#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vsy s SER 1002N 0.00 -0.69 0.13 0.00 0.15 -1.26 -1.75 113.70 110.28 1vsy s SER 1002Ca 0.00 -0.51 0.04 0.00 0.70 0.00 0.00 55.95 56.18 1vsy s SER 1002Cb 0.00 0.88 -0.04 0.00 -1.71 0.00 0.00 66.02 65.15 1vsy s SER 1002CO 0.00 -0.06 -0.10 0.27 1.20 0.00 0.00 173.24 174.55 1vsy s ILE 1003N 1.58 1.09 0.24 6.45 -4.36 -1.03 -2.58 121.20 122.58 1vsy s ILE 1003Ca 0.19 -1.93 -0.20 0.00 -0.26 0.00 0.00 60.65 58.45 1vsy s ILE 1003Cb 0.04 -1.70 0.03 0.00 1.25 0.00 0.00 42.46 42.08 1vsy s ILE 1003CO -0.11 -0.69 0.64 0.00 0.24 0.00 0.00 174.94 175.02 1vsy s MET 1004N -3.45 1.58 -0.15 0.37 0.23 -0.64 -0.87 119.30 116.38 1vsy s MET 1004Ca 0.13 -0.87 -0.11 0.00 -1.03 0.00 0.00 55.69 53.81 1vsy s MET 1004Cb 0.01 0.58 0.04 0.00 -1.53 0.00 0.00 34.83 33.93 1vsy s MET 1004CO 0.00 -0.71 0.37 0.00 -2.03 0.00 0.00 175.02 172.66 1vsy s ALA 1005N -3.88 -0.93 -0.00 3.16 0.00 -0.58 -1.29 121.76 118.24 1vsy s ALA 1005Ca 0.09 1.20 0.04 0.00 0.00 0.00 0.00 51.96 53.29 1vsy s ALA 1005Cb -0.04 -0.72 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 1vsy s ALA 1005CO 0.01 -0.21 -0.13 0.08 0.00 0.00 0.00 175.76 175.51 1vsy s VAL 1006N 0.68 1.05 0.14 0.00 1.01 -0.23 -1.61 120.40 121.43 1vsy s VAL 1006Ca -0.04 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.34 1vsy s VAL 1006Cb -0.05 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1vsy s VAL 1006CO -0.05 0.25 0.22 0.42 0.00 0.00 0.00 175.10 175.95 1vsy s THR 1007N -0.39 5.05 0.00 3.92 -4.23 -0.85 -0.01 115.64 119.13 1vsy s THR 1007Ca 0.05 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 1vsy s THR 1007Cb -0.05 -3.57 0.00 0.00 1.34 0.00 0.00 72.50 70.22 1vsy s THR 1007CO -0.00 -0.05 0.00 2.22 -0.54 0.00 0.00 174.62 176.24 1vsy n PHE 1008N -0.32 -0.58 -0.26 3.99 -1.74 -0.03 -4.47 117.46 114.05 1vsy n PHE 1008Ca -0.07 0.00 0.06 0.00 -0.56 0.00 0.00 57.45 56.88 1vsy n PHE 1008Cb 0.54 0.00 0.20 0.00 1.52 0.00 0.00 39.48 41.73 1vsy n PHE 1008CO 0.00 0.00 0.00 -0.22 -0.56 0.00 0.00 176.76 175.98 1vsy h LYS 1009N 0.00 0.44 0.00 3.97 3.64 -1.72 -2.81 116.57 120.09 1vsy h LYS 1009Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1vsy h LYS 1009Cb 0.00 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1vsy h LYS 1009CO 0.00 0.29 -1.13 -0.25 -2.27 0.00 0.00 179.45 176.10 1vsy n ASP 1010N -4.99 0.74 0.00 4.20 8.00 -1.26 -4.93 116.55 118.30 1vsy n ASP 1010Ca 0.15 -0.66 0.00 0.00 0.71 0.00 0.00 54.79 54.98 1vsy n ASP 1010Cb 0.43 1.07 0.00 0.00 -0.02 0.00 0.00 41.12 42.60 1vsy n ASP 1010CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vsy n GLY 1011N 1.44 -0.52 3.17 0.44 0.00 -1.06 -4.36 105.19 104.30 1vsy n GLY 1011Ca 0.03 0.12 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 1vsy n GLY 1011CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vsy s VAL 1012N 0.00 0.04 -0.05 1.61 0.11 -1.07 -0.85 120.40 120.19 1vsy s VAL 1012Ca 0.00 -0.37 0.03 0.00 -2.93 0.00 0.00 61.98 58.71 1vsy s VAL 1012Cb 0.00 -0.48 0.01 0.00 -1.53 0.00 0.00 36.38 34.38 1vsy s VAL 1012CO 0.00 -0.20 -0.14 -0.63 -3.33 0.00 0.00 175.10 170.80 1vsy s ILE 1013N -0.82 1.22 -0.04 7.04 1.01 0.98 -1.16 121.20 129.43 1vsy s ILE 1013Ca -0.09 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 59.98 1vsy s ILE 1013Cb -0.05 -1.08 -0.04 0.00 0.01 0.00 0.00 42.46 41.30 1vsy s ILE 1013CO 0.02 0.37 0.06 -0.76 0.00 0.00 0.00 174.94 174.62 1vsy s LEU 1014N 0.38 3.82 0.01 2.97 1.02 -0.19 -1.07 118.68 125.62 1vsy s LEU 1014Ca -0.10 0.17 -0.05 0.00 0.02 0.00 0.00 54.13 54.17 1vsy s LEU 1014Cb -0.13 -2.08 -0.01 0.00 0.02 0.00 0.00 46.19 43.99 1vsy s LEU 1014CO 0.03 0.32 0.08 -0.83 0.02 0.00 0.00 176.35 175.98 1vsy s GLY 1015N -1.37 0.11 0.25 -3.19 0.00 -0.41 -0.56 107.32 102.14 1vsy s GLY 1015Ca 0.19 -0.31 -0.21 0.00 0.00 0.00 0.00 44.72 44.39 1vsy s GLY 1015CO 0.09 -0.43 0.68 0.00 0.00 0.00 0.00 173.10 173.44 1vsy s ALA 1016N -1.52 -1.29 0.51 3.20 0.00 -0.26 -1.62 121.76 120.78 1vsy s ALA 1016Ca -0.14 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 51.70 1vsy s ALA 1016Cb -0.08 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.91 1vsy s ALA 1016CO 0.00 -0.96 0.00 -0.40 0.00 0.00 0.00 175.76 174.40 1vsy n ASP 1017N -0.43 0.00 -1.88 0.00 5.75 -1.07 -1.60 116.55 117.32 1vsy n ASP 1017Ca -0.07 -0.48 0.02 0.00 -0.01 0.00 0.00 54.79 54.25 1vsy n ASP 1017Cb 0.61 0.00 0.03 0.00 -1.03 0.00 0.00 41.12 40.72 1vsy n ASP 1017CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1vsy n SER 1018N -1.43 1.03 -4.08 -1.12 3.41 -0.24 -4.49 113.62 106.70 1vsy n SER 1018Ca 0.00 -2.01 -0.33 0.00 -0.26 0.00 0.00 58.87 56.27 1vsy n SER 1018Cb 0.00 -0.31 -0.14 0.00 -0.26 0.00 0.00 64.21 63.50 1vsy n SER 1018CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1vsy s ARG 1019N -1.07 1.90 -0.28 4.33 3.52 -1.09 -1.69 118.95 124.56 1vsy s ARG 1019Ca 0.30 -1.67 -0.13 0.00 -0.13 0.00 0.00 55.73 54.10 1vsy s ARG 1019Cb 0.35 -3.23 -0.04 0.00 -1.56 0.00 0.00 34.95 30.47 1vsy s ARG 1019CO -0.13 -0.85 0.30 0.95 -0.81 0.00 0.00 175.30 174.77 1vsy s THR 1020N 1.05 5.23 -0.10 4.11 -4.23 -1.04 -4.68 115.64 115.98 1vsy s THR 1020Ca 0.04 0.37 0.00 0.00 -1.18 0.00 0.00 61.69 60.92 1vsy s THR 1020Cb -0.20 -3.65 -0.02 0.00 1.34 0.00 0.00 72.50 69.97 1vsy s THR 1020CO -0.05 0.17 -0.10 0.42 -0.54 0.00 0.00 174.62 174.51 1vsy s THR 1021N 1.94 3.35 -0.35 3.99 -4.23 -1.26 -2.38 115.64 116.70 1vsy s THR 1021Ca 0.12 -0.58 -0.05 0.00 -1.18 0.00 0.00 61.69 59.99 1vsy s THR 1021Cb -0.16 -2.39 0.06 0.00 1.34 0.00 0.00 72.50 71.35 1vsy s THR 1021CO 0.10 0.55 0.12 0.42 -0.54 0.00 0.00 174.62 175.28 1vsy s THR 1022N -0.20 3.64 0.00 3.99 -4.23 -0.97 -4.95 115.64 112.92 1vsy s THR 1022Ca 0.01 -1.