#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x0p s LEU 6003N 0.00 4.22 0.20 0.99 2.96 -1.26 -3.14 118.68 122.66 1x0p s LEU 6003Ca 0.00 1.21 0.04 0.00 -0.22 0.00 0.00 54.13 55.15 1x0p s LEU 6003Cb 0.00 -3.22 -0.05 0.00 0.50 0.00 0.00 46.19 43.42 1x0p s LEU 6003CO 0.00 -0.32 -0.03 -1.00 -1.32 0.00 0.00 176.35 173.68 1x0p s HIS 6004N 1.76 1.45 -0.05 5.38 3.76 0.48 -1.12 115.29 126.94 1x0p s HIS 6004Ca 0.39 -0.89 0.01 0.00 -0.15 0.00 0.00 55.06 54.42 1x0p s HIS 6004Cb -0.17 -0.81 0.02 0.00 1.11 0.00 0.00 32.58 32.73 1x0p s HIS 6004CO 0.15 -0.03 -0.06 0.50 -0.85 0.00 0.00 174.74 174.45 1x0p s ARG 6005N -3.84 1.03 -0.06 1.40 3.52 0.06 -1.52 118.95 119.55 1x0p s ARG 6005Ca 0.25 -0.17 0.02 0.00 -0.13 0.00 0.00 55.73 55.69 1x0p s ARG 6005Cb 0.05 -0.98 -0.03 0.00 -1.56 0.00 0.00 34.95 32.43 1x0p s ARG 6005CO 0.06 -0.06 -0.08 -1.17 -0.81 0.00 0.00 175.30 173.23 1x0p s LEU 6006N 0.90 3.08 -0.04 -0.88 2.96 0.76 -2.36 118.68 123.10 1x0p s LEU 6006Ca -0.11 -0.07 0.02 0.00 -0.22 0.00 0.00 54.13 53.75 1x0p s LEU 6006Cb -0.15 -1.67 0.01 0.00 0.50 0.00 0.00 46.19 44.88 1x0p s LEU 6006CO 0.01 0.35 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.66 1x0p s ILE 6007N -0.81 0.85 0.14 6.68 1.01 0.80 -0.64 121.20 129.23 1x0p s ILE 6007Ca 0.13 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.28 1x0p s ILE 6007Cb -0.11 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.60 1x0p s ILE 6007CO 0.02 0.27 0.34 -0.72 0.00 0.00 0.00 174.94 174.85 1x0p s TYR 6008N 0.35 0.08 0.17 3.97 -0.85 -0.62 -0.38 117.35 120.08 1x0p s TYR 6008Ca -0.06 -0.45 0.05 0.00 -0.52 0.00 0.00 57.07 56.09 1x0p s TYR 6008Cb -0.11 0.11 -0.05 0.00 0.38 0.00 0.00 41.96 42.30 1x0p s TYR 6008CO 0.01 -0.72 -0.09 -0.48 -1.52 0.00 0.00 175.55 172.75 1x0p s LEU 6009N -2.88 2.49 0.25 -3.49 0.05 -0.05 -1.61 118.68 113.44 1x0p s LEU 6009Ca 0.09 -1.05 -0.22 0.00 0.05 0.00 0.00 54.13 53.01 1x0p s LEU 6009Cb 0.02 -0.39 0.03 0.00 -2.05 0.00 0.00 46.19 43.80 1x0p s LEU 6009CO -0.06 -0.33 0.73 -0.94 -0.55 0.00 0.00 176.35 175.20 1x0p s SER 6010N -3.22 -0.29 -0.19 1.48 1.04 -0.64 0.03 113.70 111.92 1x0p s SER 6010Ca 0.19 -0.52 -0.06 0.00 0.48 0.00 0.00 55.95 56.04 1x0p s SER 6010Cb 0.02 0.69 -0.03 0.00 0.10 0.00 0.00 66.02 66.80 1x0p s SER 6010CO 0.03 -1.26 0.04 0.00 0.98 0.00 0.00 173.24 173.03 1x0p s ALA 6012N 0.66 3.57 0.41 0.00 0.00 -0.83 -0.13 121.76 125.44 1x0p s ALA 6012Ca 0.02 1.15 -0.27 0.00 0.00 0.00 0.00 51.96 52.87 1x0p s ALA 6012Cb -0.14 -3.52 -0.09 0.00 0.00 0.00 0.00 23.12 19.37 1x0p s ALA 6012CO 0.02 -0.60 1.41 0.99 0.00 0.00 0.00 175.76 177.58 1x0p s THR 6013N 0.49 2.21 0.22 0.00 2.01 -0.64 -4.87 115.64 115.06 1x0p s THR 6013Ca 0.60 0.19 -0.32 0.00 0.31 0.00 0.00 61.69 62.48 1x0p s THR 6013Cb -0.38 -3.12 -0.14 0.00 0.01 0.00 0.00 72.50 68.87 1x0p s THR 6013CO 0.36 0.04 1.27 0.47 -0.69 0.00 0.00 174.62 176.06 1x0p n ASP 6014N 0.14 2.05 0.00 3.53 8.00 -1.26 -1.82 116.55 127.19 1x0p n ASP 6014Ca 0.03 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.68 1x0p n ASP 6014Cb 0.41 -1.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.18 1x0p n ASP 6014CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x0p n GLY 6015N 1.99 0.42 3.68 0.44 0.00 -1.26 -5.03 105.19 105.42 1x0p n GLY 6015Ca 0.13 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.65 1x0p n GLY 6015CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1x0p n LEU 6016N 0.00 3.07 -4.53 0.99 7.94 -0.75 -4.95 117.00 118.77 1x0p n LEU 6016Ca 0.00 1.02 -0.25 0.00 -1.11 0.00 0.00 56.01 55.67 1x0p n LEU 6016Cb 0.00 -1.33 -0.10 0.00 0.53 0.00 0.00 43.42 42.53 1x0p n LEU 6016CO 0.00 -0.23 -0.25 -0.94 -1.11 0.00 0.00 177.39 174.86 1x0p s SER 6017N 3.12 2.89 0.24 1.96 1.04 -1.26 -5.03 113.70 116.66 1x0p s SER 6017Ca 0.90 -1.50 -0.13 0.00 0.48 0.00 0.00 55.95 55.71 1x0p s SER 6017Cb -0.77 0.13 0.32 0.00 0.10 0.00 0.00 66.02 65.79 1x0p s SER 6017CO 0.51 -0.71 1.58 1.88 0.98 0.00 0.00 173.24 177.48 1x0p h TYR 6018N 1.88 -0.61 -0.59 5.02 0.99 -2.01 0.83 116.97 122.48 1x0p h TYR 6018Ca -0.40 0.08 0.12 0.00 2.00 0.00 0.00 58.73 60.53 1x0p h TYR 6018Cb 1.26 0.40 -0.03 0.00 1.00 0.00 0.00 36.73 39.36 1x0p h TYR 6018CO 0.98 -0.37 0.40 -1.00 -0.00 0.00 0.00 178.16 178.17 1x0p h PRO 6019N -0.02 0.28 -0.30 4.88 0.13 -1.99 -1.58 132.00 133.39 1x0p h PRO 6019Ca 0.37 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.44 1x0p h PRO 6019Cb 0.61 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.66 1x0p h PRO 6019CO -0.87 0.18 0.01 -0.44 -0.23 0.00 0.00 178.00 176.66 1x0p h ASP 6020N 0.29 0.51 -0.79 1.44 3.32 -1.24 -2.64 116.42 117.32 1x0p h ASP 6020Ca 0.28 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 1x0p h ASP 6020Cb 0.71 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.09 