#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ass s ILE 3006N 0.00 4.66 -0.01 5.09 1.01 -1.26 -4.18 121.20 126.51 2ass s ILE 3006Ca 0.00 1.18 -0.25 0.00 0.00 0.00 0.00 60.65 61.58 2ass s ILE 3006Cb 0.00 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 2ass s ILE 3006CO 0.00 -0.45 0.77 -0.47 0.00 0.00 0.00 174.94 174.80 2ass s TYR 3007N 3.30 3.66 -0.14 3.97 5.04 -0.72 -4.95 117.35 127.51 2ass s TYR 3007Ca 0.36 1.42 0.01 0.00 -2.44 0.00 0.00 57.07 56.42 2ass s TYR 3007Cb -0.13 -2.86 -0.00 0.00 0.35 0.00 0.00 41.96 39.32 2ass s TYR 3007CO 0.17 0.15 -0.16 0.71 -1.34 0.00 0.00 175.55 175.08 2ass s TYR 3008N 0.45 2.76 0.94 4.97 1.51 -1.26 -0.53 117.35 126.19 2ass s TYR 3008Ca 0.40 -0.95 -0.14 0.00 -1.01 0.00 0.00 57.07 55.38 2ass s TYR 3008Cb -0.19 -1.86 0.20 0.00 -0.11 0.00 0.00 41.96 40.00 2ass s TYR 3008CO 0.22 -0.41 1.29 -1.54 -1.11 0.00 0.00 175.55 174.00 2ass s SER 3009N 0.65 3.18 0.47 2.29 1.04 -0.86 -5.02 113.70 115.46 2ass s SER 3009Ca -0.08 0.12 -0.14 0.00 0.48 0.00 0.00 55.95 56.32 2ass s SER 3009Cb -0.16 -0.17 -0.07 0.00 0.10 0.00 0.00 66.02 65.72 2ass s SER 3009CO 0.02 -2.67 0.90 -1.81 0.98 0.00 0.00 173.24 170.66 2ass s ASP 3010N -4.90 6.57 -0.22 7.02 1.01 -1.26 -4.83 116.67 120.06 2ass s ASP 3010Ca 0.74 1.39 -0.12 0.00 0.71 0.00 0.00 52.55 55.27 2ass s ASP 3010Cb -0.03 -2.43 -0.05 0.00 1.01 0.00 0.00 42.92 41.42 2ass s ASP 3010CO 0.52 -0.52 0.24 -0.54 0.21 0.00 0.00 175.17 175.08 2ass s LYS 3011N -4.01 4.12 0.48 8.23 1.02 -1.26 -4.57 119.74 123.75 2ass s LYS 3011Ca 0.56 -0.10 0.02 0.00 0.02 0.00 0.00 55.97 56.47 2ass s LYS 3011Cb -0.10 -3.53 -0.02 0.00 -0.52 0.00 0.00 37.83 33.66 2ass s LYS 3011CO 0.32 0.05 0.02 1.52 -0.92 0.00 0.00 175.35 176.34 2ass s TYR 3012N 1.08 1.93 0.16 3.18 -0.85 -1.07 -4.92 117.35 116.87 2ass s TYR 3012Ca 0.12 -0.98 -0.24 0.00 -0.52 0.00 0.00 57.07 55.45 2ass s TYR 3012Cb -0.14 -1.55 0.06 0.00 0.38 0.00 0.00 41.96 40.71 2ass s TYR 3012CO 0.05 0.17 0.83 0.16 -1.52 0.00 0.00 175.55 175.24 2ass s ASP 3013N -3.81 -0.29 0.00 -0.18 1.47 -1.26 -0.34 116.67 112.26 2ass s ASP 3013Ca 0.12 -0.34 0.00 0.00 1.18 0.00 0.00 52.55 53.51 2ass s ASP 3013Cb 0.03 0.56 0.00 0.00 -0.34 0.00 0.00 42.92 43.16 2ass s ASP 3013CO 0.07 -0.99 0.00 -0.90 0.68 0.00 0.00 175.17 174.02 2ass n ASP 3014N -0.42 0.00 -1.66 2.11 5.68 -1.07 -4.98 116.55 116.21 2ass n ASP 3014Ca -0.08 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.30 2ass n ASP 3014Cb 0.61 0.00 0.37 0.00 -1.14 0.00 0.00 41.12 40.96 2ass n ASP 3014CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 2ass n GLU 3015N 0.00 4.07 0.00 0.11 2.13 -1.26 -4.58 120.64 121.11 2ass n GLU 3015Ca 0.00 -2.98 0.00 0.00 0.66 0.00 0.00 