#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wc0 n HIS 1003N 0.00 0.00 -1.86 7.33 8.25 -1.26 -5.05 115.22 122.63 1wc0 n HIS 1003Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 1wc0 n HIS 1003Cb 0.00 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 1wc0 n HIS 1003CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 1wc0 s MET 1004N -0.08 4.03 0.36 -0.41 0.00 -1.26 -4.95 119.30 116.99 1wc0 s MET 1004Ca 0.00 2.27 -0.24 0.00 0.00 0.00 0.00 55.69 57.72 1wc0 s MET 1004Cb 0.00 -4.09 -0.10 0.00 0.00 0.00 0.00 34.83 30.64 1wc0 s MET 1004CO 0.00 -1.05 0.96 1.03 0.00 0.00 0.00 175.02 175.96 1wc0 s ARG 1005N 4.47 4.43 0.05 4.11 0.52 -1.26 -0.66 118.95 130.61 1wc0 s ARG 1005Ca 0.81 1.30 -0.37 0.00 -0.52 0.00 0.00 55.73 56.95 1wc0 s ARG 1005Cb -0.36 -2.60 -0.16 0.00 0.52 0.00 0.00 34.95 32.35 1wc0 s ARG 1005CO 0.34 0.14 1.39 -2.30 0.02 0.00 0.00 175.30 174.90 1wc0 n PRO 1006N 0.15 1.19 -3.77 3.54 -0.02 -1.25 -4.66 135.00 130.18 1wc0 n PRO 1006Ca 0.04 0.43 -0.13 0.00 -2.02 0.00 0.00 63.50 61.81 1wc0 n PRO 1006Cb 0.51 -2.08 -0.09 0.00 -0.02 0.00 0.00 33.50 31.82 1wc0 n PRO 1006CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1wc0 s GLU 1007N 0.84 0.61 0.34 -0.52 -1.05 0.10 -4.92 118.70 114.10 1wc0 s GLU 1007Ca 0.86 -0.08 -0.28 0.00 -0.15 0.00 0.00 54.97 55.31 1wc0 s GLU 1007Cb -0.96 0.27 -0.10 0.00 -0.44 0.00 0.00 34.13 32.91 1wc0 s GLU 1007CO 0.48 -0.16 1.24 -1.25 0.95 0.00 0.00 175.26 176.53 1wc0 s PRO 1008N -1.06 4.32 -0.25 -4.83 0.04 -1.26 -0.47 135.00 131.48 1wc0 s PRO 1008Ca -0.11 2.06 -0.26 0.00 0.04 0.00 0.00 61.00 62.73 1wc0 s PRO 1008Cb -0.05 -2.99 0.11 0.00 0.04 0.00 0.00 34.50 31.61 1wc0 s PRO 1008CO 0.03 -0.16 0.96 0.50 0.04 0.00 0.00 177.00 178.37 1wc0 s ARG 1009N -1.86 0.60 -0.34 4.56 3.52 -0.12 -4.88 118.95 120.42 1wc0 s ARG 1009Ca 0.50 0.59 -0.29 0.00 -0.13 0.00 0.00 55.73 56.41 1wc0 s ARG 1009Cb -0.36 0.29 0.02 0.00 -1.56 0.00 0.00 34.95 33.33 1wc0 s ARG 1009CO 0.48 -0.10 1.12 -1.17 -0.81 0.00 0.00 175.30 174.82 1wc0 s LEU 1010N 0.01 3.88 0.22 -0.88 2.96 -1.26 -1.20 118.68 122.41 1wc0 s LEU 1010Ca 0.01 0.99 -0.00 0.00 -0.22 0.00 0.00 54.13 54.91 1wc0 s LEU 1010Cb -0.04 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.06 1wc0 s LEU 1010CO -0.03 -0.97 0.11 0.27 -1.32 0.00 0.00 176.35 174.41 1wc0 s ILE 1011N 3.89 0.24 -0.16 6.68 -4.36 -0.63 -4.86 121.20 122.00 1wc0 s ILE 1011Ca 0.48 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.87 1wc0 s ILE 1011Cb -0.12 -2.54 -0.00 0.00 1.25 0.00 0.00 42.46 41.04 1wc0 s ILE 1011CO 0.19 -0.02 -0.15 -0.89 0.24 0.00 0.00 174.94 174.32 1wc0 s THR 1012N -3.99 2.70 -0.14 8.37 2.01 -0.21 -1.30 115.64 123.08 1wc0 s THR 1012Ca 0.38 -0.75 -0.04 0.00 0.31 0.00 0.00 61.69 61.59 1wc0 s THR 1012Cb 0.07 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 1wc0 s THR 1012CO 0.12 0.51 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.92 1wc0 s ILE 1013N 0.86 4.14 -0.14 1.82 1.09 0.90 -1.18 121.20 128.70 1wc0 s ILE 1013Ca -0.04 -0.28 0.03 0.00 -1.10 0.00 0.00 60.65 59.25 1wc0 s ILE 1013Cb -0.15 -2.80 0.01 0.00 -1.06 0.00 0.00 42.46 38.45 1wc0 s ILE 1013CO -0.01 0.52 -0.22 -0.22 -0.10 0.00 0.00 174.94 174.91 1wc0 s LEU 1014N 0.02 2.13 -0.12 2.97 0.20 -0.08 -1.86 118.68 121.94 1wc0 s LEU 1014Ca 0.02 -0.59 0.03 0.00 0.69 0.00 0.00 54.13 54.28 1wc0 s LEU 1014Cb -0.13 -1.45 0.01 0.00 -0.43 0.00 0.00 46.19 44.19 1wc0 s LEU 1014CO 0.02 0.09 -0.22 -0.36 -0.29 0.00 0.00 176.35 175.60 1wc0 s PHE 1015N 0.75 2.49 0.11 5.38 0.40 -0.29 -0.47 117.98 126.34 1wc0 s PHE 1015Ca -0.09 -1.14 0.06 0.00 -0.60 0.00 0.00 56.93 55.16 1wc0 s PHE 1015Cb -0.16 -1.69 -0.04 0.00 0.51 0.00 0.00 43.02 41.64 1wc0 s PHE 1015CO -0.00 -0.50 -0.15 -1.54 0.70 0.00 0.00 175.22 173.73 1wc0 s SER 1016N 0.63 1.95 -0.23 1.36 1.04 -0.30 0.09 113.70 118.25 1wc0 s SER 1016Ca -0.12 -0.75 -0.24 0.00 0.48 0.00 0.00 55.95 55.31 1wc0 s SER 1016Cb -0.16 -0.07 0.07 0.00 0.10 0.00 0.00 66.02 65.95 1wc0 s SER 1016CO 0.03 -0.11 0.68 -0.62 0.98 0.00 0.00 173.24 174.19 1wc0 s ASP 1017N -2.23 -0.70 0.20 7.02 2.15 0.48 -0.53 116.67 123.07 1wc0 s ASP 1017Ca 0.06 1.27 0.08 0.00 0.43 0.00 0.00 52.55 54.39 1wc0 s ASP 1017Cb -0.07 1.27 -0.04 0.00 -0.30 0.00 0.00 42.92 43.78 1wc0 s ASP 1017CO 0.03 -0.29 -0.01 0.27 -0.17 0.00 0.00 175.17 175.00 1wc0 s ILE 1018N 0.14 3.63 -0.11 4.11 -4.36 -1.26 -0.90 121.20 122.45 1wc0 s ILE 1018Ca -0.02 -1.55 -0.00 0.00 -0.26 0.00 0.00 60.65 58.83 1wc0 s ILE 1018Cb -0.04 -2.85 0.02 0.00 1.25 0.00 0.00 42.46 40.84 1wc0 s ILE 1018CO 0.02 -0.17 -0.08 -0.69 0.24 0.00 0.00 174.94 174.26 1wc0 s VAL 1019N -1.86 1.03 0.00 8.37 1.01 -0.17 -4.77 120.40 124.01 1wc0 s VAL 1019Ca 0.28 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1wc0 s VAL 1019Cb -0.09 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.26 1wc0 s VAL 1019CO 0.19 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1wc0 n GLY 1020N 4.77 -0.04 0.06 4.51 0.00 -1.26 -1.34 105.19 111.89 1wc0 n GLY 1020Ca -0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.75 1wc0 n GLY 1020CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1wc0 h PHE 1021N 0.00 0.04 0.05 1.61 3.57 -1.95 -1.03 116.94 119.22 1wc0 h PHE 1021Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1wc0 h PHE 1021Cb 0.00 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1wc0 h PHE 1021CO 0.00 0.54 -0.05 1.15 -2.23 0.00 0.00 178.31 177.71 1wc0 h THR 1022N -0.47 0.87 -0.56 4.41 2.02 -1.96 0.20 112.91 117.43 1wc0 h THR 1022Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.22 1wc0 h THR 1022Cb 0.53 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 1wc0 h THR 1022CO 0.00 0.00 0.31 -0.09 0.37 0.00 0.00 175.52 176.11 1wc0 h ARG 1023N -0.12 0.57 -0.28 6.66 9.65 -1.99 -0.29 114.38 128.59 1wc0 h ARG 1023Ca 0.01 -0.03 -0.10 0.00 -1.10 0.00 0.00 59.98 58.75 1wc0 h ARG 1023Cb 0.12 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.56 1wc0 h ARG 1023CO -0.02 0.38 -0.24 1.98 2.80 0.00 0.00 179.97 184.87 1wc0 h MET 1024N 0.59 0.53 -0.00 0.20 4.05 -0.90 -3.02 114.93 116.38 1wc0 h MET 1024Ca 0.24 -0.20 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 1wc0 h MET 1024Cb 0.11 