1x0p h ASP 6020CO -0.06 0.68 0.41 -0.07 -1.72 0.00 0.00 179.24 178.48 1x0p h LEU 6021N 0.33 1.01 -0.18 1.55 3.38 -1.13 -1.66 115.31 118.60 1x0p h LEU 6021Ca 0.09 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1x0p h LEU 6021Cb 0.41 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1x0p h LEU 6021CO 0.01 0.83 0.08 0.03 0.09 0.00 0.00 178.44 179.49 1x0p h ARG 6022N 1.12 0.26 -0.90 1.13 3.08 -1.26 -0.60 114.38 117.22 1x0p h ARG 6022Ca 0.28 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.29 1x0p h ARG 6022Cb 0.06 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 1x0p h ARG 6022CO -0.04 0.30 0.58 0.22 -1.07 0.00 0.00 179.97 179.97 1x0p h ASP 6023N 0.16 1.04 -0.27 7.04 3.58 -1.25 0.11 116.42 126.82 1x0p h ASP 6023Ca 0.06 -0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 1x0p h ASP 6023Cb 0.13 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1x0p h ASP 6023CO -0.01 0.76 0.15 0.40 -2.88 0.00 0.00 179.24 177.66 1x0p h ILE 6024N 1.22 1.12 -0.40 2.25 2.04 -0.94 -2.25 117.51 120.56 1x0p h ILE 6024Ca 0.33 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1x0p h ILE 6024Cb -0.12 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 1x0p h ILE 6024CO -0.07 0.12 0.17 0.24 0.00 0.00 0.00 178.15 178.61 1x0p h MET 6025N 0.33 0.59 -0.16 2.37 2.86 -0.44 -0.15 114.93 120.33 1x0p h MET 6025Ca 0.10 -0.10 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 1x0p h MET 6025Cb 0.06 -0.10 -0.06 0.00 0.06 0.00 0.00 31.60 31.57 1x0p h MET 6025CO -0.02 0.55 -0.23 0.00 1.06 0.00 0.00 176.91 178.27 1x0p h ALA 6026N 1.01 -0.17 -0.44 6.32 0.00 -0.64 0.29 119.26 125.63 1x0p h ALA 6026Ca 0.13 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 1x0p h ALA 6026Cb 0.17 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1x0p h ALA 6026CO -0.01 -0.68 -0.22 1.57 0.00 0.00 0.00 179.25 179.91 1x0p h LYS 6027N -0.28 0.89 -0.07 0.00 2.10 -1.31 -3.02 116.57 114.88 1x0p h LYS 6027Ca 0.11 -0.37 0.00 0.00 -2.00 0.00 0.00 60.65 58.39 1x0p h LYS 6027Cb 0.44 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.73 1x0p h LYS 6027CO -0.32 1.02 0.04 0.77 -2.00 0.00 0.00 179.45 178.96 1x0p h SER 6028N 0.77 0.06 -0.60 7.07 0.02 -0.44 -0.57 113.55 119.86 1x0p h SER 6028Ca 0.10 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.08 1x0p h SER 6028Cb 0.76 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.25 1x0p h SER 6028CO 0.06 0.05 0.37 -0.33 -1.14 0.00 0.00 176.83 175.84 1x0p h GLU 6029N 0.09 0.70 -0.27 3.45 5.08 -0.97 0.15 114.58 122.81 1x0p h GLU 6029Ca 0.03 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 1x0p h GLU 6029Cb -0.00 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1x0p h GLU 6029CO -0.01 0.46 0.01 0.28 -1.00 0.00 0.00 179.01 178.75 1x0p h VAL 6030N 0.72 1.25 -0.21 3.13 2.07 -1.38 -2.03 116.25 119.80 1x0p h VAL 6030Ca 0.24 -0.90 -0.20 0.00 0.82 0.00 0.00 66.70 66.67 1x0p h VAL 6030Cb 0.02 1.31 0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1x0p h VAL 6030CO -0.10 0.29 -0.65 0.78 0.02 0.00 0.00 177.57 177.90 1x0p h ASN 6031N 0.26 0.94 -0.42 0.57 2.35 -0.92 -2.75 115.58 115.62 1x0p h ASN 6031Ca 0.08 -0.59 -0.12 0.00 -0.55 0.00 0.00 56.30 55.12 1x0p h ASN 6031Cb 0.41 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 1x0p h ASN 6031CO 0.01 1.36 -0.22 0.78 -1.65 0.00 0.00 177.43 177.72 1x0p h ASN 6032N 0.57 0.92 -0.57 5.81 2.35 -0.76 -0.39 115.58 123.50 1x0p h ASN 6032Ca -0.02 -0.41 0.02 0.00 -0.55 0.00 0.00 56.30 55.35 1x0p h ASN 6032Cb 1.27 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 39.35 1x0p h ASN 6032CO 0.14 1.12 0.35 0.25 -1.65 0.00 0.00 177.43 177.64 1x0p h LEU 6033N 0.71 0.57 -0.88 1.61 6.46 -1.42 0.31 115.31 122.66 1x0p h LEU 6033Ca 0.09 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.84 1x0p h LEU 6033Cb 0.78 -0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 40.55 1x0p h LEU 6033CO 0.06 0.40 0.50 -0.09 -0.62 0.00 0.00 178.44 178.69 1x0p h ARG 6034N 0.69 1.22 -0.37 1.25 2.43 -1.23 -2.90 114.38 115.48 1x0p h ARG 6034Ca 0.23 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1x0p h ARG 6034Cb 0.01 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.32 1x0p h ARG 6034CO -0.09 0.88 0.00 -0.25 -1.51 0.00 0.00 179.97 179.00 1x0p n ASP 6035N -4.37 2.40 -0.92 -3.80 8.00 -0.18 -4.91 116.55 112.77 1x0p n ASP 6035Ca 0.09 -1.91 -0.11 0.00 0.71 0.00 0.00 54.79 53.57 1x0p n ASP 6035Cb 0.08 -0.24 -0.04 0.00 -0.02 0.00 0.00 41.12 40.90 1x0p n ASP 6035CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x0p n GLY 6036N 1.25 1.04 3.86 0.44 0.00 0.15 -4.74 105.19 107.20 1x0p n GLY 6036Ca 0.16 -0.50 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 1x0p n GLY 6036CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x0p