#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vsy n GLY 1011N 0.00 4.56 0.32 0.00 0.00 -1.26 -4.50 105.19 104.32 1vsy n GLY 1011Ca 0.00 -1.69 0.08 0.00 0.00 0.00 0.00 46.02 44.41 1vsy n GLY 1011CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1vsy n TYR 1012N 2.86 0.29 1.66 1.61 0.18 -1.26 -4.40 117.16 118.10 1vsy n TYR 1012Ca 0.72 -0.85 0.09 0.00 1.88 0.00 0.00 57.90 59.74 1vsy n TYR 1012Cb 0.26 -0.17 0.45 0.00 -0.38 0.00 0.00 39.34 39.50 1vsy n TYR 1012CO 0.00 0.00 0.00 -0.40 -2.08 0.00 0.00 176.86 174.38 1vsy n ASP 1013N -0.90 0.73 0.00 9.48 5.75 -1.26 -3.20 116.55 127.15 1vsy n ASP 1013Ca 0.15 -1.57 0.11 0.00 -0.01 0.00 0.00 54.79 53.47 1vsy n ASP 1013Cb 0.63 -0.05 0.11 0.00 -1.03 0.00 0.00 41.12 40.79 1vsy n ASP 1013CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1vsy n ARG 1014N -0.29 0.01 -0.01 0.11 5.12 -1.26 -4.40 116.66 115.94 1vsy n ARG 1014Ca 0.14 0.00 0.03 0.00 -1.93 0.00 0.00 57.85 56.10 1vsy n ARG 1014Cb 0.18 -1.51 -0.06 0.00 -1.16 0.00 0.00 32.46 29.91 1vsy n ARG 1014CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1vsy n HIS 1015N -1.52 0.00 -4.49 -1.55 8.25 -1.19 -4.51 115.22 110.20 1vsy n HIS 1015Ca 0.05 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.28 1vsy n HIS 1015Cb 0.34 -0.21 -0.10 0.00 1.12 0.00 0.00 29.99 31.14 1vsy n HIS 1015CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 1vsy s ILE 1016N -2.52 1.29 -1.40 1.59 -4.36 -1.25 -4.97 121.20 109.59 1vsy s ILE 1016Ca -0.03 -2.00 -0.09 0.00 -0.26 0.00 0.00 60.65 58.27 1vsy s ILE 1016Cb 0.05 -2.79 -0.08 0.00 1.25 0.00 0.00 42.46 40.89 1vsy s ILE 1016CO 0.33 0.00 2.68 0.35 0.24 0.00 0.00 174.94 178.54 1vsy n THR 1017N -0.76 3.70 -4.55 8.37 -2.24 -1.26 -4.48 114.28 113.06 1vsy n THR 1017Ca -0.03 -2.23 -0.26 0.00 -2.27 0.00 0.00 64.05 59.26 1vsy n THR 1017Cb 0.67 -2.46 -0.10 0.00 -2.10 0.00 0.00 70.33 66.33 1vsy n THR 1017CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1vsy s ILE 1018N 2.60 1.25 -0.13 2.28 -4.36 -1.26 -4.57 121.20 117.01 1vsy s ILE 1018Ca 0.60 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.69 1vsy s ILE 1018Cb 0.15 -2.65 -0.01 0.00 1.25 0.00 0.00 42.46 41.20 1vsy s ILE 1018CO -0.05 0.00 1.10 -0.36 0.24 0.00 0.00 174.94 175.87 1vsy s PHE 1019N -3.08 3.30 1.11 1.37 0.08 -1.26 -4.42 117.98 115.07 1vsy s PHE 1019Ca 0.29 1.38 -0.15 0.00 0.12 0.00 0.00 56.93 58.58 1vsy s PHE 1019Cb 0.07 -3.31 0.24 0.00 -0.57 0.00 0.00 43.02 39.45 1vsy s PHE 1019CO 0.14 -0.78 1.07 -1.54 -0.10 0.00 0.00 175.22 174.01 1vsy s SER 1020N 1.34 1.65 0.60 1.36 1.04 -0.18 -4.90 113.70 114.61 1vsy s SER 1020Ca 0.50 1.09 0.38 0.00 0.48 0.00 0.00 55.95 58.40 1vsy s SER 1020Cb -0.20 -1.68 1.91 0.00 0.10 0.00 0.00 66.02 66.16 1vsy s SER 1020CO 0.16 -3.73 2.20 -0.65 0.98 0.00 0.00 173.24 172.20 1vsy h PRO 1021N -2.30 0.00 -0.68 4.02 0.11 -1.96 -2.65 132.00 128.54 1vsy h PRO 1021Ca -0.54 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.27 1vsy h PRO 1021Cb 1.33 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.26 1vsy h PRO 1021CO 0.50 0.02 0.28 0.39 -0.21 0.00 0.00 178.00 178.98 1vsy n GLU 1022N -3.20 2.56 -2.46 1.05 4.71 -1.26 -4.94 120.64 117.10 1vsy n GLU 1022Ca -0.02 -3.07 -0.12 0.00 -0.01 0.00 0.00 57.16 53.95 1vsy n GLU 1022Cb 0.18 -2.05 0.01 0.00 -1.01 0.00 0.00 31.44 28.56 1vsy n GLU 1022CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1vsy n GLY 1023N -0.84 -0.03 3.66 0.62 0.00 -1.00 -5.02 105.19 102.59 1vsy n GLY 1023Ca 0.44 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1vsy n GLY 1023CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vsy s ARG 1024N -4.89 2.53 -0.53 1.61 0.52 -1.26 -4.87 118.95 112.07 1vsy s ARG 1024Ca 0.09 -0.81 -0.09 0.00 -0.52 0.00 0.00 55.73 54.40 1vsy s ARG 1024Cb -0.04 -2.53 0.14 0.00 0.52 0.00 0.00 34.95 33.04 1vsy s ARG 1024CO 0.11 0.56 0.40 -0.51 0.02 0.00 0.00 175.30 175.88 1vsy s LEU 1025N -2.07 5.75 0.18 2.53 1.43 -1.26 -1.01 118.68 124.22 1vsy s LEU 1025Ca 0.23 -2.13 -0.12 0.00 -1.03 0.00 0.00 54.13 51.09 1vsy s LEU 1025Cb -0.12 -2.01 0.09 0.00 0.03 0.00 0.00 46.19 44.19 1vsy s LEU 1025CO 0.15 -0.64 1.79 1.88 0.23 0.00 0.00 176.35 179.77 1vsy h TYR 1026N 8.18 0.87 0.00 0.29 0.05 -1.77 -2.07 116.97 122.51 1vsy h TYR 1026Ca -0.15 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.58 1vsy h TYR 1026Cb 1.05 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 38.51 1vsy h TYR 1026CO 0.69 0.63 -0.10 1.96 -1.05 0.00 0.00 178.16 180.28 1vsy h GLN 1027N 0.85 0.00 0.04 4.88 1.08 -1.79 -2.22 115.11 117.96 1vsy h GLN 1027Ca 0.22 0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 57.19 1vsy h GLN 1027Cb 0.06 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.51 1vsy h GLN 1027CO -0.03 0.10 -0.94 0.28 -0.95 0.00 0.00 178.83 177.29 1vsy h VAL 1028N 0.00 1.34 -0.38 -0.54 2.07 -1.76 -2.03 116.25 114.96 1vsy h VAL 1028Ca -0.00 -2.26 0.03 0.00 0.82 0.00 0.00 66.70 65.29 1vsy h VAL 1028Cb 0.23 2.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.56 1vsy h VAL 1028CO 0.01 0.68 0.25 -0.33 0.02 0.00 0.00 177.57 178.21 1vsy h GLU 1029N 0.15 0.38 0.03 1.57 5.08 -1.18 -1.47 114.58 119.15 1vsy h GLU 1029Ca -0.13 -0.02 -0.23 0.00 -1.00 0.00 0.00 59.36 57.98 1vsy h GLU 1029Cb 1.62 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 30.81 1vsy h GLU 1029CO 0.18 0.25 -0.93 1.88 -1.00 0.00 0.00 179.01 179.39 1vsy h TYR 1030N 0.39 0.88 -0.83 4.33 0.05 -1.40 -3.13 116.97 117.26 1vsy h TYR 1030Ca 0.15 -0.50 0.11 0.00 0.05 0.00 0.00 58.73 58.55 1vsy h TYR 1030Cb 0.13 -0.09 -0.08 0.00 1.01 0.00 0.00 36.73 37.70 1vsy h TYR 1030CO -0.00 1.34 0.46 0.00 -1.05 0.00 0.00 178.16 178.90 1vsy h ALA 1031N 0.33 1.21 -0.31 3.88 0.00 -0.61 0.45 119.26 124.20 1vsy h ALA 1031Ca -0.13 0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.89 1vsy h ALA 1031Cb 1.62 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.27 1vsy h ALA 1031CO 0.18 0.03 -0.03 0.74 0.00 0.00 0.00 179.25 180.17 1vsy h PHE 1032N 0.73 -0.07 -0.06 0.00 0.04 -1.31 -2.16 116.94 114.10 1vsy h PHE 1032Ca 0.42 0.02 0.02 0.00 2.80 0.00 0.00 57.97 61.23 1vsy h PHE 1032Cb 0.46 0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.69 1vsy h PHE 1032CO -0.07 -0.08 0.20 0.87 -0.60 0.00 0.00 178.31 178.62 1vsy h LYS 1033N 0.06 0.00 0.00 1.51 1.57 -0.85 -0.03 116.57 118.82 1vsy h LYS 1033Ca 0.15 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.79 1vsy h LYS 1033Cb 0.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1vsy h LYS 1033CO -0.28 0.00 -0.67 0.00 -0.57 0.00 0.00 179.45 177.93 1vsy h ALA 1034N 1.65 0.79 0.00 3.86 0.00 -1.16 -3.25 119.26 121.16 1vsy h ALA 1034Ca 0.03 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1vsy h ALA 1034Cb 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1vsy h ALA 1034CO -0.00 0.84 0.00 0.25 0.00 0.00 0.00 179.25 180.34 1vsy n THR 1035N -3.59 1.20 0.00 0.00 -2.24 -0.03 -1.00 114.28 108.62 1vsy n THR 1035Ca -0.00 0.60 0.00 0.00 -2.27 0.00 0.00 64.05 62.38 1vsy n THR 1035Cb 0.69 -1.58 -0.11 0.00 -2.10 0.00 0.00 70.33 67.23 1vsy n THR 1035CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1vsy n ASN 1036N -2.08 0.56 0.15 3.42 3.02 -1.22 -3.33 115.26 115.77 1vsy n ASN 1036Ca -0.00 0.25 0.03 0.00 -0.03 0.00 0.00 54.58 54.82 1vsy n ASN 1036Cb 0.06 0.61 0.17 0.00 -0.61 0.00 0.00 39.78 40.02 1vsy n ASN 1036CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1vsy n GLN 1037N -2.76 0.05 -0.01 3.52 7.27 -0.17 0.10 117.38 125.38 1vsy n GLN 1037Ca -0.13 0.49 -0.12 0.00 0.07 0.00 0.00 57.00 57.31 1vsy n GLN 1037Cb 0.85 -2.15 -0.14 0.00 2.41 0.00 0.00 30.24 31.21 1vsy n GLN 1037CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 1vsy h THR 1038N 0.00 0.85 -1.05 1.69 1.35 -1.77 -3.49 112.91 110.49 1vsy h THR 1038Ca 0.00 -2.66 -0.07 0.00 -0.55 0.00 0.00 66.41 63.13 1vsy h THR 1038Cb 0.99 2.48 0.01 0.00 -1.73 0.00 0.00 68.15 69.89 1vsy h THR 1038CO 0.00 0.62 -0.11 -3.20 -0.25 0.00 0.00 175.52 172.59 1vsy n ASN 1039N -3.18 -2.23 -4.61 5.36 4.05 0.29 -5.05 115.26 109.88 1vsy n ASN 1039Ca -0.20 -0.04 -0.34 0.00 0.45 0.00 0.00 54.58 54.46 1vsy n ASN 1039Cb 1.05 -1.29 -0.10 0.00 1.23 0.00 0.00 39.78 40.66 1vsy n ASN 1039CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1vsy s ILE 1040N -2.53 3.85 0.02 -1.44 -1.09 -1.26 -4.99 121.20 113.77 1vsy s ILE 1040Ca 0.04 -0.50 0.01 0.00 -2.23 0.00 0.00 60.65 57.97 1vsy s ILE 1040Cb -0.02 -2.62 -0.04 0.00 -1.58 0.00 0.00 42.46 38.21 1vsy s ILE 1040CO 0.05 0.54 0.04 0.20 -1.23 0.00 0.00 174.94 174.54 1vsy s ASN 1041N -1.02 5.36 0.05 3.58 0.02 -1.26 -4.38 114.94 117.29 1vsy s ASN 1041Ca 0.14 0.02 0.03 0.00 -1.02 0.00 0.00 52.86 52.03 1vsy s ASN 1041Cb -0.11 -1.44 -0.03 0.00 0.02 0.00 0.00 41.25 39.69 1vsy s ASN 1041CO 0.04 0.25 -0.09 -0.94 0.02 0.00 0.00 177.10 176.37 1vsy s SER 1042N -1.84 1.07 0.05 -1.22 1.04 -1.06 -2.26 113.70 109.49 1vsy s SER 1042Ca 0.23 -0.56 -0.02 0.00 0.48 0.00 0.00 55.95 56.07 1vsy s SER 1042Cb -0.12 0.01 -0.03 0.00 0.10 0.00 0.00 66.02 65.98 1vsy s SER 1042CO 0.14 -0.17 0.01 -1.48 0.98 0.00 0.00 173.24 172.73 1vsy s LEU 1043N -1.61 2.26 -0.01 2.42 0.05 -0.74 -1.71 118.68 119.34 1vsy s LEU 1043Ca -0.08 -0.87 -0.02 0.00 0.05 0.00 0.00 54.13 53.21 1vsy s LEU 1043Cb -0.10 0.34 -0.00 0.00 -2.05 0.00 0.00 46.19 44.38 1vsy s LEU 1043CO 0.01 -0.58 0.05 0.00 -0.55 0.00 0.00 176.35 175.27 1vsy s ALA 1044N -3.59 -0.10 0.08 1.48 0.00 -0.25 -1.73 121.76 117.66 1vsy s ALA 1044Ca 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 51.90 1vsy s ALA 1044Cb 0.05 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 1vsy s ALA 1044CO -0.09 -0.09 -0.04 0.14 0.00 0.00 0.00 175.76 175.68 1vsy s VAL 1045N -0.61 0.44 -0.05 0.00 -7.23 -0.49 -2.13 120.40 110.33 1vsy s VAL 1045Ca -0.07 -1.87 -0.00 0.00 -1.81 0.00 0.00 61.98 58.23 1vsy s VAL 1045Cb -0.04 -1.62 -0.03 0.00 0.56 0.00 0.00 36.38 35.24 1vsy s VAL 1045CO -0.00 -0.92 0.00 -0.13 -0.31 0.00 0.00 175.10 173.75 1vsy s ARG 1046N -3.89 2.90 0.00 4.82 0.52 -1.24 -2.02 118.95 120.04 1vsy s ARG 1046Ca 0.10 -0.49 0.00 0.00 -0.52 0.00 0.00 55.73 54.82 1vsy s ARG 1046Cb 0.07 -2.74 0.00 0.00 0.52 0.00 0.00 34.95 32.80 1vsy s ARG 1046CO -0.07 0.67 0.00 0.41 0.02 0.00 0.00 175.30 176.33 1vsy n GLY 1047N 1.82 3.09 0.24 -3.53 0.00 0.72 -1.37 105.19 106.16 1vsy n GLY 1047Ca -0.17 -2.17 -0.02 0.00 0.00 0.00 0.00 46.02 43.66 1vsy n GLY 1047CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1vsy h LYS 1048N 0.00 0.46 -0.07 1.61 3.64 -1.58 -3.38 116.57 117.25 1vsy h LYS 1048Ca 0.00 -0.16 -0.21 0.00 -1.27 0.00 0.00 60.65 59.01 1vsy h LYS 1048Cb 0.00 -0.04 -0.17 0.00 -0.41 0.00 0.00 32.23 31.61 1vsy h LYS 1048CO 0.00 0.65 -0.39 -0.40 -2.27 0.00 0.00 179.45 177.03 1vsy n ASP 1049N -4.15 -1.52 -3.86 4.20 5.68 -1.26 -4.86 116.55 110.78 1vsy n ASP 1049Ca -0.00 -2.40 -0.10 0.00 -0.50 0.00 0.00 54.79 51.79 1vsy n ASP 1049Cb 0.38 0.81 -0.05 0.00 -1.14 0.00 0.00 41.12 41.12 1vsy n ASP 1049CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1vsy s THR 1051N -3.83 0.04 -0.02 0.00 2.01 -0.19 -0.20 115.64 113.45 1vsy s THR 1051Ca 0.23 -0.30 0.02 0.00 0.31 0.00 0.00 61.69 61.96 1vsy s THR 1051Cb -0.01 -0.10 0.00 0.00 0.01 0.00 0.00 72.50 72.40 1vsy s THR 1051CO 0.10 -0.16 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.10 1vsy s VAL 1052N -0.48 0.68 -0.11 3.82 1.01 -0.86 -0.69 120.40 123.77 1vsy s VAL 1052Ca -0.05 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.62 1vsy s VAL 1052Cb -0.03 -0.61 0.02 0.00 0.00 0.00 0.00 36.38 35.75 1vsy s VAL 1052CO -0.00 0.22 -0.10 0.68 0.00 0.00 0.00 175.10 175.89 1vsy s VAL 1053N 0.21 1.20 -0.17 2.92 -7.23 -0.26 -1.40 120.40 115.68 1vsy s VAL 1053Ca -0.03 -0.42 -0.06 0.00 -1.81 0.00 0.00 61.98 59.66 1vsy s VAL 1053Cb -0.08 -1.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.66 1vsy s VAL 1053CO 0.00 0.39 0.03 -0.63 -0.31 0.00 0.00 175.10 174.59 1vsy s ILE 1054N 1.46 4.51 0.19 -0.62 1.09 -0.70 -0.42 121.20 126.71 1vsy s ILE 1054Ca 0.01 -0.14 0.07 0.00 -1.10 0.00 0.00 60.65 59.50 1vsy s ILE 1054Cb -0.13 -3.01 -0.05 0.00 -1.06 0.00 0.00 42.46 38.22 1vsy s ILE 1054CO -0.07 0.48 -0.15 -0.55 -0.10 0.00 0.00 174.94 174.56 1vsy s SER 1055N 0.24 2.48 0.41 3.58 0.15 -0.20 -1.80 113.70 118.57 1vsy s SER 1055Ca 0.02 -0.98 -0.20 0.00 0.70 0.00 0.00 55.95 55.49 1vsy s SER 1055Cb -0.13 -0.12 -0.11 0.00 -1.71 0.00 0.00 66.02 63.95 1vsy s SER 1055CO 0.01 -0.16 0.91 -1.10 1.20 0.00 0.00 173.24 174.10 1vsy s GLN 1056N -3.48 4.18 -0.17 5.44 -0.21 -0.96 -0.69 119.66 123.77 1vsy s GLN 1056Ca 0.20 1.03 0.01 0.00 0.02 0.00 0.00 55.36 56.62 1vsy s GLN 1056Cb -0.01 -2.22 0.01 0.00 1.00 0.00 0.00 33.01 31.78 1vsy s GLN 1056CO 0.06 -0.01 -0.18 0.21 -2.12 0.00 0.00 175.29 173.25 1vsy s LYS 1057N -3.18 3.07 -0.23 2.91 2.20 -0.27 -4.70 119.74 119.53 1vsy s LYS 1057Ca 0.60 -0.80 0.02 0.00 -0.36 0.00 0.00 55.97 55.43 1vsy s LYS 1057Cb -0.09 -2.59 0.05 0.00 -1.51 0.00 0.00 37.83 33.69 1vsy s LYS 1057CO 0.15 -0.13 -0.10 0.15 -0.36 0.00 0.00 175.35 175.06 1vsy s LYS 1058N 1.12 2.05 -0.52 4.03 1.02 -1.26 -4.44 119.74 121.74 1vsy s LYS 1058Ca 0.01 -1.10 0.02 0.00 0.02 0.00 0.00 55.97 54.92 1vsy s LYS 1058Cb -0.14 -2.68 0.13 0.00 -0.52 0.00 0.00 37.83 34.62 1vsy s LYS 1058CO -0.07 -0.53 0.28 0.08 -0.92 0.00 0.00 175.35 174.19 1vsy s VAL 1059N 1.26 2.84 -0.14 3.17 1.01 -1.26 -4.96 120.40 122.33 1vsy s VAL 1059Ca -0.06 -3.09 -0.28 0.00 0.00 0.00 0.00 61.98 58.56 1vsy s VAL 1059Cb -0.18 -2.95 -0.25 0.00 0.00 0.00 0.00 36.38 33.00 1vsy s VAL 1059CO -0.07 -0.79 0.73 -0.65 0.00 0.00 0.00 175.10 174.32 1vsy h PRO 1060N 6.80 0.00 -6.38 2.72 0.11 -2.02 -3.45 132.00 129.78 1vsy h PRO 1060Ca -0.06 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.51 1vsy h PRO 1060Cb 0.92 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.04 1vsy h PRO 1060CO 0.68 0.95 1.00 0.34 -0.21 0.00 0.00 178.00 180.76 1vsy s ASP 1061N -6.19 6.66 0.41 -2.05 -1.08 -1.26 -4.88 116.67 108.28 1vsy s ASP 1061Ca -0.18 2.36 0.29 0.00 -0.52 0.00 0.00 52.55 54.49 1vsy s ASP 1061Cb -0.03 -2.55 1.17 0.00 -1.46 0.00 0.00 42.92 40.05 1vsy s ASP 1061CO 0.66 -0.87 1.85 0.11 0.52 0.00 0.00 175.17 177.43 1vsy h LYS 1062N 8.64 0.00 0.00 4.34 1.57 -2.05 -2.50 116.57 126.57 1vsy h LYS 1062Ca -0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1vsy h LYS 1062Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1vsy h LYS 1062CO 0.93 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 181.09 1vsy n LEU 1063N -2.69 0.49 -4.77 2.94 4.77 -1.26 -4.88 117.00 111.60 1vsy n LEU 1063Ca 0.01 0.57 -0.30 0.00 -0.03 0.00 0.00 56.01 56.26 1vsy n LEU 1063Cb 0.28 -0.45 0.10 0.00 -2.33 0.00 0.00 43.42 41.02 1vsy n LEU 1063CO 0.24 -0.25 0.70 -0.76 -1.33 0.00 0.00 177.39 175.98 1vsy s LEU 1064N -3.98 2.67 -0.41 2.23 1.43 -0.94 -5.03 118.68 114.64 1vsy s LEU 1064Ca 0.09 1.52 0.03 0.00 -1.03 0.00 0.00 54.13 54.75 1vsy s LEU 1064Cb 0.13 -4.13 0.11 0.00 0.03 0.00 0.00 46.19 42.32 1vsy s LEU 1064CO 0.48 -2.10 0.14 -0.62 0.23 0.00 0.00 176.35 174.48 1vsy s ASP 1065N -3.63 4.65 0.50 2.29 2.15 -1.26 -5.00 116.67 116.37 1vsy s ASP 1065Ca 0.61 -2.46 0.40 0.00 0.43 0.00 0.00 52.55 51.53 1vsy s ASP 1065Cb -0.16 -1.65 1.60 0.00 -0.30 0.00 0.00 42.92 42.41 1vsy s ASP 1065CO 0.56 -0.34 1.59 -0.65 -0.17 0.00 0.00 175.17 176.16 1vsy h PRO 1066N 7.24 0.01 0.00 4.34 0.11 -1.96 0.24 132.00 141.98 1vsy h PRO 1066Ca -0.06 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 1vsy h PRO 1066Cb 0.98 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 1vsy h PRO 1066CO 0.59 0.01 -0.02 1.79 -0.21 0.00 0.00 178.00 180.16 1vsy h THR 1067N 0.01 0.07 -0.01 -1.15 1.35 -2.04 -2.34 112.91 108.81 1vsy h THR 1067Ca 0.89 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 66.43 1vsy h THR 1067Cb 3.21 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 70.93 1vsy h THR 1067CO -0.25 0.02 -0.65 0.35 -0.25 0.00 0.00 175.52 174.73 1vsy n THR 1068N -3.15 0.00 -3.18 6.82 -2.24 0.83 -4.83 114.28 108.52 1vsy n THR 1068Ca -0.01 -0.14 -0.45 0.00 -2.27 0.00 0.00 64.05 61.18 1vsy n THR 1068Cb 0.21 1.04 -0.05 0.00 -2.10 0.00 0.00 70.33 69.43 1vsy n THR 1068CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1vsy s VAL 1069N -2.70 4.95 -0.09 2.28 1.01 -0.88 -5.01 120.40 119.95 1vsy s VAL 1069Ca 0.15 -1.