#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x0p s LEU 3003N 0.00 4.38 0.13 0.99 2.96 -1.26 -3.57 118.68 122.31 1x0p s LEU 3003Ca 0.00 1.09 -0.00 0.00 -0.22 0.00 0.00 54.13 55.00 1x0p s LEU 3003Cb 0.00 -2.89 -0.04 0.00 0.50 0.00 0.00 46.19 43.76 1x0p s LEU 3003CO 0.00 0.06 0.03 -1.00 -1.32 0.00 0.00 176.35 174.12 1x0p s HIS 3004N 0.05 0.89 -0.06 5.38 3.76 -0.26 -1.40 115.29 123.66 1x0p s HIS 3004Ca 0.31 -1.15 0.02 0.00 -0.15 0.00 0.00 55.06 54.09 1x0p s HIS 3004Cb -0.17 -0.52 0.01 0.00 1.11 0.00 0.00 32.58 33.01 1x0p s HIS 3004CO 0.16 -0.42 -0.12 0.50 -0.85 0.00 0.00 174.74 174.01 1x0p s ARG 3005N -3.99 1.58 -0.05 1.40 3.52 -0.11 -1.70 118.95 119.60 1x0p s ARG 3005Ca 0.21 -0.39 0.03 0.00 -0.13 0.00 0.00 55.73 55.45 1x0p s ARG 3005Cb 0.07 -1.33 -0.03 0.00 -1.56 0.00 0.00 34.95 32.10 1x0p s ARG 3005CO 0.00 0.04 -0.11 -1.17 -0.81 0.00 0.00 175.30 173.25 1x0p s LEU 3006N 0.61 2.92 -0.03 -0.88 2.96 0.92 -2.34 118.68 122.84 1x0p s LEU 3006Ca -0.13 -0.13 0.01 0.00 -0.22 0.00 0.00 54.13 53.66 1x0p s LEU 3006Cb -0.15 -1.62 0.02 0.00 0.50 0.00 0.00 46.19 44.94 1x0p s LEU 3006CO 0.03 0.35 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.74 1x0p s ILE 3007N -0.78 0.43 0.13 6.68 1.01 -0.08 -0.48 121.20 128.12 1x0p s ILE 3007Ca 0.12 -0.10 -0.12 0.00 0.00 0.00 0.00 60.65 60.55 1x0p s ILE 3007Cb -0.11 -0.46 0.01 0.00 0.01 0.00 0.00 42.46 41.92 1x0p s ILE 3007CO 0.01 0.18 0.31 -0.72 0.00 0.00 0.00 174.94 174.73 1x0p s TYR 3008N 0.70 0.09 0.16 3.97 -0.85 -0.78 0.55 117.35 121.19 1x0p s TYR 3008Ca -0.09 -0.46 0.06 0.00 -0.52 0.00 0.00 57.07 56.07 1x0p s TYR 3008Cb -0.12 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.26 1x0p s TYR 3008CO -0.00 -0.67 -0.14 -0.48 -1.52 0.00 0.00 175.55 172.73 1x0p s LEU 3009N -2.87 2.48 0.18 -3.49 0.05 0.77 -1.84 118.68 113.95 1x0p s LEU 3009Ca 0.08 -0.91 -0.16 0.00 0.05 0.00 0.00 54.13 53.18 1x0p s LEU 3009Cb 0.03 -0.58 0.02 0.00 -2.05 0.00 0.00 46.19 43.61 1x0p s LEU 3009CO -0.08 -0.17 0.47 -0.94 -0.55 0.00 0.00 176.35 175.08 1x0p s SER 3010N -2.86 -0.22 -0.27 1.48 1.04 -0.55 0.09 113.70 112.42 1x0p s SER 3010Ca 0.15 -0.50 -0.11 0.00 0.48 0.00 0.00 55.95 55.98 1x0p s SER 3010Cb -0.02 0.54 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 1x0p s SER 3010CO 0.04 -1.00 0.19 0.00 0.98 0.00 0.00 173.24 173.45 1x0p s ALA 3012N 1.56 2.93 0.12 0.00 0.00 -0.23 -0.57 121.76 125.57 1x0p s ALA 3012Ca 0.08 1.20 -0.30 0.00 0.00 0.00 0.00 51.96 52.94 1x0p s ALA 3012Cb -0.15 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.41 1x0p s ALA 3012CO 0.09 -1.08 0.95 0.99 0.00 0.00 0.00 175.76 176.72 1x0p s THR 3013N -1.37 4.48 0.27 0.00 2.01 -0.72 -4.81 115.64 115.49 1x0p s THR 3013Ca 0.67 2.05 -0.28 0.00 0.31 0.00 0.00 61.69 64.44 1x0p s THR 3013Cb -0.36 -4.32 -0.15 0.00 0.01 0.00 0.00 72.50 67.68 1x0p s THR 3013CO 0.44 0.33 0.91 0.47 -0.69 0.00 0.00 174.62 176.08 1x0p n ASP 3014N 2.68 0.77 0.00 3.53 8.00 -1.26 -2.08 116.55 128.19 1x0p n ASP 3014Ca 0.02 1.17 0.00 0.00 0.71 0.00 0.00 54.79 56.69 1x0p n ASP 3014Cb 0.49 -1.22 0.00 0.00 -0.02 0.00 0.00 41.12 40.37 1x0p n ASP 3014CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x0p n GLY 3015N 1.38 0.77 3.62 0.44 0.00 -1.26 -5.01 105.19 105.13 1x0p n GLY 3015Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1x0p n GLY 3015CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x0p s LEU 3016N 0.00 3.80 0.43 0.99 2.96 -0.88 -4.96 118.68 121.02 1x0p s LEU 3016Ca 0.00 2.09 0.05 0.00 -0.22 0.00 0.00 54.13 56.05 1x0p s LEU 3016Cb 0.00 -3.52 0.01 0.00 0.50 0.00 0.00 46.19 43.18 1x0p s LEU 3016CO 0.00 -1.61 0.61 -0.94 -1.32 0.00 0.00 176.35 173.09 1x0p s SER 3017N 6.64 5.68 0.10 3.68 1.04 -1.26 -5.00 113.70 124.58 1x0p s SER 3017Ca 0.93 -0.14 -0.23 0.00 0.48 0.00 0.00 55.95 57.00 1x0p s SER 3017Cb -0.35 -1.01 -0.11 0.00 0.10 0.00 0.00 66.02 64.65 1x0p s SER 3017CO 0.37 -0.76 1.71 0.22 0.98 0.00 0.00 173.24 175.76 1x0p h TYR 3018N 0.53 -0.14 0.00 5.02 3.20 -2.01 -1.83 116.97 121.74 1x0p h TYR 3018Ca -0.43 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.44 1x0p h TYR 3018Cb 1.27 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 39.61 1x0p h TYR 3018CO 0.41 -0.09 -0.00 -1.00 -1.64 0.00 0.00 178.16 175.83 1x0p h PRO 3019N -0.09 0.00 -0.07 1.82 0.13 -1.98 -1.23 132.00 130.58 1x0p h PRO 3019Ca 0.03 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.12 1x0p h PRO 3019Cb 0.