s ILE 6037N -2.44 5.29 0.25 -0.61 1.01 0.85 -4.61 121.20 120.95 1x0p s ILE 6037Ca 0.00 0.45 0.02 0.00 0.00 0.00 0.00 60.65 61.12 1x0p s ILE 6037Cb 0.00 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.87 1x0p s ILE 6037CO 0.00 0.56 0.05 0.42 0.00 0.00 0.00 174.94 175.98 1x0p s THR 6038N -1.09 0.82 -4.76 2.92 -4.23 -0.79 -4.18 115.64 104.32 1x0p s THR 6038Ca 0.20 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 1x0p s THR 6038Cb -0.14 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.17 1x0p s THR 6038CO 0.09 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 1x0p n GLY 6039N -0.47 -0.64 3.30 3.99 0.00 -0.91 -0.44 105.19 110.02 1x0p n GLY 6039Ca -0.02 -1.11 -0.14 0.00 0.00 0.00 0.00 46.02 44.75 1x0p n GLY 6039CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1x0p s MET 6040N -1.91 0.60 -0.16 1.61 1.75 -1.01 -2.99 119.30 117.20 1x0p s MET 6040Ca 0.00 0.27 0.01 0.00 -1.25 0.00 0.00 55.69 54.72 1x0p s MET 6040Cb 0.00 0.28 0.01 0.00 2.84 0.00 0.00 34.83 37.96 1x0p s MET 6040CO 0.00 -0.13 -0.18 -1.17 -0.65 0.00 0.00 175.02 172.90 1x0p s LEU 6041N -0.46 2.31 -0.14 4.11 2.96 0.15 -1.71 118.68 125.89 1x0p s LEU 6041Ca -0.06 -0.55 -0.03 0.00 -0.22 0.00 0.00 54.13 53.28 1x0p s LEU 6041Cb -0.03 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 1x0p s LEU 6041CO 0.03 0.06 -0.07 0.00 -1.32 0.00 0.00 176.35 175.05 1x0p s TYR 6043N 0.32 1.93 -0.09 0.00 5.04 0.01 -1.07 117.35 123.49 1x0p s TYR 6043Ca -0.06 -0.96 -0.30 0.00 -2.44 0.00 0.00 57.07 53.31 1x0p s TYR 6043Cb -0.15 -1.43 0.11 0.00 0.35 0.00 0.00 41.96 40.85 1x0p s TYR 6043CO 0.04 -0.53 0.90 0.20 -1.34 0.00 0.00 175.55 174.82 1x0p s GLY 6044N 1.23 -0.38 -1.77 8.97 0.00 -0.67 -1.32 107.32 113.38 1x0p s GLY 6044Ca -0.02 1.58 -0.19 0.00 0.00 0.00 0.00 44.72 46.10 1x0p s GLY 6044CO -0.05 0.80 0.61 -2.01 0.00 0.00 0.00 173.10 172.45 1x0p n ASN 6045N 0.46 -2.09 -0.38 1.64 5.15 -1.26 0.10 115.26 118.88 1x0p n ASN 6045Ca -0.11 -1.15 -0.05 0.00 -0.60 0.00 0.00 54.58 52.67 1x0p n ASN 6045Cb 0.59 -2.12 -0.02 0.00 -0.53 0.00 0.00 39.78 37.70 1x0p n ASN 6045CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x0p n GLY 6046N -1.37 0.65 3.45 8.20 0.00 -1.26 -4.96 105.19 109.90 1x0p n GLY 6046Ca 0.04 -0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 1x0p n GLY 6046CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1x0p s MET 6047N -1.96 1.61 -0.09 1.61 -1.94 0.28 -1.96 119.30 116.86 1x0p s MET 6047Ca 0.00 -1.48 0.03 0.00 -1.71 0.00 0.00 55.69 52.54 1x0p s MET 6047Cb 0.00 -1.90 -0.01 0.00 2.01 0.00 0.00 34.83 34.92 1x0p s MET 6047CO 0.00 0.41 -0.18 -0.06 -0.01 0.00 0.00 175.02 175.18 1x0p s PHE 6048N -1.65 2.64 -0.16 -0.03 2.99 -0.11 -1.67 117.98 120.00 1x0p s PHE 6048Ca 0.21 -0.61 -0.03 0.00 0.00 0.00 0.00 56.93 56.51 1x0p s PHE 6048Cb -0.08 -1.71 0.05 0.00 0.00 0.00 0.00 43.02 41.29 1x0p s PHE 6048CO 0.11 -0.15 0.04 -1.17 -0.00 0.00 0.00 175.22 174.05 1x0p s LEU 6049N -0.05 0.85 0.07 -0.37 2.96 -0.23 -1.62 118.68 120.28 1x0p s LEU 6049Ca -0.05 -0.60 0.05 0.00 -0.22 0.00 0.00 54.13 53.31 1x0p s LEU 6049Cb -0.14 -0.47 -0.03 0.00 0.50 0.00 0.00 46.19 46.05 1x0p s LEU 6049CO 0.04 -0.29 -0.15 -1.58 -1.32 0.00 0.00 176.35 173.06 1x0p s GLN 6050N 1.95 0.86 0.00 1.98 0.74 -0.63 -0.06 119.66 124.50 1x0p s GLN 6050Ca 0.01 -0.93 0.05 0.00 0.05 0.00 0.00 55.36 54.54 1x0p s GLN 6050Cb -0.16 -0.88 -0.01 0.00 1.10 0.00 0.00 33.01 33.06 1x0p s GLN 6050CO -0.07 0.20 -0.14 -0.08 -0.55 0.00 0.00 175.29 174.64 1x0p s THR 6051N -1.19 1.14 -0.04 -0.34 -1.32 -0.69 -1.58 115.64 111.61 1x0p s THR 6051Ca -0.01 -0.72 0.02 0.00 -1.21 0.00 0.00 61.69 59.78 1x0p s THR 6051Cb -0.10 -0.97 0.01 0.00 -1.51 0.00 0.00 72.50 69.94 1x0p s THR 6051CO 0.02 0.24 -0.09 -0.76 -2.21 0.00 0.00 174.62 171.82 1x0p s LEU 6052N -0.55 1.67 0.06 9.08 1.43 0.19 -2.40 118.68 128.15 1x0p s LEU 6052Ca 0.05 -0.22 0.09 0.00 -1.03 0.00 0.00 54.13 53.02 1x0p s LEU 6052Cb -0.06 -0.63 -0.03 0.00 0.03 0.00 0.00 46.19 45.50 1x0p s LEU 6052CO -0.00 0.04 -0.23 -1.61 0.23 0.00 0.00 176.35 174.78 1x0p s GLU 6053N 0.45 1.85 0.00 1.70 2.02 0.41 -0.17 118.70 124.96 1x0p s GLU 6053Ca -0.08 -1.09 0.00 0.00 0.02 0.00 0.00 54.97 53.81 1x0p s GLU 6053Cb -0.12 -2.05 0.00 0.00 0.10 0.00 0.00 34.13 32.06 1x0p s GLU 6053CO 0.01 0.51 0.00 0.41 0.02 0.00 0.00 175.26 176.22 1x0p n GLY 6054N 1.56 -0.24 3.78 -1.39 0.00 -0.58 -1.89 105.19 106.43 1x0p n GLY 6054Ca -0.17 -1.07 -0.36 0.00 0.00 0.00 0.00 46.02 44.42 1x0p n GLY 6054CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x0p s ASP 6055N -4.00 6.39 0.13 1.61 -1.08 -1.26 -0.39 116.67 118.07 1x0p s ASP 6055Ca 0.00 2.11 -0.21 0.00 -0.52 0.00 0.00 52.55 53.93 1x0p s ASP 6055Cb 0.00 -2.59 -0.02 0.00 -1.46 0.00 0.00 42.92 