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 1vsy s THR 1022Cb -0.13 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.57 1vsy s THR 1022CO 0.03 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 1vsy n GLY 1023N 4.76 0.38 0.45 3.99 0.00 -1.26 -3.20 105.19 110.31 1vsy n GLY 1023Ca -0.11 -0.80 0.11 0.00 0.00 0.00 0.00 46.02 45.21 1vsy n GLY 1023CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vsy n ALA 1024N 8.86 3.62 -2.70 4.61 0.00 -1.26 -4.94 120.51 128.70 1vsy n ALA 1024Ca 0.00 -0.63 -0.37 0.00 0.00 0.00 0.00 53.44 52.44 1vsy n ALA 1024Cb 0.00 -0.77 -0.07 0.00 0.00 0.00 0.00 19.45 18.62 1vsy n ALA 1024CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1vsy s TYR 1025N -2.46 3.53 -0.75 0.00 5.04 -1.19 -5.04 117.35 116.47 1vsy s TYR 1025Ca 0.17 0.71 -0.23 0.00 -2.44 0.00 0.00 57.07 55.29 1vsy s TYR 1025Cb 0.17 -2.35 0.07 0.00 0.35 0.00 0.00 41.96 40.21 1vsy s TYR 1025CO 0.58 0.33 1.10 0.42 -1.34 0.00 0.00 175.55 176.63 1vsy s ILE 1026N 0.14 4.22 0.21 3.14 1.01 -1.26 -2.28 121.20 126.38 1vsy s ILE 1026Ca 0.19 -0.42 -0.04 0.00 0.00 0.00 0.00 60.65 60.38 1vsy s ILE 1026Cb -0.14 -4.78 0.01 0.00 0.01 0.00 0.00 42.46 37.56 1vsy s ILE 1026CO 0.07 -1.59 1.60 0.00 0.00 0.00 0.00 174.94 175.01 1vsy h ALA 1027N 9.57 0.83 -3.44 9.38 0.00 -1.81 -3.42 119.26 130.37 1vsy h ALA 1027Ca -0.17 -0.41 -0.31 0.00 0.00 0.00 0.00 54.91 54.02 1vsy h ALA 1027Cb 1.05 -0.13 -0.35 0.00 0.00 0.00 0.00 17.79 18.36 1vsy h ALA 1027CO 1.21 0.64 -0.72 1.21 0.00 0.00 0.00 179.25 181.60 1vsy s ASN 1028N -6.81 0.31 -0.17 0.00 2.47 -1.21 -5.04 114.94 104.50 1vsy s ASN 1028Ca -0.09 0.08 0.16 0.00 0.42 0.00 0.00 52.86 53.43 1vsy s ASN 1028Cb 0.12 -0.05 0.59 0.00 -1.45 0.00 0.00 41.25 40.46 1vsy s ASN 1028CO 0.84 -0.16 1.49 -2.11 -3.72 0.00 0.00 177.10 173.44 1vsy n ARG 1029N 4.47 3.40 -1.06 0.43 1.85 -1.26 -2.51 116.66 122.00 1vsy n ARG 1029Ca -0.22 -2.85 0.03 0.00 -1.00 0.00 0.00 57.85 53.81 1vsy n ARG 1029Cb 0.50 -1.89 0.02 0.00 -1.05 0.00 0.00 32.46 30.04 1vsy n ARG 1029CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 1vsy n VAL 1030N -0.07 0.07 -1.72 8.89 0.24 -0.98 -4.31 118.33 120.46 1vsy n VAL 1030Ca 0.22 -0.66 -0.43 0.00 -2.04 0.00 0.00 64.34 61.43 1vsy n VAL 1030Cb 0.92 0.75 -0.02 0.00 -1.47 0.00 0.00 33.84 34.03 1vsy n VAL 1030CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1vsy n THR 1031N 0.24 1.27 -2.99 3.34 -1.04 -0.68 -4.93 114.28 109.48 1vsy n THR 1031Ca 0.04 -0.32 -0.44 0.00 -2.04 0.00 0.00 64.05 61.29 1vsy n THR 1031Cb 0.95 -1.77 -0.01 0.00 -1.82 0.00 0.00 70.33 67.68 1vsy n THR 1031CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1vsy s ASP 1032N 0.24 6.86 0.00 8.00 2.15 -1.26 -4.40 116.67 128.26 1vsy s ASP 1032Ca 0.62 -2.58 0.29 0.00 0.43 0.00 0.00 52.55 51.32 1vsy s ASP 1032Cb -0.55 -2.37 1.56 0.00 -0.30 0.00 0.00 42.92 41.26 1vsy s ASP 1032CO 0.53 -0.85 2.03 0.29 -0.17 0.00 0.00 175.17 177.00 1vsy n LYS 1033N 5.73 0.59 -3.28 4.34 5.02 -1.26 -4.52 118.16 124.76 1vsy n LYS 1033Ca 0.28 0.01 -0.43 0.00 -2.02 0.00 0.00 58.31 56.15 1vsy n LYS 1033Cb 0.46 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.89 1vsy n LYS 1033CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1vsy s LEU 1034N -2.37 4.91 0.03 -0.35 1.43 -1.26 -1.65 118.68 119.41 1vsy s LEU 1034Ca 0.33 -0.73 0.08 0.00 -1.03 0.00 0.00 54.13 52.78 1vsy s LEU 1034Cb 0.20 -2.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.98 1vsy s LEU 1034CO 0.40 -0.65 -0.24 -0.89 0.23 0.00 0.00 176.35 175.21 1vsy s THR 1035N 2.23 2.33 -0.24 5.49 2.01 -0.81 -4.96 115.64 121.68 1vsy s THR 1035Ca 0.13 -1.28 -0.07 0.00 0.31 0.00 0.00 61.69 60.78 1vsy s THR 1035Cb -0.18 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 1vsy s THR 1035CO 0.13 0.39 0.05 -0.60 -0.69 0.00 0.00 174.62 173.91 1vsy s ARG 1036N -1.19 3.62 0.00 4.92 3.52 -1.26 -0.39 118.95 128.17 1vsy s ARG 1036Ca 0.12 -0.50 0.14 0.00 -0.13 0.00 0.00 55.73 55.37 1vsy s ARG 1036Cb -0.10 -3.27 -0.02 0.00 -1.56 0.00 0.00 34.95 30.00 1vsy s ARG 1036CO 0.02 -0.17 0.77 1.33 -0.81 0.00 0.00 175.30 176.44 1vsy n VAL 1037N 4.84 0.00 -3.62 7.11 0.24 -0.92 -4.92 118.33 121.06 1vsy n VAL 1037Ca -0.16 -0.33 -0.04 0.00 -2.04 0.00 0.00 64.34 61.77 1vsy n VAL 1037Cb 0.51 1.15 -0.03 0.00 -1.47 0.00 0.00 33.84 34.00 1vsy n VAL 1037CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1vsy s HIS 1038N -1.83 -0.09 0.00 6.34 2.46 -0.77 -4.69 115.29 116.71 1vsy s HIS 1038Ca 0.11 0.12 0.00 0.00 0.47 0.00 0.00 55.06 55.76 1vsy s HIS 1038Cb 0.11 0.50 0.00 0.00 -0.13 0.00 0.00 32.58 33.06 1vsy s HIS 1038CO 0.39 -0.11 0.00 -0.25 -2.47 0.00 0.00 174.74 172.31 1vsy n ASP 1039N 0.30 0.00 -2.20 9.88 9.92 -1.26 -0.65 116.55 132.54 1vsy n ASP 1039Ca -0.00 0.00 -0.21 0.00 -0.53 0.00 0.00 54.79 54.05 1vsy n ASP 1039Cb 0.58 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 41.08 1vsy n ASP 1039CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1vsy n LYS 1040N -1.96 3.30 -3.71 -1.24 5.02 -1.26 -4.92 118.16 113.38 1vsy n LYS 1040Ca 0.00 -4.11 -0.28 0.00 -2.02 0.00 0.00 58.31 51.89 1vsy n LYS 1040Cb 0.00 -2.17 -0.16 0.00 -0.02 0.00 0.00 35.03 32.68 1vsy n LYS 1040CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1vsy s ILE 1041N -4.60 0.54 0.39 -0.18 1.01 0.18 -1.76 121.20 116.78 1vsy s ILE 1041Ca 0.47 -0.80 0.08 0.00 0.00 0.00 0.00 60.65 60.40 1vsy s ILE 1041Cb 0.40 -1.19 -0.07 0.00 0.01 0.00 0.00 42.46 41.61 1vsy s ILE 1041CO -0.00 -0.40 0.04 0.26 0.00 0.00 0.00 174.94 174.84 1vsy s TRP 1042N 1.83 2.53 0.25 3.97 0.52 -0.12 -1.84 118.94 126.08 1vsy s TRP 1042Ca 0.03 -0.59 0.07 0.00 0.02 0.00 0.00 56.10 55.63 1vsy s TRP 1042Cb -0.17 -1.72 -0.05 0.00 -1.15 0.00 0.00 33.47 30.38 1vsy s TRP 1042CO -0.16 0.41 -0.09 0.00 0.02 0.00 0.00 176.95 177.13 1vsy s ARG 1045N 0.92 3.61 -0.24 0.00 0.52 -0.66 -2.22 118.95 120.88 1vsy s ARG 1045Ca -0.02 0.04 -0.26 0.00 -0.52 0.00 0.00 55.73 54.97 1vsy s ARG 1045Cb -0.15 -3.18 0.08 0.00 0.52 0.00 0.00 34.95 32.23 1vsy s ARG 1045CO -0.00 0.73 0.79 -1.54 0.02 0.00 0.00 175.30 175.30 1vsy s SER 1046N -1.18 -0.66 0.00 0.23 1.04 -1.19 -4.84 113.70 107.10 1vsy s SER 1046Ca 0.20 1.19 0.00 0.00 0.48 0.00 0.00 55.95 57.82 1vsy s SER 1046Cb -0.14 1.17 0.00 0.00 0.10 0.00 0.00 66.02 67.16 1vsy s SER 1046CO 0.09 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.64 1vsy n GLY 1047N 2.27 -0.42 3.68 7.32 0.00 -1.26 -1.97 105.19 114.81 1vsy n GLY 1047Ca -0.14 -2.11 -0.46 0.00 0.00 0.00 0.00 46.02 43.31 1vsy n GLY 1047CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1vsy n SER 1048N 0.00 3.31 0.01 1.61 2.88 -0.68 -4.84 113.62 115.91 1vsy n SER 1048Ca 0.00 1.05 -0.01 0.00 -1.33 0.00 0.00 58.87 58.58 1vsy n SER 1048Cb 0.00 -1.43 0.28 0.00 -0.75 0.00 0.00 64.21 62.30 1vsy n SER 1048CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vsy h ALA 1049N 6.98 1.30 -0.08 -1.46 0.00 -1.93 -0.88 119.26 123.19 1vsy h ALA 1049Ca -0.46 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.08 1vsy h ALA 1049Cb 1.25 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1vsy h ALA 1049CO 0.91 0.47 -0.53 0.00 0.00 0.00 0.00 179.25 180.10 1vsy h ALA 1050N 1.46 0.96 0.00 0.00 0.00 -1.98 -0.57 119.26 119.14 1vsy h ALA 1050Ca 0.09 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1vsy h ALA 1050Cb 0.43 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1vsy h ALA 1050CO 0.02 0.68 -0.01 -0.44 0.00 0.00 0.00 179.25 179.50 1vsy h ASP 1051N 0.17 0.00 -0.82 0.00 3.32 -1.85 -2.78 116.42 114.46 1vsy h ASP 1051Ca 0.00 -0.70 0.03 0.00 0.02 0.00 0.00 57.03 56.38 1vsy h ASP 1051Cb 0.99 