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 30.88 1wc0 h MET 1024CO -0.14 0.74 -0.18 -1.13 0.23 0.00 0.00 176.91 176.42 1wc0 n SER 1025N -4.12 0.19 -0.01 1.39 3.41 0.69 -3.99 113.62 111.18 1wc0 n SER 1025Ca -0.00 0.19 -0.12 0.00 -0.26 0.00 0.00 58.87 58.68 1wc0 n SER 1025Cb 0.41 -0.21 -0.10 0.00 -0.26 0.00 0.00 64.21 64.04 1wc0 n SER 1025CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wc0 h ASN 1026N 0.02 -0.05 0.00 4.04 -1.07 -0.93 -2.95 115.58 114.64 1wc0 h ASN 1026Ca 0.00 -0.60 0.00 0.00 0.07 0.00 0.00 56.30 55.77 1wc0 h ASN 1026Cb 0.49 0.01 0.00 0.00 -2.07 0.00 0.00 38.32 36.76 1wc0 h ASN 1026CO 0.00 0.62 0.00 0.00 0.07 0.00 0.00 177.43 178.12 1wc0 n ALA 1027N -2.49 2.69 -4.08 4.14 0.00 -1.25 -4.63 120.51 114.90 1wc0 n ALA 1027Ca -0.09 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.16 1wc0 n ALA 1027Cb 0.32 -1.16 -0.06 0.00 0.00 0.00 0.00 19.45 18.54 1wc0 n ALA 1027CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1wc0 n LEU 1028N 1.17 0.00 -3.54 0.00 7.94 -1.11 -5.09 117.00 116.36 1wc0 n LEU 1028Ca 0.00 -2.73 -0.23 0.00 -1.11 0.00 0.00 56.01 51.94 1wc0 n LEU 1028Cb 0.34 1.53 -0.15 0.00 0.53 0.00 0.00 43.42 45.67 1wc0 n LEU 1028CO 0.00 -0.47 -0.27 0.00 -1.11 0.00 0.00 177.39 175.54 1wc0 s GLN 1029N -3.13 0.15 0.00 1.96 -2.07 -1.26 -5.03 119.66 110.27 1wc0 s GLN 1029Ca 0.34 -0.07 0.00 0.00 -1.82 0.00 0.00 55.36 53.81 1wc0 s GLN 1029Cb 0.01 -1.40 0.00 0.00 -1.09 0.00 0.00 33.01 30.53 1wc0 s GLN 1029CO 0.24 -0.76 0.00 0.43 -1.32 0.00 0.00 175.29 173.88 1wc0 n SER 1030N 5.29 0.00 0.00 12.60 7.64 -1.26 -2.68 113.62 135.21 1wc0 n SER 1030Ca -0.06 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.85 1wc0 n SER 1030Cb 0.48 0.00 0.16 0.00 -1.01 0.00 0.00 64.21 63.83 1wc0 n SER 1030CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1wc0 n GLN 1031N 0.00 0.62 -0.00 1.43 7.27 -1.26 -0.20 117.38 125.24 1wc0 n GLN 1031Ca 0.00 0.00 0.08 0.00 0.07 0.00 0.00 57.00 57.15 1wc0 n GLN 1031Cb 0.00 -1.13 -0.12 0.00 2.41 0.00 0.00 30.24 31.40 1wc0 n GLN 1031CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1wc0 n GLY 1032N 0.16 -0.71 0.07 1.69 0.00 -1.09 -3.15 105.19 102.16 1wc0 n GLY 1032Ca 0.04 -0.45 0.07 0.00 0.00 0.00 0.00 46.02 45.68 1wc0 n GLY 1032CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wc0 n VAL 1033N -1.76 0.60 -0.00 1.61 0.31 0.72 -2.92 118.33 116.87 1wc0 n VAL 1033Ca -0.00 -0.59 -0.17 0.00 -0.01 0.00 0.00 64.34 63.57 1wc0 n VAL 1033Cb 0.36 -0.32 -0.11 0.00 -0.91 0.00 0.00 33.84 32.86 1wc0 n VAL 1033CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wc0 h ALA 1034N 1.80 0.07 -0.00 3.52 0.00 -1.39 -2.25 119.26 121.00 1wc0 h ALA 1034Ca -0.08 -0.54 -0.12 0.00 0.00 0.00 0.00 54.91 54.17 1wc0 h ALA 1034Cb 1.23 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1wc0 h ALA 1034CO 0.01 0.28 -0.57 0.93 0.00 0.00 0.00 179.25 179.90 1wc0 h GLU 1035N -0.20 0.01 0.40 0.00 5.08 -1.69 -1.87 114.58 116.31 1wc0 h GLU 1035Ca -0.06 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1wc0 h GLU 1035Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1wc0 h GLU 1035CO 0.10 0.58 -0.19 1.25 -1.00 0.00 0.00 179.01 179.75 1wc0 h LEU 1036N 0.01 -0.45 -1.01 1.33 5.85 -1.56 0.47 115.31 119.95 1wc0 h LEU 1036Ca -0.01 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.67 1wc0 h LEU 1036Cb 1.02 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 42.09 1wc0 h LEU 1036CO 0.08 -0.04 0.65 0.25 -0.34 0.00 0.00 178.44 179.04 1wc0 h LEU 1037N -0.98 1.04 -0.53 2.25 5.85 -1.46 -0.84 115.31 120.65 1wc0 h LEU 1037Ca -0.05 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1wc0 h LEU 1037Cb 0.54 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1wc0 h LEU 1037CO 0.09 0.65 0.20 0.78 -0.34 0.00 0.00 178.44 179.83 1wc0 h ASN 1038N 1.17 0.73 -0.45 1.25 2.35 -1.31 0.60 115.58 119.93 1wc0 h ASN 1038Ca 0.44 -0.17 0.04 0.00 -0.55 0.00 0.00 56.30 56.06 1wc0 h ASN 1038Cb 0.19 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 1wc0 h ASN 1038CO -0.18 0.71 0.20 -0.08 -1.65 0.00 0.00 177.43 176.43 1wc0 h GLU 1039N 0.71 0.39 0.13 0.81 4.81 0.15 0.63 114.58 122.22 1wc0 h GLU 1039Ca 0.17 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1wc0 h GLU 1039Cb 0.21 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1wc0 h GLU 1039CO -0.01 0.26 -0.06 -0.92 -0.73 0.00 0.00 179.01 177.54 1wc0 h TYR 1040N 0.40 -0.16 -0.79 0.92 3.20 -0.78 -2.51 116.97 117.25 1wc0 h TYR 1040Ca 0.20 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.10 1wc0 h TYR 1040Cb 0.14 0.05 -0.05 0.00 1.54 0.00 0.00 36.73 38.42 1wc0 h TYR 1040CO -0.12 0.11 0.52 -0.07 -1.64 0.00 0.00 178.16 176.96 1wc0 h LEU 1041N -0.43 0.83 -0.64 2.82 3.38 0.49 -1.72 115.31 120.03 1wc0 h LEU 1041Ca -0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1wc0 h LEU 1041Cb 0.35 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1wc0 h LEU 1041CO 0.03 0.56 0.41 1.23 0.09 0.00 0.00 178.44 180.76 1wc0 h GLY 1042N 0.96 0.91 0.88 0.83 0.00 0.43 -0.79 103.07 106.29 1wc0 h GLY 1042Ca 0.32 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 1wc0 h GLY 1042CO -0.09 0.35 0.05 0.83 0.00 0.00 0.00 176.54 177.68 1wc0 h GLU 1043N 0.87 0.46 -0.12 4.80 4.39 -0.93 -2.32 114.58 121.73 1wc0 h GLU 1043Ca 0.23 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 1wc0 h GLU 1043Cb -0.07 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 1wc0 h GLU 1043CO -0.05 0.57 0.07 0.52 -1.16 0.00 0.00 179.01 178.96 1wc0 h MET 1044N 0.28 0.16 -0.55 2.33 2.86 -1.10 -2.22 114.93 116.70 1wc0 h MET 1044Ca 0.09 -0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.65 1wc0 h MET 1044Cb 0.33 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1wc0 h MET 1044CO 0.00 0.14 0.10 1.79 1.06 0.00 0.00 176.91 180.01 1wc0 h THR 1045N 0.13 1.24 -0.54 2.22 1.35 -1.17 -2.26 112.91 113.89 1wc0 h THR 1045Ca 0.04 -0.89 -0.05 0.00 -0.55 0.00 0.00 66.41 64.97 1wc0 h THR 1045Cb 0.02 0.71 -0.02 0.00 -1.73 0.00 0.00 68.15 67.13 1wc0 h THR 1045CO -0.01 0.33 0.14 0.03 -0.25 0.00 0.00 175.52 175.76 1wc0 h ARG 1046N 0.82 0.81 -0.19 4.72 3.08 -1.26 0.10 114.38 122.47 1wc0 h ARG 1046Ca 0.17 -0.16 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1wc0 h ARG 1046Cb 0.35 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 1wc0 h ARG 1046CO 0.00 0.72 -0.17 0.00 -1.07 0.00 0.00 179.97 179.46 1wc0 h ALA 1047N 1.37 1.37 0.06 0.04 0.00 -0.84 0.24 119.26 121.50 1wc0 h ALA 1047Ca 0.18 -0.26 -0.20 0.00 0.00 0.00 0.00 54.91 54.63 1wc0 h ALA 1047Cb 0.26 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 17.97 1wc0 h ALA 1047CO -0.00 0.43 -0.84 0.28 0.00 0.00 0.00 179.25 179.12 1wc0 h VAL 1048N 0.29 1.40 -0.40 0.00 2.07 -0.88 -3.21 116.25 115.52 1wc0 h VAL 1048Ca 0.05 -2.28 -0.04 0.00 0.82 0.00 0.00 66.70 65.25 1wc0 h VAL 1048Cb 0.47 2.