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.26 1x0p h PRO 3019CO -0.07 0.00 -0.09 -0.44 -0.23 0.00 0.00 178.00 177.18 1x0p h ASP 3020N 0.00 0.19 -0.43 1.44 3.32 -1.73 -1.39 116.42 117.82 1x0p h ASP 3020Ca -0.00 -0.52 0.03 0.00 0.02 0.00 0.00 57.03 56.56 1x0p h ASP 3020Cb 0.05 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 1x0p h ASP 3020CO 0.00 0.68 0.22 -0.07 -1.72 0.00 0.00 179.24 178.35 1x0p h LEU 3021N -0.28 0.32 -1.09 1.55 3.38 -1.01 0.84 115.31 119.01 1x0p h LEU 3021Ca 0.01 0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.09 1x0p h LEU 3021Cb 0.63 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.27 1x0p h LEU 3021CO 0.02 0.23 0.61 0.03 0.09 0.00 0.00 178.44 179.43 1x0p h ARG 3022N 0.44 0.98 -0.19 1.13 2.47 -1.24 0.23 114.38 118.21 1x0p h ARG 3022Ca 0.18 -0.06 -0.19 0.00 -1.26 0.00 0.00 59.98 58.66 1x0p h ARG 3022Cb 0.08 -0.22 0.00 0.00 -1.65 0.00 0.00 29.97 28.18 1x0p h ARG 3022CO -0.13 0.65 -0.64 0.22 0.56 0.00 0.00 179.97 180.63 1x0p h ASP 3023N 1.01 0.79 -0.23 7.04 1.82 -0.19 -0.52 116.42 126.14 1x0p h ASP 3023Ca 0.44 -0.46 -0.01 0.00 -0.39 0.00 0.00 57.03 56.60 1x0p h ASP 3023Cb 0.33 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 40.11 1x0p h ASP 3023CO -0.19 1.23 0.09 0.40 -1.61 0.00 0.00 179.24 179.16 1x0p h ILE 3024N 0.50 1.16 -0.62 2.25 2.04 0.09 -2.21 117.51 120.72 1x0p h ILE 3024Ca -0.01 -0.48 -0.05 0.00 1.00 0.00 0.00 64.86 65.31 1x0p h ILE 3024Cb 1.23 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 1x0p h ILE 3024CO 0.13 0.16 0.18 0.24 0.00 0.00 0.00 178.15 178.85 1x0p h MET 3025N 0.22 0.98 0.12 2.37 2.86 -0.52 -0.37 114.93 120.58 1x0p h MET 3025Ca 0.08 -0.22 0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1x0p h MET 3025Cb 0.16 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1x0p h MET 3025CO -0.01 0.87 -0.26 0.00 1.06 0.00 0.00 176.91 178.58 1x0p h ALA 3026N 1.06 -0.43 -0.40 6.32 0.00 -0.94 -1.20 119.26 123.66 1x0p h ALA 3026Ca 0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1x0p h ALA 3026Cb 0.32 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1x0p h ALA 3026CO -0.00 -0.79 0.21 0.87 0.00 0.00 0.00 179.25 179.53 1x0p h LYS 3027N -0.46 0.56 -0.13 0.00 6.56 -1.30 -3.02 116.57 118.78 1x0p h LYS 3027Ca 0.03 -0.07 0.04 0.00 -1.06 0.00 0.00 60.65 59.59 1x0p h LYS 3027Cb 0.49 -0.11 -0.05 0.00 -0.57 0.00 0.00 32.23 32.00 1x0p h LYS 3027CO -0.15 0.47 -0.15 0.77 -2.06 0.00 0.00 179.45 178.33 1x0p h SER 3028N 0.51 -0.48 -0.66 0.86 0.02 -0.76 0.11 113.55 113.15 1x0p h SER 3028Ca 0.14 0.09 0.05 0.00 -0.84 0.00 0.00 61.79 61.22 1x0p h SER 3028Cb 0.08 0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.80 1x0p h SER 3028CO -0.02 -0.20 0.39 -0.33 -1.14 0.00 0.00 176.83 175.53 1x0p h GLU 3029N -0.19 0.72 -0.00 3.45 5.08 -1.23 0.29 114.58 122.69 1x0p h GLU 3029Ca 0.10 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1x0p h GLU 3029Cb 0.33 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1x0p h GLU 3029CO -0.25 0.47 -0.00 0.28 -1.00 0.00 0.00 179.01 178.52 1x0p h VAL 3030N 0.74 1.33 -0.29 3.13 2.07 -1.35 -2.21 116.25 119.66 1x0p h VAL 3030Ca 0.28 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.79 1x0p h VAL 3030Cb 0.11 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1x0p h VAL 3030CO -0.15 0.25 0.06 0.78 0.02 0.00 0.00 177.57 178.53 1x0p h ASN 3031N -0.40 0.46 -0.13 0.57 2.35 -0.56 -2.15 115.58 115.71 1x0p h ASN 3031Ca 0.00 -0.25 -0.08 0.00 -0.55 0.00 0.00 56.30 55.43 1x0p h ASN 3031Cb 0.42 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1x0p h ASN 3031CO 0.00 0.59 -0.14 0.78 -1.65 0.00 0.00 177.43 177.01 1x0p h ASN 3032N 0.31 0.49 -0.46 5.81 2.35 -0.51 -0.24 115.58 123.31 1x0p h ASN 3032Ca 0.09 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.68 1x0p h ASN 3032Cb 0.32 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 1x0p h ASN 3032CO 0.00 0.66 0.17 0.25 -1.65 0.00 0.00 177.43 176.86 1x0p h LEU 3033N 0.46 0.65 -0.83 1.61 5.85 -1.28 0.86 115.31 122.62 1x0p h LEU 3033Ca 0.08 -0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 1x0p h LEU 3033Cb 0.52 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1x0p h LEU 3033CO 0.03 0.66 0.18 -0.09 -0.34 0.00 0.00 178.44 178.88 1x0p h ARG 3034N 0.60 1.05 -0.07 1.25 2.43 -0.96 -2.96 114.38 115.72 1x0p h ARG 3034Ca 0.15 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1x0p h ARG 3034Cb 0.22 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1x0p h ARG 3034CO -0.01 0.92 0.00 -0.25 -1.51 0.00 0.00 179.97 179.12 1x0p n ASP 3035N -4.25 1.84 -1.00 -3.80 8.00 -0.14 -4.93 116.55 112.28 1x0p n ASP 3035Ca 0.05 -1.64 -0.09 0.00 0.71 0.00 0.00 54.79 53.82 1x0p n ASP 3035Cb 0.24 -0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.30 1x0p n ASP 3035CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x0p n GLY 3036N 1.20 0.11 3.86 0.44 0.00 0.76 -4.74 105.19 106.82 1x0p n GLY 3036Ca 0.18 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 1x0p n GLY 3036CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x0p s ILE 3037N -2.44 5.15 0.11 -0.61 1.01 0.26 -4.59 121.20 120.09 