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.50 1vsy h ASP 1051CO 0.08 0.86 0.54 0.71 -1.72 0.00 0.00 179.24 179.71 1vsy h THR 1052N -1.00 1.15 -0.15 0.35 1.35 -1.21 -1.57 112.91 111.83 1vsy h THR 1052Ca -0.00 -0.35 -0.01 0.00 -0.55 0.00 0.00 66.41 65.49 1vsy h THR 1052Cb 0.71 0.03 -0.01 0.00 -1.73 0.00 0.00 68.15 67.15 1vsy h THR 1052CO -0.00 0.19 0.04 1.56 -0.25 0.00 0.00 175.52 177.06 1vsy h GLN 1053N 1.03 0.24 -0.79 4.72 4.20 -1.22 -1.97 115.11 121.33 1vsy h GLN 1053Ca 0.32 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.99 1vsy h GLN 1053Cb -0.00 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.70 1vsy h GLN 1053CO -0.09 0.38 0.52 0.00 -0.67 0.00 0.00 178.83 178.97 1vsy h ALA 1054N 0.85 1.01 0.32 3.87 0.00 -1.12 -0.83 119.26 123.35 1vsy h ALA 1054Ca 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1vsy h ALA 1054Cb 0.25 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1vsy h ALA 1054CO -0.00 0.38 -0.15 0.82 0.00 0.00 0.00 179.25 180.30 1vsy h ILE 1055N 1.04 0.70 -0.68 0.00 2.04 -1.26 -1.72 117.51 117.63 1vsy h ILE 1055Ca 0.30 -0.49 0.09 0.00 1.00 0.00 0.00 64.86 65.76 1vsy h ILE 1055Cb -0.08 0.95 -0.07 0.00 -0.74 0.00 0.00 36.82 36.88 1vsy h ILE 1055CO -0.08 0.10 0.31 0.00 0.00 0.00 0.00 178.15 178.48 1vsy h ALA 1056N -0.13 0.92 -0.71 1.87 0.00 -1.24 0.29 119.26 120.25 1vsy h ALA 1056Ca -0.04 0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.04 1vsy h ALA 1056Cb 0.48 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 1vsy h ALA 1056CO 0.07 -0.10 0.33 -0.44 0.00 0.00 0.00 179.25 179.11 1vsy h ASP 1057N 0.53 0.39 0.78 0.00 5.19 -1.10 0.22 116.42 122.43 1vsy h ASP 1057Ca 0.34 0.07 -0.17 0.00 -0.62 0.00 0.00 57.03 56.66 1vsy h ASP 1057Cb 0.38 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.89 1vsy h ASP 1057CO -0.28 0.21 -0.79 0.40 -3.12 0.00 0.00 179.24 175.65 1vsy h ILE 1058N 0.54 1.56 -0.12 0.35 2.04 -0.17 -3.03 117.51 118.69 1vsy h ILE 1058Ca 0.36 -2.70 -0.20 0.00 1.00 0.00 0.00 64.86 63.33 1vsy h ILE 1058Cb 0.44 2.46 0.00 0.00 -0.74 0.00 0.00 36.82 38.97 1vsy h ILE 1058CO -0.31 0.77 -0.74 0.58 0.00 0.00 0.00 178.15 178.46 1vsy h VAL 1059N 0.01 1.33 -0.55 1.67 2.07 -0.09 -2.35 116.25 118.35 1vsy h VAL 1059Ca -0.01 -2.05 0.04 0.00 0.82 0.00 0.00 66.70 65.50 1vsy h VAL 1059Cb 1.40 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 33.18 1vsy h VAL 1059CO 0.10 0.63 0.36 -0.61 0.02 0.00 0.00 177.57 178.08 1vsy h GLN 1060N 0.39 0.58 0.43 1.57 4.15 -0.46 -1.22 115.11 120.55 1vsy h GLN 1060Ca -0.04 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.33 1vsy h GLN 1060Cb 1.33 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.90 1vsy h GLN 1060CO 0.14 0.38 -0.21 -0.92 -1.93 0.00 0.00 178.83 176.29 1vsy h TYR 1061N 0.60 -0.54 -1.08 3.99 5.03 -1.49 -1.59 116.97 121.89 1vsy h TYR 1061Ca 0.22 -0.01 0.34 0.00 2.58 0.00 0.00 58.73 61.86 1vsy h TYR 1061Cb 0.14 0.18 -0.14 0.00 1.55 0.00 0.00 36.73 38.46 1vsy h TYR 1061CO -0.00 -0.34 0.65 0.45 -1.32 0.00 0.00 178.16 177.60 1vsy h HIS 1062N -1.11 0.80 0.06 -3.82 3.86 -0.94 0.15 115.15 114.15 1vsy h HIS 1062Ca -0.06 0.03 -0.25 0.00 -1.16 0.00 0.00 60.37 58.94 1vsy h HIS 1062Cb 0.45 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.71 1vsy h HIS 1062CO 0.00 -0.16 -1.07 -0.07 0.86 0.00 0.00 177.93 177.49 1vsy h LEU 1063N 0.27 0.49 -1.36 2.43 3.38 -1.30 -0.02 115.31 119.21 1vsy h LEU 1063Ca 0.74 -0.45 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 1vsy h LEU 1063Cb 1.88 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 42.45 1vsy h LEU 1063CO -0.53 1.28 0.13 -0.08 0.09 0.00 0.00 178.44 179.34 1vsy h GLU 1064N 0.16 0.56 0.21 1.13 4.81 0.28 -0.62 114.58 121.12 1vsy h GLU 1064Ca -0.11 -0.08 -0.32 0.00 -0.13 0.00 0.00 59.36 58.72 1vsy h GLU 1064Cb 1.75 -0.10 0.03 0.00 0.63 0.00 0.00 28.75 31.05 1vsy h GLU 1064CO 0.18 0.49 -1.46 1.25 -0.73 0.00 0.00 179.01 178.75 1vsy h LEU 1065N 0.56 0.70 -1.30 1.64 5.85 -1.16 -2.39 115.31 119.21 1vsy h LEU 1065Ca 0.13 -0.79 0.01 0.00 0.84 0.00 0.00 57.88 58.08 1vsy h LEU 1065Cb 0.16 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 1vsy h LEU 1065CO -0.01 1.62 0.48 0.22 -0.34 0.00 0.00 178.44 180.41 1vsy h TYR 1066N 0.12 0.89 -0.27 1.25 5.03 -0.87 -2.35 116.97 120.78 1vsy h TYR 1066Ca -0.24 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.05 1vsy h TYR 1066Cb 2.11 -0.30 -0.01 0.00 1.55 0.00 0.00 36.73 40.08 1vsy h TYR 1066CO 0.11 0.55 -0.00 1.15 -1.32 0.00 0.00 178.16 178.65 1vsy h THR 1067N 0.95 1.26 -0.24 1.81 2.02 -1.09 -0.50 112.91 117.13 1vsy h THR 1067Ca 0.27 -0.92 0.06 0.00 0.77 0.00 0.00 66.41 66.59 1vsy h THR 1067Cb -0.07 1.33 -0.07 0.00 -1.74 0.00 0.00 68.15 67.60 1vsy h THR 1067CO -0.07 0.29 -0.36 0.28 0.37 0.00 0.00 175.52 176.04 1vsy h SER 1068N 0.25 -1.15 0.00 4.18 0.02 -0.92 -2.77 113.55 113.16 1vsy h SER 1068Ca 0.08 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1vsy h SER 1068Cb 0.42 0.50 0.00 0.00 0.14 0.00 0.00 62.40 63.46 1vsy h SER 1068CO 0.01 -0.37 -0.07 1.56 -1.14 0.00 0.00 176.83 176.83 1vsy h GLN 1069N -0.37 0.00 0.00 3.45 4.20 -1.47 -3.43 115.11 117.49 1vsy h GLN 1069Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1vsy h GLN 1069Cb 0.57 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.35 1vsy h GLN 1069CO -0.44 0.00 -1.37 0.66 -0.67 0.00 0.00 178.83 177.01 1vsy n TYR 1070N -3.86 0.34 0.00 2.96 4.01 -0.26 -5.08 117.16 115.27 1vsy n TYR 1070Ca -0.01 0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 1vsy n TYR 1070Cb 0.04 -0.57 0.00 0.00 -0.31 0.00 0.00 39.34 38.50 1vsy n TYR 1070CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vsy n GLY 1071N 1.29 0.17 3.73 2.72 0.00 -0.83 -5.00 105.19 107.28 1vsy n GLY 1071Ca -0.01 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.48 1vsy n GLY 1071CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vsy s THR 1072N 0.00 4.39 -0.09 2.61 2.01 -1.26 -3.38 115.64 119.93 1vsy s THR 1072Ca 0.00 2.05 -0.22 0.00 0.31 0.00 0.00 61.69 63.82 1vsy s THR 1072Cb 0.00 -4.31 -0.04 0.00 0.01 0.00 0.00 72.50 68.17 1vsy s THR 1072CO 0.00 0.34 0.66 -2.16 -0.69 0.00 0.00 174.62 172.78 1vsy s PRO 1073N -0.22 4.40 0.72 4.92 0.05 -1.26 -5.04 135.00 138.57 1vsy s PRO 1073Ca 0.46 0.79 -0.16 0.00 0.05 0.00 0.00 61.00 62.15 1vsy s PRO 1073Cb -0.24 -3.46 0.03 0.00 0.05 0.00 0.00 34.50 30.88 1vsy s PRO 1073CO 0.31 0.05 1.24 -1.54 0.05 0.00 0.00 177.00 177.10 1vsy s SER 1074N 0.80 4.21 0.28 6.66 1.04 -1.26 -4.87 113.70 120.57 1vsy s SER 1074Ca 0.35 2.45 -0.03 0.00 0.48 0.00 0.00 55.95 59.20 1vsy s SER 1074Cb -0.17 -2.60 0.39 0.00 0.10 0.00 0.00 66.02 63.74 1vsy s SER 1074CO 0.16 -2.26 1.95 0.74 0.98 0.00 