00 0.00 70.33 66.87 1wvi n THR 3013CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 1wvi n ILE 3014N -3.92 0.83 0.00 12.58 -5.35 -0.98 -4.55 119.36 117.96 1wvi n ILE 3014Ca -0.15 -0.91 0.00 0.00 -0.27 0.00 0.00 62.75 61.42 1wvi n ILE 3014Cb 0.43 0.67 0.00 0.00 -1.74 0.00 0.00 39.64 39.00 1wvi n ILE 3014CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wvi n TYR 3015N 1.52 0.00 -3.57 4.28 4.11 -1.26 -4.06 117.16 118.19 1wvi n TYR 3015Ca 0.22 0.00 -0.21 0.00 -0.00 0.00 0.00 57.90 57.91 1wvi n TYR 3015Cb 0.60 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.79 1wvi n TYR 3015CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 1wvi s LYS 3016N -2.00 0.11 7.42 -3.48 2.20 -0.00 0.10 119.74 124.09 1wvi s LYS 3016Ca 0.00 0.18 0.00 0.00 -0.36 0.00 0.00 55.97 55.79 1wvi s LYS 3016Cb 0.00 -1.24 0.00 0.00 -1.51 0.00 0.00 37.83 35.08 1wvi s LYS 3016CO 0.00 -0.59 0.00 0.41 -0.36 0.00 0.00 175.35 174.81 1wvi n GLY 3017N 5.31 2.78 0.10 5.54 0.00 -1.26 -1.23 105.19 116.42 1wvi n GLY 3017Ca -0.06 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 45.82 1wvi n GLY 3017CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wvi h LYS 3018N 0.00 0.00 -7.08 1.61 6.56 -2.03 -3.46 116.57 112.17 1wvi h LYS 3018Ca 0.00 0.00 -0.45 0.00 -1.06 0.00 0.00 60.65 59.14 1wvi h LYS 3018Cb 0.00 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1wvi h LYS 3018CO 0.00 0.00 0.36 -0.51 -2.06 0.00 0.00 179.45 177.24 1wvi s ASP 3019N -4.80 6.70 0.38 0.86 -0.00 -0.37 -5.08 116.67 114.37 1wvi s ASP 3019Ca 0.04 1.75 0.08 0.00 -0.00 0.00 0.00 52.55 54.42 1wvi s ASP 3019Cb 0.11 -2.54 -0.03 0.00 -0.00 0.00 0.00 42.92 40.46 1wvi s ASP 3019CO 0.74 -0.53 0.31 0.00 -0.00 0.00 0.00 175.17 175.69 1wvi s ARG 3020N -3.31 2.55 -0.36 8.23 1.70 -1.26 -0.82 118.95 125.69 1wvi s ARG 3020Ca 0.63 -1.48 0.01 0.00 -0.47 0.00 0.00 55.73 54.42 1wvi s ARG 3020Cb -0.11 -2.36 0.11 0.00 -0.57 0.00 0.00 34.95 32.02 1wvi s ARG 3020CO 0.17 -0.06 0.14 0.42 -1.08 0.00 0.00 175.30 174.89 1wvi s ILE 3021N -2.42 1.18 0.37 4.99 1.01 -1.26 -4.69 121.20 120.38 1wvi s ILE 3021Ca 0.44 -1.88 0.14 0.00 0.00 0.00 0.00 60.65 59.36 1wvi s ILE 3021Cb -0.03 -1.87 0.36 0.00 0.01 0.00 0.00 42.46 40.92 1wvi s ILE 3021CO 0.27 -0.74 1.78 1.55 0.00 0.00 0.00 174.94 177.79 1wvi h PRO 3022N 7.59 0.49 -0.54 2.79 0.13 -1.98 0.30 132.00 140.77 1wvi h PRO 3022Ca -0.08 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.98 1wvi h PRO 3022Cb 0.99 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.98 1wvi h PRO 3022CO 0.48 0.32 0.19 0.00 -0.23 0.00 0.00 178.00 178.76 1wvi h ALA 3023N 1.64 1.31 0.03 -0.56 0.00 -1.94 0.14 119.26 119.87 1wvi h ALA 3023Ca 0.58 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 1wvi h ALA 3023Cb 1.29 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1wvi h ALA 3023CO -0.33 0.50 -0.01 0.78 0.00 0.00 0.00 179.25 180.19 1wvi h GLY 3024N 0.93 -0.04 0.74 0.00 0.00 -0.68 -0.54 103.07 103.48 1wvi h GLY 3024Ca 0.18 0.02 0.06 0.00 0.00 0.00 0.00 47.33 47.59 1wvi h GLY 3024CO -0.01 -0.02 0.55 0.83 0.00 0.00 0.00 176.54 177.89 1wvi h GLU 3025N -0.37 0.98 -0.52 4.80 5.08 -1.08 -1.12 114.58 122.35 1wvi h GLU 3025Ca -0.00 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1wvi h GLU 3025Cb 0.34 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 1wvi h GLU 3025CO 0.01 0.65 0.06 0.22 -1.00 0.00 0.00 179.01 178.95 1wvi h ASP 3026N 1.01 0.78 -0.52 1.42 3.58 -0.87 -2.29 116.42 119.53 1wvi h ASP 3026Ca 0.38 -0.17 0.05 0.00 0.42 0.00 0.00 57.03 57.71 1wvi h ASP 3026Cb 0.15 -0.21 -0.05 0.00 1.72 0.00 0.00 39.33 40.95 1wvi h ASP 3026CO -0.17 0.81 0.26 0.15 -2.88 0.00 0.00 179.24 177.42 1wvi h PHE 3027N 0.78 0.48 -0.29 0.28 3.04 0.20 0.36 116.94 121.80 1wvi h PHE 3027Ca 0.16 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.09 1wvi h PHE 3027Cb 0.38 -0.14 -0.01 0.00 2.56 0.00 0.00 35.95 38.74 1wvi h PHE 3027CO 0.02 0.23 0.01 0.28 -2.02 0.00 0.00 178.31 176.83 1wvi h VAL 3028N 0.51 1.25 -0.62 1.41 2.07 -1.26 -1.52 116.25 118.09 1wvi h VAL 3028Ca 0.23 -0.91 0.03 0.00 0.82 0.00 0.00 66.70 66.86 1wvi h VAL 3028Cb 0.14 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1wvi h VAL 3028CO -0.16 0.29 0.39 0.11 0.02 0.00 0.00 177.57 178.22 1wvi h LYS 3029N 0.31 0.74 -0.80 1.57 1.57 -0.83 0.59 116.57 119.72 1wvi h LYS 3029Ca 0.08 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1wvi h LYS 3029Cb 0.42 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1wvi h LYS 3029CO 0.01 0.49 0.49 0.00 -0.57 0.00 0.00 179.45 179.88 1wvi h ARG 3030N 0.76 1.07 -0.46 3.15 3.08 -0.15 -0.00 114.38 121.83 1wvi h ARG 3030Ca 0.25 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1wvi h ARG 3030Cb 0.02 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 1wvi h ARG 3030CO -0.10 0.74 0.30 -0.07 -1.07 0.00 0.00 179.97 179.77 1wvi h LEU 3031N 1.09 0.54 -0.99 3.04 3.38 -0.30 -1.47 115.31 120.60 1wvi h LEU 3031Ca 0.29 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 1wvi h LEU 3031Cb -0.06 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 1wvi h LEU 3031CO -0.06 0.41 0.60 1.56 0.09 0.00 0.00 178.44 181.04 1wvi h GLN 3032N 0.62 1.28 -0.68 1.13 4.20 -0.32 -0.16 115.11 121.18 1wvi h GLN 3032Ca 0.17 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.73 1wvi h GLN 3032Cb -0.05 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 27.43 1wvi h GLN 3032CO -0.03 0.88 0.23 0.93 -0.67 0.00 0.00 178.83 180.17 1wvi h GLU 3033N 1.31 1.05 -0.00 1.46 5.08 -0.39 -1.56 114.58 121.52 1wvi h GLU 3033Ca 0.35 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1wvi h GLU 3033Cb -0.09 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.00 1wvi h GLU 3033CO -0.07 0.90 -0.04 0.54 -1.00 0.00 0.00 179.01 179.34 1wvi n ARG 3034N -4.34 0.61 -3.47 2.33 5.12 -0.61 -4.90 116.66 111.40 1wvi n ARG 3034Ca 0.05 -0.09 -0.24 0.00 -1.93 0.00 0.00 57.85 55.64 1wvi n ARG 3034Cb 0.21 -1.50 0.06 0.00 -1.16 0.00 0.00 32.46 30.07 1wvi n ARG 3034CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1wvi n GLN 3035N -1.12 -6.66 -3.12 5.56 6.02 -0.20 -4.96 117.38 112.89 1wvi n GLN 3035Ca 0.16 0.81 -0.39 0.00 -0.01 0.00 0.00 57.00 57.57 1wvi n GLN 3035Cb 0.24 -5.78 -0.05 0.00 1.02 0.00 0.00 30.24 25.66 1wvi n GLN 3035CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1wvi s LEU 3036N -7.11 4.28 0.56 1.08 1.43 -0.44 -5.03 118.68 113.45 1wvi s LEU 3036Ca 0.51 1.04 -0.21 0.00 -1.03 0.00 0.00 54.13 54.45 1wvi s LEU 3036Cb -0.23 -2.96 -0.04 0.00 0.03 0.00 0.00 46.19 42.99 1wvi s LEU 3036CO 0.64 -0.11 1.29 -2.16 0.23 0.00 0.00 176.35 176.23 1wvi s PRO 3037N 0.92 3.09 -0.03 1.29 0.04 -1.26 -4.65 135.00 134.41 1wvi s PRO 3037Ca 0.33 2.06 -0.30 0.00 0.04 0.00 0.00 61.00 63.13 1wvi s PRO 3037Cb -0.17 -2.14 0.07 0.00 0.04 0.00 0.00 34.50 32.30 1wvi s PRO 3037CO 0.15 -1.17 0.67 1.52 0.04 0.00 0.00 177.00 178.21 1wvi s TYR 3038N -1.41 -0.64 -0.03 0.56 1.13 -1.26 -2.03 117.35 113.66 1wvi s TYR 3038Ca 0.74 1.04 0.02 0.00 -1.41 0.00 0.00 57.07 57.45 1wvi s TYR 3038Cb -0.36 0.43 0.01 0.00 -1.10 0.00 0.00 41.96 40.94 1wvi s TYR 3038CO 0.41 -0.64 -0.06 0.42 -2.51 0.00 0.00 175.55 173.17 1wvi s ILE 3039N -1.49 0.63 -0.22 -3.49 1.09 0.03 -4.78 121.20 112.97 1wvi s ILE 3039Ca -0.10 -0.23 -0.19 0.00 -1.10 0.00 0.00 60.65 59.03 1wvi s ILE 3039Cb -0.00 -0.60 -0.03 0.00 -1.06 0.00 0.00 42.46 40.77 1wvi s ILE 3039CO 0.07 0.22 0.57 -0.76 -0.10 0.00 0.00 174.94 174.94 1wvi s LEU 3040N 0.51 4.11 -0.18 2.97 2.01 0.20 -0.81 118.68 127.50 1wvi s LEU 3040Ca -0.07 0.69 -0.02 0.00 0.01 0.00 0.00 54.13 54.75 1wvi s LEU 3040Cb -0.11 -2.77 -0.01 0.00 0.01 0.00 0.00 46.19 43.31 1wvi s LEU 3040CO 0.00 -0.26 -0.10 -0.69 1.01 0.00 0.00 176.35 176.32 1wvi s VAL 3041N 1.98 3.05 0.04 -1.59 1.01 0.14 -0.84 120.40 124.18 1wvi s VAL 3041Ca 0.25 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.64 1wvi s VAL 3041Cb -0.16 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 1wvi s VAL 3041CO 0.09 0.48 -0.12 0.28 0.00 0.00 0.00 175.10 175.84 1wvi s THR 3042N 0.98 0.94 -1.94 3.92 -1.32 -1.02 -3.69 115.64 113.51 1wvi s THR 3042Ca -0.01 -0.95 0.28 0.00 -1.21 0.00 0.00 61.69 59.80 1wvi s THR 3042Cb -0.15 -0.87 0.41 0.00 -1.51 0.00 0.00 72.50 70.38 1wvi s THR 3042CO -0.01 -0.06 1.71 0.59 -2.21 0.00 0.00 174.62 174.64 1wvi n ASN 3043N 1.90 0.98 -4.72 8.08 5.03 -1.26 -1.68 115.26 123.59 1wvi n ASN 3043Ca -0.18 -0.98 -0.42 0.00 0.87 0.00 0.00 54.58 53.86 1wvi n ASN 3043Cb 0.55 0.05 -0.03 0.00 -1.02 0.00 0.00 39.78 