57.16 54.84 2ass n GLU 3015Cb 0.00 -2.00 0.00 0.00 0.27 0.00 0.00 31.44 29.71 2ass n GLU 3015CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2ass n GLU 3016N 0.95 0.00 -4.44 5.31 2.13 -1.26 -5.02 120.64 118.31 2ass n GLU 3016Ca 0.26 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.83 2ass n GLU 3016Cb 0.98 -0.34 -0.11 0.00 0.27 0.00 0.00 31.44 32.25 2ass n GLU 3016CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 2ass s PHE 3017N -1.00 2.28 -0.10 4.31 0.08 -1.26 -1.75 117.98 120.54 2ass s PHE 3017Ca 0.00 -0.35 -0.01 0.00 0.12 0.00 0.00 56.93 56.69 2ass s PHE 3017Cb 0.00 -1.05 -0.03 0.00 -0.57 0.00 0.00 43.02 41.37 2ass s PHE 3017CO 0.00 0.61 -0.04 -2.00 -0.10 0.00 0.00 175.22 173.69 2ass s GLU 3018N -3.13 3.06 0.23 0.44 2.12 -0.04 -2.61 118.70 118.77 2ass s GLU 3018Ca 0.25 -0.49 0.08 0.00 0.36 0.00 0.00 54.97 55.17 2ass s GLU 3018Cb -0.06 -2.74 -0.05 0.00 0.26 0.00 0.00 34.13 31.54 2ass s GLU 3018CO 0.12 0.57 -0.13 0.71 -0.54 0.00 0.00 175.26 176.00 2ass s TYR 3019N -0.55 1.80 -0.22 5.30 2.02 0.54 -2.02 117.35 124.23 2ass s TYR 3019Ca 0.09 -0.59 -0.30 0.00 -0.37 0.00 0.00 57.07 55.91 2ass s TYR 3019Cb -0.12 -0.88 0.16 0.00 -0.40 0.00 0.00 41.96 40.72 2ass s TYR 3019CO 0.02 0.36 1.17 0.50 -1.57 0.00 0.00 175.55 176.03 2ass s ARG 3020N -3.65 0.34 0.27 -0.62 3.52 -1.07 -2.58 118.95 115.15 2ass s ARG 3020Ca 0.25 0.09 0.12 0.00 -0.13 0.00 0.00 55.73 56.05 2ass s ARG 3020Cb -0.00 0.16 -0.05 0.00 -1.56 0.00 0.00 34.95 33.50 2ass s ARG 3020CO 0.09 -0.10 -0.19 -3.38 -0.81 0.00 0.00 175.30 170.90 2ass s HIS 3021N -1.03 2.32 -0.15 5.12 -3.43 -1.26 -0.51 115.29 116.36 2ass s HIS 3021Ca 0.03 -0.32 -0.00 0.00 -0.80 0.00 0.00 55.06 53.96 2ass s HIS 3021Cb -0.01 -1.02 0.03 0.00 -1.43 0.00 0.00 32.58 30.15 2ass s HIS 3021CO -0.03 0.69 -0.07 0.08 -2.00 0.00 0.00 174.74 173.41 2ass s VAL 3022N -2.41 1.12 0.14 -5.38 1.01 -0.23 -2.03 120.40 112.63 2ass s VAL 3022Ca 0.29 -0.52 -0.30 0.00 0.00 0.00 0.00 61.98 61.45 2ass s VAL 3022Cb -0.05 -1.23 -0.07 0.00 0.00 0.00 0.00 36.38 35.03 2ass s VAL 3022CO 0.15 0.23 0.96 -0.04 0.00 0.00 0.00 175.10 176.40 2ass s MET 3023N 1.64 4.73 -0.06 2.72 -1.94 0.31 -1.82 119.30 124.89 2ass s MET 3023Ca 0.02 1.47 0.02 0.00 -1.71 0.00 0.00 55.69 55.50 2ass s MET 3023Cb -0.14 -3.35 -0.03 0.00 2.01 0.00 0.00 34.83 33.32 2ass s MET 3023CO -0.08 0.27 -0.11 -0.51 -0.01 0.00 0.00 175.02 174.58 2ass s LEU 3024N -0.27 2.91 0.21 -0.03 1.02 -0.39 -1.75 118.68 120.38 2ass s LEU 3024Ca 0.46 -0.12 -0.32 0.00 0.02 0.00 0.00 54.13 54.16 2ass s LEU 3024Cb -0.24 -1.61 -0.12 0.00 0.02 0.00 0.00 46.19 44.24 2ass s LEU 3024CO 0.31 0.35 1.72 -2.65 0.02 0.00 0.00 176.35 176.10 2ass n PRO 3025N 2.27 