0.00 173.24 174.82 1vsy h THR 1075N -0.12 1.23 -0.98 2.02 2.02 -1.94 -0.91 112.91 114.23 1vsy h THR 1075Ca -0.49 -0.43 0.21 0.00 0.77 0.00 0.00 66.41 66.48 1vsy h THR 1075Cb 1.31 -0.05 -0.11 0.00 -1.74 0.00 0.00 68.15 67.56 1vsy h THR 1075CO 0.50 0.22 0.56 -0.08 0.37 0.00 0.00 175.52 177.10 1vsy h GLU 1076N 1.18 0.62 -0.22 6.66 4.81 -1.98 -2.71 114.58 122.94 1vsy h GLU 1076Ca 0.32 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.47 1vsy h GLU 1076Cb -0.12 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 1vsy h GLU 1076CO -0.07 0.41 -0.01 1.15 -0.73 0.00 0.00 179.01 179.77 1vsy h THR 1077N 0.64 1.26 -0.47 0.32 2.02 -1.50 -1.84 112.91 113.33 1vsy h THR 1077Ca 0.59 -0.91 0.10 0.00 0.77 0.00 0.00 66.41 66.96 1vsy h THR 1077Cb 1.02 1.42 -0.09 0.00 -1.74 0.00 0.00 68.15 68.76 1vsy h THR 1077CO -0.43 0.28 -0.14 0.00 0.37 0.00 0.00 175.52 175.59 1vsy h ALA 1078N 0.79 0.27 -0.48 6.16 0.00 -1.34 0.40 119.26 125.06 1vsy h ALA 1078Ca 0.06 0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.23 1vsy h ALA 1078Cb 0.42 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 18.54 1vsy h ALA 1078CO 0.01 -0.47 0.09 0.00 0.00 0.00 0.00 179.25 178.89 1vsy h ALA 1079N 1.41 0.53 -0.46 0.00 0.00 -1.26 -1.68 119.26 117.81 1vsy h ALA 1079Ca 0.23 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1vsy h ALA 1079Cb 0.38 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1vsy h ALA 1079CO -0.50 -0.31 0.22 1.03 0.00 0.00 0.00 179.25 179.69 1vsy h SER 1080N 0.23 0.57 0.12 0.00 0.87 -0.13 0.63 113.55 115.84 1vsy h SER 1080Ca 0.24 -0.05 -0.14 0.00 -1.23 0.00 0.00 61.79 60.61 1vsy h SER 1080Cb 0.32 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 1vsy h SER 1080CO -0.32 0.49 -0.52 0.58 -0.53 0.00 0.00 176.83 176.54 1vsy h VAL 1081N 0.65 1.33 0.80 2.23 2.07 -0.50 -0.63 116.25 122.19 1vsy h VAL 1081Ca 0.16 -1.76 -0.04 0.00 0.82 0.00 0.00 66.70 65.88 1vsy h VAL 1081Cb 0.07 1.77 0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1vsy h VAL 1081CO -0.02 0.54 -0.38 -0.26 0.02 0.00 0.00 177.57 177.46 1vsy h PHE 1082N 0.35 -0.99 -0.80 1.57 0.04 -0.43 -2.91 116.94 113.77 1vsy h PHE 1082Ca 0.01 -0.02 0.18 0.00 2.80 0.00 0.00 57.97 60.94 1vsy h PHE 1082Cb 1.02 0.33 -0.12 0.00 2.20 0.00 0.00 35.95 39.39 1vsy h PHE 1082CO 0.03 -0.61 0.26 1.57 -0.60 0.00 0.00 178.31 178.96 1vsy h LYS 1083N -1.27 0.32 -0.59 1.51 2.10 -0.86 0.97 116.57 118.75 1vsy h LYS 1083Ca -0.11 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.51 1vsy h LYS 1083Cb 0.83 -0.07 -0.03 0.00 -0.90 0.00 0.00 32.23 32.05 1vsy h LYS 1083CO 0.18 0.21 0.33 1.49 -2.00 0.00 0.00 179.45 179.66 1vsy h GLU 1084N 0.33 0.80 -0.07 0.07 4.57 -1.11 0.12 114.58 119.28 1vsy h GLU 1084Ca 0.47 -0.07 -0.09 0.00 -1.18 0.00 0.00 59.36 58.49 1vsy h GLU 1084Cb 0.83 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.26 1vsy h GLU 1084CO -0.52 0.57 -0.29 -0.07 -1.18 0.00 0.00 179.01 177.52 1vsy h LEU 1085N 0.81 0.39 -0.28 1.64 3.38 -0.65 -2.76 115.31 117.84 1vsy h LEU 1085Ca 0.21 -0.63 -0.14 0.00 0.09 0.00 0.00 57.88 57.40 1vsy h LEU 1085Cb -0.00 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1vsy h LEU 1085CO -0.04 0.95 -0.39 0.00 0.09 0.00 0.00 178.44 179.06 1vsy h TYR 1087N 0.51 0.28 0.00 0.00 3.20 -0.92 -2.49 116.97 117.55 1vsy h TYR 1087Ca 0.03 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.76 1vsy h TYR 1087Cb 0.98 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.21 1vsy h TYR 1087CO 0.08 0.90 0.00 -1.91 -1.64 0.00 0.00 178.16 175.59 1vsy n GLU 1088N -4.52 0.24 -0.56 1.82 4.07 -1.04 -2.37 120.64 118.29 1vsy n GLU 1088Ca -0.09 0.10 0.06 0.00 -0.06 0.00 0.00 57.16 57.17 1vsy n GLU 1088Cb 0.48 -1.50 0.11 0.00 -0.06 0.00 0.00 31.44 30.47 1vsy n GLU 1088CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1vsy n ASN 1089N -1.32 1.43 -0.37 4.31 3.02 -1.05 -4.89 115.26 116.40 1vsy n ASN 1089Ca 0.09 -2.89 0.04 0.00 -0.03 0.00 0.00 54.58 51.79 1vsy n ASN 1089Cb 0.17 -0.39 0.20 0.00 -0.61 0.00 0.00 39.78 39.16 1vsy n ASN 1089CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 1vsy h LYS 1090N 0.45 1.08 -0.05 3.52 2.10 -1.06 -2.37 116.57 120.24 1vsy h LYS 1090Ca -0.04 -0.06 0.01 0.00 -2.00 0.00 0.00 60.65 58.56 1vsy h LYS 1090Cb 1.24 -0.24 -0.00 0.00 -0.90 0.00 0.00 32.23 32.33 1vsy h LYS 1090CO 0.02 0.71 0.06 -0.44 -2.00 0.00 0.00 179.45 177.81 1vsy h ASP 1091N 1.11 0.00 0.00 7.07 3.45 -1.88 -2.98 116.42 123.19 1vsy h ASP 1091Ca 0.45 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.91 1vsy h ASP 1091Cb 0.28 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.04 1vsy h ASP 1091CO -0.20 0.00 -0.15 0.59 -1.57 0.00 0.00 179.24 177.91 1vsy n ASN 1092N -3.75 1.95 -4.06 6.45 3.02 -0.90 -5.04 115.26 112.92 1vsy n ASN 1092Ca -0.02 -3.03 -0.15 0.00 -0.03 0.00 0.00 54.58 51.35 1vsy n ASN 1092Cb 0.15 -0.41 -0.12 0.00 -0.61 0.00 0.00 39.78 38.79 1vsy n ASN 1092CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1vsy s LEU 1093N -2.51 2.21 -0.48 3.41 1.43 -1.13 -5.08 118.68 116.53 1vsy s LEU 1093Ca 0.29 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 52.95 1vsy s LEU 1093Cb 0.26 -0.26 0.15 0.00 0.03 0.00 0.00 46.19 46.36 1vsy s LEU 1093CO 0.01 -0.12 0.30 -0.89 0.23 0.00 0.00 176.35 175.88 1vsy s THR 1094N -1.10 1.45 -0.10 5.49 2.01 -1.26 -4.93 115.64 117.21 1vsy s THR 1094Ca -0.06 -2.84 -0.05 0.00 0.31 0.00 0.00 61.69 59.05 1vsy s THR 1094Cb -0.08 -2.00 0.05 0.00 0.01 0.00 0.00 72.50 70.47 1vsy s THR 1094CO 0.01 -0.97 0.24 0.00 -0.69 0.00 0.00 174.62 173.20 1vsy s ALA 1095N 0.02 -0.54 -0.17 7.40 0.00 -1.26 -1.69 121.76 125.51 1vsy s ALA 1095Ca 0.21 0.98 0.01 0.00 0.00 0.00 0.00 51.96 53.17 1vsy s ALA 1095Cb -0.16 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.34 1vsy s ALA 1095CO -0.06 -0.20 -0.20 0.20 0.00 0.00 0.00 175.76 175.49 1vsy s GLY 1096N 1.28 1.38 0.07 0.00 0.00 -0.83 -4.36 107.32 104.86 1vsy s GLY 1096Ca -0.09 -1.19 0.07 0.00 0.00 0.00 0.00 44.72 43.51 1vsy s GLY 1096CO -0.08 0.22 -0.18 -0.42 0.00 0.00 0.00 173.10 172.64 1vsy s ILE 1097N 1.20 1.43 -0.19 0.90 1.01 0.25 -3.20 121.20 122.61 1vsy s ILE 1097Ca 0.03 -1.31 0.01 0.00 0.00 0.00 0.00 60.65 59.37 1vsy s ILE 1097Cb -0.14 -1.31 0.03 0.00 0.01 0.00 0.00 42.46 41.06 1vsy s ILE 1097CO -0.11 -0.04 -0.17 -0.63 0.00 0.00 0.00 174.94 173.99 1vsy s ILE 1098N -1.06 1.97 -0.18 2.92 1.01 -0.94 0.18 121.20 125.10 1vsy s ILE 1098Ca 0.04 -1.00 -0.09 0.00 0.00 0.00 0.00 60.65 59.59 1vsy s ILE 1098Cb -0.09 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.48 1vsy s ILE 1098CO 0.03 0.42 0.13 -0.69 0.00 0.00 0.00 174.94 174.83 1vsy s VAL 1099N 1.30 5.43 -0.05 2.92 1.01 0.38 0.76 120.40 132.15 