1x0p s ILE 3037Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.33 1x0p s ILE 3037Cb 0.00 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 39.01 1x0p s ILE 3037CO 0.00 0.28 -0.02 0.42 0.00 0.00 0.00 174.94 175.63 1x0p s THR 3038N -1.32 0.42 -3.44 2.92 -4.23 -0.77 -4.24 115.64 104.97 1x0p s THR 3038Ca 0.27 -1.90 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 1x0p s THR 3038Cb -0.12 -1.80 0.00 0.00 1.34 0.00 0.00 72.50 71.92 1x0p s THR 3038CO 0.19 -0.74 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 1x0p n GLY 3039N -0.05 -0.59 3.26 3.99 0.00 -0.41 -0.63 105.19 110.76 1x0p n GLY 3039Ca -0.10 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.82 1x0p n GLY 3039CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1x0p s MET 3040N -1.38 0.57 -0.22 1.61 1.75 -1.07 -2.65 119.30 117.91 1x0p s MET 3040Ca 0.00 0.16 0.01 0.00 -1.25 0.00 0.00 55.69 54.61 1x0p s MET 3040Cb 0.00 0.26 0.03 0.00 2.84 0.00 0.00 34.83 37.97 1x0p s MET 3040CO 0.00 -0.13 -0.14 -1.17 -0.65 0.00 0.00 175.02 172.94 1x0p s LEU 3041N -0.60 2.81 -0.18 4.11 2.96 0.26 -1.76 118.68 126.28 1x0p s LEU 3041Ca -0.07 -0.95 -0.09 0.00 -0.22 0.00 0.00 54.13 52.80 1x0p s LEU 3041Cb -0.04 -1.55 -0.05 0.00 0.50 0.00 0.00 46.19 45.06 1x0p s LEU 3041CO 0.03 -0.09 0.12 0.00 -1.32 0.00 0.00 176.35 175.08 1x0p s TYR 3043N 0.15 1.21 -0.20 0.00 5.04 -0.26 -0.62 117.35 122.67 1x0p s TYR 3043Ca 0.08 -0.52 -0.29 0.00 -2.44 0.00 0.00 57.07 53.90 1x0p s TYR 3043Cb -0.11 -1.05 0.14 0.00 0.35 0.00 0.00 41.96 41.28 1x0p s TYR 3043CO -0.01 -0.40 1.06 0.20 -1.34 0.00 0.00 175.55 175.06 1x0p s GLY 3044N 1.52 -0.18 -1.41 8.97 0.00 -0.59 -2.28 107.32 113.36 1x0p s GLY 3044Ca 0.00 2.31 -0.08 0.00 0.00 0.00 0.00 44.72 46.95 1x0p s GLY 3044CO -0.05 1.24 0.58 -2.01 0.00 0.00 0.00 173.10 172.86 1x0p n ASN 3045N 1.04 -4.78 0.00 1.64 5.15 -1.26 -0.49 115.26 116.56 1x0p n ASN 3045Ca -0.10 -0.37 0.00 0.00 -0.60 0.00 0.00 54.58 53.51 1x0p n ASN 3045Cb 0.58 -3.89 0.00 0.00 -0.53 0.00 0.00 39.78 35.93 1x0p n ASN 3045CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x0p n GLY 3046N -1.36 0.20 3.55 8.20 0.00 -1.26 -4.98 105.19 109.54 1x0p n GLY 3046Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 1x0p n GLY 3046CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1x0p s MET 3047N -1.20 2.18 -0.04 1.61 -1.94 0.35 -1.07 119.30 119.20 1x0p s MET 3047Ca 0.00 -0.96 0.03 0.00 -1.71 0.00 0.00 55.69 53.05 1x0p s MET 3047Cb 0.00 -2.31 -0.03 0.00 2.01 0.00 0.00 34.83 34.50 1x0p s MET 3047CO 0.00 0.53 -0.11 -0.06 -0.01 0.00 0.00 175.02 175.37 1x0p s PHE 3048N -1.10 2.79 -0.16 -0.03 2.99 0.13 -1.54 117.98 121.06 1x0p s PHE 3048Ca 0.19 -0.09 -0.05 0.00 0.00 0.00 0.00 56.93 56.98 1x0p s PHE 3048Cb -0.11 -1.64 0.06 0.00 0.00 0.00 0.00 43.02 41.33 1x0p s PHE 3048CO 0.10 0.26 0.08 -1.17 -0.00 0.00 0.00 175.22 174.50 1x0p s LEU 3049N -0.90 0.36 0.09 -0.37 2.96 0.21 -1.48 118.68 119.56 1x0p s LEU 3049Ca 0.13 -0.56 0.07 0.00 -0.22 0.00 0.00 54.13 53.55 1x0p s LEU 3049Cb -0.11 -0.25 -0.03 0.00 0.50 0.00 0.00 46.19 46.30 1x0p s LEU 3049CO 0.02 -0.34 -0.19 -1.58 -1.32 0.00 0.00 176.35 172.94 1x0p s GLN 3050N 2.13 1.07 -0.01 1.98 0.74 -0.77 0.31 119.66 125.11 1x0p s GLN 3050Ca 0.02 -1.10 0.04 0.00 0.05 0.00 0.00 55.36 54.37 1x0p s GLN 3050Cb -0.16 -1.27 -0.01 0.00 1.10 0.00 0.00 33.01 32.67 1x0p s GLN 3050CO -0.08 0.29 -0.14 -0.08 -0.55 0.00 0.00 175.29 174.73 1x0p s THR 3051N -1.17 1.13 -0.05 -0.34 -1.32 -0.72 -1.86 115.64 111.31 1x0p s THR 3051Ca 0.05 -0.64 0.02 0.00 -1.21 0.00 0.00 61.69 59.90 1x0p s THR 3051Cb -0.10 -0.95 0.02 0.00 -1.51 0.00 0.00 72.50 69.96 1x0p s THR 3051CO 0.04 0.30 -0.08 -0.76 -2.21 0.00 0.00 174.62 171.90 1x0p s LEU 3052N -0.39 1.52 0.02 9.08 1.43 0.37 -2.59 118.68 128.12 1x0p s LEU 3052Ca 0.05 -0.21 0.08 0.00 -1.03 0.00 0.00 54.13 53.02 1x0p s LEU 3052Cb -0.06 -0.62 -0.03 0.00 0.03 0.00 0.00 46.19 45.52 1x0p s LEU 3052CO -0.00 -0.00 -0.23 -1.61 0.23 0.00 0.00 176.35 174.74 1x0p s GLU 3053N 0.71 2.01 0.00 1.70 2.02 0.20 -0.05 118.70 125.28 1x0p s GLU 3053Ca -0.12 -1.00 0.00 0.00 0.02 0.00 0.00 54.97 53.87 1x0p s GLU 3053Cb -0.14 -2.09 0.00 0.00 0.10 0.00 0.00 34.13 31.99 1x0p s GLU 3053CO 0.02 0.54 0.00 0.41 0.02 0.00 0.00 175.26 176.25 1x0p n GLY 3054N 1.87 -0.09 3.75 -1.39 0.00 -0.69 -1.85 105.19 106.80 1x0p n GLY 3054Ca -0.17 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.20 1x0p n GLY 3054CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x0p s ASP 3055N -4.00 5.40 0.18 1.61 2.15 -1.26 -1.10 116.67 119.65 1x0p s ASP 3055Ca 0.00 2.52 -0.12 0.00 0.43 0.00 0.00 52.55 55.38 1x0p s ASP 3055Cb 0.00 -2.61 0.10 0.00 -0.30 0.00 0.00 42.92 40.10 1x0p s ASP 3055CO 0.00 -1.46 1.81 -0.09 -0.17 0.00 0.00 175.17 175.26 1x0p