2.77 -0.87 1.29 -0.02 -1.26 -4.74 135.00 134.45 2ass n PRO 3025Ca -0.17 1.00 -0.30 0.00 -2.02 0.00 0.00 63.50 62.00 2ass n PRO 3025Cb 0.52 -2.85 -0.03 0.00 -0.02 0.00 0.00 33.50 31.12 2ass n PRO 3025CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2ass n LYS 3026N 3.99 1.68 0.00 -0.52 5.02 -1.26 -1.53 118.16 125.55 2ass n LYS 3026Ca 0.16 -1.56 0.00 0.00 -2.02 0.00 0.00 58.31 54.89 2ass n LYS 3026Cb 0.35 -2.63 0.00 0.00 -0.02 0.00 0.00 35.03 32.73 2ass n LYS 3026CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2ass n ASP 3027N 5.74 0.00 -0.00 4.39 5.75 -1.26 -4.80 116.55 126.37 2ass n ASP 3027Ca 0.44 0.00 0.07 0.00 -0.01 0.00 0.00 54.79 55.29 2ass n ASP 3027Cb 0.25 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.24 2ass n ASP 3027CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 2ass n ILE 3028N -0.48 0.00 0.20 2.12 -5.35 -0.58 -4.08 119.36 111.20 2ass n ILE 3028Ca 0.00 -0.21 0.08 0.00 -0.27 0.00 0.00 62.75 62.35 2ass n ILE 3028Cb 0.00 0.73 0.36 0.00 -1.74 0.00 0.00 39.64 39.00 2ass n ILE 3028CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ass h ALA 3029N 1.86 0.96 0.00 -1.28 0.00 -1.70 -2.16 119.26 116.94 2ass h ALA 3029Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2ass h ALA 3029Cb 0.45 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2ass h ALA 3029CO 0.00 0.35 0.00 0.36 0.00 0.00 0.00 179.25 179.96 2ass n LYS 3030N -3.37 0.25 0.06 0.00 2.85 -1.26 -2.02 118.16 114.67 2ass n LYS 3030Ca 0.00 0.12 0.11 0.00 -1.05 0.00 0.00 58.31 57.50 2ass n LYS 3030Cb 0.49 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 33.32 2ass n LYS 3030CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2ass n LEU 3031N -1.27 0.54 -4.67 -5.58 4.77 -0.81 -4.94 117.00 105.04 2ass n LEU 3031Ca 0.08 0.18 -0.48 0.00 -0.03 0.00 0.00 56.01 55.76 2ass n LEU 3031Cb 0.13 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.12 2ass n LEU 3031CO 0.12 -0.10 1.32 0.52 -1.33 0.00 0.00 177.39 177.93 2ass n VAL 3032N -2.45 0.29 -1.89 4.08 0.31 -0.85 -4.90 118.33 112.92 2ass n VAL 3032Ca -0.01 -0.05 -0.42 0.00 -0.01 0.00 0.00 64.34 63.85 2ass n VAL 3032Cb 0.54 -1.64 -0.02 0.00 -0.91 0.00 0.00 33.84 31.81 2ass n VAL 3032CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2ass s PRO 3033N 2.53 4.19 -0.11 5.55 0.02 -1.26 -4.93 135.00 141.00 2ass s PRO 3033Ca 0.87 2.43 0.04 0.00 0.02 0.00 0.00 61.00 64.36 2ass s PRO 3033Cb -0.72 -3.10 -0.24 0.00 0.02 0.00 0.00 34.50 30.46 2ass s PRO 3033CO 0.46 -0.59 0.41 1.63 -0.33 0.00 0.00 177.00 178.59 2ass n LYS 3034N 3.14 0.69 0.00 5.54 4.01 -1.26 -4.40 118.16 125.88 2ass n LYS 3034Ca 0.11 0.24 0.15 0.00 -0.51 0.00 0.00 58.31 58.30 2ass n LYS 3034Cb 0.38 -1.71 0.70 