1vsy s VAL 1099Ca 0.02 0.20 -0.05 0.00 0.00 0.00 0.00 61.98 62.15 1vsy s VAL 1099Cb -0.14 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 32.79 1vsy s VAL 1099CO -0.11 0.48 0.15 0.00 0.00 0.00 0.00 175.10 175.62 1vsy s ALA 1100N 0.02 -0.36 0.16 5.51 0.00 0.40 -1.02 121.76 126.46 1vsy s ALA 1100Ca 0.10 0.34 -0.24 0.00 0.00 0.00 0.00 51.96 52.16 1vsy s ALA 1100Cb -0.11 -0.20 0.06 0.00 0.00 0.00 0.00 23.12 22.87 1vsy s ALA 1100CO -0.00 -0.09 0.81 0.20 0.00 0.00 0.00 175.76 176.67 1vsy s GLY 1101N -0.13 -0.31 -0.17 0.00 0.00 -1.05 -0.94 107.32 104.71 1vsy s GLY 1101Ca -0.02 0.25 0.01 0.00 0.00 0.00 0.00 44.72 44.95 1vsy s GLY 1101CO 0.00 0.07 -0.15 -0.47 0.00 0.00 0.00 173.10 172.55 1vsy s TYR 1102N -3.52 2.48 0.29 1.90 5.04 -0.72 -2.79 117.35 120.03 1vsy s TYR 1102Ca 0.08 -1.50 0.03 0.00 -2.44 0.00 0.00 57.07 53.25 1vsy s TYR 1102Cb -0.03 -1.73 0.03 0.00 0.35 0.00 0.00 41.96 40.59 1vsy s TYR 1102CO -0.02 -0.74 0.24 -0.40 -1.34 0.00 0.00 175.55 173.29 1vsy n ASP 1103N 4.69 1.87 -0.00 4.32 3.85 -1.22 -4.84 116.55 125.21 1vsy n ASP 1103Ca -0.18 -1.99 -0.07 0.00 -0.71 0.00 0.00 54.79 51.84 1vsy n ASP 1103Cb 0.49 -0.04 -0.12 0.00 -1.35 0.00 0.00 41.12 40.10 1vsy n ASP 1103CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 1vsy h ASP 1104N 0.33 0.00 0.29 -1.12 3.32 -1.99 -2.95 116.42 114.29 1vsy h ASP 1104Ca -0.18 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.85 1vsy h ASP 1104Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.23 1vsy h ASP 1104CO 0.28 0.91 -0.14 0.50 -1.72 0.00 0.00 179.24 179.07 1vsy h LYS 1105N 0.00 -0.37 0.00 3.56 3.11 -2.04 -3.36 116.57 117.46 1vsy h LYS 1105Ca -0.23 0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.63 1vsy h LYS 1105Cb 1.90 0.09 0.00 0.00 -1.00 0.00 0.00 32.23 33.21 1vsy h LYS 1105CO 0.08 -0.25 -0.80 -0.91 -2.81 0.00 0.00 179.45 174.76 1vsy h ASN 1106N -0.53 0.00 0.00 4.20 2.35 -2.01 -3.49 115.58 116.10 1vsy h ASN 1106Ca -0.04 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 1vsy h ASN 1106Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1vsy h ASN 1106CO 0.07 0.04 0.00 0.29 -1.65 0.00 0.00 177.43 176.18 1vsy n LYS 1107N -2.48 0.00 -2.62 0.81 5.02 -1.12 -4.68 118.16 113.09 1vsy n LYS 1107Ca 0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.87 1vsy n LYS 1107Cb 0.51 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.50 1vsy n LYS 1107CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1vsy s GLY 1108N 0.00 1.54 -0.05 0.72 0.00 -1.24 -3.41 107.32 104.88 1vsy s GLY 1108Ca 0.00 -0.05 0.02 0.00 0.00 0.00 0.00 44.72 44.69 1vsy s GLY 1108CO 0.00 2.30 -0.09 -0.54 0.00 0.00 0.00 173.10 174.76 1vsy s GLU 1109N 3.70 1.24 -0.04 2.90 2.02 -1.12 -4.92 118.70 122.48 1vsy s GLU 1109Ca 0.46 -0.30 -0.00 0.00 0.02 0.00 0.00 54.97 55.15 1vsy s GLU 1109Cb -0.12 -1.10 0.03 0.00 0.10 0.00 0.00 34.13 33.03 1vsy s GLU 1109CO 0.16 0.03 -0.00 0.08 0.02 0.00 0.00 175.26 175.55 1vsy s VAL 1110N 0.57 0.26 -0.14 2.63 1.01 -1.24 -2.51 120.40 120.98 1vsy s VAL 1110Ca -0.10 0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.99 1vsy s VAL 1110Cb -0.13 -0.37 0.01 0.00 0.00 0.00 0.00 36.38 35.89 1vsy s VAL 1110CO 0.02 0.19 -0.21 -0.31 0.00 0.00 0.00 175.10 174.78 1vsy s TYR 1111N 1.29 2.69 -0.16 5.22 1.51 -0.19 -0.68 117.35 127.03 1vsy s TYR 1111Ca -0.06 -1.34 -0.04 0.00 -1.01 0.00 0.00 57.07 54.62 1vsy s TYR 1111Cb -0.13 -1.83 -0.03 0.00 -0.11 0.00 0.00 41.96 39.86 1vsy s TYR 1111CO -0.02 -0.62 -0.02 -0.08 -1.11 0.00 0.00 175.55 173.70 1vsy s THR 1112N 0.85 4.05 -0.45 -0.71 -1.32 -0.46 -0.47 115.64 117.13 1vsy s THR 1112Ca -0.06 -0.30 -0.02 0.00 -1.21 0.00 0.00 61.69 60.09 1vsy s THR 1112Cb -0.15 -2.78 0.12 0.00 -1.51 0.00 0.00 72.50 68.18 1vsy s THR 1112CO -0.03 0.49 0.24 -0.63 -2.21 0.00 0.00 174.62 172.49 1vsy s ILE 1113N 0.31 3.26 0.00 5.08 1.01 0.13 -1.82 121.20 129.16 1vsy s ILE 1113Ca -0.03 -2.30 0.00 0.00 0.00 0.00 0.00 60.65 58.32 1vsy s ILE 1113Cb -0.14 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.11 1vsy s ILE 1113CO 0.02 -0.72 0.00 -0.81 0.00 0.00 0.00 174.94 173.43 1vsy n PRO 1114N 4.30 -1.44 -0.03 2.79 -0.04 -1.25 -0.58 135.00 138.75 1vsy n PRO 1114Ca 0.00 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.33 1vsy n PRO 1114Cb 0.40 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.77 1vsy n PRO 1114CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1vsy h LEU 1115N 0.00 0.15 -0.88 1.53 4.07 -1.93 -3.26 115.31 115.00 1vsy h LEU 1115Ca 0.00 -0.56 0.15 0.00 0.08 0.00 0.00 57.88 57.55 1vsy h LEU 1115Cb 0.00 -0.04 -0.15 0.00 1.08 0.00 0.00 40.66 41.55 1vsy h LEU 1115CO 0.00 0.68 -0.29 0.61 -1.08 0.00 0.00 178.44 178.36 1vsy n GLY 1116N 0.44 -1.68 0.00 0.83 0.00 -1.26 -4.76 105.19 98.76 1vsy n GLY 1116Ca -0.08 0.96 0.00 0.00 0.00 0.00 0.00 46.02 46.90 1vsy n GLY 1116CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vsy n GLY 1117N -1.47 0.77 3.52 -0.02 0.00 -1.23 -4.49 105.19 102.28 1vsy n GLY 1117Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1vsy n GLY 1117CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vsy n SER 1118N 0.00 -0.99 -3.89 1.61 3.41 -1.26 -4.50 113.62 108.00 1vsy n SER 1118Ca 0.00 0.18 -0.17 0.00 -0.26 0.00 0.00 58.87 58.63 1vsy n SER 1118Cb 0.00 -1.31 -0.15 0.00 -0.26 0.00 0.00 64.21 62.48 1vsy n SER 1118CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1vsy s VAL 1119N -2.49 0.33 -0.10 -3.33 1.01 -1.26 -3.91 120.40 110.66 1vsy s VAL 1119Ca 0.64 -0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.53 1vsy s VAL 1119Cb -0.22 -0.35 0.03 0.00 0.00 0.00 0.00 36.38 35.84 1vsy s VAL 1119CO 0.63 0.14 0.01 -1.00 0.00 0.00 0.00 175.10 174.88 1vsy s HIS 1120N 0.51 0.72 0.08 5.22 3.76 -0.76 -5.00 115.29 119.82 1vsy s HIS 1120Ca -0.06 -0.29 -0.26 0.00 -0.15 0.00 0.00 55.06 54.30 1vsy s HIS 1120Cb -0.09 -0.84 -0.06 0.00 1.11 0.00 0.00 32.58 32.70 1vsy s HIS 1120CO -0.01 -0.38 0.80 0.21 -0.85 0.00 0.00 174.74 174.51 1vsy s LYS 1121N 1.96 4.54 0.13 1.40 2.20 -1.26 -1.35 119.74 127.35 1vsy s LYS 1121Ca 0.04 1.14 -0.12 0.00 -0.36 0.00 0.00 55.97 56.67 1vsy s LYS 1121Cb -0.13 -3.35 0.01 0.00 -1.51 0.00 0.00 37.83 32.85 1vsy s LYS 1121CO -0.06 0.32 0.30 -0.51 -0.36 0.00 0.00 175.35 175.05 1vsy s LEU 1122N -0.23 0.90 0.25 5.43 1.43 0.14 -4.99 118.68 121.60 1vsy s LEU 1122Ca 0.39 -0.58 -0.01 0.00 -1.03 0.00 0.00 54.13 52.90 1vsy s LEU 1122Cb -0.21 1.41 0.30 0.00 0.03 0.00 0.00 46.19 47.72 1vsy s LEU 1122CO 0.25 -0.83 1.69 -0.65 0.23 0.00 0.00 176.35 177.04 1vsy h PRO 1123N 2.54 0.67 -3.21 1.29 0.11 -1.95 -3.28 132.00 128.17 1vsy h PRO 1123Ca -0.33 -0.24 -0.06 0.00 0.11 0.00 0.00 66.00 65.48 1vsy h PRO 