39.33 1wvi n ASN 3043CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1wvi s ASN 3044N -2.34 6.52 0.00 6.41 2.47 -1.26 -4.60 114.94 122.14 1wvi s ASN 3044Ca 0.30 2.70 0.08 0.00 0.42 0.00 0.00 52.86 56.36 1wvi s ASN 3044Cb 0.20 -2.60 0.16 0.00 -1.45 0.00 0.00 41.25 37.57 1wvi s ASN 3044CO 0.45 -0.87 1.02 0.35 -3.72 0.00 0.00 177.10 174.34 1wvi n THR 3045N 3.93 0.63 -0.03 -5.21 -2.24 -1.26 -4.21 114.28 105.89 1wvi n THR 3045Ca 0.14 -0.81 -0.22 0.00 -2.27 0.00 0.00 64.05 60.89 1wvi n THR 3045Cb 0.37 0.75 -0.13 0.00 -2.10 0.00 0.00 70.33 69.22 1wvi n THR 3045CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1wvi n THR 3046N 0.32 1.71 -3.40 4.28 -2.24 -1.26 -3.85 114.28 109.83 1wvi n THR 3046Ca 0.07 -0.50 -0.38 0.00 -2.27 0.00 0.00 64.05 60.97 1wvi n THR 3046Cb 0.31 -1.79 -0.06 0.00 -2.10 0.00 0.00 70.33 66.69 1wvi n THR 3046CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1wvi s ARG 3047N -2.51 4.16 0.87 -0.78 0.52 -1.26 -4.61 118.95 115.34 1wvi s ARG 3047Ca -0.25 0.43 -0.12 0.00 -0.52 0.00 0.00 55.73 55.27 1wvi s ARG 3047Cb 0.07 -3.34 0.11 0.00 0.52 0.00 0.00 34.95 32.31 1wvi s ARG 3047CO 0.71 0.40 1.11 0.95 0.02 0.00 0.00 175.30 178.49 1wvi s THR 3048N -0.16 2.61 0.25 0.02 -4.23 -1.26 -4.76 115.64 108.11 1wvi s THR 3048Ca 0.24 0.20 -0.04 0.00 -1.18 0.00 0.00 61.69 60.91 1wvi s THR 3048Cb -0.16 -2.87 0.23 0.00 1.34 0.00 0.00 72.50 71.05 1wvi s THR 3048CO 0.11 -0.26 1.85 -0.65 -0.54 0.00 0.00 174.62 175.13 1wvi h PRO 3049N -1.37 0.96 -0.09 3.99 0.11 -1.96 0.16 132.00 133.80 1wvi h PRO 3049Ca -0.49 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.57 1wvi h PRO 3049Cb 1.29 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1wvi h PRO 3049CO 0.59 0.63 0.02 0.93 -0.21 0.00 0.00 178.00 179.96 1wvi h GLU 3050N 0.99 0.05 -0.50 1.05 3.07 -1.93 0.35 114.58 117.66 1wvi h GLU 3050Ca 0.40 -0.00 0.05 0.00 -0.50 0.00 0.00 59.36 59.30 1wvi h GLU 3050Cb 0.23 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.08 1wvi h GLU 3050CO -0.19 0.04 0.24 0.52 -1.40 0.00 0.00 179.01 178.21 1wvi h MET 3051N 0.05 0.46 -0.27 2.33 2.86 -1.71 0.11 114.93 118.76 1wvi h MET 3051Ca 0.04 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1wvi h MET 3051Cb 0.03 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1wvi h MET 3051CO -0.05 0.30 0.17 0.28 1.06 0.00 0.00 176.91 178.67 1wvi h VAL 3052N 0.47 1.10 -0.35 -2.22 2.07 -0.51 -0.12 116.25 116.70 1wvi h VAL 3052Ca 0.22 -0.22 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1wvi h VAL 3052Cb 0.14 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1wvi h VAL 3052CO -0.16 0.09 0.15 -0.61 0.02 0.00 0.00 177.57 177.06 1wvi h GLN 3053N 0.35 0.30 -0.50 1.57 4.15 0.33 -1.42 115.11 119.89 1wvi h GLN 3053Ca 0.10 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.48 1wvi h GLN 3053Cb 0.01 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 1wvi h GLN 3053CO -0.02 0.20 0.22 1.49 -1.93 0.00 0.00 178.83 178.79 1wvi h GLU 3054N 0.31 0.74 -0.53 1.69 4.81 -0.57 -2.41 114.58 118.62 1wvi h GLU 3054Ca 0.15 -0.12 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1wvi h GLU 3054Cb 0.09 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 1wvi h GLU 3054CO -0.13 0.64 0.28 1.98 -0.73 0.00 0.00 179.01 181.05 1wvi h MET 3055N 0.67 0.54 -0.46 1.92 4.05 -0.71 0.18 114.93 121.11 1wvi h MET 3055Ca 0.17 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.57 1wvi h MET 3055Cb 0.16 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 30.81 1wvi h MET 3055CO -0.02 0.35 0.30 -0.07 0.23 0.00 0.00 176.91 177.70 1wvi h LEU 3056N 0.55 0.51 -0.12 3.39 3.38 -1.02 0.20 115.31 122.20 1wvi h LEU 3056Ca 0.23 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 1wvi h LEU 3056Cb 0.11 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1wvi h LEU 3056CO -0.14 0.36 -0.29 0.00 0.09 0.00 0.00 178.44 178.47 1wvi h ALA 3057N 1.18 0.19 -0.25 1.53 0.00 -0.48 -0.56 119.26 120.87 1wvi h ALA 3057Ca 0.17 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.55 1wvi h ALA 3057Cb -0.05 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1wvi h ALA 3057CO -0.05 0.21 -0.33 1.15 0.00 0.00 0.00 179.25 180.23 1wvi h THR 3058N -0.03 1.31 0.00 0.00 2.02 -0.58 -3.17 112.91 112.47 1wvi h THR 3058Ca -0.00 -1.52 0.00 0.00 0.77 0.00 0.00 66.41 65.66 1wvi h THR 3058Cb 0.89 1.70 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 1wvi h THR 3058CO 0.06 0.48 -1.17 -1.20 0.37 0.00 0.00 175.52 174.06 1wvi n SER 3059N -4.27 0.81 -0.43 4.18 7.64 0.71 -4.70 113.62 117.56 1wvi n SER 3059Ca -0.05 -0.64 0.01 0.00 1.01 0.00 0.00 58.87 59.20 1wvi n SER 3059Cb 0.49 1.27 0.02 0.00 -1.01 0.00 0.00 64.21 64.97 1wvi n SER 3059CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1wvi n PHE 3060N -1.65 0.00 -2.01 1.43 3.72 -0.46 -4.95 117.46 113.54 1wvi n PHE 3060Ca 0.01 -0.11 -0.15 0.00 -0.05 0.00 0.00 57.45 57.16 1wvi n PHE 3060Cb 0.35 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.80 1wvi n PHE 3060CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1wvi n ASN 3061N -0.16 -4.23 -4.35 4.37 3.02 -0.97 -4.88 115.26 108.07 1wvi n ASN 3061Ca 0.02 0.23 -0.36 0.00 -0.03 0.00 0.00 54.58 54.44 1wvi n ASN 3061Cb 0.68 -3.69 -0.13 0.00 -0.61 0.00 0.00 39.78 36.03 1wvi n ASN 3061CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1wvi s ILE 3062N -2.53 3.83 -0.30 2.41 1.01 -0.34 -4.94 121.20 120.33 1wvi s ILE 3062Ca 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 60.65 60.06 1wvi s ILE 3062Cb 0.00 -2.88 0.05 0.00 0.01 0.00 0.00 42.46 39.63 1wvi s ILE 3062CO 0.00 0.22 0.02 -0.54 0.00 0.00 0.00 174.94 174.64 1wvi s LYS 3063N 1.51 2.50 0.03 2.79 1.02 -1.26 -0.81 119.74 125.52 1wvi s LYS 3063Ca 0.04 -1.22 0.04 0.00 0.02 0.00 0.00 55.97 54.84 1wvi s LYS 3063Cb -0.16 -3.23 -0.02 0.00 -0.52 0.00 0.00 37.83 33.90 1wvi s LYS 3063CO 0.01 -0.61 -0.12 -0.08 -0.92 0.00 0.00 175.35 173.63 1wvi s THR 3064N 1.29 0.92 0.64 2.17 -1.32 -1.26 -5.07 115.64 113.01 1wvi s THR 3064Ca -0.04 -0.92 -0.17 0.00 -1.21 0.00 0.00 61.69 59.34 1wvi s THR 3064Cb -0.19 -0.85 -0.03 0.00 -1.51 0.00 0.00 72.50 69.91 1wvi s THR 3064CO -0.00 -0.06 0.97 -2.65 -2.21 0.00 0.00 174.62 170.66 1wvi n PRO 3065N 1.94 0.77 0.04 7.08 -0.02 -1.26 -4.88 135.00 138.67 1wvi n PRO 3065Ca -0.18 0.31 0.04 0.00 -2.02 0.00 0.00 63.50 61.65 1wvi n PRO 3065Cb 0.55 -2.19 0.45 0.00 -0.02 0.00 0.00 33.50 32.29 1wvi n PRO 3065CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1wvi h LEU 3066N 0.23 0.40 0.00 2.45 5.85 -1.98 -2.29 115.31 119.97 1wvi h LEU 3066Ca -0.48 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1wvi h LEU 3066Cb 1.36 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1wvi h LEU 3066CO 0.49 0.31 0.00 -0.62 -0.34 0.00 0.00 178.44 178.28 1wvi n GLU 3067N -4.47 0.05 0.00 1.25 4.71 -1.26 -2.31 120.64 118.62 1wvi n GLU 3067Ca 0.02 0.23 0.13 0.00 -0.01 0.00 0.00 57.16 57.53 1wvi n GLU 3067Cb 0.08 -1.50 0.43 0.00 -1.01 0.00 0.00 31.44 29.44 1wvi n GLU 3067CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1wvi n THR 3068N -1.44 0.00 -3.51 2.62 -2.24 -0.86 -4.76 114.28 104.09 1wvi n THR 3068Ca 0.04 -0.12 -0.42 0.00 -2.27 0.00 0.00 64.05 61.28 1wvi n THR 3068Cb 0.15 0.31 -0.10 0.00 -2.10 0.00 0.00 70.33 68.59 1wvi n THR 3068CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1wvi s ILE 3069N -2.47 4.93 -0.24 2.28 1.01 -0.98 0.60 121.20 126.34 1wvi s ILE 3069Ca 0.26 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 60.05 1wvi s ILE 3069Cb 0.19 -3.81 0.04 0.00 0.01 0.00 0.00 42.46 38.89 1wvi s ILE 3069CO 0.50 -0.35 -0.10 -0.47 0.00 0.00 0.00 174.94 174.52 1wvi s TYR 3070N 1.61 3.09 0.41 3.97 5.04 -0.02 -4.92 117.35 126.53 1wvi s TYR 3070Ca 0.04 -1.86 0.08 0.00 -2.44 0.00 0.00 57.07 52.89 1wvi s TYR 3070Cb -0.20 -1.99 -0.01 0.00 0.35 0.00 0.00 41.96 40.10 1wvi s TYR 3070CO 0.08 -0.80 0.43 0.95 -1.34 0.00 0.00 175.55 174.86 1wvi s THR 3071N 1.24 2.80 0.41 4.34 -4.23 -1.26 -2.44 115.64 116.50 1wvi s THR 3071Ca -0.02 -1.24 0.13 0.00 -1.18 0.00 0.00 61.69 59.38 1wvi s THR 3071Cb -0.17 -3.01 0.14 0.00 1.34 0.00 0.00 72.50 70.80 1wvi s THR 3071CO -0.06 -0.01 1.92 0.00 -0.54 0.00 0.00 174.62 175.93 1wvi h ALA 3072N 0.92 1.55 -0.21 3.99 0.00 -1.49 -1.43 119.26 122.59 1wvi h ALA 3072Ca -0.41 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 1wvi h ALA 3072Cb 1.27 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1wvi h ALA 3072CO 0.54 0.34 0.08 1.15 0.00 0.00 0.00 179.25 181.36 1wvi h THR 3073N 0.01 1.17 -0.45 0.00 