38.86 1x0p s ASP 6055CO 0.00 -0.75 1.69 -0.09 0.52 0.00 0.00 175.17 176.53 1x0p h ARG 6056N 2.04 -0.08 -0.18 4.34 2.43 -1.91 -0.09 114.38 120.93 1x0p h ARG 6056Ca -0.49 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 58.65 1x0p h ARG 6056Cb 1.23 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 1x0p h ARG 6056CO 0.60 -0.05 -0.01 0.37 -1.51 0.00 0.00 179.97 179.37 1x0p h GLN 6057N -0.08 0.32 -0.46 0.20 4.15 -1.93 -2.27 115.11 115.04 1x0p h GLN 6057Ca 0.10 -0.11 -0.05 0.00 0.77 0.00 0.00 58.65 59.36 1x0p h GLN 6057Cb 0.23 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.88 1x0p h GLN 6057CO -0.23 0.54 0.07 0.87 -1.93 0.00 0.00 178.83 178.16 1x0p h LYS 6058N 0.06 0.76 -0.64 1.69 1.79 -1.91 -0.85 116.57 117.47 1x0p h LYS 6058Ca 0.05 -0.20 -0.03 0.00 -2.18 0.00 0.00 60.65 58.29 1x0p h LYS 6058Cb 0.41 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.94 1x0p h LYS 6058CO 0.01 0.77 0.30 0.28 -1.08 0.00 0.00 179.45 179.73 1x0p h VAL 6059N 0.62 1.22 -0.58 0.50 2.07 -1.05 -1.11 116.25 117.92 1x0p h VAL 6059Ca 0.14 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 1x0p h VAL 6059Cb 0.38 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1x0p h VAL 6059CO 0.01 0.26 0.23 0.28 0.02 0.00 0.00 177.57 178.36 1x0p h SER 6060N 0.88 0.80 -0.12 0.57 0.02 -1.19 -1.56 113.55 112.95 1x0p h SER 6060Ca 0.22 -0.17 -0.10 0.00 -0.84 0.00 0.00 61.79 60.90 1x0p h SER 6060Cb 0.13 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1x0p h SER 6060CO -0.03 0.75 -0.23 -0.33 -1.14 0.00 0.00 176.83 175.86 1x0p h GLU 6061N 0.79 0.55 -0.44 3.45 5.08 -0.92 -1.78 114.58 121.30 1x0p h GLU 6061Ca 0.19 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1x0p h GLU 6061Cb 0.21 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1x0p h GLU 6061CO -0.02 0.74 -0.17 1.15 -1.00 0.00 0.00 179.01 179.71 1x0p h THR 6062N 0.49 1.27 -0.67 1.13 2.02 -0.91 -2.13 112.91 114.11 1x0p h THR 6062Ca 0.07 -1.29 -0.08 0.00 0.77 0.00 0.00 66.41 65.89 1x0p h THR 6062Cb 0.66 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 68.15 1x0p h THR 6062CO 0.05 0.44 0.12 0.22 0.37 0.00 0.00 175.52 176.71 1x0p h TYR 6063N 0.75 1.17 -0.51 3.16 3.20 -0.99 -0.46 116.97 123.30 1x0p h TYR 6063Ca 0.11 -0.16 -0.02 0.00 3.14 0.00 0.00 58.73 61.80 1x0p h TYR 6063Cb 0.70 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 1x0p h TYR 6063CO 0.04 0.98 0.23 0.00 -1.64 0.00 0.00 178.16 177.76 1x0p h ALA 6064N 1.05 1.44 -0.22 1.82 0.00 -1.04 -1.10 119.26 121.22 1x0p h ALA 6064Ca 0.20 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1x0p h ALA 6064Cb 0.43 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1x0p h ALA 6064CO 0.01 0.43 -0.34 0.00 0.00 0.00 0.00 179.25 179.35 1x0p h ARG 6065N 0.72 0.62 -0.57 0.00 3.08 -0.87 -3.08 114.38 114.28 1x0p h ARG 6065Ca 0.18 -0.38 0.02 0.00 0.07 0.00 0.00 59.98 59.87 1x0p h ARG 6065Cb 0.11 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1x0p h ARG 6065CO -0.02 0.99 0.38 0.82 -1.07 0.00 0.00 179.97 181.06 1x0p h ILE 6066N 0.32 1.12 0.00 2.04 2.04 -0.66 -1.43 117.51 120.94 1x0p h ILE 6066Ca 0.02 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 1x0p h ILE 6066Cb 0.93 0.32 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1x0p h ILE 6066CO 0.08 0.13 -0.03 -0.07 0.00 0.00 0.00 178.15 178.26 1x0p h LEU 6067N 0.73 0.00 -0.17 1.44 3.38 -1.12 -2.13 115.31 117.44 1x0p h LEU 6067Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1x0p h LEU 6067Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1x0p h LEU 6067CO -0.05 0.03 -0.39 0.29 0.09 0.00 0.00 178.44 178.41 1x0p n LYS 6068N -3.23 0.31 -2.38 1.13 5.02 -0.54 -4.87 118.16 113.60 1x0p n LYS 6068Ca -0.01 -0.17 -0.42 0.00 -2.02 0.00 0.00 58.31 55.68 1x0p n LYS 6068Cb 0.19 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.68 1x0p n LYS 6068CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1x0p s ASP 6069N -2.81 6.96 0.00 4.39 -1.08 -0.80 -4.91 116.67 118.42 1x0p s ASP 6069Ca 0.16 1.85 0.19 0.00 -0.52 0.00 0.00 52.55 54.23 1x0p s ASP 6069Cb 0.18 -2.55 0.86 0.00 -1.46 0.00 0.00 42.92 39.95 1x0p s ASP 6069CO 0.62 -0.68 1.59 -0.81 0.52 0.00 0.00 175.17 176.41 1x0p n PRO 6070N 5.80 0.10 0.00 4.34 -0.04 -1.26 -3.43 135.00 140.51 1x0p n PRO 6070Ca 0.13 0.15 0.10 0.00 -0.04 0.00 0.00 63.50 63.84 1x0p n PRO 6070Cb 0.45 -1.50 0.61 0.00 -0.04 0.00 0.00 33.50 33.02 1x0p n PRO 6070CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1x0p n ARG 6071N -1.42 0.72 -3.88 0.54 1.74 -1.26 -4.70 116.66 108.39 1x0p n ARG 6071Ca 0.06 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.06 1x0p n ARG 6071Cb 0.19 -1.44 -0.02 0.00 -1.02 0.00 0.00 32.46 30.17 1x0p n ARG 6071CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1x0p s HIS 6072N -2.00 0.04 0.35 -1.55 -3.43 -1.22 -1.61 115.29 105.87 1x0p s HIS 6072Ca 0.31 -0.52 -0.17 0.00 -0.80 0.00 0.00 55.06 53.88 1x0p s HIS 6072Cb 0.14 0.61 0.06 0.00 -1.43 0.00 0.00 32.58 31.96 1x0p s HIS 6072CO 0.24 -1.26 0.84 -3.38 -2.00 0.00 0.00 174.74 169.17 1x0p s HIS 6073N -3.54 0.12 -1.39 0.38 -3.43 0.81 -4.77 115.29 103.47 1x0p s HIS 6073Ca 0.15 -0.76 -0.06 0.00 -0.80 0.00 0.00 55.06 53.59 1x0p s HIS 6073Cb -0.05 0.82 0.03 0.00 -1.43 0.00 0.00 32.58 31.96 1x0p s HIS 6073CO 0.09 -1.47 0.90 0.43 -2.00 0.00 0.00 174.74 172.70 1x0p n SER 6074N -1.41 -3.35 -4.77 7.38 7.64 -1.26 0.02 113.62 117.87 1x0p n SER 6074Ca -0.08 -0.75 -0.40 0.00 1.01 0.00 0.00 58.87 58.66 1x0p n SER 6074Cb 0.60 -4.23 -0.02 0.00 -1.01 0.00 0.00 64.21 59.54 1x0p n SER 6074CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x0p s ALA 6075N -3.45 3.39 -0.05 -0.43 0.00 -1.26 -4.28 121.76 115.67 1x0p s ALA 6075Ca 0.33 1.16 0.01 0.00 0.00 0.00 0.00 51.96 53.46 1x0p s ALA 6075Cb -0.16 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.54 1x0p s ALA 6075CO 0.80 -0.59 -0.05 -1.21 0.00 0.00 0.00 175.76 174.71 1x0p s GLU 6076N -1.91 0.87 0.15 0.00 2.02 0.10 -4.97 118.70 114.96 1x0p s GLU 6076Ca 0.51 -0.11 -0.30 0.00 0.02 0.00 0.00 54.97 55.09 1x0p s GLU 6076Cb -0.37 -0.90 -0.07 0.00 0.10 0.00 0.00 34.13 32.89 1x0p s GLU 6076CO 0.48 -0.10 1.13 0.42 0.02 0.00 0.00 175.26 177.21 1x0p s ILE 6077N 1.02 3.90 -0.24 -1.63 1.01 -1.26 -0.87 121.20 123.13 1x0p s ILE 6077Ca -0.09 1.57 -0.02 0.00 0.00 0.00 0.00 60.65 62.11 1x0p s ILE 6077Cb -0.14 -4.00 -0.14 0.00 0.01 0.00 0.00 42.46 38.18 1x0p s ILE 6077CO -0.00 0.23 -0.24 0.52 0.00 0.00 0.00 174.94 175.45 1x0p n VAL 6078N 2.74 1.37 -3.55 2.92 0.31 0.49 -4.92 118.33 117.68 1x0p n VAL 6078Ca 0.04 -0.48 -0.14 0.00 -0.01 0.00 0.00 64.34 63.75 1x0p n VAL 6078Cb 0.46 -1.46 -0.06 0.00 -0.91 0.00 0.00 33.84 31.88 1x0p n VAL 6078CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1x0p s GLU 6079N -2.47 0.79 -0.24 5.55 2.12 -0.73 -4.63 118.70 119.08 1x0p s GLU 6079Ca -0.33 0.21 -0.03 0.00 0.36 0.00 0.00 54.97 55.17 1x0p s GLU 6079Cb 0.09 0.37 0.13 0.00 0.26 0.00 0.00 34.13 34.99 1x0p s GLU 6079CO 0.52 -0.24 0.42 0.12 -0.54 0.00 0.00 175.26 175.54 1x0p s PHE 6080N -1.11 -0.94 0.19 5.30 5.36 -1.26 -0.14 117.98 125.38 1x0p s PHE 6080Ca -0.06 1.12 -0.15 0.00 -0.96 0.00 0.00 56.93 56.88 1x0p s PHE 6080Cb -0.00 0.17 0.02 0.00 -0.34 0.00 0.00 43.02 42.86 1x0p s PHE 6080CO 0.05 -0.69 0.46 -1.59 -1.46 0.00 0.00 175.22 171.99 1x0p s LYS 6081N 2.61 1.33 0.43 10.12 -2.85 -1.00 -4.99 119.74 125.38 1x0p s LYS 6081Ca 0.11 -0.95 -0.22 0.00 -1.00 0.00 0.00 55.97 53.90 1x0p s LYS 6081Cb -0.15 0.48 -0.10 0.00 -2.06 0.00 0.00 37.83 36.01 1x0p s LYS 6081CO -0.16 -0.55 1.00 0.00 0.10 0.00 0.00 175.35 175.74 1x0p s ALA 6082N -3.90 3.02 0.06 0.59 0.00 -1.26 -0.76 121.76 119.51 1x0p s ALA 6082Ca 0.11 0.54 0.03 0.00 0.00 0.00 0.00 51.96 52.65 1x0p s ALA 6082Cb 0.00 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 1x0p s ALA 6082CO -0.02 -0.07 -0.10 0.96 0.00 0.00 0.00 175.76 176.53 1x0p s ILE 6083N -1.94 0.78 0.09 0.00 -4.36 -0.27 -4.85 121.20 110.66 1x0p s ILE 6083Ca 0.61 -1.23 -0.07 0.00 -0.26 0.00 0.00 60.65 59.70 1x0p s ILE 6083Cb -0.15 -0.86 -0.24 0.00 1.25 0.00 0.00 42.46 42.45 1x0p s ILE 6083CO 0.19 -0.35 1.20 1.05 0.24 0.00 0.00 174.94 177.27 1x0p h GLU 6084N 4.31 0.44 -3.51 0.37 -0.00 -1.98 -3.42 114.58 110.79 1x0p h GLU 6084Ca -0.38 -0.57 -0.10 0.00 -0.00 0.00 0.00 59.36 58.31 1x0p h GLU 6084Cb 1.20 0.18 -0.17 0.00 -0.00 0.00 0.00 28.75 29.96 1x0p h GLU 6084CO 0.42 1.22 -0.34 -1.83 -0.00 0.00 0.00 179.01 178.47 1x0p s GLU 6085N -3.02 0.75 0.40 1.06 -1.05 -1.26 -5.05 118.70 110.53 1x0p s GLU 6085Ca -0.06 -0.64 -0.23 0.00 -0.15 0.00 0.00 54.97 53.89 1x0p s GLU 6085Cb 0.07 0.31 -0.10 0.00 -0.44 0.00 0.00 34.13 33.98 1x0p s GLU 6085CO 0.89 -0.23 0.97 1.03 0.95 0.00 0.00 175.26 178.87 1x0p s ARG 6086N -2.74 4.27 -0.23 -4.83 0.52 -1.26 -4.98 118.95 109.70 1x0p s ARG 6086Ca -0.04 1.25 -0.03 0.00 -0.52 0.00 0.00 55.73 56.39 1x0p s ARG 6086Cb -0.00 -2.38 -0.13 0.00 0.52 0.00 0.00 34.95 32.96 1x0p s ARG 6086CO -0.05 -0.01 -0.24 2.41 0.02 0.00 0.00 175.30 177.44 1x0p n THR 6087N -0.29 1.30 -2.34 0.02 -1.04 -1.26 -4.67 114.28 106.01 1x0p n THR 6087Ca 0.06 -0.44 -0.41 0.00 -2.04 0.00 0.00 64.05 61.22 1x0p n THR 6087Cb 0.52 -1.48 0.01 0.00 -1.82 0.00 0.00 70.33 67.56 1x0p n THR 6087CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1x0p n PHE 6088N -3.47 2.66 0.08 -1.42 3.01 -1.26 -4.75 117.46 112.30 1x0p n PHE 6088Ca -0.42 -2.70 -0.12 0.00 1.01 0.00 0.00 57.45 55.22 1x0p n PHE 6088Cb 0.89 -1.57 -0.08 0.00 -0.01 0.00 0.00 39.48 38.71 1x0p n PHE 6088CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1x0p