1123Cb 1.23 -0.05 -0.15 0.00 0.11 0.00 0.00 31.00 32.15 1vsy h PRO 1123CO 0.50 0.81 -0.08 1.52 -0.21 0.00 0.00 178.00 180.55 1vsy s TYR 1124N -4.65 -0.24 -0.15 0.65 1.13 -1.26 -2.00 117.35 110.82 1vsy s TYR 1124Ca -0.08 0.06 -0.13 0.00 -1.41 0.00 0.00 57.07 55.51 1vsy s TYR 1124Cb 0.14 0.25 0.04 0.00 -1.10 0.00 0.00 41.96 41.29 1vsy s TYR 1124CO 0.81 -0.65 0.38 0.00 -2.51 0.00 0.00 175.55 173.58 1vsy s ALA 1125N -3.22 -0.94 0.23 9.51 0.00 -0.64 -4.99 121.76 121.71 1vsy s ALA 1125Ca -0.01 1.13 0.10 0.00 0.00 0.00 0.00 51.96 53.18 1vsy s ALA 1125Cb 0.01 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 1vsy s ALA 1125CO -0.08 -0.19 -0.08 0.96 0.00 0.00 0.00 175.76 176.37 1vsy s ILE 1126N 0.38 3.14 0.00 0.00 -4.36 -1.26 -1.52 121.20 117.58 1vsy s ILE 1126Ca -0.01 -1.91 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 1vsy s ILE 1126Cb -0.04 -2.62 0.00 0.00 1.25 0.00 0.00 42.46 41.05 1vsy s ILE 1126CO -0.01 -0.27 0.00 0.00 0.24 0.00 0.00 174.94 174.90 1vsy n ALA 1127N -0.45 0.00 -0.35 2.27 0.00 -0.05 -4.98 120.51 116.95 1vsy n ALA 1127Ca -0.08 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.40 1vsy n ALA 1127Cb 0.58 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 1vsy n ALA 1127CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vsy n GLY 1128N 0.00 -2.68 0.35 0.00 0.00 -1.26 -2.48 105.19 99.12 1vsy n GLY 1128Ca 0.00 -1.36 -0.05 0.00 0.00 0.00 0.00 46.02 44.61 1vsy n GLY 1128CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1vsy h SER 1129N -0.35 -1.18 0.00 1.61 0.87 -1.71 -2.00 113.55 110.79 1vsy h SER 1129Ca -0.04 0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1vsy h SER 1129Cb 0.34 0.58 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 1vsy h SER 1129CO 0.02 -0.31 0.00 0.61 -0.53 0.00 0.00 176.83 176.62 1vsy n GLY 1130N -1.43 0.57 0.13 5.77 0.00 -0.77 -3.77 105.19 105.69 1vsy n GLY 1130Ca 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 1vsy n GLY 1130CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vsy h SER 1131N 0.08 0.23 -1.03 1.61 4.64 -1.48 -3.30 113.55 114.31 1vsy h SER 1131Ca 0.00 -0.18 0.30 0.00 -0.47 0.00 0.00 61.79 61.43 1vsy h SER 1131Cb 0.29 -0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 62.27 1vsy h SER 1131CO 0.00 0.97 0.74 0.71 -0.87 0.00 0.00 176.83 178.38 1vsy h THR 1132N 0.11 0.49 -0.00 2.95 1.35 -1.79 -0.12 112.91 115.89 1vsy h THR 1132Ca -0.04 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 1vsy h THR 1132Cb 1.45 0.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1vsy h THR 1132CO 0.13 0.00 -0.25 0.49 -0.25 0.00 0.00 175.52 175.64 1vsy n PHE 1133N -4.25 0.00 -0.02 4.73 3.72 -1.24 -3.90 117.46 116.51 1vsy n PHE 1133Ca 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.62 1vsy n PHE 1133Cb 1.08 -0.33 0.00 0.00 -0.94 0.00 0.00 39.48 39.29 1vsy n PHE 1133CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1vsy n ILE 1134N -1.40 0.68 -0.04 4.37 -5.35 -0.06 -4.47 119.36 113.08 1vsy n ILE 1134Ca 0.07 -0.83 0.10 0.00 -0.27 0.00 0.00 62.75 61.83 1vsy n ILE 1134Cb 0.33 0.66 0.50 0.00 -1.74 0.00 0.00 39.64 39.39 1vsy n ILE 1134CO 0.00 0.00 0.00 1.88 -1.76 0.00 0.00 176.55 176.67 1vsy h TYR 1135N 0.00 0.41 0.53 4.28 -1.99 -1.66 0.26 116.97 118.80 1vsy h TYR 1135Ca 0.00 0.01 -0.03 0.00 2.00 0.00 0.00 58.73 60.71 1vsy h TYR 1135Cb 0.36 -0.13 0.01 0.00 2.00 0.00 0.00 36.73 38.96 1vsy h TYR 1135CO 0.00 0.21 -0.26 0.78 -0.00 0.00 0.00 178.16 178.89 1vsy h GLY 1136N 0.40 -0.75 0.69 3.88 0.00 -1.85 -2.89 103.07 102.55 1vsy h GLY 1136Ca 0.23 0.28 0.05 0.00 0.00 0.00 0.00 47.33 47.89 1vsy h GLY 1136CO -0.06 -0.27 0.30 -1.82 0.00 0.00 0.00 176.54 174.69 1vsy h TYR 1137N -1.11 0.55 0.12 5.60 3.20 -1.70 -3.01 116.97 120.62 1vsy h TYR 1137Ca -0.07 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 1vsy h TYR 1137Cb 0.60 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.71 1vsy h TYR 1137CO 0.01 0.26 -0.06 0.00 -1.64 0.00 0.00 178.16 176.73 1vsy h ASP 1139N -0.49 0.00 0.34 0.00 3.58 -1.50 0.80 116.42 119.15 1vsy h ASP 1139Ca -0.02 0.00 -0.33 0.00 0.42 0.00 0.00 57.03 57.11 1vsy h ASP 1139Cb 0.40 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.45 1vsy h ASP 1139CO 0.03 0.00 -1.62 0.11 -2.88 0.00 0.00 179.24 174.88 1vsy h LYS 1140N 0.00 0.32 -0.01 0.28 1.79 -1.42 -3.39 116.57 114.14 1vsy h LYS 1140Ca 0.14 -0.55 0.00 0.00 -2.18 0.00 0.00 60.65 58.06 1vsy h LYS 1140Cb 0.60 0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.45 1vsy h LYS 1140CO -0.00 1.21 -0.48 0.09 -1.08 0.00 0.00 179.45 179.19 1vsy n ASN 1141N -3.52 1.85 -4.79 0.86 4.13 -0.44 -4.96 115.26 108.39 1vsy n ASN 1141Ca -0.20 -1.41 -0.37 0.00 1.68 0.00 0.00 54.58 54.29 1vsy n ASN 1141Cb 1.06 0.46 -0.06 0.00 -1.54 0.00 0.00 39.78 39.70 1vsy n ASN 1141CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1vsy s PHE 1142N -2.51 3.68 0.03 3.10 5.36 0.20 -5.04 117.98 122.81 1vsy s PHE 1142Ca 0.19 1.66 0.01 0.00 -0.96 0.00 0.00 56.93 57.83 1vsy s PHE 1142Cb 0.18 -2.83 -0.02 0.00 -0.34 0.00 0.00 43.02 40.01 1vsy s PHE 1142CO 0.58 0.25 -0.05 1.03 -1.46 0.00 0.00 175.22 175.58 1vsy s ARG 1143N -2.01 0.42 0.58 10.12 0.52 -1.26 -5.01 118.95 122.31 1vsy s ARG 1143Ca 0.48 -0.70 -0.15 0.00 -0.52 0.00 0.00 55.73 54.83 1vsy s ARG 1143Cb -0.18 -0.06 -0.05 0.00 0.52 0.00 0.00 34.95 35.19 1vsy s ARG 1143CO 0.23 -0.01 1.03 -1.21 0.02 0.00 0.00 175.30 175.36 1vsy s GLU 1144N -1.64 3.53 -1.33 3.54 2.02 -1.26 -4.26 118.70 119.30 1vsy s GLU 1144Ca -0.12 1.04 -0.06 0.00 0.02 0.00 0.00 54.97 55.85 1vsy s GLU 1144Cb -0.09 -2.07 0.02 0.00 0.10 0.00 0.00 34.13 32.09 1vsy s GLU 1144CO -0.01 -0.63 1.04 0.09 0.02 0.00 0.00 175.26 175.77 1vsy n ASN 1145N -2.06 -4.17 -4.85 -0.19 5.03 -1.26 -4.97 115.26 102.80 1vsy n ASN 1145Ca 0.08 -0.64 -0.30 0.00 0.87 0.00 0.00 54.58 54.58 1vsy n ASN 1145Cb 0.53 -4.75 0.05 0.00 -1.02 0.00 0.00 39.78 34.60 1vsy n ASN 1145CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 1vsy s MET 1146N -6.04 2.89 0.62 3.52 -1.94 -1.26 -4.42 119.30 112.66 1vsy s MET 1146Ca 0.35 0.67 -0.10 0.00 -1.71 0.00 0.00 55.69 54.91 1vsy s MET 1146Cb -0.16 -2.01 -0.02 0.00 2.01 0.00 0.00 34.83 34.65 1vsy s MET 1146CO 0.76 -1.06 1.00 -1.54 -0.01 0.00 0.00 175.02 174.16 1vsy s SER 1147N -4.10 5.93 0.12 3.03 1.04 -1.26 -2.70 113.70 115.77 1vsy s SER 1147Ca 0.58 1.18 -0.29 0.00 0.48 0.00 0.00 55.95 57.90 1vsy s SER 1147Cb -0.12 -2.19 -0.07 0.00 0.10 0.00 0.00 66.02 63.74 1vsy s SER 1147CO 0.54 -0.98 1.60 0.50 0.98 0.00 0.00 173.24 175.87 1vsy h LYS 1148N -0.32 -0.51 0.00 4.02 3.64 -2.00 -0.91 116.57 120.49 1vsy h LYS 1148Ca -0.45 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 