2.02 -1.87 0.67 112.91 114.47 1wvi h THR 3073Ca 0.00 -0.53 -0.02 0.00 0.77 0.00 0.00 66.41 66.64 1wvi h THR 3073Cb 0.47 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.98 1wvi h THR 3073CO 0.03 0.17 0.21 -0.07 0.37 0.00 0.00 175.52 176.23 1wvi h LEU 3074N 0.19 0.59 -0.77 2.58 3.38 -1.83 -1.37 115.31 118.07 1wvi h LEU 3074Ca 0.07 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1wvi h LEU 3074Cb 0.19 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1wvi h LEU 3074CO -0.00 0.57 0.49 0.00 0.09 0.00 0.00 178.44 179.59 1wvi h ALA 3075N 1.05 0.98 -0.44 1.53 0.00 -1.12 -0.39 119.26 120.87 1wvi h ALA 3075Ca 0.15 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1wvi h ALA 3075Cb 0.14 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1wvi h ALA 3075CO -0.02 0.42 0.20 1.15 0.00 0.00 0.00 179.25 181.00 1wvi h THR 3076N 1.05 1.19 -0.60 0.00 2.02 -0.52 -0.67 112.91 115.37 1wvi h THR 3076Ca 0.28 -0.54 -0.09 0.00 0.77 0.00 0.00 66.41 66.83 1wvi h THR 3076Cb -0.09 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 1wvi h THR 3076CO -0.06 0.21 0.03 0.40 0.37 0.00 0.00 175.52 176.46 1wvi h ILE 3077N 0.57 1.26 -0.54 3.11 2.04 -0.94 -0.07 117.51 122.95 1wvi h ILE 3077Ca 0.15 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1wvi h ILE 3077Cb 0.14 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1wvi h ILE 3077CO -0.02 0.41 0.35 0.44 0.00 0.00 0.00 178.15 179.33 1wvi h ASP 3078N 0.95 0.62 -0.22 1.72 3.32 -0.80 0.81 116.42 122.82 1wvi h ASP 3078Ca 0.17 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 1wvi h ASP 3078Cb 0.53 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1wvi h ASP 3078CO 0.03 0.45 0.13 0.22 -1.72 0.00 0.00 179.24 178.35 1wvi h TYR 3079N 0.73 0.30 -0.64 4.55 3.20 -0.87 0.49 116.97 124.72 1wvi h TYR 3079Ca 0.20 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.12 1wvi h TYR 3079Cb -0.08 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.04 1wvi h TYR 3079CO -0.04 0.23 0.35 0.52 -1.64 0.00 0.00 178.16 177.59 1wvi h MET 3080N 0.27 0.64 -0.56 1.82 2.86 -0.50 -0.45 114.93 119.01 1wvi h MET 3080Ca 0.08 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.62 1wvi h MET 3080Cb 0.03 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 1wvi h MET 3080CO -0.01 0.42 0.09 -0.91 1.06 0.00 0.00 176.91 177.55 1wvi h ASN 3081N 0.66 0.84 -0.20 1.22 2.35 -0.37 -2.60 115.58 117.48 1wvi h ASN 3081Ca 0.28 -0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 55.83 1wvi h ASN 3081Cb 0.17 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1wvi h ASN 3081CO -0.18 0.85 0.02 0.44 -1.65 0.00 0.00 177.43 176.92 1wvi h ASP 3082N 0.84 0.32 0.53 5.81 3.45 0.02 -2.97 116.42 124.42 1wvi h ASP 3082Ca 0.17 -0.27 -0.02 0.00 0.43 0.00 0.00 57.03 57.34 1wvi h ASP 3082Cb 0.38 -0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 39.06 1wvi h ASP 3082CO 0.01 0.51 -0.10 0.24 -1.57 0.00 0.00 179.24 178.33 1wvi h MET 3083N 0.11 0.00 -6.62 3.56 2.86 -1.04 -3.48 114.93 110.33 1wvi h MET 3083Ca 0.06 0.00 -0.45 0.00 -2.06 0.00 0.00 59.70 57.25 1wvi h MET 3083Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1wvi h MET 3083CO 0.01 0.10 -0.97 0.36 1.06 0.00 0.00 176.91 177.46 1wvi n LYS 3084N -3.42 -1.37 -4.21 1.72 2.85 -0.99 -5.02 118.16 107.72 1wvi n LYS 3084Ca -0.01 0.74 -0.29 0.00 -1.05 0.00 0.00 58.31 57.70 1wvi n LYS 3084Cb 0.26 -2.71 -0.03 0.00 -0.65 0.00 0.00 35.03 31.89 1wvi n LYS 3084CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1wvi n ARG 3085N -2.86 0.75 -0.57 -1.58 3.00 -1.26 -5.07 116.66 109.06 1wvi n ARG 3085Ca -0.26 -3.50 -0.18 0.00 -0.01 0.00 0.00 57.85 53.90 1wvi n ARG 3085Cb 0.66 0.67 0.01 0.00 0.00 0.00 0.00 32.46 33.80 1wvi n ARG 3085CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1wvi n GLY 3086N -1.19 -1.58 2.19 -0.13 0.00 -1.26 -4.77 105.19 98.46 1wvi n GLY 3086Ca -0.12 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 1wvi n GLY 3086CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wvi n LYS 3087N 0.75 2.16 -4.15 1.61 4.01 -1.26 -4.72 118.16 116.56 1wvi n LYS 3087Ca 0.03 -2.13 -0.15 0.00 -0.51 0.00 0.00 58.31 55.55 1wvi n LYS 3087Cb 0.22 -1.91 -0.11 0.00 -0.51 0.00 0.00 35.03 32.73 1wvi n LYS 3087CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1wvi s THR 3088N -2.72 0.90 -0.10 -0.18 -4.23 -1.26 -2.48 115.64 105.57 1wvi s THR 3088Ca 0.46 -1.40 -0.30 0.00 -1.18 0.00 0.00 61.69 59.27 1wvi s THR 3088Cb 0.33 -1.09 0.07 0.00 1.34 0.00 0.00 72.50 73.16 1wvi s THR 3088CO -0.10 -0.41 0.71 0.00 -0.54 0.00 0.00 174.62 174.28 1wvi s ALA 3089N -1.82 -1.78 -0.19 3.99 0.00 -0.90 -2.34 121.76 118.71 1wvi s ALA 3089Ca -0.01 1.46 -0.04 0.00 0.00 0.00 0.00 51.96 53.37 1wvi s ALA 3089Cb -0.07 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.77 1wvi s ALA 3089CO 0.01 -0.36 -0.02 -0.47 0.00 0.00 0.00 175.76 174.92 1wvi s TYR 3090N -0.91 3.01 -0.07 0.00 5.04 -0.27 -2.49 117.35 121.67 1wvi s TYR 3090Ca -0.08 -0.49 0.05 0.00 -2.44 0.00 0.00 57.07 54.10 1wvi s TYR 3090Cb -0.01 -2.05 -0.01 0.00 0.35 0.00 0.00 41.96 40.24 1wvi s TYR 3090CO 0.08 -0.23 -0.21 0.08 -1.34 0.00 0.00 175.55 173.92 1wvi s VAL 3091N 0.89 2.39 -0.21 3.14 1.01 -1.26 -1.16 120.40 125.20 1wvi s VAL 3091Ca 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 1wvi s VAL 3091Cb -0.14 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 1wvi s VAL 3091CO 0.02 0.57 -0.06 -0.63 0.00 0.00 0.00 175.10 175.00 1wvi s ILE 3092N -0.14 3.29 -3.60 2.22 1.01 0.02 -4.97 121.20 119.02 1wvi s ILE 3092Ca -0.03 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.09 1wvi s ILE 3092Cb -0.14 -2.49 0.00 0.00 0.01 0.00 0.00 42.46 39.84 1wvi s ILE 3092CO 0.04 0.43 0.00 0.61 0.00 0.00 0.00 174.94 176.02 1wvi n GLY 3093N 4.72 -1.71 3.75 6.18 0.00 -1.26 -0.68 105.19 116.19 1wvi n GLY 3093Ca -0.18 -1.15 -0.30 0.00 0.00 0.00 0.00 46.02 44.38 1wvi n GLY 3093CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wvi s GLU 3094N -1.63 1.90 0.34 1.61 0.41 -1.05 -4.76 118.70 115.51 1wvi s GLU 3094Ca 0.00 0.99 0.08 0.00 -0.41 0.00 0.00 54.97 55.64 1wvi s GLU 3094Cb 0.00 -1.87 0.80 0.00 -1.78 0.00 0.00 34.13 31.28 1wvi s GLU 3094CO 0.00 -1.84 1.82 0.00 -0.49 0.00 0.00 175.26 174.75 1wvi h THR 3095N -1.26 0.77 -0.24 3.63 1.03 -1.95 -2.02 112.91 112.86 1wvi h THR 3095Ca -0.46 -0.25 0.04 0.00 -0.01 0.00 0.00 66.41 65.74 1wvi h THR 3095Cb 1.25 -0.01 -0.04 0.00 -1.07 0.00 0.00 68.15 68.28 1wvi h THR 3095CO 0.53 0.13 -0.02 1.23 -0.01 0.00 0.00 175.52 177.39 1wvi h GLY 3096N 0.72 0.22 0.93 2.99 0.00 -1.88 0.38 103.07 106.42 1wvi h GLY 3096Ca 0.51 0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.86 1wvi h GLY 3096CO -0.28 -0.06 0.11 -2.00 0.00 0.00 0.00 176.54 174.31 1wvi h LEU 3097N 0.05 0.53 -1.13 3.11 5.85 -1.49 -0.77 115.31 121.47 1wvi h LEU 3097Ca 0.12 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1wvi h LEU 3097Cb 0.16 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1wvi h LEU 3097CO -0.21 0.60 0.30 0.11 -0.34 0.00 0.00 178.44 178.90 1wvi h LYS 3098N 0.44 0.91 0.04 1.25 1.57 -1.21 -2.04 116.57 117.54 1wvi h LYS 3098Ca 0.12 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1wvi h LYS 3098Cb 0.26 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1wvi h LYS 3098CO -0.00 0.71 -0.02 -0.22 -0.57 0.00 0.00 179.45 179.35 1wvi h LYS 3099N 0.91 -0.05 -0.98 3.15 3.64 -0.69 -2.41 116.57 120.14 1wvi h LYS 3099Ca 0.22 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.72 1wvi h LYS 3099Cb 0.10 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 31.85 1wvi h LYS 3099CO -0.03 0.36 0.61 0.00 -2.27 0.00 0.00 179.45 178.12 1wvi h ALA 3100N 0.45 1.46 -0.34 5.00 0.00 -0.94 0.84 119.26 125.73 1wvi h ALA 3100Ca -0.01 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1wvi h ALA 3100Cb 0.43 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1wvi h ALA 3100CO 0.01 0.23 -0.25 0.28 0.00 0.00 0.00 179.25 179.52 1wvi h VAL 3101N 0.98 1.29 -0.47 0.00 2.07 -1.36 -1.41 116.25 117.35 1wvi h VAL 3101Ca 0.48 -1.40 -0.04 0.00 0.82 0.00 0.00 66.70 66.56 1wvi h VAL 3101Cb 0.45 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1wvi h VAL 3101CO -0.26 0.46 0.13 0.00 0.02 0.00 0.00 177.57 177.92 1wvi h ALA 3102N 0.76 0.62 0.00 1.67 0.00 -0.84 -2.28 119.26 119.19 1wvi h ALA 3102Ca 0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1wvi h ALA 3102Cb 0.81 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1wvi h ALA 3102CO 0.07 0.30 -0.03 0.93 0.00 0.00 0.00 179.25 180.52 1wvi h GLU 