h ILE 6089N 2.64 0.86 -1.72 4.37 2.04 -1.94 -3.23 117.51 120.54 1x0p h ILE 6089Ca 0.57 -0.99 0.52 0.00 1.00 0.00 0.00 64.86 65.97 1x0p h ILE 6089Cb 0.37 1.38 -0.10 0.00 -0.74 0.00 0.00 36.82 37.73 1x0p h ILE 6089CO 1.38 0.20 1.20 0.78 0.00 0.00 0.00 178.15 181.70 1x0p h ASN 6090N -0.79 0.08 -4.36 1.72 2.35 -1.96 -3.42 115.58 109.19 1x0p h ASN 6090Ca -0.03 0.05 -0.37 0.00 -0.55 0.00 0.00 56.30 55.41 1x0p h ASN 6090Cb 0.52 0.05 -0.25 0.00 0.05 0.00 0.00 38.32 38.70 1x0p h ASN 6090CO 0.04 -0.09 -0.77 0.26 -1.65 0.00 0.00 177.43 175.23 1x0p s TRP 6091N -5.02 0.90 0.42 1.19 0.51 -1.26 -4.98 118.94 110.70 1x0p s TRP 6091Ca -0.06 -0.34 0.13 0.00 -2.12 0.00 0.00 56.10 53.71 1x0p s TRP 6091Cb 0.28 -0.54 0.90 0.00 -0.81 0.00 0.00 33.47 33.30 1x0p s TRP 6091CO 0.87 -0.01 1.95 0.66 -0.51 0.00 0.00 176.95 179.90 1x0p h SER 6092N 5.05 0.06 -1.49 2.95 4.64 -1.82 -2.42 113.55 120.53 1x0p h SER 6092Ca -0.35 -0.01 0.19 0.00 -0.47 0.00 0.00 61.79 61.15 1x0p h SER 6092Cb 1.19 -0.02 -0.29 0.00 -0.31 0.00 0.00 62.40 62.97 1x0p h SER 6092CO 0.44 0.27 0.52 -0.32 -0.87 0.00 0.00 176.83 176.87 1x0p s MET 6093N -4.60 0.16 -0.08 4.77 -2.45 -1.26 -3.44 119.30 112.41 1x0p s MET 6093Ca -0.04 0.33 0.05 0.00 -1.25 0.00 0.00 55.69 54.78 1x0p s MET 6093Cb 0.15 0.11 -0.00 0.00 1.25 0.00 0.00 34.83 36.34 1x0p s MET 6093CO 0.71 -0.04 -0.24 0.50 1.05 0.00 0.00 175.02 177.00 1x0p s ARG 6094N 1.62 2.69 -0.15 4.11 6.06 -1.16 -4.83 118.95 127.29 1x0p s ARG 6094Ca -0.05 -0.86 -0.08 0.00 -2.50 0.00 0.00 55.73 52.24 1x0p s ARG 6094Cb -0.03 -2.16 -0.04 0.00 0.06 0.00 0.00 34.95 32.78 1x0p s ARG 6094CO -0.14 0.27 0.11 -1.17 -2.50 0.00 0.00 175.30 171.88 1x0p s LEU 6095N 0.10 4.18 -0.16 -0.88 0.20 -1.26 0.30 118.68 121.17 1x0p s LEU 6095Ca -0.11 0.31 -0.00 0.00 0.69 0.00 0.00 54.13 55.02 1x0p s LEU 6095Cb -0.16 -2.04 0.04 0.00 -0.43 0.00 0.00 46.19 43.60 1x0p s LEU 6095CO 0.06 0.30 -0.08 -0.69 -0.29 0.00 0.00 176.35 175.65 1x0p s VAL 6096N -0.38 1.28 -0.44 1.68 1.01 0.11 -4.95 120.40 118.72 1x0p s VAL 6096Ca 0.11 -0.65 -0.17 0.00 0.00 0.00 0.00 61.98 61.28 1x0p s VAL 6096Cb -0.12 -1.36 0.04 0.00 0.00 0.00 0.00 36.38 34.94 1x0p s VAL 6096CO 0.01 0.23 0.42 -1.10 0.00 0.00 0.00 175.10 174.66 1x0p s GLN 6097N 1.57 3.04 0.43 2.72 -0.21 -1.26 -0.81 119.66 125.14 1x0p s GLN 6097Ca 0.02 -0.98 0.15 0.00 0.02 0.00 0.00 55.36 54.57 1x0p s GLN 6097Cb -0.15 -4.03 1.04 0.00 1.00 0.00 0.00 33.01 30.88 1x0p s GLN 6097CO -0.08 -0.92 1.93 -0.07 -2.12 0.00 0.00 175.29 174.03 1x0p h LEU 6098N 8.97 0.39 -2.22 2.90 3.38 -1.61 -0.54 115.31 126.57 1x0p h LEU 6098Ca -0.27 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1x0p h LEU 6098Cb 1.11 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1x0p h LEU 6098CO 0.82 0.21 -0.05 1.23 0.09 0.00 0.00 178.44 180.74 1x0p h GLY 6099N 0.42 0.00 -0.34 0.83 0.00 -1.92 -1.99 103.07 100.06 1x0p h GLY 6099Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1x0p h GLY 6099CO -0.11 0.00 -0.28 1.18 0.00 0.00 0.00 176.54 177.34 1x0p n GLU 6100N -3.76 1.14 -2.15 4.80 1.02 -0.22 -4.94 120.64 116.53 1x0p n GLU 6100Ca -0.02 -0.78 -0.27 0.00 -0.02 0.00 0.00 57.16 56.06 1x0p n GLU 6100Cb 0.15 -1.48 0.06 0.00 -0.02 0.00 0.00 31.44 30.15 1x0p n GLU 6100CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1x0p s MET 6101N -2.40 2.40 -0.09 3.49 -1.94 -0.75 -4.98 119.30 115.03 1x0p s MET 6101Ca 0.24 -0.05 -0.29 0.00 -1.71 0.00 0.00 55.69 53.88 1x0p s MET 6101Cb 0.19 -2.14 -0.05 0.00 2.01 0.00 0.00 34.83 34.84 1x0p s MET 6101CO 0.50 -1.15 1.75 0.34 -0.01 0.00 0.00 175.02 176.44 1x0p s ASP 6102N -4.46 6.47 0.31 3.03 2.15 -1.26 -4.87 116.67 118.03 1x0p s ASP 6102Ca 0.59 2.16 0.04 0.00 0.43 0.00 0.00 52.55 55.77 1x0p s ASP 6102Cb -0.11 -2.53 0.81 0.00 -0.30 0.00 0.00 42.92 40.79 1x0p s ASP 6102CO 0.46 -1.10 1.60 -1.28 -0.17 0.00 0.00 175.17 174.69 1x0p h SER 6103N 10.41 -0.19 1.32 -0.34 0.87 -1.93 0.30 113.55 123.99 1x0p h SER 6103Ca -0.40 0.24 -0.11 0.00 -1.23 0.00 0.00 61.79 60.30 1x0p h SER 6103Cb 1.19 0.37 -0.02 0.00 -0.44 0.00 0.00 62.40 63.50 1x0p h SER 6103CO 0.96 -0.29 -0.51 -0.78 -0.53 0.00 0.00 176.83 175.69 1x0p h ASP 6104N 0.08 0.00 -0.22 6.23 1.82 -1.99 -1.70 116.42 120.64 1x0p h ASP 6104Ca 0.61 0.00 -0.11 0.00 -0.39 0.00 0.00 57.03 57.14 1x0p h ASP 6104Cb 1.31 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.32 1x0p h ASP 6104CO -0.79 0.51 -0.30 0.74 -1.61 0.00 0.00 179.24 177.79 1x0p h THR 6105N 0.00 1.32 -0.02 2.25 2.02 -0.84 -2.33 112.91 115.32 1x0p h THR 6105Ca -0.01 -1.49 -0.21 0.00 0.77 0.00 0.00 66.41 65.47 1x0p h THR 6105Cb 1.31 1.76 -0.00 0.00 -1.74 0.00 0.00 68.15 69.47 1x0p h THR 6105CO 0.07 0.46 -0.87 -0.29 0.37 0.00 0.00 175.52 175.26 1x0p h ILE 6106N 0.29 1.42 -0.03 