0.00 -0.51 0.00 0.00 35.03 33.89 2ass n LYS 3034CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 2ass n THR 3035N -3.22 0.00 -3.86 -0.18 -2.24 -1.26 -4.97 114.28 98.56 2ass n THR 3035Ca -0.27 -0.08 -0.03 0.00 -2.27 0.00 0.00 64.05 61.40 2ass n THR 3035Cb 1.05 -0.12 0.01 0.00 -2.10 0.00 0.00 70.33 69.18 2ass n THR 3035CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2ass s HIS 3036N -2.26 0.04 0.27 4.78 -3.43 -1.26 -5.18 115.29 108.26 2ass s HIS 3036Ca 0.36 -0.42 0.07 0.00 -0.80 0.00 0.00 55.06 54.26 2ass s HIS 3036Cb 0.21 0.69 -0.03 0.00 -1.43 0.00 0.00 32.58 32.02 2ass s HIS 3036CO 0.42 -0.90 0.27 -0.51 -2.00 0.00 0.00 174.74 172.02 2ass s LEU 3037N -3.34 3.89 -0.05 5.38 1.02 -1.26 -4.68 118.68 119.64 2ass s LEU 3037Ca 0.20 -0.23 -0.10 0.00 0.02 0.00 0.00 54.13 54.03 2ass s LEU 3037Cb -0.02 -2.45 -0.05 0.00 0.02 0.00 0.00 46.19 43.68 2ass s LEU 3037CO 0.05 -0.14 0.27 -0.04 0.02 0.00 0.00 176.35 176.51 2ass s MET 3038N -3.92 3.65 0.77 1.70 -1.94 -1.26 -5.09 119.30 113.19 2ass s MET 3038Ca 0.36 0.09 -0.09 0.00 -1.71 0.00 0.00 55.69 54.34 2ass s MET 3038Cb -0.08 -3.18 0.09 0.00 2.01 0.00 0.00 34.83 33.67 2ass s MET 3038CO 0.27 0.72 1.09 -1.54 -0.01 0.00 0.00 175.02 175.55 2ass s SER 3039N -1.18 4.48 0.28 3.03 1.04 -1.26 -4.23 113.70 115.86 2ass s SER 3039Ca 0.21 0.45 0.01 0.00 0.48 0.00 0.00 55.95 57.10 2ass s SER 3039Cb -0.14 -0.96 0.52 0.00 0.10 0.00 0.00 66.02 65.54 2ass s SER 3039CO 0.10 -1.84 1.85 -0.08 0.98 0.00 0.00 173.24 174.25 2ass h GLU 3040N -0.84 1.01 -0.66 4.02 4.81 -1.99 0.30 114.58 121.22 2ass h GLU 3040Ca -0.44 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 58.75 2ass h GLU 3040Cb 1.31 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 30.42 2ass h GLU 3040CO 0.57 0.67 0.41 0.77 -0.73 0.00 0.00 179.01 180.70 2ass h SER 3041N 1.04 0.68 -0.15 1.04 0.02 -1.98 -1.79 113.55 112.40 2ass h SER 3041Ca 0.48 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.37 2ass h SER 3041Cb 0.41 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 2ass h SER 3041CO -0.24 0.47 -0.13 -0.33 -1.14 0.00 0.00 176.83 175.46 2ass h GLU 3042N 0.81 0.36 0.00 3.45 5.08 -1.34 -1.92 114.58 121.01 2ass h GLU 3042Ca 0.26 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 2ass h GLU 3042Cb 0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2ass h GLU 3042CO -0.10 0.73 -0.42 0.11 -1.00 0.00 0.00 179.01 178.32 2ass h TRP 3043N -0.01 0.00 -0.48 4.33 5.08 -1.13 -1.69 115.95 122.05 2ass h TRP 3043Ca 0.03 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.88 2ass h TRP 3043Cb 0.65 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.80 2ass h TRP 3043CO 0.08 0.42 -0.16 0.00 -1.28 0.00 0.00 178.44 