3103N 0.64 0.00 -0.01 0.00 5.08 -0.81 -1.47 114.58 118.01 1wvi h GLU 3103Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1wvi h GLU 3103Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1wvi h GLU 3103CO -0.00 0.03 0.00 0.00 -1.00 0.00 0.00 179.01 178.04 1wvi n ALA 3104N -2.12 2.64 0.00 3.43 0.00 -0.54 -4.86 120.51 119.06 1wvi n ALA 3104Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1wvi n ALA 3104Cb 0.29 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1wvi n ALA 3104CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wvi n GLY 3105N 0.90 0.89 3.20 0.00 0.00 -0.56 -5.07 105.19 104.55 1wvi n GLY 3105Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1wvi n GLY 3105CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wvi s TYR 3106N -2.00 3.45 0.44 1.61 1.51 -0.93 -4.69 117.35 116.74 1wvi s TYR 3106Ca 0.00 -1.95 -0.23 0.00 -1.01 0.00 0.00 57.07 53.88 1wvi s TYR 3106Cb 0.00 -3.25 -0.08 0.00 -0.11 0.00 0.00 41.96 38.52 1wvi s TYR 3106CO 0.00 -0.95 1.09 -0.98 -1.11 0.00 0.00 175.55 173.60 1wvi s ARG 3107N 1.31 3.92 0.08 -0.62 1.70 -1.04 -3.57 118.95 120.73 1wvi s ARG 3107Ca 0.05 1.57 -0.31 0.00 -0.47 0.00 0.00 55.73 56.57 1wvi s ARG 3107Cb -0.24 -2.38 -0.08 0.00 -0.57 0.00 0.00 34.95 31.68 1wvi s ARG 3107CO -0.01 -0.36 1.52 -1.21 -1.08 0.00 0.00 175.30 174.15 1wvi s GLU 3108N -2.75 4.25 -0.20 3.89 0.41 -1.26 -2.12 118.70 120.93 1wvi s GLU 3108Ca 0.62 2.18 -0.05 0.00 -0.41 0.00 0.00 54.97 57.32 1wvi s GLU 3108Cb -0.23 -3.45 0.07 0.00 -1.78 0.00 0.00 34.13 28.74 1wvi s GLU 3108CO 0.28 -0.61 0.09 0.34 -0.49 0.00 0.00 175.26 174.88 1wvi s ASP 3109N 1.79 2.64 0.00 -0.19 -1.08 -1.04 -4.90 116.67 113.88 1wvi s ASP 3109Ca 0.69 -0.77 0.24 0.00 -0.52 0.00 0.00 52.55 52.18 1wvi s ASP 3109Cb -0.38 -0.30 0.94 0.00 -1.46 0.00 0.00 42.92 41.73 1wvi s ASP 3109CO 0.30 -0.37 1.66 -1.54 0.52 0.00 0.00 175.17 175.75 1wvi n SER 3110N 5.25 1.39 -0.08 -0.34 3.41 -1.26 -3.61 113.62 118.38 1wvi n SER 3110Ca -0.07 -1.58 -0.11 0.00 -0.26 0.00 0.00 58.87 56.85 1wvi n SER 3110Cb 0.47 -0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.33 1wvi n SER 3110CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1wvi n GLU 3111N 0.12 0.48 -2.74 4.33 -0.58 -1.26 -4.81 120.64 116.18 1wvi n GLU 3111Ca 0.17 0.19 -0.16 0.00 -0.42 0.00 0.00 57.16 56.95 1wvi n GLU 3111Cb 0.31 -1.34 0.01 0.00 -0.57 0.00 0.00 31.44 29.85 1wvi n GLU 3111CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1wvi n ASN 3112N -4.31 2.27 -4.73 1.62 4.13 -1.26 -4.69 115.26 108.29 1wvi n ASN 3112Ca -0.19 -3.06 -0.35 0.00 1.68 0.00 0.00 54.58 52.67 1wvi n ASN 3112Cb 0.53 -0.53 0.08 0.00 -1.54 0.00 0.00 39.78 38.32 1wvi n ASN 3112CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1wvi s PRO 3113N -3.11 2.30 0.18 3.52 0.04 -1.24 -4.91 135.00 131.77 1wvi s PRO 3113Ca 0.36 1.77 0.10 0.00 0.04 0.00 0.00 61.00 63.26 1wvi s PRO 3113Cb 0.41 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 33.04 1wvi s PRO 3113CO -0.05 -1.72 1.36 0.00 0.04 0.00 0.00 177.00 176.64 1wvi h ALA 3114N -0.09 0.50 -3.51 8.56 0.00 -1.75 -3.39 119.26 119.59 1wvi h ALA 3114Ca -0.48 -0.75 -0.41 0.00 0.00 0.00 0.00 54.91 53.27 1wvi h ALA 3114Cb 1.30 -0.13 -0.22 0.00 0.00 0.00 0.00 17.79 18.73 1wvi h ALA 3114CO 0.51 1.03 -0.78 0.71 0.00 0.00 0.00 179.25 180.71 1wvi s TYR 3115N -2.87 1.19 -0.22 0.00 2.02 -1.00 -0.85 117.35 115.61 1wvi s TYR 3115Ca 0.02 -0.43 0.01 0.00 -0.37 0.00 0.00 57.07 56.30 1wvi s TYR 3115Cb 0.10 -0.68 0.05 0.00 -0.40 0.00 0.00 41.96 41.03 1wvi s TYR 3115CO 0.79 0.04 -0.06 0.08 -1.57 0.00 0.00 175.55 174.83 1wvi s VAL 3116N -1.14 1.52 -0.14 0.71 1.01 -0.08 -1.12 120.40 121.17 1wvi s VAL 3116Ca -0.01 -1.12 -0.03 0.00 0.00 0.00 0.00 61.98 60.82 1wvi s VAL 3116Cb -0.09 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 1wvi s VAL 3116CO 0.02 -0.02 -0.05 -0.69 0.00 0.00 0.00 175.10 174.36 1wvi s VAL 3117N 1.41 3.81 -0.07 2.92 1.01 -0.30 -0.90 120.40 128.28 1wvi s VAL 3117Ca -0.04 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.55 1wvi s VAL 3117Cb -0.18 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.57 1wvi s VAL 3117CO -0.07 0.51 -0.08 -0.69 0.00 0.00 0.00 175.10 174.78 1wvi s VAL 3118N 0.15 0.84 0.17 2.92 1.01 -0.09 -0.80 120.40 124.60 1wvi s VAL 3118Ca -0.02 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.71 1wvi s VAL 3118Cb -0.14 -0.83 -0.01 0.00 0.00 0.00 0.00 36.38 35.41 1wvi s VAL 3118CO 0.03 0.30 0.08 0.61 0.00 0.00 0.00 175.10 176.12 1wvi n GLY 3119N 4.17 3.68 3.76 4.51 0.00 0.14 -1.15 105.19 120.30 1wvi n GLY 3119Ca -0.21 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.47 1wvi n GLY 3119CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wvi s LEU 3120N 0.00 4.37 -0.26 0.99 0.20 -1.26 -4.29 118.68 118.43 1wvi s LEU 3120Ca 0.11 2.82 -0.03 0.00 0.69 0.00 0.00 54.13 57.72 1wvi s LEU 3120Cb 0.01 -3.64 0.09 0.00 -0.43 0.00 0.00 46.19 42.21 1wvi s LEU 3120CO 0.08 -0.76 0.10 -0.62 -0.29 0.00 0.00 176.35 174.86 1wvi s ASP 3121N 0.13 3.29 0.00 3.68 -1.08 -1.26 -2.54 116.67 118.89 1wvi s ASP 3121Ca 0.57 -1.15 0.12 0.00 -0.52 0.00 0.00 52.55 51.57 1wvi s ASP 3121Cb -0.44 -0.45 0.71 0.00 -1.46 0.00 0.00 42.92 41.29 1wvi s ASP 3121CO 0.50 -0.40 1.16 0.35 0.52 0.00 0.00 175.17 177.31 1wvi n THR 3122N 5.16 0.00 -1.56 1.71 -2.24 -1.26 -1.65 114.28 114.44 1wvi n THR 3122Ca -0.06 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.79 1wvi n THR 3122Cb 0.44 -0.56 0.17 0.00 -2.10 0.00 0.00 70.33 68.28 1wvi n THR 3122CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1wvi n ASN 3123N -0.84 1.76 -4.63 3.42 4.13 -1.26 -5.06 115.26 112.77 1wvi n ASN 3123Ca 0.09 -3.49 -0.42 0.00 1.68 0.00 0.00 54.58 52.44 1wvi n ASN 3123Cb 0.04 -0.48 0.01 0.00 -1.54 0.00 0.00 39.78 37.81 1wvi n ASN 3123CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1wvi n LEU 3124N -1.03 2.88 -4.11 3.41 0.00 -0.66 -5.01 117.00 112.48 1wvi n LEU 3124Ca 0.17 1.09 -0.08 0.00 0.00 0.00 0.00 56.01 57.18 1wvi n LEU 3124Cb 0.72 -1.39 -0.10 0.00 0.00 0.00 0.00 43.42 42.65 1wvi n LEU 3124CO -0.03 -1.20 -0.35 0.42 0.00 0.00 0.00 177.39 176.23 1wvi s THR 3125N -1.21 0.24 0.22 1.96 -4.23 -1.26 -5.05 115.64 106.32 1wvi s THR 3125Ca 0.61 -1.84 -0.08 0.00 -1.18 0.00 0.00 61.69 59.20 1wvi s THR 3125Cb -0.57 -1.64 0.19 0.00 1.34 0.00 0.00 72.50 71.82 1wvi s THR 3125CO 0.58 -0.88 1.89 0.22 -0.54 0.00 0.00 174.62 175.89 1wvi h TYR 3126N 3.07 1.03 -0.75 3.99 3.20 -1.99 -2.45 116.97 123.07 1wvi h TYR 3126Ca -0.34 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.63 1wvi h TYR 3126Cb 1.15 -0.35 -0.07 0.00 1.54 0.00 0.00 36.73 39.01 1wvi h TYR 3126CO 0.52 0.63 0.42 1.49 -1.64 0.00 0.00 178.16 179.58 1wvi h GLU 3127N 1.10 0.72 -0.64 1.82 4.57 -1.98 0.22 114.58 120.38 1wvi h GLU 3127Ca 0.32 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.37 1wvi h GLU 3127Cb -0.08 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.32 1wvi h GLU 3127CO -0.08 0.47 0.07 0.87 -1.18 0.00 0.00 179.01 179.16 1wvi h LYS 3128N 0.74 1.07 -0.57 1.92 1.57 -1.86 0.33 116.57 119.77 1wvi h LYS 3128Ca 0.35 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1wvi h LYS 3128Cb 0.29 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1wvi h LYS 3128CO -0.22 1.00 0.14 -0.07 -0.57 0.00 0.00 179.45 179.73 1wvi h LEU 3129N 0.99 0.86 -0.39 2.94 4.07 -0.91 -1.45 115.31 121.41 1wvi h LEU 3129Ca 0.19 -0.23 -0.02 0.00 0.08 0.00 0.00 57.88 57.90 1wvi h LEU 3129Cb 0.47 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.97 1wvi h LEU 3129CO 0.02 0.87 0.18 0.74 -1.08 0.00 0.00 178.44 179.16 1wvi h THR 3130N 0.81 1.18 -0.28 0.22 2.02 -0.30 0.18 112.91 116.74 1wvi h THR 3130Ca 0.18 -0.53 0.02 0.00 0.77 0.00 0.00 66.41 66.85 1wvi h THR 3130Cb 0.34 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1wvi h THR 3130CO 0.00 0.20 0.14 -0.07 0.37 0.00 0.00 175.52 176.15 1wvi h LEU 3131N 0.50 0.20 -0.41 2.58 4.07 -0.71 -0.76 115.31 120.78 1wvi h LEU 3131Ca 0.13 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 58.09 1wvi h LEU 3131Cb 0.14 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 1wvi h LEU 3131CO -0.01 0.15 0.16 0.00 -1.08 0.00 0.00 178.44 177.66 1wvi h ALA 3132N 1.15 0.53 -0.14 1.53 0.00 -1.06 -1.90 119.26 119.38 1wvi h ALA 3132Ca 0.12 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1wvi h ALA 3132Cb 0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1wvi h ALA 3132CO -0.09 0.14 -0.01 1.15 0.00 0.00 0.00 179.25 180.44 1wvi h THR 3133N 0.52 0.89 -0.46 