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.02 1vsy s VAL 1069Cb 0.17 -4.41 0.04 0.00 0.00 0.00 0.00 36.38 32.19 1vsy s VAL 1069CO 0.68 -0.99 0.20 -0.55 0.00 0.00 0.00 175.10 174.44 1vsy s SER 1070N 3.45 -0.08 0.00 3.32 0.15 -1.26 -4.98 113.70 114.30 1vsy s SER 1070Ca 0.09 0.42 0.16 0.00 0.70 0.00 0.00 55.95 57.32 1vsy s SER 1070Cb -0.25 0.32 0.34 0.00 -1.71 0.00 0.00 66.02 64.72 1vsy s SER 1070CO 0.06 -0.17 1.25 -1.22 1.20 0.00 0.00 173.24 174.36 1vsy n TYR 1071N 4.38 0.45 -3.69 3.44 4.02 -1.26 -4.92 117.16 119.59 1vsy n TYR 1071Ca -0.23 -0.34 -0.37 0.00 -0.01 0.00 0.00 57.90 56.95 1vsy n TYR 1071Cb 0.52 -0.01 -0.12 0.00 -0.02 0.00 0.00 39.34 39.71 1vsy n TYR 1071CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1vsy s ILE 1072N -1.11 4.69 -0.06 -0.72 -1.09 -1.26 -1.49 121.20 120.16 1vsy s ILE 1072Ca 0.29 -0.08 0.03 0.00 -2.23 0.00 0.00 60.65 58.66 1vsy s ILE 1072Cb 0.16 -3.23 -0.03 0.00 -1.58 0.00 0.00 42.46 37.78 1vsy s ILE 1072CO 0.22 0.28 -0.13 -0.36 -1.23 0.00 0.00 174.94 173.72 1vsy s PHE 1073N 1.67 2.76 -0.42 3.97 0.40 0.13 -5.00 117.98 121.49 1vsy s PHE 1073Ca 0.06 -0.15 -0.21 0.00 -0.60 0.00 0.00 56.93 56.04 1vsy s PHE 1073Cb -0.16 -1.66 0.02 0.00 0.51 0.00 0.00 43.02 41.73 1vsy s PHE 1073CO 0.06 0.20 0.64 0.00 0.70 0.00 0.00 175.22 176.82 1vsy h ILE 1075N 5.84 0.83 -2.41 0.00 1.08 -1.56 -3.49 117.51 117.79 1vsy h ILE 1075Ca -0.26 -2.59 -0.04 0.00 -0.39 0.00 0.00 64.86 61.58 1vsy h ILE 1075Cb 1.10 2.52 -0.01 0.00 -3.07 0.00 0.00 36.82 37.36 1vsy h ILE 1075CO 0.88 0.71 0.01 -1.54 -0.69 0.00 0.00 178.15 177.53 1vsy n SER 1076N -3.29 -0.48 -0.22 1.72 3.41 -0.97 -4.55 113.62 109.24 1vsy n SER 1076Ca -0.22 -1.47 -0.04 0.00 -0.26 0.00 0.00 58.87 56.87 1vsy n SER 1076Cb 1.05 0.84 0.07 0.00 -0.26 0.00 0.00 64.21 65.91 1vsy n SER 1076CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1vsy h ARG 1077N 0.00 0.74 0.00 4.33 9.65 -1.94 -3.31 114.38 123.84 1vsy h ARG 1077Ca -0.08 -0.04 -0.31 0.00 -1.10 0.00 0.00 59.98 58.45 1vsy h ARG 1077Cb 0.33 -0.17 -0.06 0.00 -1.39 0.00 0.00 29.97 28.68 1vsy h ARG 1077CO 0.11 0.49 -2.03 0.25 2.80 0.00 0.00 179.97 181.58 1vsy n THR 1078N -4.72 1.41 -4.43 0.20 -2.24 -1.26 -0.48 114.28 102.75 1vsy n THR 1078Ca 0.06 -0.81 -0.34 0.00 -2.27 0.00 0.00 64.05 60.70 1vsy n THR 1078Cb 0.09 -0.69 -0.12 0.00 -2.10 0.00 0.00 70.33 67.50 1vsy n THR 1078CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1vsy s ILE 1079N -2.61 3.77 0.20 2.28 1.01 -1.25 -4.23 121.20 120.38 1vsy s ILE 1079Ca -0.07 -0.40 0.10 0.00 0.00 0.00 0.00 60.65 60.28 1vsy s ILE 1079Cb 0.07 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 1vsy s ILE 1079CO 0.83 0.49 -0.15 -0.83 0.00 0.00 0.00 174.94 175.29 1vsy s GLY 1080N 0.40 1.73 -0.03 6.18 0.00 0.25 -1.34 107.32 114.51 1vsy s GLY 1080Ca -0.05 -1.59 -0.01 0.00 0.00 0.00 0.00 44.72 43.07 1vsy s GLY 1080CO 0.03 -1.62 0.07 -0.29 0.00 0.00 0.00 173.10 171.29 1vsy s MET 1081N -2.92 0.04 -0.07 2.90 1.75 -0.32 -0.68 119.30 119.99 1vsy s MET 1081Ca 0.25 0.20 0.05 0.00 -1.25 0.00 0.00 55.69 54.93 1vsy s MET 1081Cb -0.08 -0.13 -0.00 0.00 2.84 0.00 0.00 34.83 37.46 1vsy s MET 1081CO 0.14 -0.11 -0.22 0.54 -0.65 0.00 0.00 175.02 174.72 1vsy s VAL 1082N 0.71 1.84 -0.07 10.11 0.11 -0.36 0.22 120.40 132.97 1vsy s VAL 1082Ca -0.06 -0.93 0.01 0.00 -2.93 0.00 0.00 61.98 58.07 1vsy s VAL 1082Cb -0.08 -1.58 -0.03 0.00 -1.53 0.00 0.00 36.38 33.16 1vsy s VAL 1082CO -0.03 0.52 -0.08 -0.69 -3.33 0.00 0.00 175.10 171.49 1vsy s VAL 1083N 0.08 3.60 -0.29 2.04 1.01 -0.56 -1.22 120.40 125.06 1vsy s VAL 1083Ca -0.09 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.31 1vsy s VAL 1083Cb -0.15 -2.46 0.01 0.00 0.00 0.00 0.00 36.38 33.78 1vsy s VAL 1083CO 0.05 0.60 0.08 0.20 0.00 0.00 0.00 175.10 176.02 1vsy s ASN 1084N -0.77 5.11 0.00 3.32 -0.87 -1.05 -4.89 114.94 115.78 1vsy s ASN 1084Ca 0.12 -0.70 0.00 0.00 -1.57 0.00 0.00 52.86 50.71 1vsy s ASN 1084Cb -0.11 -1.88 0.00 0.00 -0.02 0.00 0.00 41.25 39.24 1vsy s ASN 1084CO 0.01 -0.19 0.00 0.61 -2.57 0.00 0.00 177.10 174.97 1vsy n GLY 1085N 4.86 2.58 3.61 0.66 0.00 -1.21 -2.05 105.19 113.64 1vsy n GLY 1085Ca -0.15 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 1vsy n GLY 1085CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1vsy n PRO 1086N -1.48 1.41 -0.29 1.61 -0.02 -1.26 -4.78 135.00 130.19 1vsy n PRO 1086Ca 0.00 0.50 -0.02 0.00 -2.02 0.00 0.00 63.50 61.96 1vsy n PRO 1086Cb 0.00 -2.04 0.10 0.00 -0.02 0.00 0.00 33.50 31.55 1vsy n PRO 1086CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1vsy h ILE 1087N 1.66 1.11 -0.50 4.25 6.09 -1.99 -2.74 117.51 125.39 1vsy h ILE 1087Ca -0.44 -0.34 0.09 0.00 -1.37 0.00 0.00 64.86 62.79 1vsy h ILE 1087Cb 1.33 0.03 -0.07 0.00 0.47 0.00 0.00 36.82 38.58 1vsy h ILE 1087CO 0.58 0.18 0.10 -0.65 -3.07 0.00 0.00 178.15 175.29 1vsy h PRO 1088N 1.00 0.23 -0.29 2.19 0.11 -2.01 -1.58 132.00 131.64 1vsy h PRO 1088Ca 0.33 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.31 1vsy h PRO 1088Cb 0.03 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 1vsy h PRO 1088CO -0.12 0.15 -0.32 -0.44 -0.21 0.00 0.00 178.00 177.06 1vsy h ASP 1089N 0.23 0.63 -0.06 -2.05 3.32 -1.88 -2.62 116.42 113.99 1vsy h ASP 1089Ca 0.25 -0.25 0.02 0.00 0.02 0.00 0.00 57.03 57.08 1vsy h ASP 1089Cb 0.34 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1vsy h ASP 1089CO -0.33 0.91 -0.08 0.00 -1.72 0.00 0.00 179.24 178.01 1vsy h ALA 1090N 1.13 -0.04 -0.85 3.45 0.00 -1.02 -2.24 119.26 119.70 1vsy h ALA 1090Ca 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1vsy h ALA 1090Cb 0.80 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 1vsy h ALA 1090CO 0.07 -0.56 0.49 0.00 0.00 0.00 0.00 179.25 179.25 1vsy h ARG 1091N -0.12 1.16 -0.73 0.00 3.08 -1.36 0.18 114.38 116.59 1vsy h ARG 1091Ca 0.05 -0.12 0.14 0.00 0.07 0.00 0.00 59.98 60.12 1vsy h ARG 1091Cb 0.19 -0.24 -0.05 0.00 0.08 0.00 0.00 29.97 29.96 1vsy h ARG 1091CO -0.13 0.83 0.49 -0.97 -1.07 0.00 0.00 179.97 179.13 1vsy h ASN 1092N 1.17 0.41 0.12 7.04 -1.24 -1.17 0.18 115.58 122.09 1vsy h ASN 1092Ca 0.30 0.02 -0.23 0.00 0.71 0.00 0.00 56.30 57.10 1vsy h ASN 1092Cb -0.01 -0.06 0.01 0.00 0.73 0.00 0.00 38.32 38.98 1vsy h ASN 1092CO -0.05 0.22 -1.13 0.00 -1.29 0.00 0.00 177.43 175.18 1vsy h ALA 1093N 1.65 0.07 -0.07 1.57 0.00 -0.75 -3.12 119.26 118.61 1vsy h ALA 1093Ca 0.36 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1vsy h ALA 1093Cb 0.76 0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1vsy h ALA 1093CO -0.12 0.62 0.05 0.00 0.00 0.00 0.00 179.25 179.80 1vsy h ALA 1094N -0.01 0.09 -0.76 0.00 0.00 -0.40 0.38 119.26 118.56 1vsy h ALA 1094Ca -0.23 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.76 1vsy h ALA 1094Cb 1.67 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 19.36 1vsy h ALA 1094CO 0.08 -0.41 0.40 1.25 0.00 0.00 0.00 179.25 180.57 1vsy h LEU 1095N 0.09 0.54 -1.07 0.00 5.85 -0.80 0.20 115.31 120.12 1vsy h LEU 1095Ca 0.03 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 1vsy h LEU 1095Cb 0.00 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1vsy h LEU 1095CO -0.01 0.31 -0.34 -0.09 -0.34 0.00 0.00 178.44 177.97 1vsy h ARG 1096N 0.67 0.22 0.13 1.25 9.65 -1.37 -3.02 114.38 121.91 1vsy h ARG 1096Ca 0.37 -0.09 -0.28 0.00 -1.10 0.00 0.00 59.98 58.88 1vsy h ARG 1096Cb 0.38 -0.01 0.03 0.00 -1.39 0.00 0.00 29.97 28.98 1vsy h ARG 1096CO -0.26 0.55 -1.18 0.00 2.80 0.00 0.00 179.97 181.87 1vsy h ALA 1097N 1.45 -0.03 0.00 2.80 0.00 -0.13 -2.10 119.26 121.25 1vsy h ALA 1097Ca 0.02 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1vsy h ALA 1097Cb 0.70 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1vsy h ALA 1097CO 0.05 0.63 0.25 0.87 0.00 0.00 0.00 179.25 181.05 1vsy h LYS 1098N 0.17 0.00 0.00 0.00 1.57 -0.58 -1.99 116.57 115.73 1vsy h LYS 1098Ca -0.18 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 1vsy h LYS 1098Cb 1.87 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.18 1vsy h LYS 1098CO 0.23 0.00 -1.53 0.00 -0.57 0.00 0.00 179.45 177.58 1vsy n ALA 1099N -1.85 2.40 0.41 3.86 0.00 -1.15 -3.54 120.51 120.64 1vsy n ALA 1099Ca -0.02 -0.28 0.12 0.00 0.00 0.00 0.00 53.44 53.26 1vsy n ALA 1099Cb 0.29 -0.38 0.26 0.00 0.00 0.00 0.00 19.45 19.62 1vsy n ALA 1099CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1vsy h GLU 1100N 0.00 0.00 0.00 0.00 4.39 -0.65 -2.71 114.58 115.61 1vsy h GLU 1100Ca -0.01 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 1vsy h GLU 1100Cb 0.55 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 1vsy h GLU 1100CO 0.00 0.00 -1.81 0.00 -1.16 0.00 0.00 179.01 176.04 1vsy n ALA 1101N -1.95 2.47 0.01 3.43 0.00 -0.97 -1.95 120.51 121.54 1vsy n ALA 1101Ca 0.04 -0.49 -0.18 0.00 0.00 0.00 0.00 53.44 52.81 1vsy n ALA 1101Cb 0.48 -0.50 -0.13 0.00 0.00 0.00 0.00 19.45 19.30 1vsy n ALA 1101CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vsy h ALA 1102N 1.42 -0.01 -0.82 0.00 0.00 -1.65 -2.98 119.26 115.22 1vsy h ALA 1102Ca -0.06 -0.60 0.01 0.00 0.00 0.00 0.00 54.91 54.26 1vsy h ALA 1102Cb 0.95 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 1vsy h ALA 1102CO 0.00 0.28 0.54 1.49 0.00 0.00 0.00 179.25 181.57 1vsy h GLU 1103N -0.37 1.08 -0.56 0.00 4.81 -1.61 -2.44 114.58 115.49 1vsy h GLU 1103Ca -0.09 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.07 1vsy h GLU 1103Cb 1.37 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 30.48 1vsy h GLU 1103CO 0.11 0.71 0.31 0.35 -0.73 0.00 0.00 179.01 179.76 1vsy h PHE 1104N 1.11 0.76 -0.70 0.92 3.04 -1.47 -0.75 116.94 119.86 1vsy h PHE 1104Ca 0.30 -0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.25 1vsy h PHE 1104Cb -0.12 -0.24 -0.04 0.00 2.56 0.00 0.00 35.95 38.11 1vsy h PHE 1104CO -0.02 0.55 0.46 -0.09 -2.02 0.00 0.00 178.31 177.19 1vsy h ARG 1105N 0.75 0.90 -0.21 1.11 9.65 -1.35 -2.01 114.38 123.22 1vsy h ARG 1105Ca 0.20 -0.05 -0.09 0.00 -1.10 0.00 0.00 59.98 58.93 1vsy h ARG 1105Cb 0.03 -0.20 -0.00 0.00 -1.39 0.00 0.00 29.97 28.41 1vsy h ARG 1105CO -0.03 0.60 -0.22 -0.92 2.80 0.00 0.00 179.97 182.20 1vsy h TYR 1106N 0.93 0.63 -0.28 2.20 3.20 -1.03 -1.21 116.97 121.41 1vsy h TYR 1106Ca 0.26 -0.19 -0.18 0.00 3.14 0.00 0.00 58.73 61.76 1vsy h TYR 1106Cb -0.09 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.05 1vsy h TYR 1106CO -0.03 0.87 -0.51 0.87 -1.64 0.00 0.00 178.16 177.72 1vsy h LYS 1107N 0.20 0.84 0.00 1.82 1.57 -1.12 -3.38 116.57 116.50 1vsy h LYS 1107Ca 0.03 -0.53 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1vsy h LYS 1107Cb 0.77 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1vsy h LYS 1107CO 0.05 1.16 -0.71 0.66 -0.57 0.00 0.00 179.45 180.05 1vsy n TYR 1108N -4.06 0.00 -0.05 -1.35 4.01 -0.76 -5.04 117.16 109.92 1vsy n TYR 1108Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1vsy n TYR 1108Cb 0.61 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.59 1vsy n TYR 1108CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vsy n GLY 1109N 1.39 1.43 3.45 2.72 0.00 -0.46 -5.04 105.19 108.67 1vsy n GLY 1109Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1vsy n GLY 1109CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1vsy s TYR 1110N -2.55 2.14 0.57 1.61 1.13 -1.26 -5.03 117.35 113.96 1vsy s TYR 1110Ca 0.00 -0.44 -0.20 0.00 -1.41 0.00 0.00 57.07 55.02 1vsy s TYR 1110Cb 0.00 -1.00 -0.05 0.00 -1.10 0.00 0.00 41.96 39.81 1vsy s TYR 1110CO 0.00 0.58 1.15 -0.25 -2.51 0.00 0.00 175.55 174.52 1vsy n ASP 1111N -0.58 1.68 -4.68 -0.18 8.00 -1.26 -3.95 116.55 115.57 1vsy n ASP 1111Ca -0.06 0.89 -0.43 0.00 0.71 0.00 0.00 54.79 55.91 1vsy n ASP 1111Cb 0.61 -1.47 -0.02 0.00 -0.02 0.00 0.00 41.12 40.21 1vsy n ASP 1111CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1vsy s MET 1112N -2.81 4.32 0.33 -1.24 1.75 -1.26 -4.92 119.30 115.47 1vsy s MET 1112Ca 0.74 1.57 -0.27 0.00 -1.25 0.00 0.00 55.69 56.48 1vsy s MET 1112Cb -0.43 -3.63 -0.09 0.00 2.84 0.00 0.00 34.83 33.52 1vsy s MET 1112CO 0.48 -0.52 1.11 -1.25 -0.65 0.00 0.00 175.02 174.18 1vsy s PRO 1113N 2.69 4.41 0.19 4.11 0.04 -1.26 -4.87 135.00 140.31 1vsy s PRO 1113Ca 0.52 1.76 -0.15 0.00 0.04 0.00 0.00 61.00 63.18 1vsy s PRO 1113Cb -0.21 -2.94 0.18 0.00 0.04 0.00 0.00 34.50 31.56 1vsy s PRO 1113CO 0.17 0.02 1.64 0.00 0.04 0.00 0.00 177.00 178.87 1vsy h ASP 1115N 0.00 0.00 -0.05 0.00 2.03 -1.97 -2.44 116.42 113.99 1vsy h ASP 1115Ca 0.26 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 56.37 1vsy h ASP 1115Cb 0.39 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.90 1vsy h ASP 1115CO -0.55 0.22 -0.71 0.58 -1.03 0.00 0.00 179.24 177.75 1vsy h VAL 1116N 0.00 1.35 -0.96 4.15 2.07 -1.75 -2.01 116.25 119.11 1vsy h VAL 1116Ca -0.00 -2.03 0.06 0.00 0.82 0.00 0.00 66.70 65.54 1vsy h VAL 1116Cb 0.73 2.34 -0.06 0.00 -1.52 0.00 0.00 31.29 32.78 1vsy h VAL 1116CO 0.03 0.61 0.63 0.25 0.02 0.00 0.00 177.57 179.11 1vsy h LEU 1117N 0.17 1.00 -0.14 2.57 5.85 -1.29 -1.33 115.31 122.13 1vsy h LEU 1117Ca -0.07 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 1vsy h LEU 1117Cb 1.38 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 1vsy h LEU 1117CO 0.14 0.65 -0.06 0.00 -0.34 0.00 0.00 178.44 178.83 1vsy h ALA 1118N 1.47 0.20 -0.78 1.25 0.00 -1.40 -1.66 119.26 118.34 1vsy h ALA 1118Ca 0.41 -0.26 0.12 0.00 0.00 0.00 0.00 54.91 55.18 1vsy h ALA 1118Cb 0.15 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1vsy h ALA 1118CO -0.15 -0.01 0.51 -0.22 0.00 0.00 0.00 179.25 179.37 1vsy h LYS 1119N -0.04 0.58 0.00 0.00 3.64 -1.08 0.42 116.57 120.09 1vsy h LYS 1119Ca 0.03 -0.04 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 1vsy h LYS 1119Cb 0.52 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1vsy h LYS 1119CO 0.02 0.39 -0.80 -0.09 -2.27 0.00 0.00 179.45 176.69 1vsy h ARG 1120N 0.60 0.00 0.00 1.90 9.65 -0.91 -0.03 114.38 125.59 1vsy h ARG 1120Ca 0.37 0.00 -0.21 0.00 -1.10 0.00 0.00 59.98 59.04 1vsy h ARG 1120Cb 0.61 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.16 1vsy h ARG 1120CO -0.14 0.80 -1.16 0.52 2.80 0.00 0.00 179.97 182.79 1vsy h MET 1121N 0.00 0.00 -0.19 0.20 2.86 -0.81 -2.38 114.93 114.61 1vsy h MET 1121Ca -0.01 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.43 1vsy h MET 1121Cb 1.47 0.00 0.01 0.00 0.06 0.00 0.00 31.60 33.13 1vsy h MET 1121CO 0.10 0.69 -0.65 0.00 1.06 0.00 0.00 176.91 178.11 1vsy h ALA 1122N 1.14 0.34 -0.36 6.32 0.00 -0.91 0.47 119.26 126.26 1vsy h ALA 1122Ca -0.10 -0.55 0.05 0.00 0.00 0.00 0.00 54.91 54.30 1vsy h ALA 1122Cb 1.75 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.46 1vsy h ALA 1122CO 0.09 0.62 0.09 -0.91 0.00 0.00 0.00 179.25 179.15 1vsy h ASN 1123N 0.51 0.05 0.32 0.00 -0.26 -1.06 0.54 115.58 115.68 1vsy h ASN 1123Ca -0.03 0.05 -0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1vsy h ASN 1123Cb 1.28 0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 38.58 1vsy h ASN 1123CO 0.14 0.06 -0.29 -0.07 -1.06 0.00 0.00 177.43 176.21 1vsy h LEU 1124N 0.22 -0.76 -1.94 1.61 4.07 -1.26 -1.92 115.31 115.33 1vsy h LEU 1124Ca 0.17 0.06 0.07 0.00 0.08 0.00 0.00 57.88 58.26 1vsy h LEU 1124Cb 0.18 0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 1vsy h LEU 1124CO -0.21 -0.42 0.42 0.28 -1.08 0.00 0.00 178.44 177.43 1vsy h SER 1125N -0.63 0.00 0.01 -0.43 0.02 0.35 -0.69 113.55 112.18 1vsy h SER 1125Ca -0.02 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.71 1vsy h SER 1125Cb 0.56 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.12 1vsy h SER 1125CO -0.04 0.00 -0.87 -0.61 -1.14 0.00 0.00 176.83 174.17 1vsy h GLN 1126N 0.00 0.57 -0.70 3.45 -0.00 -0.11 -3.25 115.11 115.07 1vsy h GLN 1126Ca 0.12 -0.63 0.05 0.00 -0.00 0.00 0.00 58.65 58.19 1vsy h GLN 1126Cb 0.95 0.18 -0.05 0.00 0.00 0.00 0.00 27.48 28.56 1vsy h GLN 1126CO -0.00 1.24 0.41 0.82 0.00 0.00 0.00 178.83 181.30 1vsy h ILE 1127N 0.16 1.01 -0.43 2.39 5.03 -0.73 0.48 117.51 125.43 1vsy h ILE 1127Ca -0.11 -0.27 0.13 0.00 -0.12 0.00 0.00 64.86 64.49 1vsy h ILE 1127Cb 1.55 0.17 -0.02 0.00 -3.03 0.00 0.00 36.82 35.50 1vsy h ILE 1127CO 0.17 0.14 0.31 1.88 -0.68 0.00 0.00 178.15 179.97 1vsy h TYR 1128N 0.78 0.00 0.00 1.37 0.05 -1.62 0.64 116.97 118.18 1vsy h TYR 1128Ca 0.31 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.09 1vsy h TYR 1128Cb 0.14 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.88 1vsy h TYR 1128CO -0.06 0.00 0.00 2.41 -1.05 0.00 0.00 178.16 179.46 1vsy n THR 1129N -4.40 0.08 -0.18 -2.88 -1.04 0.14 -3.88 114.28 102.13 1vsy n THR 1129Ca 0.07 0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1vsy n THR 1129Cb 0.51 -0.55 0.00 0.00 -1.82 0.00 0.00 70.33 68.47 1vsy n THR 1129CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1vsy n GLN 1130N -1.33 0.66 -4.27 -2.82 7.27 -0.01 -4.86 117.38 112.02 1vsy n GLN 1130Ca 0.12 -0.01 -0.34 0.00 0.07 0.00 0.00 57.00 56.83 1vsy n GLN 1130Cb 0.25 -0.16 -0.11 0.00 2.41 0.00 0.00 30.24 32.63 1vsy n GLN 1130CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1vsy s ARG 1131N -0.10 3.58 0.11 3.69 0.52 0.01 -5.02 118.95 121.74 1vsy s ARG 1131Ca 0.00 -0.43 -0.26 0.00 -0.52 0.00 0.00 55.73 54.52 1vsy s ARG 1131Cb 0.00 -2.97 -0.07 0.00 0.52 0.00 0.00 34.95 32.42 1vsy s ARG 1131CO 0.00 0.38 1.65 0.00 0.02 0.00 0.00 175.30 177.35 1vsy h ALA 1132N 6.26 -0.33 0.00 2.13 0.00 -1.88 -3.29 119.26 122.15 1vsy h ALA 1132Ca -0.38 