177.51 2ass h ARG 3044N 0.00 0.93 0.00 0.12 3.08 -1.32 -1.26 114.38 115.93 2ass h ARG 3044Ca -0.00 -0.36 -0.01 0.00 0.07 0.00 0.00 59.98 59.67 2ass h ARG 3044Cb 0.81 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.80 2ass h ARG 3044CO 0.06 1.02 -0.07 -0.91 -1.07 0.00 0.00 179.97 178.99 2ass h ASN 3045N 0.82 0.00 0.57 7.04 2.35 -0.74 -0.06 115.58 125.57 2ass h ASN 3045Ca 0.12 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.73 2ass h ASN 3045Cb 0.71 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.06 2ass h ASN 3045CO 0.05 0.07 -0.63 -0.07 -1.65 0.00 0.00 177.43 175.21 2ass h LEU 3046N 0.00 0.06 0.00 1.61 3.38 -0.36 -3.47 115.31 116.54 2ass h LEU 3046Ca -0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2ass h LEU 3046Cb 0.14 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2ass h LEU 3046CO 0.01 0.67 0.00 0.61 0.09 0.00 0.00 178.44 179.82 2ass n GLY 3047N 0.28 0.87 3.71 0.83 0.00 -0.03 -5.08 105.19 105.77 2ass n GLY 3047Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2ass n GLY 3047CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ass s VAL 3048N -1.79 3.40 -0.28 1.61 1.01 -0.82 -4.99 120.40 118.55 2ass s VAL 3048Ca 0.00 1.01 0.02 0.00 0.00 0.00 0.00 61.98 63.00 2ass s VAL 3048Cb 0.00 -3.64 0.08 0.00 0.00 0.00 0.00 36.38 32.81 2ass s VAL 3048CO 0.00 0.08 -0.00 -1.10 0.00 0.00 0.00 175.10 174.07 2ass s GLN 3049N 1.12 1.48 0.28 2.72 -0.21 -1.26 -4.30 119.66 119.48 2ass s GLN 3049Ca 0.64 -1.28 -0.11 0.00 0.02 0.00 0.00 55.36 54.63 2ass s GLN 3049Cb -0.36 -2.68 0.00 0.00 1.00 0.00 0.00 33.01 30.98 2ass s GLN 3049CO 0.30 -0.76 0.50 1.14 -2.12 0.00 0.00 175.29 174.35 2ass s GLN 3050N 1.27 1.67 1.05 2.91 -2.07 -1.26 -5.12 119.66 118.12 2ass s GLN 3050Ca 0.01 -1.36 -0.19 0.00 -1.82 0.00 0.00 55.36 52.00 2ass s GLN 3050Cb -0.19 0.48 0.02 0.00 -1.09 0.00 0.00 33.01 32.23 2ass s GLN 3050CO -0.10 -0.71 -0.22 0.43 -1.32 0.00 0.00 175.29 173.38 2ass n SER 3051N -0.66 -2.72 -4.84 12.60 7.64 -1.26 -4.97 113.62 119.42 2ass n SER 3051Ca -0.02 0.03 -0.29 0.00 1.01 0.00 0.00 58.87 59.60 2ass n SER 3051Cb 0.62 -0.93 0.10 0.00 -1.01 0.00 0.00 64.21 62.99 2ass n SER 3051CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2ass s GLN 3052N -3.14 1.80 0.00 1.43 -0.21 -1.26 -4.13 119.66 114.16 2ass s GLN 3052Ca 0.52 0.33 0.00 0.00 0.02 0.00 0.00 55.36 56.23 2ass s GLN 3052Cb -0.11 -1.91 0.00 0.00 1.00 0.00 0.00 33.01 31.99 2ass s GLN 3052CO 0.68 -1.75 0.00 0.41 -2.12 0.00 0.00 175.29 172.51 2ass n GLY 3053N -2.62 3.13 3.73 3.09 0.00 -1.26 -5.01 105.19 106.25 2ass n GLY 3053Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2ass n GLY 3053CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ass