0.00 2.02 -0.25 -0.10 112.91 115.52 1wvi h THR 3133Ca 0.14 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.30 1wvi h THR 3133Cb 0.19 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1wvi h THR 3133CO -0.01 0.01 0.27 -0.07 0.37 0.00 0.00 175.52 176.09 1wvi h LEU 3134N 0.03 0.55 -0.53 2.58 4.07 -1.08 -1.38 115.31 119.55 1wvi h LEU 3134Ca 0.06 -0.06 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1wvi h LEU 3134Cb 0.08 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.66 1wvi h LEU 3134CO -0.12 0.45 0.28 0.00 -1.08 0.00 0.00 178.44 177.97 1wvi h ALA 3135N 1.13 0.68 -0.28 1.53 0.00 -1.09 -2.04 119.26 119.20 1wvi h ALA 3135Ca 0.16 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1wvi h ALA 3135Cb -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1wvi h ALA 3135CO -0.03 0.22 0.17 0.82 0.00 0.00 0.00 179.25 180.43 1wvi h ILE 3136N 0.71 1.10 -0.59 0.00 2.04 -0.82 -1.82 117.51 118.13 1wvi h ILE 3136Ca 0.18 -0.23 0.12 0.00 1.00 0.00 0.00 64.86 65.93 1wvi h ILE 3136Cb 0.08 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1wvi h ILE 3136CO -0.03 0.10 0.40 1.56 0.00 0.00 0.00 178.15 180.18 1wvi h GLN 3137N 0.36 0.28 0.00 2.37 4.20 -0.93 0.83 115.11 122.21 1wvi h GLN 3137Ca 0.10 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1wvi h GLN 3137Cb 0.01 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.73 1wvi h GLN 3137CO -0.02 0.18 0.00 1.63 -0.67 0.00 0.00 178.83 179.95 1wvi n LYS 3138N -4.45 0.47 0.00 1.46 5.02 -0.72 -4.88 118.16 115.05 1wvi n LYS 3138Ca 0.10 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1wvi n LYS 3138Cb 0.45 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 1wvi n LYS 3138CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wvi n GLY 3139N 1.06 0.94 3.75 0.72 0.00 0.28 -5.10 105.19 106.85 1wvi n GLY 3139Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1wvi n GLY 3139CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wvi s ALA 3140N -2.00 2.85 -0.26 4.61 0.00 -1.01 -4.90 121.76 121.05 1wvi s ALA 3140Ca 0.00 1.36 -0.29 0.00 0.00 0.00 0.00 51.96 53.03 1wvi s ALA 3140Cb 0.00 -3.58 -0.00 0.00 0.00 0.00 0.00 23.12 19.54 1wvi s ALA 3140CO 0.00 -1.38 1.32 0.08 0.00 0.00 0.00 175.76 175.78 1wvi s VAL 3141N -1.29 4.13 -0.45 0.00 1.01 -0.03 -4.72 120.40 119.05 1wvi s VAL 3141Ca 0.71 1.29 -0.26 0.00 0.00 0.00 0.00 61.98 63.72 1wvi s VAL 3141Cb -0.41 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 31.92 1wvi s VAL 3141CO 0.49 -0.38 0.95 0.12 0.00 0.00 0.00 175.10 176.27 1wvi s PHE 3142N 4.26 2.93 -0.05 5.22 5.99 -1.26 -0.90 117.98 134.17 1wvi s PHE 3142Ca 0.57 0.46 0.06 0.00 0.00 0.00 0.00 56.93 58.02 1wvi s PHE 3142Cb -0.19 -3.98 -0.01 0.00 0.00 0.00 0.00 43.02 38.84 1wvi s PHE 3142CO 0.22 -1.09 -0.24 0.42 -0.00 0.00 0.00 175.22 174.54 1wvi s ILE 3143N 3.79 2.21 -0.10 3.12 1.01 -0.08 -1.01 121.20 130.14 1wvi s ILE 3143Ca 0.38 -1.02 -0.00 0.00 0.00 0.00 0.00 60.65 60.01 1wvi s ILE 3143Cb -0.10 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 1wvi s ILE 3143CO 0.26 0.57 -0.08 -0.83 0.00 0.00 0.00 174.94 174.87 1wvi s GLY 3144N -0.29 1.67 0.10 6.18 0.00 -0.12 -0.91 107.32 113.95 1wvi s GLY 3144Ca 0.01 -0.88 -0.14 0.00 0.00 0.00 0.00 44.72 43.71 1wvi s GLY 3144CO 0.02 -0.46 1.38 -0.91 0.00 0.00 0.00 173.10 173.13 1wvi h THR 3145N 4.64 1.30 -2.88 0.90 1.35 -1.45 -0.90 112.91 115.88 1wvi h THR 3145Ca -0.41 -1.64 -0.08 0.00 -0.55 0.00 0.00 66.41 63.73 1wvi h THR 3145Cb 1.18 1.72 -0.18 0.00 -1.73 0.00 0.00 68.15 69.15 1wvi h THR 3145CO 0.55 0.52 -0.10 0.54 -0.25 0.00 0.00 175.52 176.78 1wvi s ASN 3146N -6.74 -0.32 0.00 5.36 6.03 -1.26 -0.11 114.94 117.91 1wvi s ASN 3146Ca -0.12 0.12 0.26 0.00 -1.03 0.00 0.00 52.86 52.10 1wvi s ASN 3146Cb 0.09 0.41 0.68 0.00 -3.03 0.00 0.00 41.25 39.40 1wvi s ASN 3146CO 0.85 -0.60 1.53 -0.81 -2.03 0.00 0.00 177.10 176.05 1wvi n PRO 3147N 0.76 0.11 -1.67 3.55 -0.04 -1.26 -3.44 135.00 133.00 1wvi n PRO 3147Ca -0.19 -0.05 -0.60 0.00 -0.04 0.00 0.00 63.50 62.61 1wvi n PRO 3147Cb 0.58 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.47 1wvi n PRO 3147CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wvi n ASP 3148N -1.40 1.49 0.16 3.54 8.00 -1.26 -3.81 116.55 123.27 1wvi n ASP 3148Ca 0.07 1.13 0.04 0.00 0.71 0.00 0.00 54.79 56.74 1wvi n ASP 3148Cb 0.33 -1.03 0.17 0.00 -0.02 0.00 0.00 41.12 40.58 1wvi n ASP 3148CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1wvi h LEU 3149N 5.36 0.00 -8.73 0.64 -0.00 -1.90 0.38 115.31 111.06 1wvi h LEU 3149Ca -0.47 0.00 -0.34 0.00 -0.00 0.00 0.00 57.88 57.07 1wvi h LEU 3149Cb 1.36 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 41.87 1wvi h LEU 3149CO 0.88 0.47 -0.69 0.20 -0.00 0.00 0.00 178.44 179.30 1wvi s ASN 3150N -6.46 1.74 -0.15 -0.43 0.01 -1.26 -0.42 114.94 107.98 1wvi s ASN 3150Ca 0.02 -1.10 -0.01 0.00 -0.71 0.00 0.00 52.86 51.06 1wvi s ASN 3150Cb 0.09 0.01 0.04 0.00 0.41 0.00 0.00 41.25 41.80 1wvi s ASN 3150CO 0.72 -0.42 -0.05 -0.51 -1.51 0.00 0.00 177.10 175.34 1wvi s ILE 3151N -3.39 0.98 -0.16 0.60 1.10 0.26 -4.46 121.20 116.12 1wvi s ILE 3151Ca 0.21 -0.48 -0.29 0.00 -0.51 0.00 0.00 60.65 59.58 1wvi s ILE 3151Cb 0.04 -1.14 -0.00 0.00 0.15 0.00 0.00 42.46 41.50 1wvi s ILE 3151CO 0.03 0.17 1.06 -2.16 -2.11 0.00 0.00 174.94 171.93 1wvi s PRO 3152N 1.70 4.33 0.37 3.50 0.04 -1.26 -1.48 135.00 142.20 1wvi s PRO 3152Ca 0.02 1.42 0.04 0.00 0.04 0.00 0.00 61.00 62.52 1wvi s PRO 3152Cb -0.15 -3.60 -0.05 0.00 0.04 0.00 0.00 34.50 30.74 1wvi s PRO 3152CO -0.08 -0.49 0.07 0.95 0.04 0.00 0.00 177.00 177.49 1wvi s THR 3153N 2.66 1.03 0.51 1.26 -4.23 -0.15 -4.98 115.64 111.73 1wvi s THR 3153Ca 0.48 -2.00 0.40 0.00 -1.18 0.00 0.00 61.69 59.39 1wvi s THR 3153Cb -0.18 -2.62 0.42 0.00 1.34 0.00 0.00 72.50 71.47 1wvi s THR 3153CO 0.13 0.00 2.26 -0.08 -0.54 0.00 0.00 174.62 176.38 1wvi h GLU 3154N 1.95 0.00 0.00 3.99 4.57 -2.05 0.27 114.58 123.31 1wvi h GLU 3154Ca -0.39 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 1wvi h GLU 3154Cb 1.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 1wvi h GLU 3154CO 0.66 0.01 -0.31 -0.09 -1.18 0.00 0.00 179.01 178.10 1wvi h ARG 3155N 0.00 0.00 0.00 1.92 2.43 -1.98 -3.50 114.38 113.25 1wvi h ARG 3155Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1wvi h ARG 3155Cb 0.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1wvi h ARG 3155CO 0.00 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.87 1wvi n GLY 3156N 1.22 0.69 3.52 2.80 0.00 0.08 -4.98 105.19 108.53 1wvi n GLY 3156Ca 0.04 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.55 1wvi n GLY 3156CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wvi s LEU 3157N 0.00 3.79 0.53 0.99 1.43 -1.26 -0.98 118.68 123.18 1wvi s LEU 3157Ca 0.00 -1.20 -0.01 0.00 -1.03 0.00 0.00 54.13 51.90 1wvi s LEU 3157Cb 0.00 -2.52 0.02 0.00 0.03 0.00 0.00 46.19 43.72 1wvi s LEU 3157CO 0.00 -1.52 0.78 -0.76 0.23 0.00 0.00 176.35 175.08 1wvi s LEU 3158N 4.68 3.36 0.17 1.79 1.02 -0.55 -4.85 118.68 124.31 1wvi s LEU 3158Ca 0.37 0.26 -0.32 0.00 0.02 0.00 0.00 54.13 54.46 1wvi s LEU 3158Cb -0.06 -3.11 -0.11 0.00 0.02 0.00 0.00 46.19 42.93 1wvi s LEU 3158CO 0.00 -1.01 1.78 -2.65 0.02 0.00 0.00 176.35 174.49 1wvi n PRO 3159N -2.34 2.80 -2.86 1.29 -0.02 -1.26 -0.58 135.00 132.04 1wvi n PRO 3159Ca 0.05 1.01 -0.21 0.00 -2.02 0.00 0.00 63.50 62.33 1wvi n PRO 3159Cb 0.59 -2.88 0.09 0.00 -0.02 0.00 0.00 33.50 31.27 1wvi n PRO 3159CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1wvi s GLY 3160N 1.86 1.73 0.24 -1.23 0.00 0.44 -4.44 107.32 105.93 1wvi s GLY 3160Ca 0.78 -2.03 -0.04 0.00 0.00 0.00 0.00 44.72 43.43 1wvi s GLY 3160CO 0.34 -1.49 1.81 0.00 0.00 0.00 0.00 173.10 173.76 1wvi h ALA 3161N -0.16 1.18 -0.49 3.20 0.00 -1.81 -1.48 119.26 119.70 1wvi h ALA 3161Ca -0.32 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.68 1wvi h ALA 3161Cb 1.28 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 1wvi h ALA 3161CO 0.39 0.09 0.33 0.78 0.00 0.00 0.00 179.25 180.85 1wvi h GLY 3162N 0.78 0.57 0.96 0.00 0.00 -0.27 0.69 103.07 105.80 1wvi h GLY 3162Ca 0.40 -0.19 -0.10 0.00 0.00 0.00 0.00 47.33 47.44 1wvi h GLY 3162CO -0.25 0.15 -0.18 0.00 0.00 0.00 0.00 176.54 176.26 1wvi h ALA 3163N 1.73 0.47 -0.48 3.60 0.00 -1.38 -1.29 119.26 121.90 1wvi h ALA 3163Ca 0.21 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1wvi h ALA 3163Cb 0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1wvi h ALA 3163CO -0.05 0.40 0.18 0.82 0.00 0.00 0.00 179.25 180.59 