h ARG 3056N 1.33 0.86 0.20 4.34 2.43 -1.94 -0.37 114.38 121.24 1x0p h ARG 3056Ca -0.50 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 58.57 1x0p h ARG 3056Cb 1.29 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1x0p h ARG 3056CO 0.57 0.63 -0.10 0.37 -1.51 0.00 0.00 179.97 179.93 1x0p h GLN 3057N 0.85 -0.26 -0.24 0.20 4.15 -1.92 -2.52 115.11 115.36 1x0p h GLN 3057Ca 0.22 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.66 1x0p h GLN 3057Cb 0.00 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 1x0p h GLN 3057CO -0.04 0.06 0.15 0.87 -1.93 0.00 0.00 178.83 177.94 1x0p h LYS 3058N -0.60 0.31 -0.89 1.69 1.79 -1.92 -0.57 116.57 116.38 1x0p h LYS 3058Ca -0.03 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1x0p h LYS 3058Cb 0.44 -0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 30.98 1x0p h LYS 3058CO 0.05 0.22 0.52 0.28 -1.08 0.00 0.00 179.45 179.44 1x0p h VAL 3059N 0.31 1.25 -0.18 0.50 2.07 -1.15 -0.68 116.25 118.37 1x0p h VAL 3059Ca 0.09 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1x0p h VAL 3059Cb -0.02 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.75 1x0p h VAL 3059CO -0.02 0.27 0.07 0.28 0.02 0.00 0.00 177.57 178.19 1x0p h SER 3060N 1.24 0.25 -0.55 0.57 0.02 -1.07 -1.79 113.55 112.22 1x0p h SER 3060Ca 0.32 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1x0p h SER 3060Cb -0.03 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.42 1x0p h SER 3060CO -0.06 0.35 0.27 -0.33 -1.14 0.00 0.00 176.83 175.92 1x0p h GLU 3061N 0.13 0.82 -0.33 3.45 5.08 -0.78 -1.31 114.58 121.64 1x0p h GLU 3061Ca 0.06 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 1x0p h GLU 3061Cb 0.18 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1x0p h GLU 3061CO -0.00 0.64 -0.03 1.15 -1.00 0.00 0.00 179.01 179.77 1x0p h THR 3062N 0.82 1.27 -0.18 1.13 2.02 -0.92 -1.75 112.91 115.29 1x0p h THR 3062Ca 0.20 -1.03 0.01 0.00 0.77 0.00 0.00 66.41 66.36 1x0p h THR 3062Cb 0.09 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1x0p h THR 3062CO -0.03 0.33 0.11 0.22 0.37 0.00 0.00 175.52 176.53 1x0p h TYR 3063N 0.39 0.21 -0.96 3.16 3.20 -0.97 0.14 116.97 122.14 1x0p h TYR 3063Ca 0.09 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.08 1x0p h TYR 3063Cb 0.50 -0.07 -0.08 0.00 1.54 0.00 0.00 36.73 38.62 1x0p h TYR 3063CO 0.04 0.13 0.59 0.00 -1.64 0.00 0.00 178.16 177.28 1x0p h ALA 3064N 1.08 1.42 -0.46 1.82 0.00 -1.14 -0.54 119.26 121.44 1x0p h ALA 3064Ca 0.07 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1x0p h ALA 3064Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1x0p h ALA 3064CO -0.03 0.19 -0.18 -0.09 0.00 0.00 0.00 179.25 179.15 1x0p h ARG 3065N 0.94 0.94 -0.29 0.00 2.43 -0.48 -2.86 114.38 115.06 1x0p h ARG 3065Ca 0.47 -0.39 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1x0p h ARG 3065Cb 0.45 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1x0p h ARG 3065CO -0.26 1.05 0.07 0.82 -1.51 0.00 0.00 179.97 180.14 1x0p h ILE 3066N 0.78 1.14 0.00 1.20 2.04 0.60 -2.06 117.51 121.21 1x0p h ILE 3066Ca 0.11 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1x0p h ILE 3066Cb 0.74 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1x0p h ILE 3066CO 0.06 0.18 0.00 -0.07 0.00 0.00 0.00 178.15 178.32 1x0p h LEU 3067N 0.41 0.00 0.00 1.44 3.38 -0.91 -1.94 115.31 117.69 1x0p h LEU 3067Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1x0p h LEU 3067Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1x0p h LEU 3067CO -0.00 0.00 -0.61 0.11 0.09 0.00 0.00 178.44 178.03 1x0p h LYS 3068N 0.00 0.00 -6.28 1.13 1.57 -1.41 -3.46 116.57 108.12 1x0p h LYS 3068Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 1x0p h LYS 3068Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1x0p h LYS 3068CO 0.00 0.00 1.14 0.34 -0.57 0.00 0.00 179.45 180.36 1x0p s ASP 3069N -5.44 6.57 0.00 0.86 -1.08 -0.73 -4.88 116.67 111.96 1x0p s ASP 3069Ca 0.03 2.29 0.22 0.00 -0.52 0.00 0.00 52.55 54.58 1x0p s ASP 3069Cb 0.09 -2.53 1.12 0.00 -1.46 0.00 0.00 42.92 40.14 1x0p s ASP 3069CO 0.74 -1.00 1.73 -0.81 0.52 0.00 0.00 175.17 176.34 1x0p n PRO 3070N 7.30 0.30 0.00 4.34 -0.04 -1.26 -3.35 135.00 142.29 1x0p n PRO 3070Ca 0.18 0.08 0.09 0.00 -0.04 0.00 0.00 63.50 63.81 1x0p n PRO 3070Cb 0.43 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 32.93 1x0p n PRO 3070CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1x0p n ARG 3071N -1.30 0.53 -3.85 0.54 1.74 -1.26 -4.72 116.66 108.34 1x0p n ARG 3071Ca 0.10 0.02 -0.08 0.00 -0.77 0.00 0.00 57.85 57.12 1x0p n ARG 3071Cb 0.18 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 1x0p n ARG 3071CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1x0p s HIS 3072N -2.10 -0.05 0.39 -1.55 -3.43 -1.21 -1.76 115.29 105.57 1x0p