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.40 1vsy h ALA 1132Cb 1.18 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 1vsy h ALA 1132CO 0.63 -0.74 -0.56 0.10 0.00 0.00 0.00 179.25 178.68 1vsy h TYR 1133N -0.38 0.00 -2.78 0.00 -0.00 -1.95 -3.39 116.97 108.47 1vsy h TYR 1133Ca 0.04 0.00 -0.65 0.00 -0.00 0.00 0.00 58.73 58.13 1vsy h TYR 1133Cb 0.43 0.00 -0.06 0.00 -0.00 0.00 0.00 36.73 37.10 1vsy h TYR 1133CO -0.23 0.54 -0.41 0.00 -0.00 0.00 0.00 178.16 178.05 1vsy s MET 1134N -2.94 3.56 0.02 0.10 0.23 -1.24 -5.10 119.30 113.92 1vsy s MET 1134Ca 0.04 -0.03 -0.02 0.00 -1.03 0.00 0.00 55.69 54.65 1vsy s MET 1134Cb 0.08 -3.17 -0.04 0.00 -1.53 0.00 0.00 34.83 30.17 1vsy s MET 1134CO 0.75 0.73 0.18 -0.98 -2.03 0.00 0.00 175.02 173.68 1vsy s ARG 1135N -1.26 3.41 1.10 3.16 1.70 -1.26 -4.76 118.95 121.05 1vsy s ARG 1135Ca 0.20 -0.38 -0.14 0.00 -0.47 0.00 0.00 55.73 54.94 1vsy s ARG 1135Cb -0.13 -3.06 0.24 0.00 -0.57 0.00 0.00 34.95 31.43 1vsy s ARG 1135CO 0.09 0.65 1.07 -2.14 -1.08 0.00 0.00 175.30 173.89 1vsy s PRO 1136N -2.14 -0.40 0.01 3.89 0.02 -1.26 -4.92 135.00 130.20 1vsy s PRO 1136Ca 0.30 0.46 -0.01 0.00 0.02 0.00 0.00 61.00 61.77 1vsy s PRO 1136Cb -0.13 -1.65 -0.04 0.00 0.02 0.00 0.00 34.50 32.71 1vsy s PRO 1136CO 0.22 -3.28 0.12 -0.51 -0.33 0.00 0.00 177.00 173.23 1vsy s LEU 1137N -6.81 4.08 -0.43 -5.54 1.43 -1.26 -4.98 118.68 105.16 1vsy s LEU 1137Ca 0.67 0.21 -0.07 0.00 -1.03 0.00 0.00 54.13 53.91 1vsy s LEU 1137Cb -0.19 -2.46 -0.18 0.00 0.03 0.00 0.00 46.19 43.39 1vsy s LEU 1137CO 0.59 0.25 3.34 0.61 0.23 0.00 0.00 176.35 181.38 1vsy n GLY 1138N 0.96 3.50 3.06 -3.19 0.00 -1.26 -4.58 105.19 103.67 1vsy n GLY 1138Ca -0.11 -1.38 -0.14 0.00 0.00 0.00 0.00 46.02 44.39 1vsy n GLY 1138CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vsy s VAL 1139N 0.75 0.56 -0.26 1.61 -7.23 -1.26 -3.70 120.40 110.87 1vsy s VAL 1139Ca 0.66 -0.98 0.02 0.00 -1.81 0.00 0.00 61.98 59.87 1vsy s VAL 1139Cb 0.29 -0.60 0.07 0.00 0.56 0.00 0.00 36.38 36.70 1vsy s VAL 1139CO -0.04 -0.31 -0.07 -0.63 -0.31 0.00 0.00 175.10 173.74 1vsy s ILE 1140N -1.21 1.97 -0.32 -0.62 1.01 -0.87 -3.95 121.20 117.21 1vsy s ILE 1140Ca -0.08 -1.59 -0.22 0.00 0.00 0.00 0.00 60.65 58.76 1vsy s ILE 1140Cb -0.09 -2.17 -0.00 0.00 0.01 0.00 0.00 42.46 40.21 1vsy s ILE 1140CO 0.00 -0.13 0.74 -0.76 0.00 0.00 0.00 174.94 174.80 1vsy s LEU 1141N 1.18 4.12 -0.38 2.97 1.43 -0.92 -2.54 118.68 124.53 1vsy s LEU 1141Ca -0.06 0.54 -0.13 0.00 -1.03 0.00 0.00 54.13 53.45 1vsy s LEU 1141Cb -0.20 -2.99 0.01 0.00 0.03 0.00 0.00 46.19 43.05 1vsy s LEU 1141CO -0.06 -0.59 0.25 -0.89 0.23 0.00 0.00 176.35 175.29 1vsy s THR 1142N 2.87 5.04 -0.13 5.49 2.01 -0.36 -1.29 115.64 129.27 1vsy s THR 1142Ca 0.30 -0.58 -0.10 0.00 0.31 0.00 0.00 61.69 61.61 1vsy s THR 1142Cb -0.14 -3.74 -0.05 0.00 0.01 0.00 0.00 72.50 68.58 1vsy s THR 1142CO 0.13 -0.19 0.21 -0.36 -0.69 0.00 0.00 174.62 173.72 1vsy s PHE 1143N 1.65 3.54 0.10 4.92 0.08 0.10 -1.22 117.98 127.16 1vsy s PHE 1143Ca 0.05 0.56 0.05 0.00 0.12 0.00 0.00 56.93 57.70 1vsy s PHE 1143Cb -0.18 -2.13 -0.04 0.00 -0.57 0.00 0.00 43.02 40.10 1vsy s PHE 1143CO 0.09 0.51 -0.12 0.14 -0.10 0.00 0.00 175.22 175.73 1vsy s VAL 1144N -0.37 1.12 0.09 -0.44 -7.23 0.14 -0.73 120.40 112.98 1vsy s VAL 1144Ca 0.15 -1.62 -0.15 0.00 -1.81 0.00 0.00 61.98 58.54 1vsy s VAL 1144Cb -0.13 -1.38 0.05 0.00 0.56 0.00 0.00 36.38 35.48 1vsy s VAL 1144CO 0.04 -0.46 0.71 -1.54 -0.31 0.00 0.00 175.10 173.55 1vsy n SER 1145N 0.65 -1.05 -2.85 4.85 3.41 -1.09 -0.58 113.62 116.95 1vsy n SER 1145Ca -0.16 -1.49 -0.26 0.00 -0.26 0.00 0.00 58.87 56.70 1vsy n SER 1145Cb 0.57 1.69 -0.03 0.00 -0.26 0.00 0.00 64.21 66.18 1vsy n SER 1145CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1vsy n VAL 1146N -0.51 2.54 -1.55 -3.33 0.31 -1.26 -1.54 118.33 112.99 1vsy n VAL 1146Ca -0.00 -5.26 -0.47 0.00 -0.01 0.00 0.00 64.34 58.59 1vsy n VAL 1146Cb 0.38 -1.19 -0.03 0.00 -0.91 0.00 0.00 33.84 32.09 1vsy n VAL 1146CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1vsy n ASP 1147N -0.24 0.87 0.31 4.52 2.03 -0.58 -4.69 116.55 118.75 1vsy n ASP 1147Ca 0.31 1.16 0.17 0.00 0.52 0.00 0.00 54.79 56.95 1vsy n ASP 1147Cb 0.49 -1.19 0.98 0.00 -0.72 0.00 0.00 41.12 40.68 1vsy n ASP 1147CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1vsy h GLU 1148N 2.44 0.00 0.01 -0.67 4.11 -1.99 -1.66 114.58 116.82 1vsy h GLU 1148Ca -0.40 0.00 -0.39 0.00 0.07 0.00 0.00 59.36 58.64 1vsy h GLU 1148Cb 1.36 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.54 1vsy h GLU 1148CO 0.64 0.01 -2.44 0.39 0.07 0.00 0.00 179.01 177.68 1vsy n GLU 1149N -3.62 0.65 0.04 1.06 1.02 -1.26 -4.74 120.64 113.79 1vsy n GLU 1149Ca -0.03 0.17 0.11 0.00 -0.02 0.00 0.00 57.16 57.40 1vsy n GLU 1149Cb 0.10 -1.53 -0.08 0.00 -0.02 0.00 0.00 31.44 29.90 1vsy n GLU 1149CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1vsy n LEU 1150N -3.37 0.41 0.00 -4.62 4.77 -1.15 -5.09 117.00 107.94 1vsy n LEU 1150Ca -0.46 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 1vsy n LEU 1150Cb 0.98 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 42.04 1vsy n LEU 1150CO 0.25 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 1vsy n GLY 1151N 1.25 -0.76 3.70 -0.72 0.00 -0.64 -4.87 105.19 103.15 1vsy n GLY 1151Ca -0.02 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.77 1vsy n GLY 1151CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1vsy n PRO 1152N 0.00 2.77 -4.74 1.61 -0.02 -1.26 -1.53 135.00 131.84 1vsy n PRO 1152Ca 0.00 1.01 -0.30 0.00 -2.02 0.00 0.00 63.50 62.19 1vsy n PRO 1152Cb 0.00 -2.89 -0.14 0.00 -0.02 0.00 0.00 33.50 30.45 1vsy n PRO 1152CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1vsy s SER 1153N 2.34 3.38 -0.21 2.55 0.01 -0.59 -4.93 113.70 116.25 1vsy s SER 1153Ca 0.80 -0.57 -0.04 0.00 1.31 0.00 0.00 55.95 57.45 1vsy s SER 1153Cb -0.49 -0.37 0.09 0.00 0.21 0.00 0.00 66.02 65.46 1vsy s SER 1153CO 0.36 0.24 0.18 -0.63 0.41 0.00 0.00 173.24 173.80 1vsy s ILE 1154N -0.89 -0.24 -0.09 1.44 1.01 -1.26 -2.67 121.20 118.50 1vsy s ILE 1154Ca 0.13 -0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.57 1vsy s ILE 1154Cb -0.10 -0.70 0.01 0.00 0.01 0.00 0.00 42.46 41.68 1vsy s ILE 1154CO 0.04 -0.30 -0.14 -0.31 0.00 0.00 0.00 174.94 174.23 1vsy s TYR 1155N 2.25 1.75 -0.11 3.97 1.51 0.09 -0.91 117.35 125.90 1vsy s TYR 1155Ca 0.06 -0.75 0.01 0.00 -1.01 0.00 0.00 57.07 55.38 1vsy s TYR 1155Cb -0.16 -1.27 -0.01 0.00 -0.11 0.00 0.00 41.96 40.41 1vsy s TYR 1155CO -0.15 -0.39 -0.15 0.21 -1.11 0.00 0.00 175.55 173.95 1vsy s LYS 1156N 0.87 3.21 0.12 -0.62 2.20 -1.06 0.02 119.74 124.48 1vsy s LYS 1156Ca -0.10 -0.72 0.08 0.00 -0.36 0.00 0.00 55.97 54.87 1vsy s LYS 1156Cb -0.15 -2.54 -0.04 0.00 -1.51 0.00 0.00 37.83 33.59 1vsy s LYS 1156CO 0.01 0.26 -0.10 0.95 -0.36 0.00 0.00 175.35 176.11 1vsy s THR 1157N 0.21 3.30 0.27 3.43 -4.23 -0.41 -3.03 115.64 115.18 1vsy s THR 1157Ca -0.09 -1.37 0.02 0.00 -1.18 0.00 0.00 61.69 59.07 1vsy s THR 1157Cb -0.16 -2.56 -0.06 0.00 1.34 0.00 0.00 72.50 71.07 1vsy s THR 1157CO 0.06 0.06 0.07 1.51 -0.54 0.00 0.00 174.62 175.77 1vsy s ASP 1158N -2.35 1.68 0.30 3.99 1.47 -0.83 -2.17 116.67 118.76 1vsy s ASP 1158Ca 0.22 -1.35 0.18 0.00 1.18 0.00 0.00 52.55 52.78 1vsy s ASP 1158Cb -0.11 0.06 0.98 0.00 -0.34 0.00 0.00 42.92 43.51 1vsy s ASP 1158CO 0.14 -0.65 1.53 -2.65 0.68 0.00 0.00 175.17 174.21 1vsy n PRO 1159N -0.53 0.12 0.15 2.11 -0.02 -1.25 -1.31 135.00 134.27 1vsy n PRO 1159Ca -0.02 0.61 0.04 0.00 -2.02 0.00 0.00 63.50 62.11 1vsy n PRO 1159Cb 0.66 -1.96 0.12 0.00 -0.02 0.00 0.00 33.50 32.30 1vsy n PRO 1159CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vsy h ALA 1160N 1.81 0.76 0.00 3.55 0.00 -1.90 -3.45 119.26 120.03 1vsy h ALA 1160Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1vsy h ALA 1160Cb 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1vsy h ALA 1160CO 0.00 0.58 0.00 0.41 0.00 0.00 0.00 179.25 180.24 1vsy n GLY 1161N 0.95 0.97 3.82 0.00 0.00 -0.43 -4.71 105.19 105.80 1vsy n GLY 1161Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1vsy n GLY 1161CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1vsy s TYR 1162N -2.00 3.68 -0.01 1.61 6.14 -1.25 -4.55 117.35 120.97 1vsy s TYR 1162Ca 0.00 1.23 -0.07 0.00 0.64 0.00 0.00 57.07 58.86 1vsy s TYR 1162Cb 0.00 -2.48 0.01 0.00 0.42 0.00 0.00 41.96 39.90 1vsy s TYR 1162CO 0.00 0.45 0.15 1.52 