1wvi h ILE 3164N 0.48 1.22 -0.80 0.00 2.04 -1.14 -2.48 117.51 116.83 1wvi h ILE 3164Ca 0.07 -0.70 0.08 0.00 1.00 0.00 0.00 64.86 65.31 1wvi h ILE 3164Cb 0.72 0.77 -0.07 0.00 -0.74 0.00 0.00 36.82 37.50 1wvi h ILE 3164CO 0.05 0.26 0.47 -0.07 0.00 0.00 0.00 178.15 178.86 1wvi h LEU 3165N 0.64 0.69 -1.00 1.44 3.38 -0.74 -1.79 115.31 117.94 1wvi h LEU 3165Ca 0.16 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 1wvi h LEU 3165Cb 0.23 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1wvi h LEU 3165CO -0.01 0.42 0.11 -0.26 0.09 0.00 0.00 178.44 178.79 1wvi h PHE 3166N 0.82 0.87 -0.14 1.13 0.04 -0.86 0.16 116.94 118.96 1wvi h PHE 3166Ca 0.37 -0.09 0.02 0.00 2.80 0.00 0.00 57.97 61.07 1wvi h PHE 3166Cb 0.27 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.14 1wvi h PHE 3166CO -0.06 0.74 -0.00 1.25 -0.60 0.00 0.00 178.31 179.64 1wvi h LEU 3167N 0.80 -0.06 -0.66 1.54 7.12 -0.91 0.20 115.31 123.34 1wvi h LEU 3167Ca 0.17 0.03 -0.07 0.00 0.13 0.00 0.00 57.88 58.14 1wvi h LEU 3167Cb 0.32 0.06 -0.03 0.00 -0.53 0.00 0.00 40.66 40.48 1wvi h LEU 3167CO 0.00 -0.01 0.14 -0.07 -0.13 0.00 0.00 178.44 178.37 1wvi h LEU 3168N 0.04 1.03 -0.42 2.25 3.38 -0.96 -1.13 115.31 119.50 1wvi h LEU 3168Ca 0.06 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.80 1wvi h LEU 3168Cb 0.08 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1wvi h LEU 3168CO -0.11 1.01 0.26 -0.08 0.09 0.00 0.00 178.44 179.61 1wvi h GLU 3169N 1.00 0.51 -0.59 1.13 4.81 -0.30 -0.15 114.58 120.98 1wvi h GLU 3169Ca 0.21 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1wvi h GLU 3169Cb 0.40 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 1wvi h GLU 3169CO 0.01 0.34 0.28 0.87 -0.73 0.00 0.00 179.01 179.78 1wvi h LYS 3170N 0.52 0.85 0.00 1.92 1.79 -0.67 0.50 116.57 121.49 1wvi h LYS 3170Ca 0.17 -0.13 -0.09 0.00 -2.18 0.00 0.00 60.65 58.42 1wvi h LYS 3170Cb -0.01 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.47 1wvi h LYS 3170CO -0.07 0.69 -0.44 0.00 -1.08 0.00 0.00 179.45 178.56 1wvi h ALA 3171N 1.12 1.19 0.00 3.86 0.00 -0.81 -3.31 119.26 121.29 1wvi h ALA 3171Ca 0.20 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1wvi h ALA 3171Cb 0.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1wvi h ALA 3171CO -0.03 0.55 -1.29 0.25 0.00 0.00 0.00 179.25 178.73 1wvi n THR 3172N -3.89 0.00 -1.08 0.00 -2.24 -0.10 -5.00 114.28 101.97 1wvi n THR 3172Ca -0.01 -0.27 -0.03 0.00 -2.27 0.00 0.00 64.05 61.47 1wvi n THR 3172Cb 0.48 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 69.13 1wvi n THR 3172CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1wvi n ARG 3173N -1.75 -0.80 -4.65 -0.78 1.74 0.18 -4.96 116.66 105.63 1wvi n ARG 3173Ca -0.01 0.40 -0.33 0.00 -0.77 0.00 0.00 57.85 57.13 1wvi n ARG 3173Cb 0.29 -4.12 -0.14 0.00 -1.02 0.00 0.00 32.46 27.47 1wvi n ARG 3173CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1wvi s VAL 3174N -1.79 3.11 0.04 1.55 -7.23 -1.23 -5.04 120.40 109.81 1wvi s VAL 3174Ca 0.00 -0.63 -0.30 0.00 -1.81 0.00 0.00 61.98 59.23 1wvi s VAL 3174Cb 0.00 -2.32 -0.05 0.00 0.56 0.00 0.00 36.38 34.57 1wvi s VAL 3174CO 0.00 0.51 1.14 -0.54 -0.31 0.00 0.00 175.10 175.90 1wvi s LYS 3175N 0.49 4.46 0.42 4.82 -0.14 -1.26 -4.42 119.74 124.11 1wvi s LYS 3175Ca -0.08 1.67 -0.22 0.00 -1.36 0.00 0.00 55.97 55.97 1wvi s LYS 3175Cb -0.16 -3.39 -0.09 0.00 -1.68 0.00 0.00 37.83 32.51 1wvi s LYS 3175CO 0.04 -0.21 1.01 -1.25 -0.76 0.00 0.00 175.35 174.18 1wvi s PRO 3176N 1.11 4.11 -0.30 -1.68 0.04 -1.26 -4.93 135.00 132.09 1wvi s PRO 3176Ca 0.57 1.36 -0.24 0.00 0.04 0.00 0.00 61.00 62.73 1wvi s PRO 3176Cb -0.27 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 31.92 1wvi s PRO 3176CO 0.28 -0.16 0.81 -1.50 0.04 0.00 0.00 177.00 176.48 1wvi s ILE 3177N -1.87 4.77 -0.18 0.56 1.10 -0.18 -4.82 121.20 120.59 1wvi s ILE 3177Ca 0.61 1.26 -0.13 0.00 -0.51 0.00 0.00 60.65 61.88 1wvi s ILE 3177Cb -0.17 -4.17 -0.05 0.00 0.15 0.00 0.00 42.46 38.23 1wvi s ILE 3177CO 0.22 -0.25 0.25 -0.63 -2.11 0.00 0.00 174.94 172.41 1wvi s ILE 3178N 3.00 5.33 -0.16 2.00 1.01 -1.26 -0.94 121.20 130.19 1wvi s ILE 3178Ca 0.34 0.45 -0.20 0.00 0.00 0.00 0.00 60.65 61.23 1wvi s ILE 3178Cb -0.14 -3.59 -0.17 0.00 0.01 0.00 0.00 42.46 38.57 1wvi s ILE 3178CO 0.12 0.39 0.36 0.40 0.00 0.00 0.00 174.94 176.22 1wvi h ILE 3179N 4.71 1.03 -3.13 2.92 1.08 -1.28 -3.44 117.51 119.40 1wvi h ILE 3179Ca -0.41 -1.94 -0.42 0.00 -0.39 0.00 0.00 64.86 61.70 1wvi h ILE 3179Cb 1.16 2.11 0.22 0.00 -3.07 0.00 0.00 36.82 37.24 1wvi h ILE 3179CO 0.75 0.35 -0.04 -0.83 -0.69 0.00 0.00 178.15 177.70 1wvi s GLY 3180N -4.34 1.51 0.42 5.37 0.00 0.84 -2.25 107.32 108.87 1wvi s GLY 3180Ca -0.19 -0.26 -0.26 0.00 0.00 0.00 0.00 44.72 44.01 1wvi s GLY 3180CO 0.50 0.53 1.31 0.28 0.00 0.00 0.00 173.10 175.72 1wvi n LYS 3181N -5.14 2.03 -0.61 2.90 5.02 -1.26 -0.41 118.16 120.69 1wvi n LYS 3181Ca 0.04 0.72 -0.01 0.00 -2.02 0.00 0.00 58.31 57.04 1wvi n LYS 3181Cb 0.55 -2.43 0.21 0.00 -0.02 0.00 0.00 35.03 33.34 1wvi n LYS 3181CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1wvi n PRO 3182N 0.06 2.99 -1.50 1.97 -0.04 -1.25 -4.48 135.00 132.74 1wvi n PRO 3182Ca 0.06 -1.92 -0.30 0.00 -0.04 0.00 0.00 63.50 61.30 1wvi n PRO 3182Cb 0.40 -1.91 0.10 0.00 -0.04 0.00 0.00 33.50 32.05 1wvi n PRO 3182CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1wvi s GLU 3183N -2.07 1.89 0.13 0.54 0.41 0.45 -4.46 118.70 115.59 1wvi s GLU 3183Ca 0.34 0.64 -0.17 0.00 -0.41 0.00 0.00 54.97 55.37 1wvi s GLU 3183Cb 0.27 -1.90 -0.02 0.00 -1.78 0.00 0.00 34.13 30.70 1wvi s GLU 3183CO 0.09 -1.76 1.71 0.00 -0.49 0.00 0.00 175.26 174.82 1wvi h ALA 3184N -1.19 0.46 -0.34 5.21 0.00 -1.85 -3.30 119.26 118.26 1wvi h ALA 3184Ca -0.48 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.39 1wvi h ALA 3184Cb 1.28 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 1wvi h ALA 3184CO 0.59 0.02 0.02 0.28 0.00 0.00 0.00 179.25 180.15 1wvi h VAL 3185N 0.45 0.77 -0.44 0.00 2.07 -1.85 0.23 116.25 117.47 1wvi h VAL 3185Ca 0.12 -0.04 -0.09 0.00 0.82 0.00 0.00 66.70 67.51 1wvi h VAL 3185Cb 0.11 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 1wvi h VAL 3185CO -0.02 0.02 -0.09 -0.29 0.02 0.00 0.00 177.57 177.21 1wvi h ILE 3186N 0.12 1.25 -0.42 4.57 2.10 -1.57 -1.84 117.51 121.71 1wvi h ILE 3186Ca 0.16 -1.14 -0.14 0.00 1.08 0.00 0.00 64.86 64.83 1wvi h ILE 3186Cb 0.22 1.02 -0.01 0.00 -1.09 0.00 0.00 36.82 36.95 1wvi h ILE 3186CO -0.26 0.39 -0.27 0.24 -1.08 0.00 0.00 178.15 177.17 1wvi h MET 3187N 0.71 0.93 -0.20 2.19 2.86 -1.51 -0.10 114.93 119.81 1wvi h MET 3187Ca 0.12 -0.43 -0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1wvi h MET 3187Cb 0.56 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 1wvi h MET 3187CO 0.03 1.09 0.10 -0.91 1.06 0.00 0.00 176.91 178.29 1wvi h ASN 3188N 0.75 0.25 -0.48 1.22 -0.26 -0.36 0.22 115.58 116.92 1wvi h ASN 3188Ca 0.09 -0.10 -0.09 0.00 -0.56 0.00 0.00 56.30 55.64 1wvi h ASN 3188Cb 0.85 -0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 38.03 1wvi h ASN 3188CO 0.07 0.27 -0.04 0.11 -1.06 0.00 0.00 177.43 176.79 1wvi h LYS 3189N 0.20 0.87 -0.63 0.81 1.79 -1.30 -0.21 116.57 118.10 1wvi h LYS 3189Ca 0.07 -0.30 -0.01 0.00 -2.18 0.00 0.00 60.65 58.23 1wvi h LYS 3189Cb 0.08 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.64 1wvi h LYS 3189CO -0.01 0.93 0.34 0.00 -1.08 0.00 0.00 179.45 179.63 1wvi h ALA 3190N 0.91 0.81 -0.89 3.86 0.00 -0.87 -0.58 119.26 122.49 1wvi h ALA 3190Ca 0.13 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1wvi h ALA 3190Cb 0.57 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 1wvi h ALA 3190CO 0.03 0.33 0.59 1.25 0.00 0.00 0.00 179.25 181.45 1wvi h LEU 3191N 0.86 1.00 -0.32 0.00 6.46 -0.70 0.28 115.31 122.89 1wvi h LEU 3191Ca 0.22 -0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.94 1wvi h LEU 3191Cb 0.05 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 39.72 1wvi h LEU 3191CO -0.04 0.71 0.13 -0.78 -0.62 0.00 0.00 178.44 177.84 1wvi h ASP 3192N 1.18 0.44 0.37 1.25 1.82 0.05 -2.27 116.42 119.25 1wvi h ASP 3192Ca 0.34 -0.17 -0.07 0.00 -0.39 0.00 0.00 57.03 56.73 1wvi h ASP 3192Cb -0.08 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 39.80 1wvi h ASP 3192CO -0.08 0.49 -0.36 0.03 -1.61 0.00 0.00 179.24 177.71 1wvi h ARG 3193N 0.37 0.00 0.00 0.28 3.08 -0.51 -2.30 114.38 115.29 1wvi h ARG 3193Ca 0.11 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.13 1wvi h ARG 3193Cb 0.19 