s HIS 3072Ca 0.26 -0.35 -0.13 0.00 -0.80 0.00 0.00 55.06 54.05 1x0p s HIS 3072Cb 0.13 0.51 0.05 0.00 -1.43 0.00 0.00 32.58 31.84 1x0p s HIS 3072CO 0.23 -1.10 0.74 -3.38 -2.00 0.00 0.00 174.74 169.23 1x0p s HIS 3073N -3.93 0.34 -1.39 0.38 -3.43 0.26 -4.83 115.29 102.70 1x0p s HIS 3073Ca 0.13 -0.95 -0.06 0.00 -0.80 0.00 0.00 55.06 53.39 1x0p s HIS 3073Cb -0.03 0.67 0.03 0.00 -1.43 0.00 0.00 32.58 31.82 1x0p s HIS 3073CO 0.05 -1.52 0.85 0.43 -2.00 0.00 0.00 174.74 172.55 1x0p n SER 3074N -1.51 -2.87 -4.77 7.38 7.64 -1.26 -0.72 113.62 117.52 1x0p n SER 3074Ca -0.07 -0.78 -0.39 0.00 1.01 0.00 0.00 58.87 58.65 1x0p n SER 3074Cb 0.60 -4.12 -0.01 0.00 -1.01 0.00 0.00 64.21 59.68 1x0p n SER 3074CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x0p s ALA 3075N -3.50 3.18 -0.03 -0.43 0.00 -1.26 -4.26 121.76 115.46 1x0p s ALA 3075Ca 0.28 1.14 -0.00 0.00 0.00 0.00 0.00 51.96 53.38 1x0p s ALA 3075Cb -0.14 -3.45 0.03 0.00 0.00 0.00 0.00 23.12 19.56 1x0p s ALA 3075CO 0.81 -0.76 0.01 -2.00 0.00 0.00 0.00 175.76 173.82 1x0p s GLU 3076N -2.32 0.24 0.05 0.00 2.12 0.11 -4.98 118.70 113.92 1x0p s GLU 3076Ca 0.58 0.13 -0.30 0.00 0.36 0.00 0.00 54.97 55.74 1x0p s GLU 3076Cb -0.35 -0.51 -0.05 0.00 0.26 0.00 0.00 34.13 33.48 1x0p s GLU 3076CO 0.45 -0.18 1.11 0.42 -0.54 0.00 0.00 175.26 176.51 1x0p s ILE 3077N 1.28 4.34 -0.21 -3.70 1.01 -1.26 -0.16 121.20 122.49 1x0p s ILE 3077Ca -0.06 1.71 -0.09 0.00 0.00 0.00 0.00 60.65 62.20 1x0p s ILE 3077Cb -0.13 -4.09 -0.19 0.00 0.01 0.00 0.00 42.46 38.05 1x0p s ILE 3077CO -0.02 0.15 0.01 0.52 0.00 0.00 0.00 174.94 175.60 1x0p n VAL 3078N 3.76 1.60 -3.52 2.92 0.31 0.19 -4.91 118.33 118.68 1x0p n VAL 3078Ca 0.07 -0.44 -0.08 0.00 -0.01 0.00 0.00 64.34 63.89 1x0p n VAL 3078Cb 0.48 -1.75 -0.02 0.00 -0.91 0.00 0.00 33.84 31.64 1x0p n VAL 3078CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1x0p s GLU 3079N -2.50 0.74 -0.26 5.55 -1.05 -0.65 -4.62 118.70 115.92 1x0p s GLU 3079Ca -0.31 -0.27 -0.05 0.00 -0.15 0.00 0.00 54.97 54.19 1x0p s GLU 3079Cb 0.09 0.34 0.14 0.00 -0.44 0.00 0.00 34.13 34.26 1x0p s GLU 3079CO 0.62 -0.32 0.50 0.12 0.95 0.00 0.00 175.26 177.13 1x0p s PHE 3080N -3.02 -1.11 0.18 4.83 5.36 -1.25 -0.90 117.98 122.07 1x0p s PHE 3080Ca 0.06 1.53 -0.19 0.00 -0.96 0.00 0.00 56.93 57.37 1x0p s PHE 3080Cb -0.01 0.38 0.04 0.00 -0.34 0.00 0.00 43.02 43.09 1x0p s PHE 3080CO -0.08 -0.69 0.54 -1.59 -1.46 0.00 0.00 175.22 171.94 1x0p s LYS 3081N 2.71 1.34 0.44 10.12 -2.85 -0.99 -4.99 119.74 125.53 1x0p s LYS 3081Ca 0.07 -0.76 -0.22 0.00 -1.00 0.00 0.00 55.97 54.06 1x0p s LYS 3081Cb -0.14 0.54 -0.08 0.00 -2.06 0.00 0.00 37.83 36.09 1x0p s LYS 3081CO -0.17 -0.57 1.08 0.00 0.10 0.00 0.00 175.35 175.79 1x0p s ALA 3082N -3.84 2.98 0.03 0.59 0.00 -1.26 -0.93 121.76 119.33 1x0p s ALA 3082Ca 0.07 0.74 0.03 0.00 0.00 0.00 0.00 51.96 52.79 1x0p s ALA 3082Cb -0.01 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 1x0p s ALA 3082CO -0.06 -0.37 -0.10 0.96 0.00 0.00 0.00 175.76 176.19 1x0p s ILE 3083N -1.72 0.76 0.10 0.00 -4.36 -0.49 -4.85 121.20 110.63 1x0p s ILE 3083Ca 0.62 -0.87 -0.15 0.00 -0.26 0.00 0.00 60.65 60.00 1x0p s ILE 3083Cb -0.22 -0.72 -0.10 0.00 1.25 0.00 0.00 42.46 42.66 1x0p s ILE 3083CO 0.27 -0.12 1.38 -0.08 0.24 0.00 0.00 174.94 176.64 1x0p h GLU 3084N 4.99 0.72 -3.78 0.37 4.81 -1.97 -3.42 114.58 116.30 1x0p h GLU 3084Ca -0.35 -0.43 -0.10 0.00 -0.13 0.00 0.00 59.36 58.35 1x0p h GLU 3084Cb 1.19 0.04 -0.16 0.00 0.63 0.00 0.00 28.75 30.45 1x0p h GLU 3084CO 0.44 1.05 -0.44 -1.83 -0.73 0.00 0.00 179.01 177.50 1x0p s GLU 3085N -4.19 0.73 0.57 1.92 -1.05 -1.26 -5.03 118.70 110.38 1x0p s GLU 3085Ca -0.12 -0.85 -0.15 0.00 -0.15 0.00 0.00 54.97 53.70 1x0p s GLU 3085Cb 0.08 0.29 -0.05 0.00 -0.44 0.00 0.00 34.13 34.01 1x0p s GLU 3085CO 0.85 -0.21 1.02 1.03 0.95 0.00 0.00 175.26 178.90 1x0p s ARG 3086N -3.24 3.62 -0.14 -4.83 0.52 -1.26 -5.00 118.95 108.62 1x0p s ARG 3086Ca 0.00 1.01 -0.06 0.00 -0.52 0.00 0.00 55.73 56.17 1x0p s ARG 3086Cb 0.02 -2.08 -0.06 0.00 0.52 0.00 0.00 34.95 33.35 1x0p s ARG 3086CO -0.08 -0.55 -0.17 2.41 0.02 0.00 0.00 175.30 176.93 1x0p n THR 3087N -1.99 0.77 -2.35 0.02 -1.04 -1.26 -4.77 114.28 103.66 1x0p n THR 3087Ca 0.07 -0.21 -0.43 0.00 -2.04 0.00 0.00 64.05 61.45 1x0p n THR 3087Cb 0.54 -1.58 0.00 0.00 -1.82 0.00 0.00 70.33 67.47 1x0p n THR 3087CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1x0p n PHE 3088N -3.52 2.98 0.01 -1.42 3.01 -1.26 -4.76 117.46 112.50 1x0p n PHE 3088Ca -0.27 -2.80 -0.18 0.00 1.01 0.00 0.00 57.45 55.21 1x0p n PHE 3088Cb 0.70 -1.95 -0.14 0.00 -0.01 0.00 0.00 39.48 38.09 1x0p n PHE 3088CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1x0p h ILE 3089N 3.76 1.60 0.00 4.37 2.04 -1.94 -3.29 117.51 124.05 