3.11 2.10 -1.22 -2.35 117.51 120.81 1x0p h ILE 6106Ca 0.03 -2.40 0.00 0.00 1.08 0.00 0.00 64.86 63.57 1x0p h ILE 6106Cb 0.87 2.34 -0.00 0.00 -1.09 0.00 0.00 36.82 38.94 1x0p h ILE 6106CO 0.07 0.71 0.02 -0.09 -1.08 0.00 0.00 178.15 177.78 1x0p h ARG 6107N 0.21 0.04 -0.69 2.19 2.43 -1.33 0.42 114.38 117.66 1x0p h ARG 6107Ca -0.06 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.12 1x0p h ARG 6107Cb 1.48 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.99 1x0p h ARG 6107CO 0.15 0.05 0.45 0.00 -1.51 0.00 0.00 179.97 179.12 1x0p h ARG 6108N 0.02 0.90 -0.24 0.20 3.08 -1.43 -0.60 114.38 116.30 1x0p h ARG 6108Ca 0.01 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.90 1x0p h ARG 6108Cb 0.02 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.87 1x0p h ARG 6108CO -0.00 0.59 -0.26 1.25 -1.07 0.00 0.00 179.97 180.48 1x0p h LEU 6109N 0.92 0.64 -1.18 3.04 5.85 -1.10 -0.46 115.31 123.03 1x0p h LEU 6109Ca 0.26 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.45 1x0p h LEU 6109Cb -0.09 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 1x0p h LEU 6109CO -0.06 1.00 0.10 -0.09 -0.34 0.00 0.00 178.44 179.04 1x0p h ARG 6110N 0.30 0.67 -0.02 1.25 1.12 0.03 -2.49 114.38 115.24 1x0p h ARG 6110Ca 0.04 -0.13 -0.26 0.00 -1.11 0.00 0.00 59.98 58.52 1x0p h ARG 6110Cb 0.82 -0.11 0.02 0.00 -0.01 0.00 0.00 29.97 30.70 1x0p h ARG 6110CO 0.06 0.62 -0.98 -0.07 -3.11 0.00 0.00 179.97 176.49 1x0p h LEU 6111N 0.65 0.90 -0.83 3.80 3.38 -1.07 -2.71 115.31 119.43 1x0p h LEU 6111Ca 0.15 -0.72 0.15 0.00 0.09 0.00 0.00 57.88 57.54 1x0p h LEU 6111Cb 0.26 -0.27 -0.10 0.00 0.09 0.00 0.00 40.66 40.64 1x0p h LEU 6111CO -0.00 1.50 0.40 0.50 0.09 0.00 0.00 178.44 180.93 1x0p h LYS 6112N 0.39 0.55 -0.27 1.13 3.64 -0.64 -2.78 116.57 118.59 1x0p h LYS 6112Ca -0.12 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.19 1x0p h LYS 6112Cb 1.64 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 33.31 1x0p h LYS 6112CO 0.19 0.37 -0.00 0.66 -2.27 0.00 0.00 179.45 178.40 1x0p n TYR 6113N -4.91 0.96 -3.47 1.91 4.02 -1.05 -5.02 117.16 109.60 1x0p n TYR 6113Ca 0.16 -1.02 -0.15 0.00 -0.01 0.00 0.00 57.90 56.89 1x0p n TYR 6113Cb 0.44 -0.35 -0.04 0.00 -0.02 0.00 0.00 39.34 39.37 1x0p n TYR 6113CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1x0p s SER 6114N -2.07 -0.62 0.00 7.72 1.04 -1.02 -4.79 113.70 113.96 1x0p s SER 6114Ca 0.42 0.37 0.20 0.00 0.48 0.00 0.00 55.95 57.43 1x0p s SER 6114Cb 0.35 0.57 0.57 0.00 0.10 0.00 0.00 66.02 67.61 1x0p s SER 6114CO 0.07 -0.78 1.46 -0.81 0.98 0.00 0.00 173.24 174.16 1x0p n PRO 6115N 0.29 2.06 -2.89 4.02 -0.04 -1.26 -4.53 135.00 132.65 1x0p n PRO 6115Ca -0.18 -1.61 -0.29 0.00 -0.04 0.00 0.00 63.50 61.38 1x0p n PRO 6115Cb 0.61 -1.43 -0.02 0.00 -0.04 0.00 0.00 33.50 32.62 1x0p n PRO 6115CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x0p s ALA 6116N -1.61 3.42 -0.90 0.55 0.00 -1.26 -4.98 121.76 116.98 1x0p s ALA 6116Ca 0.34 -0.37 0.27 0.00 0.00 0.00 0.00 51.96 52.20 1x0p s ALA 6116Cb 0.19 -2.58 0.84 0.00 0.00 0.00 0.00 23.12 21.56 1x0p s ALA 6116CO 0.27 -0.06 1.67 0.00 0.00 0.00 0.00 175.76 177.64 1x0p n ALA 6117N -1.51 2.74 -2.55 0.00 0.00 -1.26 -4.77 120.51 113.15 1x0p n ALA 6117Ca 0.01 -0.18 -0.16 0.00 0.00 0.00 0.00 53.44 53.11 1x0p n ALA 6117Cb 0.54 -1.33 -0.07 0.00 0.00 0.00 0.00 19.45 18.60 1x0p n ALA 6117CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1x0p s THR 6118N -3.04 0.00 -0.36 0.00 -4.23 -1.26 -5.09 115.64 101.66 1x0p s THR 6118Ca 0.11 -1.81 -0.28 0.00 -1.18 0.00 0.00 61.69 58.53 1x0p s THR 6118Cb 0.17 -2.54 -0.02 0.00 1.34 0.00 0.00 72.50 71.45 1x0p s THR 6118CO 0.62 0.00 1.78 0.12 -0.54 0.00 0.00 174.62 176.59 1x0p s PHE 6119N -3.40 1.84 -0.39 3.99 5.36 -1.26 -4.91 117.98 119.20 1x0p s PHE 6119Ca 0.36 0.65 0.02 0.00 -0.96 0.00 0.00 56.93 57.00 1x0p s PHE 6119Cb 0.02 -4.14 0.15 0.00 -0.34 0.00 0.00 43.02 38.71 1x0p s PHE 6119CO 0.22 -2.81 0.28 -0.65 -1.46 0.00 0.00 175.22 170.80 1x0p s GLN 6120N 5.74 0.81 0.40 10.12 -0.21 -1.26 -4.76 119.66 130.51 1x0p s GLN 6120Ca 0.77 -1.79 0.15 0.00 0.02 0.00 0.00 55.36 54.51 1x0p s GLN 6120Cb -0.21 -1.48 1.00 0.00 1.00 0.00 0.00 33.01 33.33 1x0p s GLN 6120CO 0.32 -1.29 1.88 -1.00 -2.12 0.00 0.00 175.29 173.08 1x0p h PRO 6121N 6.32 0.47 0.00 2.91 0.13 -1.94 -0.69 132.00 139.20 1x0p h PRO 6121Ca 0.15 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1x0p h PRO 6121Cb 0.93 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1x0p h PRO 6121CO 0.34 0.31 0.15 0.00 -0.23 0.00 0.00 178.00 178.57 1x0p h ARG 6122N 0.48 0.00 -0.60 0.86 3.08 -1.97 0.14 114.38 116.37 1x0p h ARG 6122Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.48 1x0p h ARG 6122Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.00 