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 1wvi h ARG 3193CO -0.01 0.36 -0.13 1.25 -1.07 0.00 0.00 179.97 180.37 1wvi h LEU 3194N 0.00 0.00 0.84 3.04 5.85 -0.39 -3.47 115.31 121.19 1wvi h LEU 3194Ca -0.00 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.52 1wvi h LEU 3194Cb 0.63 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.62 1wvi h LEU 3194CO 0.05 0.13 -0.21 0.61 -0.34 0.00 0.00 178.44 178.68 1wvi n GLY 3195N -1.08 0.63 3.39 3.75 0.00 -0.87 -4.82 105.19 106.20 1wvi n GLY 3195Ca -0.02 -0.55 -0.20 0.00 0.00 0.00 0.00 46.02 45.24 1wvi n GLY 3195CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wvi s VAL 3196N -2.41 1.63 0.48 1.61 1.01 -1.26 -5.11 120.40 116.36 1wvi s VAL 3196Ca 0.00 -2.15 -0.20 0.00 0.00 0.00 0.00 61.98 59.63 1wvi s VAL 3196Cb 0.00 -2.31 -0.09 0.00 0.00 0.00 0.00 36.38 33.98 1wvi s VAL 3196CO 0.00 -0.40 1.01 -0.54 0.00 0.00 0.00 175.10 175.17 1wvi s LYS 3197N -3.71 3.93 0.24 2.72 1.02 -1.26 -4.85 119.74 117.83 1wvi s LYS 3197Ca 0.27 1.24 -0.06 0.00 0.02 0.00 0.00 55.97 57.44 1wvi s LYS 3197Cb 0.02 -2.12 0.44 0.00 -0.52 0.00 0.00 37.83 35.66 1wvi s LYS 3197CO 0.10 -0.31 1.64 -0.09 -0.92 0.00 0.00 175.35 175.78 1wvi h ARG 3198N 1.57 0.13 0.00 1.68 2.43 -1.95 0.18 114.38 118.41 1wvi h ARG 3198Ca -0.49 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1wvi h ARG 3198Cb 1.20 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1wvi h ARG 3198CO 0.60 0.08 0.00 -2.39 -1.51 0.00 0.00 179.97 176.75 1wvi n HIS 3199N -5.31 0.00 1.00 2.20 1.44 -1.26 -2.39 115.22 110.90 1wvi n HIS 3199Ca 0.14 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.95 1wvi n HIS 3199Cb 0.47 -0.23 -0.04 0.00 0.12 0.00 0.00 29.99 30.31 1wvi n HIS 3199CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1wvi n GLU 3200N -1.23 0.78 -3.05 -1.40 1.02 0.60 -4.96 120.64 112.40 1wvi n GLU 3200Ca 0.12 -0.65 -0.18 0.00 -0.02 0.00 0.00 57.16 56.43 1wvi n GLU 3200Cb 0.16 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.10 1wvi n GLU 3200CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wvi s ALA 3201N -2.66 4.42 -0.15 0.62 0.00 -1.00 -0.67 121.76 122.30 1wvi s ALA 3201Ca 0.15 -1.60 -0.12 0.00 0.00 0.00 0.00 51.96 50.39 1wvi s ALA 3201Cb 0.17 -1.69 0.04 0.00 0.00 0.00 0.00 23.12 21.65 1wvi s ALA 3201CO 0.68 -0.28 0.39 -1.50 0.00 0.00 0.00 175.76 175.04 1wvi s ILE 3202N -2.36 -0.01 -0.21 0.00 2.07 -1.01 -3.93 121.20 115.75 1wvi s ILE 3202Ca 0.54 0.03 -0.15 0.00 -1.41 0.00 0.00 60.65 59.66 1wvi s ILE 3202Cb -0.10 -0.56 -0.04 0.00 0.13 0.00 0.00 42.46 41.89 1wvi s ILE 3202CO 0.33 0.01 0.34 -0.32 -1.91 0.00 0.00 174.94 173.40 1wvi s MET 3203N 0.58 4.14 -0.18 3.50 -2.45 0.16 -0.90 119.30 124.16 1wvi s MET 3203Ca -0.03 0.09 -0.03 0.00 -1.25 0.00 0.00 55.69 54.47 1wvi s MET 3203Cb -0.05 -3.54 -0.01 0.00 1.25 0.00 0.00 34.83 32.48 1wvi s MET 3203CO -0.04 -0.03 -0.06 0.08 1.05 0.00 0.00 175.02 176.03 1wvi s VAL 3204N 1.28 3.42 0.35 10.11 1.01 0.20 -0.65 120.40 136.13 1wvi s VAL 3204Ca 0.16 -0.50 -0.17 0.00 0.00 0.00 0.00 61.98 61.47 1wvi s VAL 3204Cb -0.14 -2.51 0.05 0.00 0.00 0.00 0.00 36.38 33.77 1wvi s VAL 3204CO 0.07 0.47 0.79 -0.83 0.00 0.00 0.00 175.10 175.60 1wvi s GLY 3205N 0.92 0.26 -0.01 4.51 0.00 -0.76 -0.83 107.32 111.42 1wvi s GLY 3205Ca -0.01 -0.63 0.09 0.00 0.00 0.00 0.00 44.72 44.17 1wvi s GLY 3205CO 0.01 -0.14 0.27 2.09 0.00 0.00 0.00 173.10 175.34 1wvi n ASP 3206N -1.20 1.76 -4.39 1.64 5.75 -1.26 -0.97 116.55 117.88 1wvi n ASP 3206Ca -0.07 -0.33 -0.39 0.00 -0.01 0.00 0.00 54.79 53.98 1wvi n ASP 3206Cb 0.60 1.21 -0.12 0.00 -1.03 0.00 0.00 41.12 41.78 1wvi n ASP 3206CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1wvi s ASN 3207N -2.44 5.58 0.13 -1.12 3.84 -1.26 -2.31 114.94 117.35 1wvi s ASN 3207Ca -0.00 -0.82 -0.20 0.00 0.21 0.00 0.00 52.86 52.06 1wvi s ASN 3207Cb 0.06 -1.99 -0.02 0.00 -0.55 0.00 0.00 41.25 38.75 1wvi s ASN 3207CO 0.36 -0.30 1.71 0.22 -2.79 0.00 0.00 177.10 176.30 1wvi h TYR 3208N 8.37 -0.08 -0.61 0.43 3.20 -1.94 0.71 116.97 127.06 1wvi h TYR 3208Ca -0.28 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.53 1wvi h TYR 3208Cb 1.12 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.43 1wvi h TYR 3208CO 0.60 -0.07 0.07 1.25 -1.64 0.00 0.00 178.16 178.37 1wvi h LEU 3209N 0.02 0.97 0.09 2.82 5.85 -1.96 -0.60 115.31 122.50 1wvi h LEU 3209Ca 0.10 -0.24 -0.36 0.00 0.84 0.00 0.00 57.88 58.22 1wvi h LEU 3209Cb 0.14 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1wvi h LEU 3209CO -0.20 0.99 -2.07 0.35 -0.34 0.00 0.00 178.44 177.17 1wvi n THR 3210N -4.21 1.70 -0.11 1.05 -2.24 -1.17 -4.26 114.28 105.04 1wvi n THR 3210Ca 0.04 -0.59 -0.23 0.00 -2.27 0.00 0.00 64.05 61.00 1wvi n THR 3210Cb 0.30 -1.69 -0.10 0.00 -2.10 0.00 0.00 70.33 66.73 1wvi n THR 3210CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1wvi n ASP 3211N -3.51 1.89 -0.11 3.42 8.00 0.23 -3.71 116.55 122.75 1wvi n ASP 3211Ca -0.36 0.41 -0.13 0.00 0.71 0.00 0.00 54.79 55.42 1wvi n ASP 3211Cb 1.01 -0.91 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 1wvi n ASP 3211CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1wvi h ILE 3212N -1.00 1.29 -0.10 0.53 1.08 -1.29 -2.53 117.51 115.49 1wvi h ILE 3212Ca -0.43 -1.46 -0.04 0.00 -0.39 0.00 0.00 64.86 62.54 1wvi h ILE 3212Cb 1.35 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 36.57 1wvi h ILE 3212CO -0.26 0.48 -0.14 0.74 -0.69 0.00 0.00 178.15 178.28 1wvi h THR 3213N 0.56 1.16 -0.50 -0.27 2.02 -1.29 -0.26 112.91 114.32 1wvi h THR 3213Ca 0.06 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 1wvi h THR 3213Cb 0.87 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 1wvi h THR 3213CO 0.08 0.21 0.21 0.00 0.37 0.00 0.00 175.52 176.38 1wvi h ALA 3214N 1.72 1.43 0.26 6.16 0.00 -1.54 0.42 119.26 127.71 1wvi h ALA 3214Ca 0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1wvi h ALA 3214Cb 0.34 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1wvi h ALA 3214CO 0.02 0.44 -0.12 0.78 0.00 0.00 0.00 179.25 180.36 1wvi h GLY 3215N 0.84 -0.36 0.01 0.00 0.00 -0.79 -3.00 103.07 99.77 1wvi h GLY 3215Ca 0.17 0.13 0.07 0.00 0.00 0.00 0.00 47.33 47.70 1wvi h GLY 3215CO -0.02 -0.13 -0.30 -2.22 0.00 0.00 0.00 176.54 173.87 1wvi h ILE 3216N -1.06 0.30 -0.51 2.60 2.04 -1.13 0.23 117.51 119.97 1wvi h ILE 3216Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.86 1wvi h ILE 3216Cb 0.35 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 1wvi h ILE 3216CO 0.06 0.00 0.34 0.50 0.00 0.00 0.00 178.15 179.05 1wvi h LYS 3217N -0.29 0.56 -0.47 2.37 3.64 -1.06 -2.71 116.57 118.62 1wvi h LYS 3217Ca 0.14 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1wvi h LYS 3217Cb 0.52 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1wvi h LYS 3217CO -0.44 0.37 0.00 0.09 -2.27 0.00 0.00 179.45 177.20 1wvi n ASN 3218N -4.47 4.53 -3.51 4.20 3.02 -0.74 -4.97 115.26 113.31 1wvi n ASN 3218Ca 0.06 -2.69 -0.19 0.00 -0.03 0.00 0.00 54.58 51.72 1wvi n ASN 3218Cb 0.14 -0.55 0.06 0.00 -0.61 0.00 0.00 39.78 38.82 1wvi n ASN 3218CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1wvi n ASP 3219N 0.42 -2.71 -3.99 6.41 2.03 -0.07 -5.01 116.55 113.63 1wvi n ASP 3219Ca 0.23 -0.73 -0.21 0.00 0.52 0.00 0.00 54.79 54.60 1wvi n ASP 3219Cb 0.91 -4.66 -0.16 0.00 -0.72 0.00 0.00 41.12 36.49 1wvi n ASP 3219CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1wvi s ILE 3220N -3.48 0.81 0.75 5.18 1.01 0.62 -4.75 121.20 121.34 1wvi s ILE 3220Ca 0.11 -0.34 -0.15 0.00 0.00 0.00 0.00 60.65 60.26 1wvi s ILE 3220Cb -0.02 -0.74 0.00 0.00 0.01 0.00 0.00 42.46 41.71 1wvi s ILE 3220CO 0.77 0.26 0.80 0.00 0.00 0.00 0.00 174.94 176.77 1wvi n ALA 3221N 3.50 -0.82 -2.74 9.38 0.00 -1.25 -3.70 120.51 124.87 1wvi n ALA 3221Ca -0.20 -0.25 -0.17 0.00 0.00 0.00 0.00 53.44 52.82 1wvi n ALA 3221Cb 0.53 -2.02 -0.14 0.00 0.00 0.00 0.00 19.45 17.82 1wvi n ALA 3221CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1wvi s THR 3222N -1.93 0.60 -0.20 0.00 -4.23 -1.26 -0.66 115.64 107.96 1wvi s THR 3222Ca 0.69 -0.48 0.01 0.00 -1.18 0.00 0.00 61.69 60.73 1wvi s THR 3222Cb -0.33 -0.53 0.05 0.00 1.34 0.00 0.00 72.50 73.02 1wvi s THR 3222CO 0.54 0.06 -0.08 -0.22 -0.54 0.00 0.00 174.62 174.38 1wvi s LEU 3223N -0.47 2.20 -0.22 4.79 0.20 0.18 -1.64 118.68 123.72 1wvi s LEU 3223Ca 0.01 -0.91 -0.09 0.00 0.69 0.00 0.00 54.13 53.83 1wvi s LEU 3223Cb -0.04 -1.15 -0.04 0.00 -0.43 0.00 0.00 46.19 44.52 1wvi s LEU 3223CO -0.00 -0.18 0.11 -0.22 -0.29 0.00 0.00 176.35 175.78 1wvi s