1x0p h ILE 3089Ca 0.39 -2.42 0.00 0.00 1.00 0.00 0.00 64.86 63.83 1x0p h ILE 3089Cb 0.63 3.21 0.00 0.00 -0.74 0.00 0.00 36.82 39.93 1x0p h ILE 3089CO 1.62 0.67 0.00 0.59 0.00 0.00 0.00 178.15 181.03 1x0p n ASN 3090N -4.31 0.62 -4.07 1.72 3.02 -1.26 -4.71 115.26 106.27 1x0p n ASN 3090Ca -0.12 0.75 -0.26 0.00 -0.03 0.00 0.00 54.58 54.91 1x0p n ASN 3090Cb 0.69 -0.84 -0.17 0.00 -0.61 0.00 0.00 39.78 38.85 1x0p n ASN 3090CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1x0p s TRP 3091N -3.50 1.73 0.28 3.10 0.51 -1.26 -4.96 118.94 114.83 1x0p s TRP 3091Ca -0.01 -0.67 -0.03 0.00 -2.12 0.00 0.00 56.10 53.27 1x0p s TRP 3091Cb 0.07 -1.23 0.40 0.00 -0.81 0.00 0.00 33.47 31.90 1x0p s TRP 3091CO 0.26 -0.32 1.94 0.77 -0.51 0.00 0.00 176.95 179.09 1x0p h SER 3092N 6.93 1.02 -1.28 2.95 0.02 -1.84 -1.09 113.55 120.26 1x0p h SER 3092Ca -0.28 -0.02 0.16 0.00 -0.84 0.00 0.00 61.79 60.82 1x0p h SER 3092Cb 1.20 -0.24 -0.25 0.00 0.14 0.00 0.00 62.40 63.25 1x0p h SER 3092CO 0.47 0.71 0.26 -0.32 -1.14 0.00 0.00 176.83 176.81 1x0p s MET 3093N -6.00 0.30 -0.04 3.45 -2.45 -1.26 -3.12 119.30 110.18 1x0p s MET 3093Ca -0.12 0.71 0.04 0.00 -1.25 0.00 0.00 55.69 55.07 1x0p s MET 3093Cb 0.19 0.37 -0.03 0.00 1.25 0.00 0.00 34.83 36.61 1x0p s MET 3093CO 0.81 -0.10 -0.13 0.50 1.05 0.00 0.00 175.02 177.15 1x0p s ARG 3094N 2.24 2.50 -0.19 4.11 3.52 -1.09 -4.82 118.95 125.23 1x0p s ARG 3094Ca -0.04 -0.70 -0.08 0.00 -0.13 0.00 0.00 55.73 54.77 1x0p s ARG 3094Cb -0.06 -2.40 -0.04 0.00 -1.56 0.00 0.00 34.95 30.89 1x0p s ARG 3094CO -0.17 0.62 0.09 -1.17 -0.81 0.00 0.00 175.30 173.86 1x0p s LEU 3095N -0.86 3.99 -0.25 -0.88 2.96 -1.26 0.93 118.68 123.31 1x0p s LEU 3095Ca 0.12 0.15 0.00 0.00 -0.22 0.00 0.00 54.13 54.18 1x0p s LEU 3095Cb -0.11 -2.02 0.07 0.00 0.50 0.00 0.00 46.19 44.63 1x0p s LEU 3095CO 0.02 0.18 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.53 1x0p s VAL 3096N 0.35 1.29 -0.37 1.68 1.01 0.56 -4.95 120.40 119.98 1x0p s VAL 3096Ca 0.05 -1.20 -0.18 0.00 0.00 0.00 0.00 61.98 60.65 1x0p s VAL 3096Cb -0.12 -1.70 0.00 0.00 0.00 0.00 0.00 36.38 34.57 1x0p s VAL 3096CO -0.01 -0.24 0.48 -1.10 0.00 0.00 0.00 175.10 174.23 1x0p s GLN 3097N 1.48 3.50 0.60 2.72 -0.21 -1.26 -1.11 119.66 125.38 1x0p s GLN 3097Ca -0.01 -0.32 0.29 0.00 0.02 0.00 0.00 55.36 55.33 1x0p s GLN 3097Cb -0.18 -3.84 1.53 0.00 1.00 0.00 0.00 33.01 31.52 1x0p s GLN 3097CO -0.09 -0.68 1.94 -0.07 -2.12 0.00 0.00 175.29 174.27 1x0p h LEU 3098N 9.06 0.00 -0.08 2.90 -0.00 -1.87 0.12 115.31 125.44 1x0p h LEU 3098Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.60 1x0p h LEU 3098Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.78 1x0p h LEU 3098CO 0.77 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.82 1x0p n GLY 3099N -1.45 -1.35 0.22 0.83 0.00 -1.26 -2.48 105.19 99.70 1x0p n GLY 3099Ca 0.06 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1x0p n GLY 3099CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1x0p n GLU 3100N -1.70 0.72 -3.47 1.61 4.07 0.41 -4.90 120.64 117.37 1x0p n GLU 3100Ca 0.05 -0.45 -0.22 0.00 -0.06 0.00 0.00 57.16 56.49 1x0p n GLU 3100Cb 0.29 -1.49 -0.01 0.00 -0.06 0.00 0.00 31.44 30.17 1x0p n GLU 3100CO 0.00 0.00 0.00 -1.64 -0.06 0.00 0.00 177.13 175.43 1x0p s MET 3101N -2.59 3.28 0.12 5.31 -1.94 -1.04 -5.04 119.30 117.41 1x0p s MET 3101Ca 0.21 -0.66 -0.31 0.00 -1.71 0.00 0.00 55.69 53.22 1x0p s MET 3101Cb 0.19 -2.74 -0.09 0.00 2.01 0.00 0.00 34.83 34.20 1x0p s MET 3101CO 0.56 0.10 1.58 -0.51 -0.01 0.00 0.00 175.02 176.75 1x0p s ASP 3102N -4.10 6.62 0.16 3.03 1.01 -1.26 -4.89 116.67 117.23 1x0p s ASP 3102Ca 0.42 2.53 -0.30 0.00 0.71 0.00 0.00 52.55 55.91 1x0p s ASP 3102Cb -0.09 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.20 1x0p s ASP 3102CO 0.33 -0.83 1.55 0.77 0.21 0.00 0.00 175.17 177.20 1x0p h SER 3103N 7.42 -1.98 -0.29 0.27 4.64 -1.94 -1.49 113.55 120.18 1x0p h SER 3103Ca -0.42 0.30 -0.02 0.00 -0.47 0.00 0.00 61.79 61.18 1x0p h SER 3103Cb 1.20 0.87 -0.02 0.00 -0.31 0.00 0.00 62.40 64.14 1x0p h SER 3103CO 0.92 -0.29 0.14 -0.78 -0.87 0.00 0.00 176.83 175.94 1x0p h ASP 3104N -0.14 0.43 0.00 4.97 3.58 -1.98 0.95 116.42 124.23 1x0p h ASP 3104Ca 0.15 -0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.56 1x0p h ASP 3104Cb 0.49 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.43 1x0p h ASP 3104CO -0.82 0.39 -0.00 0.74 -2.88 0.00 0.00 179.24 176.67 1x0p h THR 3105N 0.48 1.26 -0.35 2.25 2.02 -1.69 -1.77 112.91 115.11 1x0p h THR 3105Ca 0.12 -0.79 -0.12 0.00 0.77 0.00 0.00 66.41 66.40 1x0p h THR 3105Cb 0.10 1.80 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 1x0p h THR 3105CO -0.01 0.20 -0.26 -0.29 0.37 0.00 0.00 175.52 175.53 1x0p h ILE 3106N -0.34 1.27 0.05 3.11 -0.00 -1.13 -2.24 