1vsy h LYS 1148Cb 1.22 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 1vsy h LYS 1148CO 0.62 -0.34 0.00 1.05 -2.27 0.00 0.00 179.45 178.51 1vsy h GLU 1149N -0.53 0.00 -0.65 1.90 4.11 -1.99 -1.76 114.58 115.65 1vsy h GLU 1149Ca 0.05 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.41 1vsy h GLU 1149Cb 0.61 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 1vsy h GLU 1149CO -0.29 0.00 0.14 0.93 0.07 0.00 0.00 179.01 179.86 1vsy h GLU 1150N 0.00 1.05 0.09 1.06 5.08 -1.64 -2.37 114.58 117.84 1vsy h GLU 1150Ca 0.00 -0.26 -0.28 0.00 -1.00 0.00 0.00 59.36 57.83 1vsy h GLU 1150Cb 0.67 -0.14 0.02 0.00 0.50 0.00 0.00 28.75 29.80 1vsy h GLU 1150CO 0.00 0.94 -1.17 1.15 -1.00 0.00 0.00 179.01 178.94 1vsy h THR 1151N 0.99 1.33 -0.33 1.13 2.02 -0.51 -1.58 112.91 115.96 1vsy h THR 1151Ca 0.20 -2.50 0.03 0.00 0.77 0.00 0.00 66.41 64.91 1vsy h THR 1151Cb 0.38 2.63 -0.03 0.00 -1.74 0.00 0.00 68.15 69.40 1vsy h THR 1151CO 0.01 0.76 0.15 0.58 0.37 0.00 0.00 175.52 177.38 1vsy h VAL 1152N 0.26 0.96 0.12 3.16 2.07 -1.35 -1.35 116.25 120.12 1vsy h VAL 1152Ca -0.16 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1vsy h VAL 1152Cb 1.84 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 1vsy h VAL 1152CO 0.22 0.06 -0.06 0.44 0.02 0.00 0.00 177.57 178.25 1vsy h ASP 1153N 0.32 -0.13 -0.99 0.57 3.32 -1.43 0.26 116.42 118.34 1vsy h ASP 1153Ca 0.14 0.00 0.22 0.00 0.02 0.00 0.00 57.03 57.41 1vsy h ASP 1153Cb 0.07 0.03 -0.09 0.00 0.22 0.00 0.00 39.33 39.56 1vsy h ASP 1153CO -0.11 -0.09 0.63 0.15 -1.72 0.00 0.00 179.24 178.09 1vsy h PHE 1154N -0.16 0.81 -0.02 4.55 3.57 -1.04 -0.81 116.94 123.85 1vsy h PHE 1154Ca -0.02 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.36 1vsy h PHE 1154Cb 0.12 -0.24 0.01 0.00 2.79 0.00 0.00 35.95 38.63 1vsy h PHE 1154CO -0.07 0.15 -0.57 0.82 -2.23 0.00 0.00 178.31 176.41 1vsy h ILE 1155N 0.55 1.42 -0.81 1.41 2.04 -0.89 -2.52 117.51 118.70 1vsy h ILE 1155Ca 0.56 -2.02 0.06 0.00 1.00 0.00 0.00 64.86 64.46 1vsy h ILE 1155Cb 1.17 2.52 -0.06 0.00 -0.74 0.00 0.00 36.82 39.72 1vsy h ILE 1155CO -0.31 0.59 0.50 0.50 0.00 0.00 0.00 178.15 179.43 1vsy h LYS 1156N -0.08 0.89 0.14 2.37 3.64 0.20 -0.78 116.57 122.96 1vsy h LYS 1156Ca -0.07 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 1vsy h LYS 1156Cb 1.27 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1vsy h LYS 1156CO 0.11 0.59 -0.07 0.45 -2.27 0.00 0.00 179.45 178.26 1vsy h HIS 1157N 0.91 -0.18 -0.70 1.91 3.86 -1.28 -0.10 115.15 119.58 1vsy h HIS 1157Ca 0.35 -0.00 0.14 0.00 -1.16 0.00 0.00 60.37 59.70 1vsy h HIS 1157Cb 0.16 0.06 -0.10 0.00 1.06 0.00 0.00 27.41 28.59 1vsy h HIS 1157CO -0.04 0.25 0.17 0.77 0.86 0.00 0.00 177.93 179.93 1vsy h SER 1158N -0.69 0.02 1.31 2.45 0.02 -1.14 -1.30 113.55 114.23 1vsy h SER 1158Ca -0.02 0.13 -0.14 0.00 -0.84 0.00 0.00 61.79 60.93 1vsy h SER 1158Cb 0.50 0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.20 1vsy h SER 1158CO 0.03 -0.01 -0.69 -0.07 -1.14 0.00 0.00 176.83 174.94 1vsy h LEU 1159N 0.28 0.00 -1.17 5.07 3.38 -1.19 -2.36 115.31 119.31 1vsy h LEU 1159Ca 0.38 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.39 1vsy h LEU 1159Cb 0.63 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.33 1vsy h LEU 1159CO -0.47 0.64 0.57 0.77 0.09 0.00 0.00 178.44 180.04 1vsy h SER 1160N 0.00 0.93 0.29 -0.43 4.64 0.11 -2.78 113.55 116.30 1vsy h SER 1160Ca -0.02 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1vsy h SER 1160Cb 1.51 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1vsy h SER 1160CO 0.08 0.64 -0.14 1.56 -0.87 0.00 0.00 176.83 178.10 1vsy h GLN 1161N 1.07 -0.37 -0.91 4.77 1.08 -1.16 -2.92 115.11 116.67 1vsy h GLN 1161Ca 0.34 0.03 0.34 0.00 -1.45 0.00 0.00 58.65 57.91 1vsy h GLN 1161Cb 0.02 0.08 -0.12 0.00 -0.05 0.00 0.00 27.48 27.42 1vsy h GLN 1161CO -0.10 -0.25 0.55 0.00 -0.95 0.00 0.00 178.83 178.08 1vsy n ALA 1162N -2.61 0.92 0.04 3.87 0.00 -0.91 -0.68 120.51 121.15 1vsy n ALA 1162Ca -0.05 0.73 -0.11 0.00 0.00 0.00 0.00 53.44 54.01 1vsy n ALA 1162Cb 0.15 -0.80 -0.13 0.00 0.00 0.00 0.00 19.45 18.67 1vsy n ALA 1162CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1vsy h ILE 1163N 0.00 1.31 0.04 0.00 2.04 -1.53 -0.91 117.51 118.47 1vsy h ILE 1163Ca 0.66 -3.03 0.01 0.00 1.00 0.00 0.00 64.86 63.50 1vsy h ILE 1163Cb 1.95 2.72 -0.01 0.00 -0.74 0.00 0.00 36.82 40.74 1vsy h ILE 1163CO -0.48 0.80 -0.07 0.50 0.00 0.00 0.00 178.15 178.91 1vsy h LYS 1164N 0.03 -0.14 0.00 2.37 3.64 -0.69 -3.28 116.57 118.49 1vsy h LYS 1164Ca -0.16 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1vsy h LYS 1164Cb 1.92 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.77 1vsy h LYS 1164CO 0.13 -0.09 -0.70 -1.49 -2.27 0.00 0.00 179.45 175.03 1vsy h TRP 1165N -0.14 0.00 -3.18 1.91 4.06 -1.36 -3.46 115.95 113.77 1vsy h TRP 1165Ca 0.01 0.00 -0.67 0.00 2.06 0.00 0.00 58.89 60.30 1vsy h TRP 1165Cb 0.15 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 28.18 1vsy h TRP 1165CO -0.12 0.04 -0.59 0.34 -3.56 0.00 0.00 178.44 174.55 1vsy s ASP 1166N -5.67 5.49 0.14 -3.49 2.15 -0.35 -4.97 116.67 109.97 1vsy s ASP 1166Ca 0.02 0.19 0.22 0.00 0.43 0.00 0.00 52.55 53.41 1vsy s ASP 1166Cb 0.08 -1.67 -0.06 0.00 -0.30 0.00 0.00 42.92 40.97 1vsy s ASP 1166CO 0.75 0.35 0.93 0.61 -0.17 0.00 0.00 175.17 177.64 1vsy n GLY 1167N 2.36 -1.34 0.85 2.66 0.00 -1.26 -3.67 105.19 104.79 1vsy n GLY 1167Ca -0.19 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 45.60 1vsy n GLY 1167CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1vsy n SER 1168N -2.50 2.48 -4.04 1.61 7.64 -1.26 -4.85 113.62 112.69 1vsy n SER 1168Ca -0.01 -1.98 -0.12 0.00 1.01 0.00 0.00 58.87 57.78 1vsy n SER 1168Cb 0.54 -0.29 -0.11 0.00 -1.01 0.00 0.00 64.21 63.33 1vsy n SER 1168CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1vsy s SER 1169N -1.07 0.67 0.00 6.43 0.01 -1.24 -4.21 113.70 114.30 1vsy s SER 1169Ca 0.32 -0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.03 1vsy s SER 1169Cb 0.17 0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.45 1vsy s SER 1169CO 0.22 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.24 1vsy n GLY 1170N 1.46 -0.01 3.79 3.44 0.00 -1.26 -4.77 105.19 107.84 1vsy n GLY 1170Ca -0.23 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1vsy n GLY 1170CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vsy n GLY 1171N 0.00 0.13 3.94 -0.02 0.00 -1.26 -1.08 105.19 106.90 1vsy n GLY 1171Ca 0.00 -1.37 -0.24 0.00 0.00 0.00 0.00 46.02 44.41 1vsy n GLY 1171CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vsy s VAL 1172N 0.00 3.90 -0.33 1.61 -7.23 -1.26 -4.63 120.40 112.46 