0.64 0.00 0.00 175.55 178.31 1vsy s TYR 1163N -1.38 -0.02 0.11 4.97 1.13 -1.26 -1.98 117.35 118.93 1vsy s TYR 1163Ca 0.37 0.02 -0.25 0.00 -1.41 0.00 0.00 57.07 55.80 1vsy s TYR 1163Cb -0.17 -0.02 0.07 0.00 -1.10 0.00 0.00 41.96 40.75 1vsy s TYR 1163CO 0.20 -0.24 0.76 0.54 -2.51 0.00 0.00 175.55 174.30 1vsy s VAL 1164N -1.03 0.00 -0.14 -3.49 0.11 -1.17 -5.02 120.40 109.66 1vsy s VAL 1164Ca -0.11 -0.20 -0.06 0.00 -2.93 0.00 0.00 61.98 58.67 1vsy s VAL 1164Cb -0.06 -1.25 -0.04 0.00 -1.53 0.00 0.00 36.38 33.50 1vsy s VAL 1164CO 0.01 0.00 0.07 -0.83 -3.33 0.00 0.00 175.10 171.03 1vsy s GLY 1165N -2.70 1.97 0.05 6.54 0.00 -1.26 -2.58 107.32 109.34 1vsy s GLY 1165Ca 0.05 -0.73 0.05 0.00 0.00 0.00 0.00 44.72 44.09 1vsy s GLY 1165CO -0.07 -0.21 -0.09 -0.19 0.00 0.00 0.00 173.10 172.54 1vsy s TYR 1166N -0.31 2.81 0.08 1.90 2.02 -0.08 -5.02 117.35 118.74 1vsy s TYR 1166Ca 0.09 -0.10 -0.32 0.00 -0.37 0.00 0.00 57.07 56.36 1vsy s TYR 1166Cb -0.12 -1.53 -0.17 0.00 -0.40 0.00 0.00 41.96 39.74 1vsy s TYR 1166CO 0.02 0.38 1.62 0.87 -1.57 0.00 0.00 175.55 176.87 1vsy h LYS 1167N 4.17 -0.82 -4.15 -0.62 1.57 -1.87 -3.38 116.57 111.46 1vsy h LYS 1167Ca -0.48 0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.21 1vsy h LYS 1167Cb 1.17 0.19 -0.13 0.00 0.08 0.00 0.00 32.23 33.53 1vsy h LYS 1167CO 0.53 -0.55 -0.46 0.00 -0.57 0.00 0.00 179.45 178.40 1vsy s ALA 1168N -6.04 0.43 0.21 3.86 0.00 -1.26 -3.66 121.76 115.30 1vsy s ALA 1168Ca -0.17 -1.19 -0.14 0.00 0.00 0.00 0.00 51.96 50.45 1vsy s ALA 1168Cb 0.04 0.95 0.01 0.00 0.00 0.00 0.00 23.12 24.12 1vsy s ALA 1168CO 0.62 -0.60 0.47 -0.08 0.00 0.00 0.00 175.76 176.17 1vsy s THR 1169N -4.03 0.02 0.05 0.00 -1.32 -0.91 -4.97 115.64 104.49 1vsy s THR 1169Ca 0.23 -1.14 -0.05 0.00 -1.21 0.00 0.00 61.69 59.53 1vsy s THR 1169Cb 0.05 -1.88 -0.02 0.00 -1.51 0.00 0.00 72.50 69.15 1vsy s THR 1169CO 0.03 -0.11 0.07 0.00 -2.21 0.00 0.00 174.62 172.40 1vsy s ALA 1170N -3.95 0.06 -0.00 11.08 0.00 -1.26 -1.09 121.76 126.60 1vsy s ALA 1170Ca 0.16 -0.72 -0.13 0.00 0.00 0.00 0.00 51.96 51.27 1vsy s ALA 1170Cb -0.00 0.28 0.02 0.00 0.00 0.00 0.00 23.12 23.41 1vsy s ALA 1170CO 0.02 -0.35 0.26 0.99 0.00 0.00 0.00 175.76 176.69 1vsy s THR 1171N -3.03 0.07 0.00 0.00 2.01 -0.69 -4.97 115.64 109.03 1vsy s THR 1171Ca -0.01 -0.56 0.00 0.00 0.31 0.00 0.00 61.69 61.42 1vsy s THR 1171Cb 0.01 -0.60 0.00 0.00 0.01 0.00 0.00 72.50 71.92 1vsy s THR 1171CO -0.07 -0.31 0.00 0.61 -0.69 0.00 0.00 174.62 174.16 1vsy n GLY 1172N 1.25 -0.51 0.36 4.40 0.00 -1.26 -2.55 105.19 106.87 1vsy n GLY 1172Ca -0.22 -2.19 -0.13 0.00 0.00 0.00 0.00 46.02 43.49 1vsy n GLY 1172CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1vsy h PRO 1173N 1.94 -0.68 -1.26 1.61 0.11 -1.88 -2.43 132.00 129.40 1vsy h PRO 1173Ca 0.00 0.05 -0.35 0.00 0.11 0.00 0.00 66.00 65.80 1vsy h PRO 1173Cb 0.00 0.15 -0.17 0.00 0.11 0.00 0.00 31.00 31.09 1vsy h PRO 1173CO 0.00 -0.45 0.45 1.63 -0.21 0.00 0.00 178.00 179.42 1vsy n LYS 1174N -4.58 1.87 -0.26 1.05 4.01 -1.26 -4.61 118.16 114.38 1vsy n LYS 1174Ca -0.08 -1.81 0.06 0.00 -0.51 0.00 0.00 58.31 55.96 1vsy n LYS 1174Cb 0.33 -1.71 0.19 0.00 -0.51 0.00 0.00 35.03 33.33 1vsy n LYS 1174CO 0.00 0.00 0.00 0.37 -1.11 0.00 0.00 177.40 176.66 1vsy h GLN 1175N 1.18 0.42 0.00 1.97 -0.00 -1.70 -2.56 115.11 114.42 1vsy h GLN 1175Ca 0.35 -0.03 -0.08 0.00 -0.00 0.00 0.00 58.65 58.90 1vsy h GLN 1175Cb 1.35 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 28.72 1vsy h GLN 1175CO 0.80 0.28 -0.36 0.37 0.00 0.00 0.00 178.83 179.92 1vsy h GLN 1176N 0.43 0.00 -0.39 1.69 5.75 -1.84 -0.24 115.11 120.51 1vsy h GLN 1176Ca 0.42 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 58.79 1vsy h GLN 1176Cb 0.66 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.20 1vsy h GLN 1176CO -0.42 0.36 -0.29 0.93 -2.65 0.00 0.00 178.83 176.76 1vsy h GLU 1177N 0.00 0.88 -0.23 1.69 3.07 -1.82 -2.03 114.58 116.13 1vsy h GLU 1177Ca -0.00 -0.43 -0.14 0.00 -0.50 0.00 0.00 59.36 58.28 1vsy h GLU 1177Cb 1.17 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 1vsy h GLU 1177CO 0.05 1.07 -0.42 0.82 -1.40 0.00 0.00 179.01 179.13 1vsy h ILE 1178N 0.69 1.31 -0.39 3.13 2.04 -1.38 -3.07 117.51 119.84 1vsy h ILE 1178Ca 0.07 -1.63 -0.00 0.00 1.00 0.00 0.00 64.86 64.30 1vsy h ILE 1178Cb 0.87 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 38.70 1vsy h ILE 1178CO 0.08 0.51 0.24 0.74 0.00 0.00 0.00 178.15 179.72 1vsy h THR 1179N 0.41 1.12 0.00 -0.27 2.02 -1.06 -2.65 112.91 112.48 1vsy h THR 1179Ca 0.01 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 1vsy h THR 1179Cb 1.02 0.60 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1vsy h THR 1179CO 0.09 0.12 -0.08 0.74 0.37 0.00 0.00 175.52 176.76 1vsy h THR 1180N 0.51 0.26 -0.20 3.16 2.02 -1.43 -1.42 112.91 115.81 1vsy h THR 1180Ca 0.14 -0.63 -0.09 0.00 0.77 0.00 0.00 66.41 66.60 1vsy h THR 1180Cb -0.01 1.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 1vsy h THR 1180CO -0.03 0.08 -0.24 -1.13 0.37 0.00 0.00 175.52 174.57 1vsy h ASN 1181N 0.00 0.56 -0.22 4.18 -0.73 -1.38 -3.04 115.58 114.95 1vsy h ASN 1181Ca -0.00 -0.50 -0.04 0.00 1.87 0.00 0.00 56.30 57.63 1vsy h ASN 1181Cb 0.49 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.91 1vsy h ASN 1181CO 0.01 0.95 -0.03 -0.07 -0.37 0.00 0.00 177.43 177.92 1vsy h LEU 1182N 0.19 0.41 -1.05 0.34 3.38 -1.17 -2.96 115.31 114.46 1vsy h LEU 1182Ca 0.03 -0.34 0.20 0.00 0.09 0.00 0.00 57.88 57.86 1vsy h LEU 1182Cb 0.80 -0.11 -0.11 0.00 0.09 0.00 0.00 40.66 41.34 1vsy h LEU 1182CO 0.06 0.65 0.61 -0.33 0.09 0.00 0.00 178.44 179.52 1vsy h GLU 1183N 0.16 0.70 -0.25 1.13 5.08 -1.36 0.49 114.58 120.52 1vsy h GLU 1183Ca 0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1vsy h GLU 1183Cb 0.46 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1vsy h GLU 1183CO 0.02 0.46 0.00 0.09 -1.00 0.00 0.00 179.01 178.58 1vsy n ASN 1184N -4.76 0.56 0.00 1.42 5.03 -1.12 -2.05 115.26 114.34 1vsy n ASN 1184Ca 0.24 -2.02 0.00 0.00 0.87 0.00 0.00 54.58 53.67 1vsy n ASN 1184Cb 0.61 -0.14 0.00 0.00 -1.02 0.00 0.00 39.78 39.22 1vsy n ASN 1184CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 1vsy n HIS 1185N -0.24 0.00 0.08 3.10 -0.00 0.13 -4.34 115.22 113.96 1vsy n HIS 1185Ca 0.02 -0.01 0.01 0.00 0.46 0.00 0.00 57.72 58.20 1vsy n HIS 1185Cb 0.11 -0.00 -0.00 0.00 -0.12 0.00 0.00 29.99 29.98 1vsy n HIS 1185CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1vsy n PHE 1186N -0.01 0.00 0.12 1.57 3.72 -1.02 -3.49 117.46 118.35 1vsy n PHE 1186Ca 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.41 1vsy n PHE 1186Cb 0.12 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.66 1vsy n PHE 1186CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1vsy h LYS 1187N 0.17 0.00 0.01 -1.08 3.64 -1.66 -3.04 116.57 114.62 1vsy h LYS 1187Ca 0.00 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.03 1vsy h LYS 1187Cb 0.06 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.82 1vsy h LYS 1187CO 0.00 0.53 -2.20 1.17 -2.27 0.00 0.00 179.45 176.68 1vsy n LYS 1188N -3.20 0.68 0.00 1.90 4.81 -1.26 -4.09 118.16 117.00 1vsy n LYS 1188Ca 0.00 0.13 0.12 0.00 -0.87 0.00 0.00 58.31 57.69 1vsy n LYS 1188Cb 0.77 -1.61 0.12 0.00 0.02 0.00 0.00 35.03 34.33 1vsy n LYS 1188CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1vsy n SER 1189N -3.01 2.38 -4.41 3.14 3.41 -1.23 -5.00 113.62 108.92 1vsy n SER 1189Ca -0.32 -1.71 -0.40 0.00 -0.26 0.00 0.00 58.87 56.19 1vsy n SER 1189Cb 1.09 0.19 -0.06 0.00 -0.26 0.00 0.00 64.21 65.17 1vsy n SER 1189CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1vsy n LYS 1190N 0.61 -1.75 -0.48 4.33 5.02 -1.15 -4.91 118.16 119.82 1vsy n LYS 1190Ca 0.13 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1vsy n LYS 1190Cb 0.51 -4.85 0.00 0.00 -0.02 0.00 0.00 35.03 30.67 1vsy n LYS 1190CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1vsy n ILE 1191N -4.21 0.00 -0.31 -0.18 -5.35 -1.26 -5.07 119.36 102.99 1vsy n ILE 1191Ca 0.09 0.00 0.03 0.00 -0.27 0.00 0.00 62.75 62.60 1vsy n ILE 1191Cb 0.47 0.00 0.07 0.00 -1.74 0.00 0.00 39.64 38.44 1vsy n ILE 1191CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1vsy n ASP 1192N -0.48 2.30 -1.83 7.28 5.75 -1.26 -4.95 116.55 123.37 1vsy n ASP 1192Ca 0.00 -2.29 -0.04 0.00 -0.01 0.00 0.00 54.79 52.45 1vsy n ASP 1192Cb 0.00 -0.15 0.01 0.00 -1.03 0.00 0.00 41.12 39.95 1vsy n ASP 