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.96 1wc0 h VAL 1048CO 0.03 0.67 0.08 0.15 0.02 0.00 0.00 177.57 178.52 1wc0 h PHE 1049N -0.03 0.69 0.00 1.57 3.57 -0.65 0.53 116.94 122.62 1wc0 h PHE 1049Ca -0.12 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.28 1wc0 h PHE 1049Cb 1.56 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 40.11 1wc0 h PHE 1049CO 0.15 0.67 -0.05 0.93 -2.23 0.00 0.00 178.31 177.78 1wc0 h GLU 1050N 0.51 0.00 -0.52 1.11 5.08 -1.07 -0.49 114.58 119.20 1wc0 h GLU 1050Ca 0.12 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1wc0 h GLU 1050Cb 0.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1wc0 h GLU 1050CO 0.00 0.05 0.02 0.09 -1.00 0.00 0.00 179.01 178.18 1wc0 n ASN 1051N -3.81 5.28 -1.75 1.42 3.02 -1.05 -4.93 115.26 113.44 1wc0 n ASN 1051Ca -0.03 -2.99 -0.15 0.00 -0.03 0.00 0.00 54.58 51.39 1wc0 n ASN 1051Cb 0.14 -0.66 -0.05 0.00 -0.61 0.00 0.00 39.78 38.60 1wc0 n ASN 1051CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wc0 n GLN 1052N 0.31 -1.56 -1.95 3.52 6.02 -0.19 -4.84 117.38 118.69 1wc0 n GLN 1052Ca 0.28 0.84 -0.29 0.00 -0.01 0.00 0.00 57.00 57.81 1wc0 n GLN 1052Cb 1.16 -5.23 0.06 0.00 1.02 0.00 0.00 30.24 27.24 1wc0 n GLN 1052CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1wc0 s GLY 1053N -2.20 1.62 -0.18 1.08 0.00 0.18 -4.97 107.32 102.85 1wc0 s GLY 1053Ca 0.00 -0.48 -0.04 0.00 0.00 0.00 0.00 44.72 44.19 1wc0 s GLY 1053CO 0.00 -0.09 -0.02 -1.59 0.00 0.00 0.00 173.10 171.40 1wc0 s THR 1054N -3.38 3.89 -0.58 0.90 2.01 0.31 -4.39 115.64 114.41 1wc0 s THR 1054Ca 0.59 -0.34 -0.26 0.00 0.31 0.00 0.00 61.69 61.99 1wc0 s THR 1054Cb -0.11 -2.74 0.04 0.00 0.01 0.00 0.00 72.50 69.70 1wc0 s THR 1054CO 0.50 0.46 1.06 -0.69 -0.69 0.00 0.00 174.62 175.26 1wc0 s VAL 1055N 0.74 4.19 0.02 3.82 1.01 -1.26 0.68 120.40 129.60 1wc0 s VAL 1055Ca -0.01 0.50 -0.27 0.00 0.00 0.00 0.00 61.98 62.20 1wc0 s VAL 1055Cb -0.14 -4.65 -0.16 0.00 0.00 0.00 0.00 36.38 31.43 1wc0 s VAL 1055CO 0.02 -1.27 1.20 -0.78 0.00 0.00 0.00 175.10 174.27 1wc0 h ASP 1056N 9.47 -0.65 -5.46 3.32 1.82 -0.75 -3.48 116.42 120.68 1wc0 h ASP 1056Ca -0.26 -0.04 0.21 0.00 -0.39 0.00 0.00 57.03 56.55 1wc0 h ASP 1056Cb 1.06 0.17 -0.08 0.00 0.68 0.00 0.00 39.33 41.17 1wc0 h ASP 1056CO 1.14 -0.29 0.59 -1.59 -1.61 0.00 0.00 179.24 177.48 1wc0 s LYS 1057N -4.82 1.04 -0.05 0.28 -2.85 -1.14 -4.95 119.74 107.26 1wc0 s LYS 1057Ca -0.14 -0.61 0.03 0.00 -1.00 0.00 0.00 55.97 54.25 1wc0 s LYS 1057Cb 0.02 0.33 -0.03 0.00 -2.06 0.00 0.00 37.83 36.10 1wc0 s LYS 1057CO 0.48 -0.48 -0.12 -0.06 0.10 0.00 0.00 175.35 175.27 1wc0 s PHE 1058N -2.78 2.77 -0.59 1.78 2.99 -1.26 -1.52 117.98 119.37 1wc0 s PHE 1058Ca 0.16 -0.10 0.04 0.00 0.00 0.00 0.00 56.93 57.03 1wc0 s PHE 1058Cb -0.00 -1.65 0.17 0.00 0.00 0.00 0.00 43.02 41.54 1wc0 s PHE 1058CO 0.02 0.24 0.42 0.08 -0.00 0.00 0.00 175.22 175.98 1wc0 s VAL 1059N -0.77 1.95 0.00 -0.44 1.01 -0.13 -4.97 120.40 117.05 1wc0 s VAL 1059Ca 0.12 -3.62 0.00 0.00 0.00 0.00 0.00 61.98 58.48 1wc0 s VAL 1059Cb -0.11 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.97 1wc0 s VAL 1059CO 0.01 -1.07 0.00 0.61 0.00 0.00 0.00 175.10 174.65 1wc0 n GLY 1060N 2.37 2.72 1.39 4.51 0.00 -1.26 -1.74 105.19 113.18 1wc0 n GLY 1060Ca 0.22 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 46.04 1wc0 n GLY 1060CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1wc0 n ASP 1061N 9.05 4.05 -4.87 1.61 5.68 -1.26 -4.92 116.55 125.88 1wc0 n ASP 1061Ca 0.00 -2.08 -0.33 0.00 -0.50 0.00 0.00 54.79 51.88 1wc0 n ASP 1061Cb 0.00 -0.50 -0.05 0.00 -1.14 0.00 0.00 41.12 39.42 1wc0 n ASP 1061CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1wc0 s ALA 1062N -1.18 3.60 -0.04 2.12 0.00 -0.71 -4.05 121.76 121.50 1wc0 s ALA 1062Ca 0.49 -0.28 0.06 0.00 0.00 0.00 0.00 51.96 52.23 1wc0 s ALA 1062Cb 0.27 -2.41 -0.01 0.00 0.00 0.00 0.00 23.12 20.97 1wc0 s ALA 1062CO 0.32 0.52 -0.22 0.42 0.00 0.00 0.00 175.76 176.79 1wc0 s ILE 1063N -1.71 1.81 -0.16 0.00 -1.09 0.31 -0.96 121.20 119.40 1wc0 s ILE 1063Ca 0.44 -0.94 0.01 0.00 -2.23 0.00 0.00 60.65 57.93 1wc0 s ILE 1063Cb -0.12 -1.53 0.02 0.00 -1.58 0.00 0.00 42.46 39.25 1wc0 s ILE 1063CO 0.21 0.51 -0.20 -0.32 -1.23 0.00 0.00 174.94 173.91 1wc0 s MET 1064N -0.21 2.87 0.09 2.79 -2.45 -0.58 -1.15 119.30 120.65 1wc0 s MET 1064Ca -0.00 -0.79 0.07 0.00 -1.25 0.00 0.00 55.69 53.72 1wc0 s MET 1064Cb -0.12 -2.42 -0.03 0.00 1.25 0.00 0.00 34.83 33.51 1wc0 s MET 1064CO 0.02 -0.13 -0.19 0.00 1.05 0.00 0.00 175.02 175.76 1wc0 s ALA 1065N 1.13 1.64 0.07 4.11 0.00 0.38 0.00 121.76 129.09 1wc0 s ALA 1065Ca 0.00 -1.15 0.09 0.00 0.00 0.00 0.00 51.96 50.90 1wc0 s ALA 1065Cb -0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 1wc0 s ALA 1065CO -0.08 0.32 -0.24 -0.51 0.00 0.00 0.00 175.76 175.25 1wc0 s LEU 1066N -1.74 2.21 -0.17 0.00 1.43 0.21 -0.90 118.68 119.73 1wc0 s LEU 1066Ca 0.05 -0.62 -0.02 0.00 -1.03 0.00 0.00 54.13 52.51 1wc0 s LEU 1066Cb -0.10 -1.15 0.05 0.00 0.03 0.00 0.00 46.19 45.03 1wc0 s LEU 1066CO 0.03 0.19 -0.01 -0.31 0.23 0.00 0.00 176.35 176.49 1wc0 s TYR 1067N -0.90 1.28 0.00 0.29 1.51 -0.32 -0.53 117.35 118.68 1wc0 s TYR 1067Ca 0.10 -0.87 0.00 0.00 -1.01 0.00 0.00 57.07 55.30 1wc0 s TYR 1067Cb -0.10 -1.12 0.00 0.00 -0.11 0.00 0.00 41.96 40.63 1wc0 s TYR 1067CO 0.03 -0.57 0.00 0.41 -1.11 0.00 0.00 175.55 174.31 1wc0 n GLY 1068N 4.98 1.33 3.61 0.71 0.00 -1.26 -1.04 105.19 113.53 1wc0 n GLY 1068Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 1wc0 n GLY 