117.51 118.24 1x0p h ILE 3106Ca -0.00 -1.37 0.03 0.00 -0.00 0.00 0.00 64.86 63.51 1x0p h ILE 3106Cb 0.34 1.28 -0.04 0.00 -0.00 0.00 0.00 36.82 38.40 1x0p h ILE 3106CO 0.00 0.45 -0.26 -0.09 -0.00 0.00 0.00 178.15 178.25 1x0p h ARG 3107N 0.62 -0.42 -0.48 2.19 2.43 -0.73 0.51 114.38 118.50 1x0p h ARG 3107Ca 0.08 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1x0p h ARG 3107Cb 0.76 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.38 1x0p h ARG 3107CO 0.06 -0.28 0.28 0.00 -1.51 0.00 0.00 179.97 178.53 1x0p h ARG 3108N -0.43 0.55 -0.49 0.20 3.08 -1.21 -1.33 114.38 114.75 1x0p h ARG 3108Ca 0.05 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1x0p h ARG 3108Cb 0.49 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 1x0p h ARG 3108CO -0.19 0.37 0.23 1.25 -1.07 0.00 0.00 179.97 180.56 1x0p h LEU 3109N 0.57 0.64 -0.67 3.04 5.85 -1.05 0.68 115.31 124.36 1x0p h LEU 3109Ca 0.19 -0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.72 1x0p h LEU 3109Cb 0.01 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1x0p h LEU 3109CO -0.08 0.59 0.20 -0.09 -0.34 0.00 0.00 178.44 178.71 1x0p h ARG 3110N 0.65 1.06 -0.46 1.25 1.12 -0.71 -2.74 114.38 114.54 1x0p h ARG 3110Ca 0.17 -0.24 -0.12 0.00 -1.11 0.00 0.00 59.98 58.68 1x0p h ARG 3110Cb 0.12 -0.15 -0.01 0.00 -0.01 0.00 0.00 29.97 29.92 1x0p h ARG 3110CO -0.02 0.93 -0.16 -0.07 -3.11 0.00 0.00 179.97 177.53 1x0p h LEU 3111N 0.99 0.94 -1.38 3.80 3.38 -1.02 -2.80 115.31 119.22 1x0p h LEU 3111Ca 0.22 -0.38 0.16 0.00 0.09 0.00 0.00 57.88 57.97 1x0p h LEU 3111Cb 0.32 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 1x0p h LEU 3111CO -0.00 1.11 0.57 0.50 0.09 0.00 0.00 178.44 180.71 1x0p h LYS 3112N 0.77 0.56 -0.14 1.13 3.64 -0.56 -2.79 116.57 119.18 1x0p h LYS 3112Ca 0.11 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1x0p h LYS 3112Cb 0.73 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.39 1x0p h LYS 3112CO 0.06 0.37 -0.15 0.66 -2.27 0.00 0.00 179.45 178.12 1x0p n TYR 3113N -4.55 0.46 -3.52 1.91 4.02 -1.12 -5.03 117.16 109.32 1x0p n TYR 3113Ca 0.18 -1.26 -0.11 0.00 -0.01 0.00 0.00 57.90 56.69 1x0p n TYR 3113Cb 0.54 -0.30 -0.04 0.00 -0.02 0.00 0.00 39.34 39.53 1x0p n TYR 3113CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1x0p s SER 3114N -2.71 -0.44 0.00 7.72 1.04 -1.05 -4.75 113.70 113.51 1x0p s SER 3114Ca 0.39 0.27 0.18 0.00 0.48 0.00 0.00 55.95 57.26 1x0p s SER 3114Cb 0.35 0.40 0.52 0.00 0.10 0.00 0.00 66.02 67.40 1x0p s SER 3114CO 0.01 -0.56 1.42 -0.81 0.98 0.00 0.00 173.24 174.28 1x0p n PRO 3115N 0.28 2.03 -3.02 4.02 -0.04 -1.26 -4.55 135.00 132.46 1x0p n PRO 3115Ca -0.12 -1.58 -0.31 0.00 -0.04 0.00 0.00 63.50 61.45 1x0p n PRO 3115Cb 0.60 -1.40 -0.05 0.00 -0.04 0.00 0.00 33.50 32.62 1x0p n PRO 3115CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x0p s ALA 3116N -1.53 3.34 -1.52 0.55 0.00 -1.26 -4.97 121.76 116.36 1x0p s ALA 3116Ca 0.33 -0.08 0.27 0.00 0.00 0.00 0.00 51.96 52.47 1x0p s ALA 3116Cb 0.18 -2.73 0.80 0.00 0.00 0.00 0.00 23.12 21.37 1x0p s ALA 3116CO 0.24 0.18 1.60 0.00 0.00 0.00 0.00 175.76 177.79 1x0p n ALA 3117N -0.78 3.10 -2.57 0.00 0.00 -1.26 -4.70 120.51 114.30 1x0p n ALA 3117Ca 0.03 -0.35 -0.11 0.00 0.00 0.00 0.00 53.44 53.00 1x0p n ALA 3117Cb 0.53 -1.18 -0.08 0.00 0.00 0.00 0.00 19.45 18.72 1x0p n ALA 3117CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1x0p s THR 3118N -2.64 0.00 -0.21 0.00 -4.23 -1.26 -5.08 115.64 102.22 1x0p s THR 3118Ca 0.22 -1.78 -0.29 0.00 -1.18 0.00 0.00 61.69 58.66 1x0p s THR 3118Cb 0.19 -2.40 -0.04 0.00 1.34 0.00 0.00 72.50 71.59 1x0p s THR 3118CO 0.56 0.00 1.79 0.12 -0.54 0.00 0.00 174.62 176.54 1x0p s PHE 3119N -4.06 1.80 -0.39 3.99 5.36 -1.26 -4.92 117.98 118.51 1x0p s PHE 3119Ca 0.33 0.44 0.03 0.00 -0.96 0.00 0.00 56.93 56.76 1x0p s PHE 3119Cb 0.04 -4.03 0.16 0.00 -0.34 0.00 0.00 43.02 38.85 1x0p s PHE 3119CO 0.12 -3.44 0.32 -0.65 -1.46 0.00 0.00 175.22 170.10 1x0p s GLN 3120N 5.09 0.76 0.48 10.12 -0.21 -1.26 -4.79 119.66 129.85 1x0p s GLN 3120Ca 0.80 -1.67 0.21 0.00 0.02 0.00 0.00 55.36 54.72 1x0p s GLN 3120Cb -0.28 -1.24 1.23 0.00 1.00 0.00 0.00 33.01 33.73 1x0p s GLN 3120CO 0.32 -1.31 1.97 -1.00 -2.12 0.00 0.00 175.29 173.16 1x0p h PRO 3121N 6.23 0.19 0.00 2.91 0.13 -1.93 -0.75 132.00 138.77 1x0p h PRO 3121Ca 0.17 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1x0p h PRO 3121Cb 0.95 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1x0p h PRO 3121CO 0.30 0.12 0.00 0.00 -0.23 0.00 0.00 178.00 178.19 1x0p h ARG 3122N 0.19 0.00 -0.35 0.86 3.08 -1.97 0.88 114.38 117.07 1x0p h ARG 3122Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1x0p h ARG 3122Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.95 1x0p h ARG 3122CO -0.05 