1192CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1vsy n HIS 1193N -0.57 -1.59 -3.64 2.11 1.44 -1.26 -4.78 115.22 106.94 1vsy n HIS 1193Ca 0.06 -0.87 -0.39 0.00 -2.01 0.00 0.00 57.72 54.50 1vsy n HIS 1193Cb 0.39 0.42 -0.10 0.00 0.12 0.00 0.00 29.99 30.82 1vsy n HIS 1193CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1vsy s ILE 1194N -2.59 3.99 -1.08 0.61 -1.09 -0.47 -5.02 121.20 115.55 1vsy s ILE 1194Ca 0.08 -1.62 -0.21 0.00 -2.23 0.00 0.00 60.65 56.66 1vsy s ILE 1194Cb -0.02 -3.53 -0.08 0.00 -1.58 0.00 0.00 42.46 37.24 1vsy s ILE 1194CO 0.06 -0.59 1.92 -3.20 -1.23 0.00 0.00 174.94 171.90 1vsy n ASN 1195N 4.84 3.17 -3.92 3.58 2.85 -1.26 -3.47 115.26 121.05 1vsy n ASN 1195Ca -0.08 -2.73 -0.13 0.00 -0.11 0.00 0.00 54.58 51.53 1vsy n ASN 1195Cb 0.42 -1.53 -0.14 0.00 1.24 0.00 0.00 39.78 39.77 1vsy n ASN 1195CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1vsy s GLU 1196N 5.50 0.20 -0.09 1.20 2.56 -1.26 -5.01 118.70 121.79 1vsy s GLU 1196Ca 0.62 -0.13 -0.01 0.00 0.00 0.00 0.00 54.97 55.45 1vsy s GLU 1196Cb 0.06 -0.16 -0.00 0.00 2.00 0.00 0.00 34.13 36.02 1vsy s GLU 1196CO 0.11 0.04 -0.02 0.93 -0.56 0.00 0.00 175.26 175.77 1vsy h GLU 1197N 5.97 0.00 -6.77 4.30 3.07 -2.00 -3.18 114.58 115.97 1vsy h GLU 1197Ca -0.26 0.00 -0.52 0.00 -0.50 0.00 0.00 59.36 58.08 1vsy h GLU 1197Cb 1.20 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 29.15 1vsy h GLU 1197CO 0.50 0.00 0.59 -1.54 -1.40 0.00 0.00 179.01 177.16 1vsy s SER 1198N -5.27 6.98 0.49 1.42 1.04 -1.26 -4.69 113.70 112.41 1vsy s SER 1198Ca -0.01 2.43 0.17 0.00 0.48 0.00 0.00 55.95 59.01 1vsy s SER 1198Cb 0.00 -2.62 1.18 0.00 0.10 0.00 0.00 66.02 64.68 1vsy s SER 1198CO 0.02 -0.41 2.07 4.11 0.98 0.00 0.00 173.24 180.01 1vsy h TRP 1199N 4.40 0.00 -0.67 5.02 5.08 -1.95 -2.90 115.95 124.93 1vsy h TRP 1199Ca -0.46 0.00 0.13 0.00 1.08 0.00 0.00 58.89 59.64 1vsy h TRP 1199Cb 1.22 0.00 -0.09 0.00 -3.00 0.00 0.00 29.16 27.28 1vsy h TRP 1199CO 0.59 0.10 0.19 0.93 -1.28 0.00 0.00 178.44 178.98 1vsy h GLU 1200N 0.00 0.31 0.00 0.12 3.07 -1.99 0.17 114.58 116.27 1vsy h GLU 1200Ca -0.00 -0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 58.80 1vsy h GLU 1200Cb 0.18 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 1vsy h GLU 1200CO 0.01 0.21 -0.21 0.87 -1.40 0.00 0.00 179.01 178.49 1vsy h LYS 1201N 0.32 0.00 0.00 2.33 1.79 -1.91 -1.32 116.57 117.78 1vsy h LYS 1201Ca 0.36 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.64 1vsy h LYS 1201Cb 0.56 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 1vsy h LYS 1201CO -0.42 0.21 -0.93 0.28 -1.08 0.00 0.00 179.45 177.51 1vsy h VAL 1202N 0.00 1.61 -0.15 0.50 2.07 -0.97 -1.87 116.25 117.44 1vsy h VAL 1202Ca -0.00 -3.24 -0.17 0.00 0.82 0.00 0.00 66.70 64.10 1vsy h VAL 1202Cb 0.73 2.78 0.01 0.00 -1.52 0.00 0.00 31.29 33.28 1vsy h VAL 1202CO 0.03 0.91 -0.59 0.58 0.02 0.00 0.00 177.57 178.52 1vsy h VAL 1203N 0.00 1.32 -0.39 2.57 2.07 -0.50 -2.09 116.25 119.22 1vsy h VAL 1203Ca -0.01 -1.84 0.01 0.00 0.82 0.00 0.00 66.70 65.68 1vsy h VAL 1203Cb 1.70 2.03 -0.02 0.00 -1.52 0.00 0.00 31.29 33.48 1vsy h VAL 1203CO 0.12 0.57 0.24 -0.33 0.02 0.00 0.00 177.57 178.19 1vsy h GLU 1204N 0.33 0.47 -0.96 1.57 5.08 -1.28 -1.71 114.58 118.08 1vsy h GLU 1204Ca -0.03 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1vsy h GLU 1204Cb 1.22 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 30.31 1vsy h GLU 1204CO 0.12 0.31 0.63 0.35 -1.00 0.00 0.00 179.01 179.42 1vsy h PHE 1205N 0.49 1.17 -0.19 4.33 3.04 -1.35 0.73 116.94 125.16 1vsy h PHE 1205Ca 0.15 0.03 -0.12 0.00 3.98 0.00 0.00 57.97 62.01 1vsy h PHE 1205Cb -0.01 -0.39 -0.01 0.00 2.56 0.00 0.00 35.95 38.10 1vsy h PHE 1205CO -0.07 0.66 -0.41 0.00 -2.02 0.00 0.00 178.31 176.48 1vsy h ALA 1206N 1.40 0.94 -0.11 2.41 0.00 -1.05 -1.08 119.26 121.77 1vsy h ALA 1206Ca 0.39 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1vsy h ALA 1206Cb 0.03 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.72 1vsy h ALA 1206CO -0.13 0.63 -0.44 0.82 0.00 0.00 0.00 179.25 180.12 1vsy h ILE 1207N 0.37 1.37 0.30 0.00 2.04 -0.98 -3.18 117.51 117.42 1vsy h ILE 1207Ca 0.03 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.13 1vsy h ILE 1207Cb 0.88 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 39.09 1vsy h ILE 1207CO 0.07 0.53 -0.43 0.74 0.00 0.00 0.00 178.15 179.06 1vsy h THR 1208N 0.10 0.00 0.00 -0.27 2.02 -0.71 -0.09 112.91 113.96 1vsy h THR 1208Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1vsy h THR 1208Cb 1.08 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1vsy h THR 1208CO 0.09 0.00 0.00 1.41 0.37 0.00 0.00 175.52 177.39 1vsy n HIS 1209N -4.96 0.00 -0.09 3.16 8.25 -0.42 -1.25 115.22 119.91 1vsy n HIS 1209Ca -0.09 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.17 1vsy n HIS 1209Cb 0.37 -0.29 -0.12 0.00 1.12 0.00 0.00 29.99 31.07 1vsy n HIS 1209CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1vsy n MET 1210N -1.29 0.67 -0.03 -0.41 0.00 -0.74 -3.18 117.12 112.15 1vsy n MET 1210Ca 0.02 0.20 -0.08 0.00 0.00 0.00 0.00 57.70 57.84 1vsy n MET 1210Cb 0.04 -1.57 -0.02 0.00 0.00 0.00 0.00 33.22 31.67 1vsy n MET 1210CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 1vsy h ILE 1211N -0.08 0.62 -0.73 1.12 2.04 -0.19 0.74 117.51 121.03 1vsy h ILE 1211Ca -0.54 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.45 1vsy h ILE 1211Cb 1.90 0.62 -0.09 0.00 -0.74 0.00 0.00 36.82 38.50 1vsy h ILE 1211CO -0.07 0.00 0.28 0.44 0.00 0.00 0.00 178.15 178.80 1vsy h ASP 1212N -0.12 0.24 1.45 1.72 3.32 -1.34 0.15 116.42 121.84 1vsy h ASP 1212Ca 0.12 0.11 -0.11 0.00 0.02 0.00 0.00 57.03 57.16 1vsy h ASP 1212Cb 0.29 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 1vsy h ASP 1212CO -0.28 0.10 -0.55 0.00 -1.72 0.00 0.00 179.24 176.79 1vsy h ALA 1213N 1.53 0.67 0.00 3.45 0.00 -1.41 -3.32 119.26 120.19 1vsy h ALA 1213Ca 0.40 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1vsy h ALA 1213Cb 0.60 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1vsy h ALA 1213CO -0.40 0.65 -1.55 1.28 0.00 0.00 0.00 179.25 179.23 1vsy n LEU 1214N -3.21 0.39 -1.69 0.00 4.77 0.21 -4.68 117.00 112.79 1vsy n LEU 1214Ca 0.01 -0.20 -0.16 0.00 -0.03 0.00 0.00 56.01 55.63 1vsy n LEU 1214Cb 0.74 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.81 1vsy n LEU 1214CO 0.41 0.10 -0.19 0.61 -1.33 0.00 0.00 177.39 176.98 1vsy n GLY 1215N 1.38 0.15 3.01 -0.72 0.00 0.49 -5.00 105.19 104.50 1vsy n GLY 1215Ca -0.01 -0.22 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 1vsy n GLY 1215CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vsy s THR 1216N -2.75 0.32 0.54 2.61 -4.23 -1.24 -5.09 115.64 105.80 1vsy s THR 1216Ca 0.00 -0.91 -0.08 0.00 -1.18 0.00 0.00 61.69 59.51 1vsy s THR 1216Cb 0.00 -0.42 -0.04 0.00 1.34 0.00 0.00 72.50 73.38 1vsy s THR 1216CO 0.00 -0.39 0.91 -1.61 -0.54 0.00 0.00 174.62 172.99 1vsy s GLU 1217N -1.38 3.59 0.05 3.99 0.41 -1.26 -4.59 118.70 119.52 1vsy s GLU 1217Ca -0.12 0.49 0.09 0.00 -0.41 0.00 0.00 54.97 55.03 1vsy s GLU 1217Cb -0.09 -2.23 -0.03 0.00 -1.78 0.00 0.00 34.13 30.00 1vsy s GLU 1217CO -0.00 -0.37 -0.26 -0.06 -0.49 0.00 0.00 175.26 174.08 1vsy s PHE 1218N -2.93 2.34 0.39 1.61 0.08 -1.26 -5.11 117.98 113.10 1vsy s PHE 1218Ca 0.51 -0.40 0.08 0.00 0.12 0.00 0.00 56.93 57.24 1vsy s PHE 1218Cb -0.11 -1.38 -0.02 0.00 -0.57 0.00 0.00 43.02 40.95 1vsy s PHE 1218CO 0.48 0.16 0.39 -1.54 -0.10 0.00 0.00 175.22 174.61 1vsy s SER 1219N -1.34 5.27 0.03 1.36 1.04 -1.26 -4.99 113.70 113.81 1vsy s SER 1219Ca 0.12 -0.59 0.01 0.00 0.48 0.00 0.00 55.95 55.97 1vsy s SER 1219Cb -0.10 -0.73 0.07 0.00 0.10 0.00 0.00 66.02 65.35 1vsy s SER 1219CO 0.03 -0.58 0.87 2.29 0.98 0.00 0.00 173.24 176.83 1vsy n LYS 1220N -1.55 0.01 -0.00 4.02 2.85 -1.26 -1.70 118.16 120.52 1vsy n LYS 1220Ca 0.03 0.35 0.08 0.00 -1.05 0.00 0.00 58.31 57.72 1vsy n LYS 1220Cb 0.61 -1.70 -0.11 0.00 -0.65 0.00 0.00 35.03 33.17 1vsy n LYS 1220CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1vsy n ASN 1221N -1.39 0.84 -1.03 -5.58 4.13 -1.26 -4.47 115.26 106.49 1vsy n ASN 1221Ca -0.00 -0.71 0.11 0.00 1.68 0.00 0.00 54.58 55.66 1vsy n ASN 1221Cb 0.18 1.18 0.17 0.00 -1.54 0.00 0.00 39.78 39.76 1vsy n ASN 1221CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1vsy n ASP 1222N -1.57 3.20 -4.23 6.41 8.00 -0.69 -4.67 116.55 123.01 1vsy n ASP 1222Ca 0.02 -1.96 -0.21 0.00 0.71 0.00 0.00 54.79 53.35 1vsy n ASP 1222Cb 0.31 -0.16 -0.12 0.00 -0.02 0.00 0.00 41.12 41.14 1vsy n ASP 1222CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1vsy s LEU 1223N -1.58 2.29 -0.08 0.64 1.43 -1.25 -1.11 118.68 119.01 1vsy s LEU 1223Ca 0.33 -0.66 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 1vsy s LEU 1223Cb 0.21 -0.71 0.01 0.00 0.03 0.00 0.00 46.19 45.73 1vsy s LEU 1223CO 0.29 -0.01 -0.15 -0.70 0.23 0.00 0.00 176.35 176.01 1vsy s GLU 1224N -1.87 2.09 -0.07 1.70 2.12 0.13 -4.71 118.70 118.10 1vsy s GLU 1224Ca 0.03 -0.54 0.05 0.00 0.36 0.00 0.00 54.97 54.87 1vsy s GLU 1224Cb -0.10 -1.70 -0.00 0.00 0.26 0.00 0.00 34.13 32.58 1vsy s GLU 1224CO 0.03 0.03 -0.22 0.08 -0.54 0.00 0.00 175.26 174.64 1vsy s VAL 1225N 0.71 1.85 0.06 3.70 1.01 -1.26 -1.03 120.40 125.43 1vsy s VAL 1225Ca -0.13 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.00 1vsy s VAL 1225Cb -0.16 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.61 1vsy s VAL 1225CO 0.03 0.52 -0.22 -0.83 0.00 0.00 0.00 175.10 174.60 1vsy s GLY 1226N 0.07 1.52 -0.01 4.51 0.00 0.44 -1.41 107.32 112.44 1vsy s GLY 1226Ca -0.08 -1.27 -0.01 0.00 0.00 0.00 0.00 44.72 43.36 1vsy s GLY 1226CO 0.05 -1.17 0.02 0.14 0.00 0.00 0.00 173.10 172.14 1vsy s VAL 1227N -0.91 -0.00 -0.17 1.40 1.01 -0.45 -1.10 120.40 120.17 1vsy s VAL 1227Ca 0.14 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.14 1vsy s VAL 1227Cb -0.10 -0.04 0.03 0.00 0.00 0.00 0.00 36.38 36.26 1vsy s VAL 1227CO 0.04 0.01 -0.14 0.00 0.00 0.00 0.00 175.10 175.01 1vsy s ALA 1228N 0.09 1.96 0.53 5.51 0.00 0.13 -1.55 121.76 128.43 1vsy s ALA 1228Ca -0.01 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 50.99 1vsy s ALA 1228Cb -0.01 -1.13 0.03 0.00 0.00 0.00 0.00 23.12 22.01 1vsy s ALA 1228CO -0.00 -0.49 0.41 0.95 0.00 0.00 0.00 175.76 176.63 1vsy s THR 1229N 1.44 1.77 0.28 0.00 -4.23 -0.30 -1.02 115.64 113.57 1vsy s THR 1229Ca 0.03 -1.47 -0.30 0.00 -1.18 0.00 0.00 61.69 58.78 1vsy s THR 1229Cb -0.14 -2.23 -0.10 0.00 1.34 0.00 0.00 72.50 71.36 1vsy s THR 1229CO -0.10 0.00 1.44 -1.59 -0.54 0.00 0.00 174.62 173.82 1vsy s LYS 1230N -4.27 4.25 0.00 3.99 -2.85 -1.26 -2.83 119.74 116.76 1vsy s LYS 1230Ca 0.36 2.35 0.00 0.00 -1.00 0.00 0.00 55.97 57.68 1vsy s LYS 1230Cb -0.02 -3.08 0.00 0.00 -2.06 0.00 0.00 37.83 32.67 1vsy s LYS 1230CO 0.22 -0.41 0.00 -0.25 0.10 0.00 0.00 175.35 175.01 1vsy n ASP 1231N 1.80 0.00 -3.72 0.03 8.00 -1.26 -4.95 116.55 116.44 1vsy n ASP 1231Ca 0.05 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.41 1vsy n ASP 1231Cb 0.40 -0.37 -0.09 0.00 -0.02 0.00 0.00 41.12 41.04 1vsy n ASP 1231CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1vsy s LYS 1232N -0.10 0.60 -0.10 -1.24 2.20 -1.13 -4.82 119.74 115.15 1vsy s LYS 1232Ca 0.00 0.26 0.01 0.00 -0.36 0.00 0.00 55.97 55.88 1vsy s LYS 1232Cb 0.00 0.28 0.02 0.00 -1.51 0.00 0.00 37.83 36.62 1vsy s LYS 1232CO 0.00 -0.13 -0.13 0.12 -0.36 0.00 0.00 175.35 174.85 1vsy s PHE 1233N -0.48 1.78 0.15 4.03 5.36 0.37 -1.15 117.98 128.04 1vsy s PHE 1233Ca -0.06 -0.83 0.00 0.00 -0.96 0.00 0.00 56.93 55.08 1vsy s PHE 1233Cb -0.04 -1.32 -0.04 0.00 -0.34 0.00 0.00 43.02 41.28 1vsy s PHE 1233CO 0.03 -0.46 0.04 -0.59 -1.46 0.00 0.00 175.22 172.79 1vsy s PHE 1234N 1.09 1.03 0.08 10.12 -0.71 -0.60 -4.91 117.98 124.07 1vsy s PHE 1234Ca -0.05 -1.17 0.07 0.00 -1.04 0.00 0.00 56.93 54.74 1vsy s PHE 1234Cb -0.14 -0.58 -0.04 0.00 -1.21 0.00 0.00 43.02 41.05 1vsy s PHE 1234CO -0.02 -0.41 -0.14 0.95 -1.34 0.00 0.00 175.22 174.25 1vsy s THR 1235N -3.91 3.12 0.19 -4.49 -4.23 -1.26 -1.35 115.64 103.72 1vsy s THR 1235Ca 0.25 -1.24 -0.30 0.00 -1.18 0.00 0.00 61.69 59.22 1vsy s THR 1235Cb 0.07 -2.40 -0.08 0.00 1.34 0.00 0.00 72.50 71.43 1vsy s THR 1235CO 0.04 0.20 0.96 -0.76 -0.54 0.00 0.00 174.62 174.52 1vsy s LEU 1236N -1.89 4.59 1.05 4.79 1.43 -0.50 -5.00 118.68 123.15 1vsy s LEU 1236Ca 0.18 1.91 -0.16 0.00 -1.03 0.00 0.00 54.13 55.03 1vsy s LEU 1236Cb -0.11 -3.60 0.22 0.00 0.03 0.00 0.00 46.19 42.73 1vsy s LEU 1236CO 0.10 0.06 1.17 -0.94 0.23 0.00 0.00 176.35 176.96 1vsy s SER 1237N -0.71 2.29 0.18 2.29 1.04 -1.26 -4.57 113.70 112.96 1vsy s SER 1237Ca 0.44 0.67 -0.24 0.00 0.48 0.00 0.00 55.95 57.30 1vsy s SER 1237Cb -0.25 -0.99 0.08 0.00 0.10 0.00 0.00 66.02 64.95 1vsy s SER 1237CO 0.32 -3.28 1.57 0.00 0.98 0.00 0.00 173.24 172.83 1vsy h ALA 1238N -2.01 -0.21 -0.20 5.32 0.00 -1.97 -3.00 119.26 117.20 1vsy h ALA 1238Ca -0.47 0.14 -0.20 0.00 0.00 0.00 0.00 54.91 54.38 1vsy h ALA 1238Cb 1.29 0.91 0.01 0.00 0.00 0.00 0.00 17.79 20.00 1vsy h ALA 1238CO 0.44 -0.77 -0.65 0.93 0.00 0.00 0.00 179.25 179.21 1vsy h GLU 1239N -0.19 0.80 -0.07 0.00 4.39 -1.92 -3.10 114.58 114.49 1vsy h GLU 1239Ca 0.21 -0.59 0.02 0.00 0.34 0.00 0.00 59.36 59.34 1vsy h GLU 1239Cb 0.56 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1vsy h GLU 1239CO -0.70 1.21 0.36 -0.91 -1.16 0.00 0.00 179.01 177.81 1vsy h ASN 1240N 0.54 0.00 0.02 1.42 -0.26 -1.88 -1.22 115.58 114.21 1vsy h ASN 1240Ca -0.02 0.00 -0.24 0.00 -0.56 0.00 0.00 56.30 55.48 1vsy h ASN 1240Cb 1.27 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 38.50 1vsy h ASN 1240CO 0.14 0.00 -1.31 0.40 -1.06 0.00 0.00 177.43 175.60 1vsy h ILE 1241N 0.00 0.93 -1.01 2.81 2.04 -1.48 -3.30 117.51 117.50 1vsy h ILE 1241Ca 0.03 -2.22 0.25 0.00 1.00 0.00 0.00 64.86 63.92 1vsy h ILE 1241Cb 0.76 2.35 -0.12 0.00 -0.74 0.00 0.00 36.82 39.07 1vsy h ILE 1241CO -0.00 0.43 0.61 -0.08 0.00 0.00 0.00 178.15 179.11 1vsy h GLU 1242N -0.82 0.54 -0.61 2.37 4.57 -1.20 0.52 114.58 119.96 1vsy h GLU 1242Ca -0.34 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 57.82 1vsy h GLU 1242Cb 1.42 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 29.85 1vsy h GLU 1242CO -0.14 0.36 0.40 0.93 -1.18 0.00 0.00 179.01 179.38 1vsy h GLU 1243N 0.56 0.79 -0.41 1.92 5.08 -1.51 0.63 114.58 121.63 1vsy h GLU 1243Ca 0.63 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.88 1vsy h GLU 1243Cb 1.26 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 1vsy h GLU 1243CO -0.44 0.52 -0.00 -0.09 -1.00 0.00 0.00 179.01 178.00 1vsy h ARG 1244N 0.81 0.66 -0.08 2.33 9.65 -0.17 -2.38 114.38 125.21 1vsy h ARG 1244Ca 0.23 -0.16 -0.16 0.00 -1.10 0.00 0.00 59.98 58.79 1vsy h ARG 1244Cb -0.08 -0.09 0.01 0.00 -1.39 0.00 0.00 29.97 28.43 1vsy h ARG 1244CO -0.06 0.68 -0.56 -0.07 2.80 0.00 0.00 179.97 182.76 1vsy h LEU 1245N 0.62 0.63 -0.97 3.80 4.07 -0.52 -2.76 115.31 120.18 1vsy h LEU 1245Ca 0.13 -0.67 0.08 0.00 0.08 0.00 0.00 57.88 57.49 1vsy h LEU 1245Cb 0.39 -0.19 -0.07 0.00 1.08 0.00 0.00 40.66 41.88 1vsy h LEU 1245CO 0.01 1.21 0.62 0.58 -1.08 0.00 0.00 178.44 179.78 1vsy h VAL 1246N 0.10 1.04 -0.16 1.22 2.07 -0.80 -1.48 116.25 118.24 1vsy h VAL 1246Ca -0.05 -0.37 -0.13 0.00 0.82 0.00 0.00 66.70 66.97 1vsy h VAL 1246Cb 1.22 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1vsy h VAL 1246CO 0.12 0.20 -0.46 0.00 0.02 0.00 0.00 177.57 177.45 1vsy h ALA 1247N 1.46 0.92 -0.21 1.67 0.00 -1.42 -2.60 119.26 119.09 1vsy h ALA 1247Ca 0.43 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1vsy h ALA 1247Cb 0.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1vsy h ALA 1247CO -0.20 0.65 0.06 0.82 0.00 0.00 0.00 179.25 180.58 1vsy h ILE 1248N 0.32 1.19 0.00 0.00 2.04 -1.11 -3.13 117.51 116.81 1vsy h ILE 1248Ca 0.02 -0.60 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 1vsy h ILE 1248Cb 0.93 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1vsy h ILE 1248CO 0.08 0.19 -0.10 0.00 0.00 0.00 0.00 178.15 178.32 1vsy h ALA 1249N 0.89 1.11 -0.98 1.87 0.00 -1.17 -2.28 119.26 118.70 1vsy h ALA 1249Ca 0.07 -0.09 -0.71 0.00 0.00 0.00 0.00 54.91 54.18 1vsy h ALA 1249Cb 0.24 -0.02 -0.28 0.00 0.00 0.00 0.00 17.79 17.73 1vsy h ALA 1249CO -0.00 0.12 0.95 0.39 0.00 0.00 0.00 179.25 180.71 1vsy n GLU 1250N -3.37 2.69 0.00 0.00 1.02 -0.99 -3.97 120.64 116.02 1vsy n GLU 1250Ca -0.01 -3.34 0.00 0.00 -0.02 0.00 0.00 57.16 53.79 1vsy n GLU 1250Cb 0.28 -2.26 0.00 0.00 -0.02 0.00 0.00 31.44 29.43 1vsy n GLU 1250CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1vsy n GLN 1251N -0.68 0.00 0.00 3.49 1.13 -1.16 -5.01 117.38 115.15 1vsy n GLN 1251Ca 0.58 0.00 0.08 0.00 -1.94 0.00 0.00 57.00 55.72 1vsy n GLN 1251Cb 0.45 0.00 0.07 0.00 0.11 0.00 0.00 30.24 30.87 1vsy n GLN 1251CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15