1068CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wc0 s ALA 1069N -2.00 -1.95 0.19 4.61 0.00 -1.26 -4.43 121.76 116.92 1wc0 s ALA 1069Ca 0.00 1.75 0.23 0.00 0.00 0.00 0.00 51.96 53.94 1wc0 s ALA 1069Cb 0.00 -1.12 0.94 0.00 0.00 0.00 0.00 23.12 22.93 1wc0 s ALA 1069CO 0.00 -0.27 1.84 -1.00 0.00 0.00 0.00 175.76 176.33 1wc0 h PRO 1070N 3.56 0.00 -6.49 0.00 0.13 -1.99 -3.43 132.00 123.78 1wc0 h PRO 1070Ca -0.25 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.36 1wc0 h PRO 1070Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 1wc0 h PRO 1070CO 0.19 0.25 0.31 -2.00 -0.23 0.00 0.00 178.00 176.52 1wc0 s GLU 1071N -3.73 4.64 0.63 0.86 2.12 -1.26 -5.01 118.70 116.94 1wc0 s GLU 1071Ca -0.00 1.36 -0.19 0.00 0.36 0.00 0.00 54.97 56.50 1wc0 s GLU 1071Cb 0.11 -3.38 -0.02 0.00 0.26 0.00 0.00 34.13 31.10 1wc0 s GLU 1071CO 0.64 0.22 1.23 -1.91 -0.54 0.00 0.00 175.26 174.90 1wc0 n GLU 1072N 2.85 1.14 -3.64 4.30 4.07 -1.26 -4.08 120.64 124.02 1wc0 n GLU 1072Ca 0.01 0.44 -0.11 0.00 -0.06 0.00 0.00 57.16 57.44 1wc0 n GLU 1072Cb 0.49 -2.46 -0.07 0.00 -0.06 0.00 0.00 31.44 29.35 1wc0 n GLU 1072CO 0.00 0.00 0.00 1.41 -0.06 0.00 0.00 177.13 178.48 1wc0 s MET 1073N -3.17 0.77 0.75 5.31 -2.45 -1.26 -4.89 119.30 114.36 1wc0 s MET 1073Ca 0.80 1.08 -0.15 0.00 -1.25 0.00 0.00 55.69 56.17 1wc0 s MET 1073Cb -0.39 0.29 0.04 0.00 1.25 0.00 0.00 34.83 36.02 1wc0 s MET 1073CO 0.43 -0.12 1.17 -1.13 1.05 0.00 0.00 175.02 176.42 1wc0 n SER 1074N 3.39 1.16 0.24 1.11 3.41 -1.26 -4.76 113.62 116.92 1wc0 n SER 1074Ca -0.17 0.66 0.07 0.00 -0.26 0.00 0.00 58.87 59.18 1wc0 n SER 1074Cb 0.57 -1.50 0.58 0.00 -0.26 0.00 0.00 64.21 63.60 1wc0 n SER 1074CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1wc0 h PRO 1075N -0.41 0.00 0.09 4.33 0.11 -1.99 -0.29 132.00 133.83 1wc0 h PRO 1075Ca -0.48 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.44 1wc0 h PRO 1075Cb 1.32 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.45 1wc0 h PRO 1075CO 0.48 0.11 -0.82 0.66 -0.21 0.00 0.00 178.00 178.23 1wc0 h SER 1076N 0.00 0.57 -0.78 -2.05 4.64 -2.00 -3.07 113.55 110.86 1wc0 h SER 1076Ca -0.00 -0.86 -0.03 0.00 -0.47 0.00 0.00 61.79 60.43 1wc0 h SER 1076Cb 0.21 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.08 1wc0 h SER 1076CO 0.01 1.37 0.36 -0.33 -0.87 0.00 0.00 176.83 177.38 1wc0 h GLU 1077N -0.15 1.15 -0.49 4.77 4.39 -1.86 -0.97 114.58 121.42 1wc0 h GLU 1077Ca -0.13 -0.18 0.08 0.00 0.34 0.00 0.00 59.36 59.48 1wc0 h GLU 1077Cb 1.57 -0.20 -0.07 0.00 -0.10 0.00 0.00 28.75 29.95 1wc0 h GLU 1077CO 0.16 0.90 0.11 1.96 -1.16 0.00 0.00 179.01 180.98 1wc0 h GLN 1078N 1.13 0.25 -0.17 2.33 4.20 -1.09 -0.44 115.11 121.33 1wc0 h GLN 1078Ca 0.27 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.91 1wc0 h GLN 1078Cb 0.14 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 1wc0 h GLN 1078CO -0.03 0.16 -0.13 0.28 -0.67 0.00 0.00 178.83 178.44 1wc0 h VAL 1079N 0.26 1.33 -0.31 -0.54 2.07 -1.36 -1.25 116.25 116.45 1wc0 h VAL 1079Ca 0.25 -1.26 0.05 0.00 0.82 0.00 0.00 66.70 66.56 1wc0 h VAL 1079Cb 0.32 1.79 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 1wc0 h VAL 1079CO -0.31 0.37 0.00 -0.09 0.02 0.00 0.00 177.57 177.57 1wc0 h ARG 1080N 0.04 0.09 -0.12 1.57 2.43 -0.86 0.15 114.38 117.67 1wc0 h ARG 1080Ca 0.03 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.07 1wc0 h ARG 1080Cb 0.65 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 1wc0 h ARG 1080CO 0.03 0.06 -0.48 0.00 -1.51 0.00 0.00 179.97 178.07 1wc0 h ARG 1081N 0.09 0.31 -0.21 0.20 3.08 -1.11 -1.16 114.38 115.58 1wc0 h ARG 1081Ca 0.15 -0.17 -0.12 0.00 0.07 0.00 0.00 59.98 59.91 1wc0 h ARG 1081Cb 0.20 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 1wc0 h ARG 1081CO -0.25 0.72 -0.34 0.00 -1.07 0.00 0.00 179.97 179.03 1wc0 h ALA 1082N 1.25 0.32 -0.20 0.04 0.00 -0.81 -0.82 119.26 119.04 1wc0 h ALA 1082Ca 0.01 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 1wc0 h ALA 1082Cb 0.94 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1wc0 h ALA 1082CO 0.08 0.37 0.10 0.82 0.00 0.00 0.00 179.25 180.62 1wc0 h ILE 1083N 0.28 1.13 -0.80 0.00 1.08 -0.65 -0.89 117.51 117.66 1wc0 h ILE 1083Ca 0.02 -0.37 0.01 0.00 -0.39 0.00 0.00 64.86 64.13 1wc0 h ILE 1083Cb 0.93 1.00 -0.04 0.00 -3.07 0.00 0.00 36.82 35.64 1wc0 h ILE 1083CO 0.08 0.12 0.53 0.00 -0.69 0.00 0.00 178.15 178.19 1wc0 h ALA 1084N 0.97 1.44 -0.04 1.87 0.00 -1.19 -0.77 119.26 121.54 1wc0 h ALA 1084Ca 0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1wc0 h ALA 1084Cb 0.11 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1wc0 h ALA 1084CO -0.01 0.52 0.01 1.15 0.00 0.00 0.00 179.25 180.92 1wc0 h THR 1085N 1.07 1.20 -0.99 0.00 2.02 -0.73 -1.29 112.91 114.19 1wc0 h THR 1085Ca 0.29 -0.60 0.02 0.00 0.77 0.00 0.00 66.41 66.90 1wc0 h THR 1085Cb -0.11 1.52 -0.05 0.00 -1.74 0.00 0.00 68.15 67.76 1wc0 h THR 1085CO -0.07 0.16 0.65 0.00 0.37 0.00 0.00 175.52 176.64 1wc0 h ALA 1086N 0.78 1.28 -0.39 6.16 0.00 -0.66 -0.63 119.26 125.79 1wc0 h ALA 1086Ca 0.01 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 1wc0 h ALA 1086Cb 0.25 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1wc0 h ALA 1086CO 0.00 0.59 -0.35 0.00 0.00 0.00 0.00 179.25 179.49 1wc0 h ARG 1087N 1.29 0.93 -0.38 0.00 3.08 -1.08 -2.67 114.38 115.56 1wc0 h ARG 1087Ca 0.38 -0.48 -0.10 0.00 0.07 0.00 0.00 59.98 59.85 1wc0 h ARG 1087Cb -0.08 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1wc0 h ARG 1087CO -0.10 1.13 -0.16 0.37 -1.07 0.00 0.00 179.97 180.14 1wc0 h GLN 1088N 0.75 0.70 -0.10 0.04 4.15 -0.79 -2.17 115.11 117.69 1wc0 h GLN 1088Ca 0.07 -0.25 -0.00 0.00 0.77 0.00 0.00 58.65 59.24 1wc0 h GLN 1088Cb 0.94 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.58 1wc0 h GLN 1088CO 0.09 0.83 0.06 0.52 -1.93 0.00 0.00 178.83 178.40 1wc0 h MET 1089N 0.63 0.14 -0.75 1.69 2.86 -1.04 0.44 114.93 118.90 1wc0 h MET 1089Ca 0.10 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1wc0 h MET 1089Cb 0.63 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.23 1wc0 h MET 1089CO 0.04 0.16 0.50 1.25 1.06 0.00 0.00 176.91 179.92 1wc0 h LEU 1090N 0.09 0.85 -0.38 1.22 6.46 -1.33 0.34 115.31 122.55 