1x0p h ARG 6122CO -0.17 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.60 1x0p n SER 6123N -2.79 3.46 -4.55 7.04 3.41 -0.26 -4.94 113.62 114.99 1x0p n SER 6123Ca -0.02 -1.99 -0.30 0.00 -0.26 0.00 0.00 58.87 56.30 1x0p n SER 6123Cb 0.20 -0.40 -0.10 0.00 -0.26 0.00 0.00 64.21 63.65 1x0p n SER 6123CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1x0p s MET 6124N -1.20 2.09 0.82 4.33 -1.94 0.49 -4.61 119.30 119.27 1x0p s MET 6124Ca 0.43 -1.03 -0.09 0.00 -1.71 0.00 0.00 55.69 53.29 1x0p s MET 6124Cb 0.23 -2.27 0.14 0.00 2.01 0.00 0.00 34.83 34.93 1x0p s MET 6124CO 0.30 0.51 1.15 0.95 -0.01 0.00 0.00 175.02 177.92 1x0p s THR 6125N -1.17 2.11 0.14 2.05 -4.23 -1.26 -4.85 115.64 108.43 1x0p s THR 6125Ca 0.20 -0.22 -0.15 0.00 -1.18 0.00 0.00 61.69 60.34 1x0p s THR 6125Cb -0.11 -2.88 0.02 0.00 1.34 0.00 0.00 72.50 70.86 1x0p s THR 6125CO 0.12 0.00 1.70 0.00 -0.54 0.00 0.00 174.62 175.90 1x0p h ALA 6126N -1.04 0.58 -0.65 3.99 0.00 -1.98 -0.03 119.26 120.13 1x0p h ALA 6126Ca -0.42 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.30 1x0p h ALA 6126Cb 1.27 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1x0p h ALA 6126CO 0.47 0.18 0.24 1.05 0.00 0.00 0.00 179.25 181.19 1x0p h GLU 6127N 0.58 0.99 -0.51 0.00 9.09 -1.95 -0.11 114.58 122.67 1x0p h GLU 6127Ca 0.15 -0.19 -0.07 0.00 0.05 0.00 0.00 59.36 59.30 1x0p h GLU 6127Cb 0.18 -0.15 -0.02 0.00 -1.65 0.00 0.00 28.75 27.10 1x0p h GLU 6127CO -0.01 0.84 0.05 1.96 0.05 0.00 0.00 179.01 181.90 1x0p h GLN 6128N 0.93 0.86 -0.46 1.06 4.20 -1.84 0.12 115.11 119.99 1x0p h GLN 6128Ca 0.22 -0.25 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1x0p h GLN 6128Cb 0.24 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 1x0p h GLN 6128CO -0.01 0.87 0.15 0.00 -0.67 0.00 0.00 178.83 179.16 1x0p h PHE 6130N 0.61 0.06 -0.48 0.00 3.57 -0.83 -0.05 116.94 119.81 1x0p h PHE 6130Ca 0.15 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 1x0p h PHE 6130Cb 0.26 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 1x0p h PHE 6130CO 0.01 0.11 -0.02 0.00 -2.23 0.00 0.00 178.31 176.17 1x0p h ARG 6131N -0.01 0.81 0.22 1.11 3.08 -0.90 0.06 114.38 118.75 1x0p h ARG 6131Ca 0.01 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 59.82 1x0p h ARG 6131Cb 0.07 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1x0p h ARG 6131CO -0.00 0.84 -0.10 0.35 -1.07 0.00 0.00 179.97 179.98 1x0p h PHE 6132N 0.75 -0.27 -0.79 3.04 3.57 -0.84 -1.70 116.94 120.71 1x0p h PHE 6132Ca 0.14 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.65 1x0p h PHE 6132Cb 0.49 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.28 1x0p h PHE 6132CO 0.03 -0.11 0.51 -0.07 -2.23 0.00 0.00 178.31 176.44 1x0p h LEU 6133N -0.37 0.87 -0.72 0.59 3.38 -0.79 -2.45 115.31 115.83 1x0p h LEU 6133Ca -0.03 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1x0p h LEU 6133Cb 0.28 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1x0p h LEU 6133CO 0.05 0.61 0.33 0.50 0.09 0.00 0.00 178.44 180.03 1x0p h LYS 6134N 1.02 1.04 -0.40 1.13 3.64 -0.82 0.71 116.57 122.90 1x0p h LYS 6134Ca 0.30 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1x0p h LYS 6134Cb -0.06 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.56 1x0p h LYS 6134CO -0.09 0.83 0.06 0.93 -2.27 0.00 0.00 179.45 178.91 1x0p h GLU 6135N 1.01 0.61 -0.30 1.90 5.08 -1.00 0.13 114.58 122.00 1x0p h GLU 6135Ca 0.25 -0.12 -0.16 0.00 -1.00 0.00 0.00 59.36 58.33 1x0p h GLU 6135Cb 0.14 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1x0p h GLU 6135CO -0.03 0.59 -0.45 -0.07 -1.00 0.00 0.00 179.01 178.05 1x0p h LEU 6136N 0.59 0.85 -0.43 1.33 3.38 -0.95 -3.05 115.31 117.04 1x0p h LEU 6136Ca 0.13 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 1x0p h LEU 6136Cb 0.28 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1x0p h LEU 6136CO 0.00 1.17 0.16 0.22 0.09 0.00 0.00 178.44 180.08 1x0p h TYR 6137N 0.63 0.67 0.00 1.13 3.20 -0.04 -2.57 116.97 119.99 1x0p h TYR 6137Ca 0.04 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1x0p h TYR 6137Cb 1.02 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.09 1x0p h TYR 6137CO 0.06 0.60 0.00 -0.25 -1.64 0.00 0.00 178.16 176.92 1x0p n ASP 6138N -4.60 0.31 -0.81 -2.11 8.00 0.38 -2.24 116.55 115.48 1x0p n ASP 6138Ca 0.00 0.59 0.02 0.00 0.71 0.00 0.00 54.79 56.11 1x0p n ASP 6138Cb 0.16 -0.65 0.19 0.00 -0.02 0.00 0.00 41.12 40.79 1x0p n ASP 6138CO 0.00 0.00 0.00 1.15 -0.39 0.00 0.00 177.20 177.96 1x0p n MET 6139N -1.86 1.85 0.00 -1.24 0.00 -0.99 -5.09 117.12 109.79 1x0p n MET 6139Ca 0.02 -3.41 0.10 0.00 0.00 0.00 0.00 57.70 54.40 1x0p n MET 6139Cb 0.15 -1.71 0.08 0.00 0.00 0.00 0.00 33.22 31.73 1x0p n MET 6139CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42