LEU 3224N 1.45 3.93 -0.24 -0.68 1.98 0.06 -1.82 118.68 123.35 1wvi s LEU 3224Ca -0.02 0.06 -0.08 0.00 -2.89 0.00 0.00 54.13 51.21 1wvi s LEU 3224Cb -0.17 -2.03 -0.03 0.00 0.66 0.00 0.00 46.19 44.62 1wvi s LEU 3224CO -0.08 0.09 0.08 -0.69 -1.89 0.00 0.00 176.35 173.87 1wvi s VAL 3225N 0.88 4.46 -2.00 1.68 1.01 -0.14 -0.79 120.40 125.49 1wvi s VAL 3225Ca 0.06 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1wvi s VAL 3225Cb -0.13 -3.08 0.02 0.00 0.00 0.00 0.00 36.38 33.18 1wvi s VAL 3225CO 0.03 0.34 0.34 0.35 0.00 0.00 0.00 175.10 176.16 1wvi n THR 3226N 4.77 0.00 -1.74 3.92 -2.24 0.24 -4.38 114.28 114.86 1wvi n THR 3226Ca -0.16 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.34 1wvi n THR 3226Cb 0.52 -0.79 0.20 0.00 -2.10 0.00 0.00 70.33 68.16 1wvi n THR 3226CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1wvi n THR 3227N -0.80 0.00 -4.28 4.28 5.66 -1.26 -4.20 114.28 113.68 1wvi n THR 3227Ca 0.00 -0.85 0.00 0.00 -3.05 0.00 0.00 64.05 60.15 1wvi n THR 3227Cb 0.00 -1.49 0.00 0.00 -1.55 0.00 0.00 70.33 67.30 1wvi n THR 3227CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1wvi n GLY 3228N -3.44 0.90 0.00 1.09 0.00 -1.22 -4.33 105.19 98.20 1wvi n GLY 3228Ca 0.16 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1wvi n GLY 3228CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1wvi n PHE 3229N 0.00 0.00 -1.98 1.61 7.35 -1.26 -4.29 117.46 118.89 1wvi n PHE 3229Ca 0.00 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.28 1wvi n PHE 3229Cb 0.00 -0.32 -0.03 0.00 0.35 0.00 0.00 39.48 39.48 1wvi n PHE 3229CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1wvi s THR 3230N -2.62 3.40 0.59 -2.13 2.01 -0.98 -4.98 115.64 110.94 1wvi s THR 3230Ca 0.00 0.36 -0.19 0.00 0.31 0.00 0.00 61.69 62.17 1wvi s THR 3230Cb 0.00 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.78 1wvi s THR 3230CO 0.00 -0.54 1.19 -0.54 -0.69 0.00 0.00 174.62 174.04 1wvi s LYS 3231N 6.27 3.02 0.59 4.92 1.02 -1.26 -4.53 119.74 129.77 1wvi s LYS 3231Ca 0.77 1.76 0.29 0.00 0.02 0.00 0.00 55.97 58.81 1wvi s LYS 3231Cb -0.19 -1.94 1.78 0.00 -0.52 0.00 0.00 37.83 36.96 1wvi s LYS 3231CO 0.29 -1.15 2.23 -1.00 -0.92 0.00 0.00 175.35 174.80 1wvi h PRO 3232N 0.88 0.00 0.00 -1.68 0.13 -1.94 -1.96 132.00 127.43 1wvi h PRO 3232Ca -0.50 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.58 1wvi h PRO 3232Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1wvi h PRO 3232CO 0.55 0.00 -0.26 0.93 -0.23 0.00 0.00 178.00 179.00 1wvi h GLU 3233N 0.00 0.00 0.00 0.86 3.07 -1.96 -3.20 114.58 113.35 1wvi h GLU 3233Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1wvi h GLU 3233Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1wvi h GLU 3233CO -0.00 0.26 0.00 0.93 -1.40 0.00 0.00 179.01 178.80 1wvi h GLU 3234N 0.00 0.00 -0.94 2.33 5.08 -1.72 -3.36 114.58 115.97 1wvi h GLU 3234Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1wvi h GLU 3234Cb 1.09 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.29 1wvi h GLU 3234CO 0.03 0.00 0.57 -0.39 -1.00 0.00 0.00 179.01 178.23 1wvi h VAL 3235N 0.00 1.26 0.00 3.13 -1.51 -1.62 -2.72 116.25 114.79 1wvi h VAL 3235Ca 0.00 -0.55 -0.00 0.00 -1.23 0.00 0.00 66.70 64.92 1wvi h VAL 3235Cb 0.78 -0.08 -0.00 0.00 -2.13 0.00 0.00 31.29 29.86 1wvi h VAL 3235CO 0.00 0.27 -0.00 -0.65 -1.23 0.00 0.00 177.57 175.95 1wvi h PRO 3236N 1.30 0.00 -0.00 5.19 0.11 -1.81 -2.14 132.00 134.64 1wvi h PRO 3236Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1wvi h PRO 3236Cb -0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.04 1wvi h PRO 3236CO -0.06 0.00 -0.15 0.00 -0.21 0.00 0.00 178.00 177.58 1wvi n ALA 3237N -2.52 2.84 -1.74 -0.75 0.00 -1.03 -4.93 120.51 112.38 1wvi n ALA 3237Ca -0.03 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.70 1wvi n ALA 3237Cb 0.09 -1.29 -0.01 0.00 0.00 0.00 0.00 19.45 18.24 1wvi n ALA 3237CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wvi n LEU 3238N -0.95 4.20 -0.12 0.00 4.77 -0.81 -4.90 117.00 119.20 1wvi n LEU 3238Ca 0.13 1.18 0.00 0.00 -0.03 0.00 0.00 56.01 57.29 1wvi n LEU 3238Cb 0.30 -1.56 0.27 0.00 -2.33 0.00 0.00 43.42 40.09 1wvi n LEU 3238CO 0.25 -0.03 1.10 1.55 -1.33 0.00 0.00 177.39 178.93 1wvi h PRO 3239N 3.79 0.79 -4.00 3.23 0.13 -1.91 -3.40 132.00 130.62 1wvi h PRO 3239Ca -0.48 -0.09 -0.48 0.00 -0.87 0.00 0.00 66.00 64.08 1wvi h PRO 3239Cb 1.25 -0.15 -0.37 0.00 0.13 0.00 0.00 31.00 31.85 1wvi h PRO 3239CO 0.71 0.61 -0.79 0.42 -0.23 0.00 0.00 178.00 178.73 1wvi s ILE 3240N -5.47 0.73 0.28 -3.56 -1.09 -1.26 -5.13 121.20 105.70 1wvi s ILE 3240Ca -0.10 -0.11 -0.29 0.00 -2.23 0.00 0.00 60.65 57.92 1wvi s ILE 3240Cb 0.17 -0.80 -0.10 0.00 -1.58 0.00 0.00 42.46 40.15 1wvi s ILE 3240CO 0.77 0.31 1.15 -1.10 -1.23 0.00 0.00 174.94 174.85 1wvi s GLN 3241N 1.74 4.57 0.98 2.79 -1.52 -1.26 -5.01 119.66 121.94 1wvi s GLN 3241Ca 0.03 1.89 -0.12 0.00 -1.95 0.00 0.00 55.36 55.22 1wvi s GLN 3241Cb -0.13 -3.17 0.18 0.00 -0.22 0.00 0.00 33.01 29.67 1wvi s GLN 3241CO -0.06 0.11 1.09 -1.25 -0.25 0.00 0.00 175.29 174.92 1wvi s PRO 3242N -1.40 0.61 0.36 2.91 0.04 -1.26 -4.90 135.00 131.36 1wvi s PRO 3242Ca 0.46 0.67 0.08 0.00 0.04 0.00 0.00 61.00 62.26 1wvi s PRO 3242Cb -0.34 -1.75 0.69 0.00 0.04 0.00 0.00 34.50 33.14 1wvi s PRO 3242CO 0.43 -2.65 1.86 -0.44 0.04 0.00 0.00 177.00 176.24 1wvi h ASP 3243N -1.84 0.25 -4.18 6.66 5.19 -1.85 -3.44 116.42 117.22 1wvi h ASP 3243Ca -0.53 -0.06 -0.20 0.00 -0.62 0.00 0.00 57.03 55.61 1wvi h ASP 3243Cb 1.31 -0.07 -0.25 0.00 0.18 0.00 0.00 39.33 40.50 1wvi h ASP 3243CO 0.55 0.46 -0.67 -0.36 -3.12 0.00 0.00 179.24 176.11 1wvi s PHE 3244N -4.60 0.05 -0.07 4.55 0.08 -0.65 -5.02 117.98 112.31 1wvi s PHE 3244Ca -0.05 -0.09 0.01 0.00 0.12 0.00 0.00 56.93 56.92 1wvi s PHE 3244Cb 0.15 -0.05 0.02 0.00 -0.57 0.00 0.00 43.02 42.57 1wvi s PHE 3244CO 0.74 -0.09 -0.09 0.08 -0.10 0.00 0.00 175.22 175.77 1wvi s VAL 3245N -0.49 0.96 0.04 -0.44 1.01 -1.26 -0.76 120.40 119.45 1wvi s VAL 3245Ca -0.06 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.62 1wvi s VAL 3245Cb -0.03 -0.92 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 1wvi s VAL 3245CO -0.00 0.33 -0.09 -0.76 0.00 0.00 0.00 175.10 174.58 1wvi s LEU 3246N 1.03 2.24 0.27 3.92 1.43 0.03 -4.98 118.68 122.62 1wvi s LEU 3246Ca -0.08 -0.54 0.19 0.00 -1.03 0.00 0.00 54.13 52.67 1wvi s LEU 3246Cb -0.15 -0.25 0.09 0.00 0.03 0.00 0.00 46.19 45.92 1wvi s LEU 3246CO -0.00 -0.16 1.31 0.77 0.23 0.00 0.00 176.35 178.50 1wvi h SER 3247N 4.55 0.00 -4.08 2.29 4.64 -1.95 0.70 113.55 119.70 1wvi h SER 3247Ca -0.36 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.84 1wvi h SER 3247Cb 1.20 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.06 1wvi h SER 3247CO 0.41 0.29 -0.21 -0.55 -0.87 0.00 0.00 176.83 175.90 1wvi s SER 3248N -6.08 -0.41 0.64 4.97 0.15 -1.26 -4.37 113.70 107.33 1wvi s SER 3248Ca 0.03 0.74 0.40 0.00 0.70 0.00 0.00 55.95 57.81 1wvi s SER 3248Cb 0.07 0.78 2.20 0.00 -1.71 0.00 0.00 66.02 67.36 1wvi s SER 3248CO 0.74 -0.20 2.32 -0.07 1.20 0.00 0.00 173.24 177.23 1wvi h LEU 3249N 5.17 0.00 -2.47 3.45 -0.00 -1.89 -0.82 115.31 118.74 1wvi h LEU 3249Ca -0.27 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.61 1wvi h LEU 3249Cb 1.18 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.84 1wvi h LEU 3249CO 0.27 0.00 -0.01 0.00 -0.00 0.00 0.00 178.44 178.70 1wvi h ALA 3250N 2.00 1.46 0.00 1.53 0.00 -1.96 -0.78 119.26 121.51 1wvi h ALA 3250Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wvi h ALA 3250Cb 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1wvi h ALA 3250CO 0.00 0.01 0.00 0.39 0.00 0.00 0.00 179.25 179.65 1wvi n GLU 3251N -3.77 0.12 -2.55 0.00 1.02 -0.31 -4.81 120.64 110.34 1wvi n GLU 3251Ca -0.03 0.22 -0.42 0.00 -0.02 0.00 0.00 57.16 56.92 1wvi n GLU 3251Cb 0.09 -1.68 -0.03 0.00 -0.02 0.00 0.00 31.44 29.80 1wvi n GLU 3251CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1wvi s TRP 3252N -3.11 3.57 -0.23 -0.32 -0.11 -0.30 -5.03 118.94 113.41 1wvi s TRP 3252Ca 0.09 1.53 -0.01 0.00 1.22 0.00 0.00 56.10 58.93 1wvi s TRP 3252Cb 0.13 -3.27 0.02 0.00 -1.50 0.00 0.00 33.47 28.85 1wvi s TRP 3252CO 0.45 -0.64 -0.10 0.34 -4.62 0.00 0.00 176.95 172.39 1wvi s ASP 3253N 0.68 4.01 0.00 5.86 2.15 -1.26 -5.10 116.67 123.01 1wvi s ASP 3253Ca 0.54 -0.80 0.21 0.00 0.43 0.00 0.00 52.55 52.93 1wvi s ASP 3253Cb -0.27 -1.61 1.26 0.00 -0.30 0.00 0.00 42.92 42.00 1wvi s ASP 3253CO 0.30 -0.09 1.64 0.49 -0.17 0.00 0.00 175.17 177.35