1wc0 h LEU 1090Ca 0.04 -0.02 -0.09 0.00 -0.12 0.00 0.00 57.88 57.69 1wc0 h LEU 1090Cb 0.06 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 39.77 1wc0 h LEU 1090CO -0.01 0.61 -0.10 0.58 -0.62 0.00 0.00 178.44 178.90 1wc0 h VAL 1091N 1.00 1.28 -0.58 1.05 2.07 -0.99 -2.22 116.25 117.85 1wc0 h VAL 1091Ca 0.28 -1.19 -0.07 0.00 0.82 0.00 0.00 66.70 66.55 1wc0 h VAL 1091Cb -0.09 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 1wc0 h VAL 1091CO -0.06 0.39 0.10 0.00 0.02 0.00 0.00 177.57 178.02 1wc0 h ALA 1092N 0.83 1.08 -0.43 1.67 0.00 0.28 -1.54 119.26 121.14 1wc0 h ALA 1092Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1wc0 h ALA 1092Cb 0.62 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1wc0 h ALA 1092CO 0.04 0.60 0.24 1.25 0.00 0.00 0.00 179.25 181.38 1wc0 h LEU 1093N 0.88 0.53 -0.99 0.00 5.85 -0.20 0.15 115.31 121.54 1wc0 h LEU 1093Ca 0.18 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1wc0 h LEU 1093Cb 0.38 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1wc0 h LEU 1093CO 0.01 0.47 0.47 -0.33 -0.34 0.00 0.00 178.44 178.71 1wc0 h GLU 1094N 0.56 1.18 -0.72 1.25 5.08 -1.07 0.19 114.58 121.05 1wc0 h GLU 1094Ca 0.15 -0.13 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 1wc0 h GLU 1094Cb 0.05 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1wc0 h GLU 1094CO -0.02 0.86 0.18 -0.22 -1.00 0.00 0.00 179.01 178.81 1wc0 h LYS 1095N 1.19 1.15 -0.22 2.33 3.64 -0.61 -1.79 116.57 122.25 1wc0 h LYS 1095Ca 0.30 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1wc0 h LYS 1095Cb 0.02 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1wc0 h LYS 1095CO -0.05 1.01 0.05 -0.07 -2.27 0.00 0.00 179.45 178.11 1wc0 h LEU 1096N 1.09 0.34 -1.26 5.20 3.38 0.46 -2.19 115.31 122.33 1wc0 h LEU 1096Ca 0.23 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1wc0 h LEU 1096Cb 0.37 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 1wc0 h LEU 1096CO 0.00 0.49 0.51 0.78 0.09 0.00 0.00 178.44 180.31 1wc0 h ASN 1097N 0.17 0.84 -0.67 -0.43 2.35 -0.52 0.19 115.58 117.51 1wc0 h ASN 1097Ca 0.07 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.76 1wc0 h ASN 1097Cb 0.29 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 1wc0 h ASN 1097CO 0.00 0.59 0.28 -0.61 -1.65 0.00 0.00 177.43 176.05 1wc0 h GLN 1098N 0.99 1.02 -0.08 0.81 5.75 -1.09 0.27 115.11 122.78 1wc0 h GLN 1098Ca 0.29 -0.17 -0.05 0.00 -0.15 0.00 0.00 58.65 58.58 1wc0 h GLN 1098Cb -0.03 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.34 1wc0 h GLN 1098CO -0.08 0.83 -0.14 0.78 -2.65 0.00 0.00 178.83 177.57 1wc0 h GLY 1099N 1.07 0.25 1.67 2.39 0.00 -0.53 -2.61 103.07 105.31 1wc0 h GLY 1099Ca 0.23 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 1wc0 h GLY 1099CO -0.02 0.26 0.07 1.49 0.00 0.00 0.00 176.54 178.34 1wc0 h TRP 1100N -0.25 0.42 -0.58 5.60 6.55 -0.42 -0.53 115.95 126.75 1wc0 h TRP 1100Ca 0.00 -0.02 -0.05 0.00 0.95 0.00 0.00 58.89 59.78 1wc0 h TRP 1100Cb 0.72 -0.13 -0.03 0.00 -0.86 0.00 0.00 29.16 28.86 1wc0 h TRP 1100CO 0.11 0.38 0.17 0.37 -1.05 0.00 0.00 178.44 178.41 1wc0 h GLN 1101N 0.42 0.87 -0.17 0.49 5.75 -0.43 0.43 115.11 122.47 1wc0 h GLN 1101Ca 0.10 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 58.43 1wc0 h GLN 1101Cb 0.17 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.58 1wc0 h GLN 1101CO -0.00 0.76 0.00 0.39 -2.65 0.00 0.00 178.83 177.33 1wc0 n GLU 1102N -4.28 1.21 0.00 1.69 1.02 -0.23 -2.91 120.64 117.14 1wc0 n GLU 1102Ca 0.04 -0.30 0.00 0.00 -0.02 0.00 0.00 57.16 56.89 1wc0 n GLU 1102Cb 0.21 -1.12 0.00 0.00 -0.02 0.00 0.00 31.44 30.51 1wc0 n GLU 1102CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1wc0 n ARG 1103N -0.23 0.38 -1.25 3.49 1.74 -0.66 -4.99 116.66 115.14 1wc0 n ARG 1103Ca 0.03 -0.57 -0.09 0.00 -0.77 0.00 0.00 57.85 56.45 1wc0 n ARG 1103Cb 0.10 -0.74 -0.04 0.00 -1.02 0.00 0.00 32.46 30.76 1wc0 n ARG 1103CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wc0 n GLY 1104N -0.11 1.03 0.14 -0.13 0.00 -0.91 -4.86 105.19 100.34 1wc0 n GLY 1104Ca 0.00 -0.43 0.05 0.00 0.00 0.00 0.00 46.02 45.64 1wc0 n GLY 1104CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wc0 h LEU 1105N 0.00 0.00 -7.78 0.99 3.38 -1.21 -3.43 115.31 107.26 1wc0 h LEU 1105Ca -0.18 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.59 1wc0 h LEU 1105Cb 0.67 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.17 1wc0 h LEU 1105CO 0.26 0.36 -0.66 0.68 0.09 0.00 0.00 178.44 179.17 1wc0 s VAL 1106N -3.05 0.04 0.00 1.22 -7.23 -1.15 -4.75 120.40 105.49 1wc0 s VAL 1106Ca 0.03 -0.34 0.00 0.00 -1.81 0.00 0.00 61.98 59.86 1wc0 s VAL 1106Cb 0.07 -0.16 0.00 0.00 0.56 0.00 0.00 36.38 36.85 1wc0 s VAL 1106CO 0.75 -0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.96 1wc0 n GLY 1107N 2.47 0.69 3.64 2.32 0.00 -0.94 -4.30 105.19 109.07 1wc0 n GLY 1107Ca -0.17 -0.77 -0.09 0.00 0.00 0.00 0.00 46.02 45.00 1wc0 n GLY 1107CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wc0 s ARG 1108N -4.41 0.57 -1.32 1.61 3.52 -1.26 -4.74 118.95 112.92 1wc0 s ARG 1108Ca 0.00 0.73 0.00 0.00 -0.13 0.00 0.00 55.73 56.33 1wc0 s ARG 1108Cb 0.00 0.25 0.00 0.00 -1.56 0.00 0.00 34.95 33.64 1wc0 s ARG 1108CO 0.00 -0.08 0.00 -1.71 -0.81 0.00 0.00 175.30 172.70 1wc0 n ASN 1109N 2.63 -4.61 -0.19 -2.12 2.85 -1.26 -3.58 115.26 108.98 1wc0 n ASN 1109Ca -0.14 0.31 0.00 0.00 -0.11 0.00 0.00 54.58 54.64 1wc0 n ASN 1109Cb 0.56 -3.76 0.00 0.00 1.24 0.00 0.00 39.78 37.82 1wc0 n ASN 1109CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1wc0 n GLU 1110N -1.33 0.00 -3.59 1.20 1.02 -1.26 -4.96 120.64 111.72 1wc0 n GLU 1110Ca -0.12 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.62 1wc0 n GLU 1110Cb 0.52 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.83 1wc0 n GLU 1110CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1wc0 s VAL 1111N 0.00 4.91 0.91 2.62 0.11 -1.23 -4.95 120.40 122.76 1wc0 s VAL 1111Ca 0.00 -0.39 -0.12 0.00 -2.93 0.00 0.00 61.98 58.54 1wc0 s VAL 1111Cb 0.00 -3.54 0.08 0.00 -1.53 0.00 0.00 36.38 31.39 1wc0 s VAL 1111CO 0.00 -0.01 0.80 -0.81 -3.33 0.00 0.00 175.10 171.75 1wc0 n PRO 1112N 5.04 -0.26 -0.91 1.54 -0.04 -1.26 -2.20 135.00 