s TRP 3054N -1.56 3.23 -0.11 1.61 0.52 -1.26 -4.71 118.94 116.66 2ass s TRP 3054Ca 0.00 1.11 0.01 0.00 0.02 0.00 0.00 56.10 57.24 2ass s TRP 3054Cb 0.00 -3.65 -0.02 0.00 -1.15 0.00 0.00 33.47 28.65 2ass s TRP 3054CO 0.00 -2.13 -0.14 0.08 0.02 0.00 0.00 176.95 174.78 2ass s VAL 3055N 0.45 2.96 -0.69 4.03 1.01 0.33 -4.73 120.40 123.76 2ass s VAL 3055Ca 0.60 -0.71 -0.27 0.00 0.00 0.00 0.00 61.98 61.59 2ass s VAL 3055Cb -0.37 -2.21 0.03 0.00 0.00 0.00 0.00 36.38 33.82 2ass s VAL 3055CO 0.36 0.54 1.28 -2.28 0.00 0.00 0.00 175.10 175.00 2ass s HIS 3056N 0.09 2.35 -0.59 5.22 2.46 -1.26 -1.85 115.29 121.71 2ass s HIS 3056Ca -0.06 0.10 0.21 0.00 0.47 0.00 0.00 55.06 55.77 2ass s HIS 3056Cb -0.15 -4.58 -0.27 0.00 -0.13 0.00 0.00 32.58 27.45 2ass s HIS 3056CO 0.05 -1.96 0.71 2.48 -2.47 0.00 0.00 174.74 173.54 2ass n TYR 3057N 9.23 0.00 -3.49 3.88 4.11 -1.22 -4.64 117.16 125.04 2ass n TYR 3057Ca 0.05 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.83 2ass n TYR 3057Cb 0.49 -0.20 -0.03 0.00 -0.00 0.00 0.00 39.34 39.60 2ass n TYR 3057CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2ass s MET 3058N -3.17 0.99 -0.20 -3.48 0.23 -1.26 -5.12 119.30 107.30 2ass s MET 3058Ca 0.01 -0.20 -0.09 0.00 -1.03 0.00 0.00 55.69 54.38 2ass s MET 3058Cb 0.15 0.46 -0.05 0.00 -1.53 0.00 0.00 34.83 33.86 2ass s MET 3058CO 0.86 -0.40 0.12 0.42 -2.03 0.00 0.00 175.02 173.99 2ass s ILE 3059N -2.73 5.24 -0.93 3.16 1.01 -1.26 -4.32 121.20 121.37 2ass s ILE 3059Ca -0.00 0.13 -0.14 0.00 0.00 0.00 0.00 60.65 60.64 2ass s ILE 3059Cb -0.01 -3.39 0.21 0.00 0.01 0.00 0.00 42.46 39.28 2ass s ILE 3059CO -0.06 0.44 0.97 -2.28 0.00 0.00 0.00 174.94 174.01 2ass s HIS 3060N 0.42 3.68 0.47 3.97 5.65 -1.26 -4.91 115.29 123.32 2ass s HIS 3060Ca 0.07 -1.99 0.25 0.00 0.25 0.00 0.00 55.06 53.64 2ass s HIS 3060Cb -0.12 -3.97 1.28 0.00 -1.18 0.00 0.00 32.58 28.59 2ass s HIS 3060CO -0.01 -1.13 1.84 0.93 -0.65 0.00 0.00 174.74 175.72 2ass h GLU 3061N 7.78 0.21 0.00 2.88 5.08 -1.95 -1.76 114.58 126.81 2ass h GLU 3061Ca 0.15 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 2ass h GLU 3061Cb 0.99 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 2ass h GLU 3061CO 0.92 0.14 -0.15 -1.35 -1.00 0.00 0.00 179.01 177.56 2ass h PRO 3062N 0.21 0.00 -2.15 2.33 0.11 -2.00 -3.36 132.00 127.14 2ass h PRO 3062Ca 0.49 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 66.08 2ass h PRO 3062Cb 1.55 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 32.32 2ass h PRO 3062CO -0.12 0.15 -0.89 -1.21 -0.21 0.00 0.00 178.00 175.72 2ass s GLU 3063N -3.75 0.90 0.37 1.05 2.02 -0.66 -4.99 118.70 113.63 2ass s GLU 3063Ca 0.00 -1.87 0.19 0.00 0.02 0.00 0.00 54.97 