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.72 1x0p n SER 3123N -2.67 2.87 -4.69 7.04 3.41 -0.29 -4.93 113.62 114.36 1x0p n SER 3123Ca -0.02 -1.91 -0.32 0.00 -0.26 0.00 0.00 58.87 56.36 1x0p n SER 3123Cb 0.08 -0.23 -0.08 0.00 -0.26 0.00 0.00 64.21 63.72 1x0p n SER 3123CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1x0p s MET 3124N -1.55 2.73 0.84 4.33 -1.94 0.30 -4.64 119.30 119.36 1x0p s MET 3124Ca 0.37 -0.69 -0.12 0.00 -1.71 0.00 0.00 55.69 53.54 1x0p s MET 3124Cb 0.21 -2.64 0.11 0.00 2.01 0.00 0.00 34.83 34.52 1x0p s MET 3124CO 0.29 0.59 1.19 0.95 -0.01 0.00 0.00 175.02 178.04 1x0p s THR 3125N -1.19 2.04 0.13 2.05 -4.23 -1.26 -4.83 115.64 108.36 1x0p s THR 3125Ca 0.22 -0.06 -0.19 0.00 -1.18 0.00 0.00 61.69 60.49 1x0p s THR 3125Cb -0.12 -2.98 -0.03 0.00 1.34 0.00 0.00 72.50 70.71 1x0p s THR 3125CO 0.14 0.00 1.75 0.00 -0.54 0.00 0.00 174.62 175.97 1x0p h ALA 3126N -1.15 0.28 -0.68 3.99 0.00 -1.98 -1.02 119.26 118.70 1x0p h ALA 3126Ca -0.45 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 1x0p h ALA 3126Cb 1.30 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 1x0p h ALA 3126CO 0.56 -0.32 0.21 1.49 0.00 0.00 0.00 179.25 181.19 1x0p h GLU 3127N 0.21 1.05 -0.39 0.00 4.57 -1.95 -0.84 114.58 117.24 1x0p h GLU 3127Ca 0.11 -0.22 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 1x0p h GLU 3127Cb 0.07 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.48 1x0p h GLU 3127CO -0.10 0.90 0.15 1.96 -1.18 0.00 0.00 179.01 180.73 1x0p h GLN 3128N 1.01 0.59 -0.57 1.92 4.20 -1.80 0.41 115.11 120.88 1x0p h GLN 3128Ca 0.22 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 1x0p h GLN 3128Cb 0.29 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 1x0p h GLN 3128CO -0.01 0.57 0.26 0.00 -0.67 0.00 0.00 178.83 178.99 1x0p h PHE 3130N 0.77 -0.64 -0.65 0.00 3.57 -0.87 -0.47 116.94 118.65 1x0p h PHE 3130Ca 0.19 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.69 1x0p h PHE 3130Cb 0.14 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 1x0p h PHE 3130CO 0.00 -0.40 0.43 0.00 -2.23 0.00 0.00 178.31 176.11 1x0p h ARG 3131N -0.69 0.83 0.33 1.11 3.08 -0.83 0.15 114.38 118.36 1x0p h ARG 3131Ca -0.07 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1x0p h ARG 3131Cb 0.53 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1x0p h ARG 3131CO 0.12 0.55 -0.16 0.35 -1.07 0.00 0.00 179.97 179.76 1x0p h PHE 3132N 0.86 -0.41 -0.19 3.04 3.57 -0.90 -1.54 116.94 121.36 1x0p h PHE 3132Ca 0.24 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.69 1x0p h PHE 3132Cb -0.06 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1x0p h PHE 3132CO -0.00 -0.16 -0.08 -0.07 -2.23 0.00 0.00 178.31 175.77 1x0p h LEU 3133N -0.59 0.28 -0.52 0.59 3.38 -0.67 -2.31 115.31 115.47 1x0p h LEU 3133Ca -0.04 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1x0p h LEU 3133Cb 0.43 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1x0p h LEU 3133CO 0.07 0.40 -0.08 0.50 0.09 0.00 0.00 178.44 179.42 1x0p h LYS 3134N 0.29 0.97 -0.52 1.13 3.64 -0.48 -1.12 116.57 120.48 1x0p h LYS 3134Ca 0.06 -0.35 -0.10 0.00 -1.27 0.00 0.00 60.65 58.99 1x0p h LYS 3134Cb 0.33 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 1x0p h LYS 3134CO 0.02 1.02 -0.07 0.93 -2.27 0.00 0.00 179.45 179.08 1x0p h GLU 3135N 0.83 0.93 -0.84 1.90 5.08 -0.93 0.14 114.58 121.70 1x0p h GLU 3135Ca 0.14 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 1x0p h GLU 3135Cb 0.64 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 1x0p h GLU 3135CO 0.04 0.96 0.40 -0.07 -1.00 0.00 0.00 179.01 179.35 1x0p h LEU 3136N 0.84 1.09 -0.01 1.33 3.38 -1.25 0.11 115.31 120.80 1x0p h LEU 3136Ca 0.14 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1x0p h LEU 3136Cb 0.59 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1x0p h LEU 3136CO 0.04 0.92 -0.00 0.22 0.09 0.00 0.00 178.44 179.70 1x0p h TYR 3137N 1.19 0.02 0.00 1.13 3.20 -0.74 -3.16 116.97 118.60 1x0p h TYR 3137Ca 0.29 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.10 1x0p h TYR 3137Cb 0.11 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1x0p h TYR 3137CO 0.01 0.42 -0.26 -0.44 -1.64 0.00 0.00 178.16 176.25 1x0p h ASP 3138N -0.38 0.00 -0.82 -2.11 3.32 -0.55 -2.64 116.42 113.23 1x0p h ASP 3138Ca 0.00 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.15 1x0p h ASP 3138Cb 0.41 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.90 1x0p h ASP 3138CO 0.00 0.26 0.53 0.24 -1.72 0.00 0.00 179.24 178.55 1x0p h MET 3139N 0.00 0.73 -0.02 3.56 2.86 -0.74 -3.51 114.93 117.81 1x0p h MET 3139Ca -0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1x0p h MET 3139Cb 0.51 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1x0p h MET 3139CO 0.03 0.48 0.00 0.45 1.06 0.00 0.00 176.91 178.93