136.91 1wc0 n PRO 1112Ca -0.13 -0.02 -0.33 0.00 -0.04 0.00 0.00 63.50 62.98 1wc0 n PRO 1112Cb 0.49 -2.13 0.13 0.00 -0.04 0.00 0.00 33.50 31.95 1wc0 n PRO 1112CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1wc0 n PRO 1113N -2.83 -0.12 -2.26 0.54 -0.04 -1.26 -4.76 135.00 124.27 1wc0 n PRO 1113Ca 0.10 0.03 -0.41 0.00 -0.04 0.00 0.00 63.50 63.17 1wc0 n PRO 1113Cb 0.52 -2.18 -0.03 0.00 -0.04 0.00 0.00 33.50 31.77 1wc0 n PRO 1113CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1wc0 s VAL 1114N -2.32 3.29 0.04 0.52 1.01 -1.26 -4.88 120.40 116.79 1wc0 s VAL 1114Ca 0.66 1.08 -0.00 0.00 0.00 0.00 0.00 61.98 63.72 1wc0 s VAL 1114Cb -0.26 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1wc0 s VAL 1114CO 0.58 0.17 0.17 -0.13 0.00 0.00 0.00 175.10 175.90 1wc0 s ARG 1115N -0.27 3.31 -0.04 2.72 0.52 -0.45 -4.92 118.95 119.83 1wc0 s ARG 1115Ca 0.55 -0.45 0.07 0.00 -0.52 0.00 0.00 55.73 55.38 1wc0 s ARG 1115Cb -0.35 -2.99 -0.01 0.00 0.52 0.00 0.00 34.95 32.11 1wc0 s ARG 1115CO 0.39 0.62 -0.25 0.12 0.02 0.00 0.00 175.30 176.21 1wc0 s PHE 1116N -1.41 2.29 -0.02 -0.53 5.36 -1.26 -1.00 117.98 121.41 1wc0 s PHE 1116Ca 0.31 -0.56 0.01 0.00 -0.96 0.00 0.00 56.93 55.73 1wc0 s PHE 1116Cb -0.13 -1.49 0.01 0.00 -0.34 0.00 0.00 43.02 41.07 1wc0 s PHE 1116CO 0.23 -0.13 -0.04 1.03 -1.46 0.00 0.00 175.22 174.85 1wc0 s ARG 1117N -0.36 0.55 -0.01 10.12 0.52 -0.08 0.23 118.95 129.92 1wc0 s ARG 1117Ca 0.03 -0.10 0.01 0.00 -0.52 0.00 0.00 55.73 55.15 1wc0 s ARG 1117Cb -0.12 -0.59 0.01 0.00 0.52 0.00 0.00 34.95 34.77 1wc0 s ARG 1117CO 0.01 -0.01 -0.04 0.00 0.02 0.00 0.00 175.30 175.29 1wc0 s GLY 1119N 0.28 0.93 -0.02 0.00 0.00 0.11 -1.41 107.32 107.21 1wc0 s GLY 1119Ca -0.03 -0.63 0.04 0.00 0.00 0.00 0.00 44.72 44.10 1wc0 s GLY 1119CO -0.00 -0.20 -0.13 -0.42 0.00 0.00 0.00 173.10 172.35 1wc0 s ILE 1120N 0.27 1.04 -0.04 0.90 1.01 -0.55 -1.14 121.20 122.69 1wc0 s ILE 1120Ca -0.09 -0.53 -0.12 0.00 0.00 0.00 0.00 60.65 59.91 1wc0 s ILE 1120Cb -0.14 -0.89 0.02 0.00 0.01 0.00 0.00 42.46 41.47 1wc0 s ILE 1120CO 0.03 0.30 0.27 -2.28 0.00 0.00 0.00 174.94 173.27 1wc0 s HIS 1121N -0.08 -0.18 -0.08 3.97 2.46 -0.78 -2.55 115.29 118.06 1wc0 s HIS 1121Ca 0.01 0.35 0.04 0.00 0.47 0.00 0.00 55.06 55.93 1wc0 s HIS 1121Cb -0.08 0.07 -0.00 0.00 -0.13 0.00 0.00 32.58 32.45 1wc0 s HIS 1121CO 0.00 -0.30 -0.21 -1.14 -2.47 0.00 0.00 174.74 170.62 1wc0 s GLN 1122N -0.88 2.54 -0.06 2.88 0.74 -1.26 -0.07 119.66 123.55 1wc0 s GLN 1122Ca -0.10 -0.77 -0.21 0.00 0.05 0.00 0.00 55.36 54.34 1wc0 s GLN 1122Cb -0.05 -2.01 0.07 0.00 1.10 0.00 0.00 33.01 32.12 1wc0 s GLN 1122CO 0.03 0.20 0.93 0.41 -0.55 0.00 0.00 175.29 176.31 1wc0 n GLY 1123N 3.40 0.20 3.78 2.59 0.00 -0.42 -4.81 105.19 109.92 1wc0 n GLY 1123Ca -0.19 -0.95 -0.37 0.00 0.00 0.00 0.00 46.02 44.51 1wc0 n GLY 1123CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wc0 s MET 1124N -2.00 4.02 -0.15 1.61 -1.94 -1.26 -1.60 119.30 117.97 1wc0 s MET 1124Ca 0.22 1.59 -0.27 0.00 -1.71 0.00 0.00 55.69 55.52 1wc0 s MET 1124Cb -0.00 -2.48 0.07 0.00 2.01 0.00 0.00 34.83 34.43 1wc0 s MET 1124CO -0.02 -0.28 0.68 0.00 -0.01 0.00 0.00 175.02 175.39 1wc0 s ALA 1125N -1.64 -1.72 -0.48 3.03 0.00 -0.34 -4.32 121.76 116.29 1wc0 s ALA 1125Ca 0.60 1.61 -0.27 0.00 0.00 0.00 0.00 51.96 53.90 1wc0 s ALA 1125Cb -0.24 -0.56 0.03 0.00 0.00 0.00 0.00 23.12 22.35 1wc0 s ALA 1125CO 0.29 -0.35 1.01 0.08 0.00 0.00 0.00 175.76 176.80 1wc0 s VAL 1126N -0.43 4.35 0.05 0.00 1.01 -0.52 -0.95 120.40 123.91 1wc0 s VAL 1126Ca -0.06 0.87 0.02 0.00 0.00 0.00 0.00 61.98 62.82 1wc0 s VAL 1126Cb -0.03 -4.52 -0.04 0.00 0.00 0.00 0.00 36.38 31.80 1wc0 s VAL 1126CO 0.05 -0.95 0.05 -0.69 0.00 0.00 0.00 175.10 173.56 1wc0 s VAL 1127N 4.07 4.38 -5.00 2.92 1.01 0.38 -1.55 120.40 126.61 1wc0 s VAL 1127Ca 0.40 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.68 1wc0 s VAL 1127Cb -0.09 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1wc0 s VAL 1127CO 0.28 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1wc0 n GLY 1128N 0.82 0.81 3.68 4.51 0.00 -0.99 -0.72 105.19 113.30 1wc0 n GLY 1128Ca -0.11 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.69 1wc0 n GLY 1128CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wc0 s LEU 1129N 0.00 4.19 0.01 0.99 1.43 0.17 -1.74 118.68 123.73 1wc0 s LEU 1129Ca 0.00 1.11 0.08 0.00 -1.03 0.00 0.00 54.13 54.29 1wc0 s LEU 1129Cb 0.00 -3.14 -0.03 0.00 0.03 0.00 0.00 46.19 43.05 1wc0 s LEU 1129CO 0.00 -0.33 -0.23 -0.36 0.23 0.00 0.00 176.35 175.66 1wc0 s PHE 1130N 1.88 2.41 -1.49 0.29 0.40 -0.35 -4.37 117.98 116.75 1wc0 s PHE 1130Ca 0.36 -0.36 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 1wc0 s PHE 1130Cb -0.17 -1.47 0.00 0.00 0.51 0.00 0.00 43.02 41.89 1wc0 s PHE 1130CO 0.13 0.09 0.00 0.41 0.70 0.00 0.00 175.22 176.55 1wc0 n GLY 1131N 2.05 0.42 3.42 4.36 0.00 -1.26 -1.93 105.19 112.24 1wc0 n GLY 1131Ca -0.16 -1.64 -0.23 0.00 0.00 0.00 0.00 46.02 43.98 1wc0 n GLY 1131CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wc0 s SER 1132N -4.00 2.29 0.58 1.61 1.04 0.51 -4.95 113.70 110.79 1wc0 s SER 1132Ca 0.00 -1.71 0.27 0.00 0.48 0.00 0.00 55.95 54.99 1wc0 s SER 1132Cb 0.00 0.54 1.66 0.00 0.10 0.00 0.00 66.02 68.32 1wc0 s SER 1132CO 0.00 -0.99 2.15 1.56 0.98 0.00 0.00 173.24 176.94 1wc0 h GLN 1133N 1.94 0.00 0.01 4.02 4.20 -2.02 -0.87 115.11 122.39 1wc0 h GLN 1133Ca -0.31 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.20 1wc0 h GLN 1133Cb 1.26 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.01 1wc0 h GLN 1133CO 0.48 0.00 -0.97 0.93 -0.67 0.00 0.00 178.83 178.60 1wc0 h GLU 1134N 0.00 0.02 -1.67 1.46 5.08 -2.03 -3.46 114.58 113.98 1wc0 h GLU 1134Ca 0.06 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.47 1wc0 h GLU 1134Cb 0.30 0.01 -0.24 0.00 0.50 0.00 0.00 28.75 29.33 1wc0 h GLU 1134CO -0.00 0.97 0.20 0.50 -1.00 0.00 0.00 179.01 179.68 1wc0 s ARG 1135N -2.82 0.50 -0.06 2.33 6.06 -0.33 -5.17 118.95 119.45 1wc0 s ARG 1135Ca 0.00 0.92 -0.21 0.00 -2.50 0.00 0.00 55.73 53.95 1wc0 s ARG 1135Cb 0.10 0.21 0.05 0.00 0.06 0.00 0.00 34.95 35.36 1wc0 s ARG 1135CO 0.82 -0.12 0.48 -1.54 -2.50 0.00 0.00 175.30 172.44 