53.31 2ass s GLU 3063Cb 0.10 -1.17 1.04 0.00 0.10 0.00 0.00 34.13 34.20 2ass s GLU 3063CO 0.60 -1.37 1.53 -1.35 0.02 0.00 0.00 175.26 174.70 2ass h PRO 3064N 5.65 0.00 -0.01 0.39 0.11 -1.72 -0.20 132.00 136.22 2ass h PRO 3064Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2ass h PRO 3064Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 2ass h PRO 3064CO 0.30 0.00 -0.01 -2.39 -0.21 0.00 0.00 178.00 175.69 2ass n HIS 3065N -2.24 0.00 -3.72 0.65 1.44 -1.26 -4.68 115.22 105.41 2ass n HIS 3065Ca -0.01 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.32 2ass n HIS 3065Cb 0.21 -0.01 -0.12 0.00 0.12 0.00 0.00 29.99 30.19 2ass n HIS 3065CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2ass s ILE 3066N -2.02 4.16 -0.18 0.61 -1.09 -0.09 -1.26 121.20 121.33 2ass s ILE 3066Ca 0.38 -0.70 -0.14 0.00 -2.23 0.00 0.00 60.65 57.96 2ass s ILE 3066Cb 0.21 -3.18 -0.04 0.00 -1.58 0.00 0.00 42.46 37.86 2ass s ILE 3066CO 0.34 0.01 0.31 -0.76 -1.23 0.00 0.00 174.94 173.61 2ass s LEU 3067N 1.52 4.21 -0.18 2.97 1.43 -0.76 -4.56 118.68 123.31 2ass s LEU 3067Ca 0.03 0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 53.45 2ass s LEU 3067Cb -0.18 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.62 2ass s LEU 3067CO 0.04 0.05 0.35 -0.76 0.23 0.00 0.00 176.35 176.26 2ass s LEU 3068N 0.74 4.19 0.28 1.79 1.02 -1.26 -1.07 118.68 124.38 2ass s LEU 3068Ca 0.16 0.51 0.10 0.00 0.02 0.00 0.00 54.13 54.92 2ass s LEU 3068Cb -0.13 -2.46 -0.05 0.00 0.02 0.00 0.00 46.19 43.57 2ass s LEU 3068CO 0.05 -0.00 -0.15 -0.36 0.02 0.00 0.00 176.35 175.91 2ass s PHE 3069N 0.95 2.17 0.10 0.29 0.40 0.33 -3.45 117.98 118.76 2ass s PHE 3069Ca 0.18 -0.46 -0.25 0.00 -0.60 0.00 0.00 56.93 55.79 2ass s PHE 3069Cb -0.14 -1.07 0.08 0.00 0.51 0.00 0.00 43.02 42.40 2ass s PHE 3069CO 0.07 0.57 0.76 -0.98 0.70 0.00 0.00 175.22 176.33 2ass s ARG 3070N -3.59 1.11 -0.14 0.44 1.70 -0.77 -2.61 118.95 115.10 2ass s ARG 3070Ca 0.29 -0.45 -0.30 0.00 -0.47 0.00 0.00 55.73 54.80 2ass s ARG 3070Cb -0.01 0.49 0.11 0.00 -0.57 0.00 0.00 34.95 34.97 2ass s ARG 3070CO 0.14 -0.49 0.92 -0.98 -1.08 0.00 0.00 175.30 173.80 2ass s ARG 3071N -3.46 0.71 0.25 3.89 1.70 -0.86 -0.51 118.95 120.67 2ass s ARG 3071Ca 0.04 0.20 -0.31 0.00 -0.47 0.00 0.00 55.73 55.19 2ass s ARG 3071Cb -0.01 0.33 -0.13 0.00 -0.57 0.00 0.00 34.95 34.57 2ass s ARG 3071CO -0.09 -0.21 1.47 -2.30 -1.08 0.00 0.00 175.30 173.09 2ass n PRO 3072N 0.85 2.24 0.00 3.89 -0.02 -1.26 -0.86 135.00 139.83 2ass n PRO 3072Ca -0.12 0.80 0.15 0.00 -2.02 0.00 0.00 63.50 62.30 2ass n PRO 3072Cb 0.58 -2.49 0.88 0.00 -0.02 0.00 0.00 33.50 32.44 2ass n PRO 3072CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37