1vsy s VAL 1172Ca 0.00 -0.31 -0.12 0.00 -1.81 0.00 0.00 61.98 59.74 1vsy s VAL 1172Cb 0.00 -3.48 -0.02 0.00 0.56 0.00 0.00 36.38 33.45 1vsy s VAL 1172CO 0.00 -0.39 0.22 -0.63 -0.31 0.00 0.00 175.10 173.98 1vsy s ILE 1173N -2.71 5.10 -0.05 -0.62 1.01 -0.71 -3.12 121.20 120.11 1vsy s ILE 1173Ca 0.50 -0.26 -0.13 0.00 0.00 0.00 0.00 60.65 60.76 1vsy s ILE 1173Cb -0.10 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.70 1vsy s ILE 1173CO 0.40 0.02 0.35 -0.13 0.00 0.00 0.00 174.94 175.58 1vsy s ARG 1174N 1.69 3.88 0.18 2.79 0.52 -0.63 -1.54 118.95 125.85 1vsy s ARG 1174Ca 0.06 0.27 0.06 0.00 -0.52 0.00 0.00 55.73 55.60 1vsy s ARG 1174Cb -0.17 -3.25 -0.05 0.00 0.52 0.00 0.00 34.95 32.00 1vsy s ARG 1174CO 0.09 0.63 -0.13 -1.64 0.02 0.00 0.00 175.30 174.28 1vsy s MET 1175N -0.81 1.21 -0.10 3.54 -1.94 -0.77 -1.11 119.30 119.32 1vsy s MET 1175Ca 0.21 -1.51 -0.03 0.00 -1.71 0.00 0.00 55.69 52.65 1vsy s MET 1175Cb -0.15 -0.92 0.05 0.00 2.01 0.00 0.00 34.83 35.81 1vsy s MET 1175CO 0.10 0.14 0.12 0.08 -0.01 0.00 0.00 175.02 175.45 1vsy s VAL 1176N -3.04 -0.18 -0.23 -6.03 1.01 0.27 -0.36 120.40 111.84 1vsy s VAL 1176Ca 0.19 0.23 -0.13 0.00 0.00 0.00 0.00 61.98 62.27 1vsy s VAL 1176Cb 0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1vsy s VAL 1176CO 0.04 0.04 0.27 -0.69 0.00 0.00 0.00 175.10 174.76 1vsy s VAL 1177N 2.22 5.28 -0.37 2.92 1.01 0.35 -1.02 120.40 130.80 1vsy s VAL 1177Ca 0.04 0.41 -0.02 0.00 0.00 0.00 0.00 61.98 62.41 1vsy s VAL 1177Cb -0.13 -3.60 0.09 0.00 0.00 0.00 0.00 36.38 32.74 1vsy s VAL 1177CO -0.06 0.30 0.13 -0.76 0.00 0.00 0.00 175.10 174.70 1vsy s LEU 1178N 1.23 4.79 0.00 3.92 1.02 -0.31 -2.07 118.68 127.26 1vsy s LEU 1178Ca 0.12 -1.81 0.04 0.00 0.02 0.00 0.00 54.13 52.51 1vsy s LEU 1178Cb -0.14 -1.78 -0.02 0.00 0.02 0.00 0.00 46.19 44.28 1vsy s LEU 1178CO 0.06 -0.44 0.15 0.35 0.02 0.00 0.00 176.35 176.49 1vsy n THR 1179N 4.57 0.00 -0.27 5.49 -2.24 -1.01 -2.61 114.28 118.20 1vsy n THR 1179Ca -0.05 -2.26 -0.03 0.00 -2.27 0.00 0.00 64.05 59.44 1vsy n THR 1179Cb 0.42 0.84 0.09 0.00 -2.10 0.00 0.00 70.33 69.57 1vsy n THR 1179CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vsy h ALA 1180N 1.67 0.99 0.00 6.98 0.00 -1.95 -2.44 119.26 124.51 1vsy h ALA 1180Ca -0.29 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1vsy h ALA 1180Cb 1.15 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1vsy h ALA 1180CO 0.46 0.29 0.00 0.00 0.00 0.00 0.00 179.25 180.00 1vsy n ALA 1181N -2.32 2.00 0.00 0.00 0.00 -1.26 -4.96 120.51 113.97 1vsy n ALA 1181Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1vsy n ALA 1181Cb 0.08 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1vsy n ALA 1181CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vsy n GLY 1182N 0.44 0.77 3.49 0.00 0.00 -0.92 -5.04 105.19 103.94 1vsy n GLY 1182Ca 0.08 -2.05 -0.36 0.00 0.00 0.00 0.00 46.02 43.69 1vsy n GLY 1182CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vsy s VAL 1183N -1.64 4.47 -0.16 1.61 1.01 -1.26 -2.41 120.40 122.02 1vsy s VAL 1183Ca 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.86 1vsy s VAL 1183Cb 0.00 -3.08 0.02 0.00 0.00 0.00 0.00 36.38 33.32 1vsy s VAL 1183CO 0.00 0.35 -0.17 -0.70 0.00 0.00 0.00 175.10 174.58 1vsy s GLU 1184N 1.41 2.60 -0.12 2.72 2.12 -0.88 -4.99 118.70 121.56 1vsy s GLU 1184Ca 0.05 -0.68 -0.17 0.00 0.36 0.00 0.00 54.97 54.54 1vsy s GLU 1184Cb -0.15 -2.31 -0.04 0.00 0.26 0.00 0.00 34.13 31.89 1vsy s GLU 1184CO 0.04 -0.22 0.43 1.03 -0.54 0.00 0.00 175.26 176.00 1vsy s ARG 1185N 1.39 4.29 0.20 4.30 0.52 -1.26 -0.49 118.95 127.90 1vsy s ARG 1185Ca 0.05 0.37 0.08 0.00 -0.52 0.00 0.00 55.73 55.71 1vsy s ARG 1185Cb -0.13 -3.42 -0.04 0.00 0.52 0.00 0.00 34.95 31.88 1vsy s ARG 1185CO -0.12 0.22 -0.01 -0.51 0.02 0.00 0.00 175.30 174.90 1vsy s LEU 1186N 0.46 3.25 -0.12 2.53 1.43 0.52 -4.98 118.68 121.77 1vsy s LEU 1186Ca 0.24 -0.48 -0.08 0.00 -1.03 0.00 0.00 54.13 52.78 1vsy s LEU 1186Cb -0.15 -1.88 0.04 0.00 0.03 0.00 0.00 46.19 44.24 1vsy s LEU 1186CO 0.09 0.07 0.30 -0.51 0.23 0.00 0.00 176.35 176.53 1vsy s ILE 1187N -1.88 -0.02 -0.06 -0.59 2.07 -1.26 -1.85 121.20 117.62 1vsy s ILE 1187Ca 0.28 0.08 0.03 0.00 -1.41 0.00 0.00 60.65 59.63 1vsy s ILE 1187Cb -0.08 -0.45 0.01 0.00 0.13 0.00 0.00 42.46 42.07 1vsy s ILE 1187CO 0.19 0.03 -0.13 -0.36 -1.91 0.00 0.00 174.94 172.76 1vsy s PHE 1188N 0.85 1.45 0.39 3.50 0.08 -0.59 -5.01 117.98 118.66 1vsy s PHE 1188Ca -0.06 -0.49 0.02 0.00 0.12 0.00 0.00 56.93 56.52 1vsy s PHE 1188Cb -0.07 -1.04 -0.01 0.00 -0.57 0.00 0.00 43.02 41.33 1vsy s PHE 1188CO -0.06 -0.23 0.58 0.71 -0.10 0.00 0.00 175.22 176.12 1vsy s TYR 1189N 0.47 3.28 0.23 0.36 2.02 -1.26 -1.75 117.35 120.70 1vsy s TYR 1189Ca -0.11 0.15 -0.08 0.00 -0.37 0.00 0.00 57.07 56.67 1vsy s TYR 1189Cb -0.14 -2.11 0.27 0.00 -0.40 0.00 0.00 41.96 39.58 1vsy s TYR 1189CO 0.03 -0.13 1.84 -1.35 -1.57 0.00 0.00 175.55 174.38 1vsy h PRO 1190N 0.63 0.87 0.00 -1.71 0.11 -1.98 -0.83 132.00 129.08 1vsy h PRO 1190Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1vsy h PRO 1190Cb 1.24 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1vsy h PRO 1190CO 0.58 0.58 0.23 -0.25 -0.21 0.00 0.00 178.00 178.92 1vsy n ASP 1191N -4.66 0.37 -0.11 -2.05 9.92 -1.26 -2.69 116.55 116.08 1vsy n ASP 1191Ca 0.10 0.59 -0.23 0.00 -0.53 0.00 0.00 54.79 54.72 1vsy n ASP 1191Cb 0.14 -0.56 -0.08 0.00 -0.64 0.00 0.00 41.12 39.98 1vsy n ASP 1191CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1vsy n GLU 1192N -2.06 0.46 0.18 -1.24 2.13 -0.34 -4.51 120.64 115.25 1vsy n GLU 1192Ca -0.01 0.20 0.13 0.00 0.66 0.00 0.00 57.16 58.13 1vsy n GLU 1192Cb 0.25 -1.27 0.27 0.00 0.27 0.00 0.00 31.44 30.96 1vsy n GLU 1192CO 0.00 0.00 0.00 0.10 -0.41 0.00 0.00 177.13 176.82 1vsy h TYR 1193N -0.73 0.00 0.03 4.31 -0.00 -1.36 -3.20 116.97 116.01 1vsy h TYR 1193Ca -0.54 0.00 -0.22 0.00 0.00 0.00 0.00 58.73 57.96 1vsy h TYR 1193Cb 1.49 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 38.22 1vsy h TYR 1193CO -0.06 0.00 -0.99 0.93 -0.00 0.00 0.00 178.16 178.04 1vsy h GLU 1194N 0.00 0.26 -1.68 0.10 5.08 -1.78 -3.31 114.58 113.25 1vsy h GLU 1194Ca 0.00 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1vsy h GLU 1194Cb 0.89 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1vsy h GLU 1194CO 0.00 1.06 0.00 0.94 -1.00 0.00 0.00 179.01 180.01 1vsy n GLN 1195N -3.64 0.85 0.00 2.33 -0.06 -1.21 -5.14 117.38 110.51 1vsy n GLN 1195Ca -0.05 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.95 1vsy n GLN 1195Cb 0.87 -1.07 0.00 0.00 -4.06 0.00 0.00 30.24 25.98 1vsy n GLN 1195CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14