1wc0 s SER 1136N 1.69 -0.43 0.09 -2.12 1.04 -1.24 -0.36 113.70 112.37 1wc0 s SER 1136Ca -0.08 0.50 0.02 0.00 0.48 0.00 0.00 55.95 56.86 1wc0 s SER 1136Cb -0.05 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.57 1wc0 s SER 1136CO -0.17 -0.45 -0.07 -1.81 0.98 0.00 0.00 173.24 171.72 1wc0 s ASP 1137N -0.96 1.08 -0.15 7.02 1.01 -0.81 -4.91 116.67 118.94 1wc0 s ASP 1137Ca -0.10 -0.93 -0.24 0.00 0.71 0.00 0.00 52.55 52.00 1wc0 s ASP 1137Cb -0.03 0.09 -0.02 0.00 1.01 0.00 0.00 42.92 43.96 1wc0 s ASP 1137CO 0.06 -0.42 0.75 0.12 0.21 0.00 0.00 175.17 175.89 1wc0 s PHE 1138N -3.23 3.44 0.34 4.23 5.36 -1.26 -1.21 117.98 125.65 1wc0 s PHE 1138Ca 0.08 1.17 -0.17 0.00 -0.96 0.00 0.00 56.93 57.05 1wc0 s PHE 1138Cb 0.03 -2.92 0.06 0.00 -0.34 0.00 0.00 43.02 39.85 1wc0 s PHE 1138CO -0.04 -0.15 0.85 -0.08 -1.46 0.00 0.00 175.22 174.34 1wc0 s THR 1139N 1.80 0.00 0.06 0.12 -1.32 -0.71 -4.90 115.64 110.68 1wc0 s THR 1139Ca 0.36 -0.90 0.07 0.00 -1.21 0.00 0.00 61.69 60.01 1wc0 s THR 1139Cb -0.17 -2.93 -0.03 0.00 -1.51 0.00 0.00 72.50 67.86 1wc0 s THR 1139CO 0.13 0.00 -0.16 0.00 -2.21 0.00 0.00 174.62 172.38 1wc0 s ALA 1140N -2.20 2.68 0.03 11.08 0.00 -1.26 -2.34 121.76 129.75 1wc0 s ALA 1140Ca 0.17 -1.21 0.02 0.00 0.00 0.00 0.00 51.96 50.95 1wc0 s ALA 1140Cb -0.05 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.28 1wc0 s ALA 1140CO 0.10 0.59 -0.08 0.42 0.00 0.00 0.00 175.76 176.79 1wc0 s ILE 1141N -1.00 0.58 0.00 0.00 -1.09 -0.60 -4.96 121.20 114.13 1wc0 s ILE 1141Ca 0.16 -0.80 0.00 0.00 -2.23 0.00 0.00 60.65 57.78 1wc0 s ILE 1141Cb -0.11 -0.58 0.00 0.00 -1.58 0.00 0.00 42.46 40.19 1wc0 s ILE 1141CO 0.07 -0.17 0.00 0.61 -1.23 0.00 0.00 174.94 174.22 1wc0 n GLY 1142N 1.98 3.43 0.41 6.18 0.00 -1.26 -1.44 105.19 114.49 1wc0 n GLY 1142Ca -0.19 -1.78 0.22 0.00 0.00 0.00 0.00 46.02 44.27 1wc0 n GLY 1142CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1wc0 h PRO 1143N 0.00 0.35 -0.79 1.61 0.11 -1.99 -0.06 132.00 131.22 1wc0 h PRO 1143Ca 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1wc0 h PRO 1143Cb 0.00 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 30.99 1wc0 h PRO 1143CO 0.00 0.23 0.45 0.77 -0.21 0.00 0.00 178.00 179.25 1wc0 h SER 1144N 0.36 0.96 -0.24 -2.05 0.02 -1.90 0.10 113.55 110.80 1wc0 h SER 1144Ca 0.51 -0.07 -0.17 0.00 -0.84 0.00 0.00 61.79 61.22 1wc0 h SER 1144Cb 1.36 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1wc0 h SER 1144CO -0.19 0.75 -0.51 0.58 -1.14 0.00 0.00 176.83 176.32 1wc0 h VAL 1145N 1.09 1.29 -0.93 2.27 2.07 -1.32 -2.54 116.25 118.20 1wc0 h VAL 1145Ca 0.28 -1.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.08 1wc0 h VAL 1145Cb -0.01 1.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 1wc0 h VAL 1145CO -0.05 0.55 0.54 0.78 0.02 0.00 0.00 177.57 179.41 1wc0 h ASN 1146N 0.52 1.13 -0.07 0.57 2.35 -0.99 -2.15 115.58 116.93 1wc0 h ASN 1146Ca 0.00 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1wc0 h ASN 1146Cb 1.12 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 39.20 1wc0 h ASN 1146CO 0.11 0.88 0.04 0.40 -1.65 0.00 0.00 177.43 177.21 1wc0 h ILE 1147N 1.28 1.08 -0.98 2.81 2.04 -0.89 -0.87 117.51 121.98 1wc0 h ILE 1147Ca 0.33 -0.22 0.10 0.00 1.00 0.00 0.00 64.86 66.07 1wc0 h ILE 1147Cb -0.03 1.11 -0.08 0.00 -0.74 0.00 0.00 36.82 37.08 1wc0 h ILE 1147CO -0.06 0.07 0.63 0.00 0.00 0.00 0.00 178.15 178.78 1wc0 h ALA 1148N 0.95 1.52 -0.38 1.87 0.00 -1.14 0.24 119.26 122.32 1wc0 h ALA 1148Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1wc0 h ALA 1148Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1wc0 h ALA 1148CO -0.00 0.27 -0.02 0.00 0.00 0.00 0.00 179.25 179.49 1wc0 h ALA 1149N 1.52 0.51 0.00 0.00 0.00 -0.94 -2.75 119.26 117.60 1wc0 h ALA 1149Ca 0.46 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1wc0 h ALA 1149Cb 0.40 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1wc0 h ALA 1149CO -0.22 0.31 -0.35 0.00 0.00 0.00 0.00 179.25 178.98 1wc0 h ARG 1150N 0.50 0.00 -0.23 0.00 3.08 -0.11 -2.62 114.38 115.01 1wc0 h ARG 1150Ca 0.10 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.01 1wc0 h ARG 1150Cb 0.50 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1wc0 h ARG 1150CO 0.02 0.35 -0.47 -0.07 -1.07 0.00 0.00 179.97 178.74 1wc0 h LEU 1151N 0.00 0.64 -0.67 3.04 3.38 -0.84 -2.32 115.31 118.53 1wc0 h LEU 1151Ca -0.00 -0.31 -0.14 0.00 0.09 0.00 0.00 57.88 57.51 1wc0 h LEU 1151Cb 0.67 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1wc0 h LEU 1151CO 0.05 1.01 -0.55 -0.61 0.09 0.00 0.00 178.44 178.43 1wc0 h GLN 1152N 0.47 0.32 0.00 1.13 -0.00 -1.19 -2.50 115.11 113.34 1wc0 h GLN 1152Ca 0.03 -0.20 0.00 0.00 -0.00 0.00 0.00 58.65 58.48 1wc0 h GLN 1152Cb 0.99 0.02 0.00 0.00 0.00 0.00 0.00 27.48 28.50 1wc0 h GLN 1152CO 0.09 0.79 -0.13 0.39 0.00 0.00 0.00 178.83 179.96 1wc0 n GLU 1153N -3.92 0.09 -0.07 1.69 1.02 -1.01 -3.87 120.64 114.56 1wc0 n GLU 1153Ca -0.02 0.06 -0.13 0.00 -0.02 0.00 0.00 57.16 57.05 1wc0 n GLU 1153Cb 0.59 -1.59 -0.14 0.00 -0.02 0.00 0.00 31.44 30.27 1wc0 n GLU 1153CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wc0 n ALA 1154N -1.60 1.40 -0.95 0.62 0.00 -0.88 -4.98 120.51 114.12 1wc0 n ALA 1154Ca 0.06 -1.04 -0.31 0.00 0.00 0.00 0.00 53.44 52.15 1wc0 n ALA 1154Cb 0.37 -0.40 0.13 0.00 0.00 0.00 0.00 19.45 19.55 1wc0 n ALA 1154CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1wc0 s THR 1155N -2.53 2.58 0.76 0.00 -1.32 -0.96 -5.02 115.64 109.15 1wc0 s THR 1155Ca -0.16 0.19 -0.12 0.00 -1.21 0.00 0.00 61.69 60.40 1wc0 s THR 1155Cb 0.07 -2.42 0.05 0.00 -1.51 0.00 0.00 72.50 68.69 1wc0 s THR 1155CO 0.77 -0.24 1.13 0.00 -2.21 0.00 0.00 174.62 174.07 1wc0 s ALA 1156N -2.73 2.73 0.40 11.08 0.00 -1.26 -4.99 121.76 126.99 1wc0 s ALA 1156Ca 0.65 -0.46 -0.25 0.00 0.00 0.00 0.00 51.96 51.90 1wc0 s ALA 1156Cb -0.21 -3.01 -0.11 0.00 0.00 0.00 0.00 23.12 19.79 1wc0 s ALA 1156CO 0.57 -1.42 0.97 -2.30 0.00 0.00 0.00 175.76 173.57 1wc0 n PRO 1157N -3.18 1.28 -4.06 0.00 -0.02 -1.26 -2.76 135.00 125.00 1wc0 n PRO 1157Ca 0.07 0.46 -0.32 0.00 -2.02 0.00 0.00 63.50 61.69 1wc0 n PRO 1157Cb 0.59 -1.96 -0.01 0.00 -0.02 0.00 0.00 33.50 32.10 1wc0 n PRO 1157CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1wc0 n ASN 1158N 0.71 -3.03 -4.23 2.55 5.03 0.61 -4.90 115.26 112.02 1wc0 n ASN 1158Ca 0.10 -0.94 -0.13 0.00 0.87 0.00 0.00 54.58 54.48 1wc0 n ASN 1158Cb 0.38 -3.19 -0.10 0.00 -1.02 0.00 0.00 39.78 35.85 1wc0 n ASN 1158CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1wc0 s SER 1159N -3.56 1.16 -0.15 6.41 1.04 -1.07 -4.96 113.70 112.56 1wc0 s SER 1159Ca 0.54 -1.15 0.01 0.00 0.48 0.00 0.00 55.95 55.83 1wc0 s SER 1159Cb -0.28 0.12 0.02 0.00 0.10 0.00 0.00 66.02 65.98 1wc0 s SER 1159CO 0.89 -0.56 -0.18 -0.63 0.98 0.00 0.00 173.24 173.74 1wc0 s ILE 1160N -3.67 1.82 -0.14 -1.02 1.01 -1.26 -2.14 121.20 115.80 1wc0 s ILE 1160Ca 0.22 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 60.09 1wc0 s ILE 1160Cb 0.06 -1.66 0.01 0.00 0.01 0.00 0.00 42.46 40.87 1wc0 s ILE 1160CO 0.03 0.50 -0.21 -0.32 0.00 0.00 0.00 174.94 174.94 1wc0 s MET 1161N 1.26 3.07 0.29 2.79 1.75 -0.50 -1.53 119.30 126.43 1wc0 s MET 1161Ca 0.02 -0.83 0.10 0.00 -1.25 0.00 0.00 55.69 53.73 1wc0 s MET 1161Cb -0.14 -2.46 -0.05 0.00 2.84 0.00 0.00 34.83 35.02 1wc0 s MET 1161CO -0.09 0.03 -0.15 0.14 -0.65 0.00 0.00 175.02 174.29 1wc0 s VAL 1162N 0.74 2.24 0.62 10.11 -7.23 -0.24 -1.48 120.40 125.16 1wc0 s VAL 1162Ca -0.08 -2.30 -0.03 0.00 -1.81 0.00 0.00 61.98 57.75 1wc0 s VAL 1162Cb -0.16 -2.37 0.04 0.00 0.56 0.00 0.00 36.38 34.45 1wc0 s VAL 1162CO 0.00 -0.37 0.89 -0.94 -0.31 0.00 0.00 175.10 174.37 1wc0 s SER 1163N -3.50 5.11 0.36 4.85 1.04 -1.06 -0.27 113.70 120.23 1wc0 s SER 1163Ca 0.30 0.27 0.07 0.00 0.48 0.00 0.00 55.95 57.06 1wc0 s SER 1163Cb -0.02 -1.07 0.78 0.00 0.10 0.00 0.00 66.02 65.81 1wc0 s SER 1163CO 0.14 -1.32 1.93 0.00 0.98 0.00 0.00 173.24 174.96 1wc0 h ALA 1164N -0.24 1.76 -0.46 5.32 0.00 -1.89 0.08 119.26 123.84 1wc0 h ALA 1164Ca -0.44 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.50 1wc0 h ALA 1164Cb 1.30 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1wc0 h ALA 1164CO 0.57 0.08 0.31 1.98 0.00 0.00 0.00 179.25 182.18 1wc0 h MET 1165N 0.72 0.48 0.14 0.00 1.85 -1.90 -2.24 114.93 113.98 1wc0 h MET 1165Ca 0.36 -0.03 -0.27 0.00 -0.61 0.00 0.00 59.70 59.15 1wc0 h MET 1165Cb 0.44 -0.11 0.01 0.00 0.43 0.00 0.00 31.60 32.36 1wc0 h MET 1165CO -0.14 0.32 -1.31 0.28 -0.40 0.00 0.00 176.91 175.66 1wc0 h VAL 1166N 0.50 1.15 -0.50 -5.77 2.07 -1.37 -3.36 116.25 108.96 1wc0 h VAL 1166Ca 0.19 -2.46 0.11 0.00 0.82 0.00 0.00 66.70 65.36 1wc0 h VAL 1166Cb 0.13 2.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.72 1wc0 h VAL 1166CO -0.05 0.73 0.34 0.00 0.02 0.00 0.00 177.57 178.61 1wc0 h ALA 1167N 0.01 2.24 -0.03 1.67 0.00 -0.75 -2.01 119.26 120.39 1wc0 h ALA 1167Ca -0.27 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1wc0 h ALA 1167Cb 1.79 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 1wc0 h ALA 1167CO 0.10 -0.37 0.10 -0.56 0.00 0.00 0.00 179.25 178.53 1wc0 h GLN 1168N 0.16 0.00 -0.01 0.00 3.07 -1.57 0.26 115.11 117.04 1wc0 h GLN 1168Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.97 1wc0 h GLN 1168Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.26 1wc0 h GLN 1168CO -0.03 0.00 -0.70 0.66 0.09 0.00 0.00 178.83 178.84 1wc0 n TYR 1169N -3.23 0.00 -3.66 0.06 4.02 -0.76 -4.93 117.16 108.66 1wc0 n TYR 1169Ca -0.02 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.51 1wc0 n TYR 1169Cb 0.18 -0.04 -0.07 0.00 -0.02 0.00 0.00 39.34 39.39 1wc0 n TYR 1169CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1wc0 s VAL 1170N -2.78 5.36 0.10 -0.72 1.01 0.08 -4.98 120.40 118.48 1wc0 s VAL 1170Ca 0.13 0.36 -0.36 0.00 0.00 0.00 0.00 61.98 62.12 1wc0 s VAL 1170Cb 0.17 -3.54 -0.16 0.00 0.00 0.00 0.00 36.38 32.85 1wc0 s VAL 1170CO 0.72 0.45 1.32 -2.65 0.00 0.00 0.00 175.10 174.93 1wc0 n PRO 1171N 3.30 1.19 -0.33 2.72 -0.02 -1.26 -4.83 135.00 135.77 1wc0 n PRO 1171Ca -0.15 0.43 0.19 0.00 -2.02 0.00 0.00 63.50 61.95 1wc0 n PRO 1171Cb 0.52 -2.05 0.44 0.00 -0.02 0.00 0.00 33.50 32.39 1wc0 n PRO 1171CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1wc0 h ASP 1172N 4.41 0.57 0.74 2.55 3.32 -1.96 0.16 116.42 126.21 1wc0 h ASP 1172Ca -0.47 0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1wc0 h ASP 1172Cb 1.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 1wc0 h ASP 1172CO 0.77 0.13 0.00 1.05 -1.72 0.00 0.00 179.24 179.47 1wc0 h GLU 1173N 0.51 0.00 -0.01 3.56 9.09 -2.02 -2.52 114.58 123.18 1wc0 h GLU 1173Ca 0.60 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.01 1wc0 h GLU 1173Cb 1.29 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.39 1wc0 h GLU 1173CO -0.35 0.00 -0.05 0.39 0.05 0.00 0.00 179.01 179.05 1wc0 n GLU 1174N -2.33 1.43 -3.10 1.06 1.02 0.55 -4.71 120.64 114.57 1wc0 n GLU 1174Ca 0.02 -0.78 -0.45 0.00 -0.02 0.00 0.00 57.16 55.93 1wc0 n GLU 1174Cb 0.23 -1.48 -0.04 0.00 -0.02 0.00 0.00 31.44 30.13 1wc0 n GLU 1174CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1wc0 s ILE 1175N -2.11 4.81 0.06 -3.67 -1.09 -0.95 -0.04 121.20 118.21 1wc0 s ILE 1175Ca 0.36 -1.01 -0.24 0.00 -2.23 0.00 0.00 60.65 57.53 1wc0 s ILE 1175Cb 0.21 -4.50 -0.16 0.00 -1.58 0.00 0.00 42.46 36.42 1wc0 s ILE 1175CO 0.37 -1.15 1.62 0.40 -1.23 0.00 0.00 174.94 174.96 1wc0 h ILE 1176N 5.91 1.06 -3.64 2.92 2.04 -0.79 -3.46 117.51 121.56 1wc0 h ILE 1176Ca -0.28 -0.27 -0.17 0.00 1.00 0.00 0.00 64.86 65.14 1wc0 h ILE 1176Cb 1.08 1.24 -0.23 0.00 -0.74 0.00 0.00 36.82 38.18 1wc0 h ILE 1176CO 1.10 0.07 -0.59 -0.75 0.00 0.00 0.00 178.15 177.98 1wc0 s LYS 1177N -5.72 0.32 -0.07 2.37 2.20 -1.01 -4.97 119.74 112.86 1wc0 s LYS 1177Ca -0.14 -0.29 0.04 0.00 -0.36 0.00 0.00 55.97 55.22 1wc0 s LYS 1177Cb 0.05 0.13 0.00 0.00 -1.51 0.00 0.00 37.83 36.50 1wc0 s LYS 1177CO 0.66 -0.06 -0.18 1.03 -0.36 0.00 0.00 175.35 176.43 1wc0 s ARG 1178N -0.94 2.19 -0.23 4.03 0.52 -1.26 -0.96 118.95 122.30 1wc0 s ARG 1178Ca -0.10 -0.65 -0.26 0.00 -0.52 0.00 0.00 55.73 54.20 1wc0 s ARG 1178Cb -0.06 -1.77 0.09 0.00 0.52 0.00 0.00 34.95 33.73 1wc0 s ARG 1178CO 0.00 0.16 0.85 -2.00 0.02 0.00 0.00 175.30 174.33 1wc0 s GLU 1179N 0.32 0.74 -0.09 3.54 2.12 -0.80 -5.02 118.70 119.51 1wc0 s GLU 1179Ca -0.12 0.66 -0.23 0.00 0.36 0.00 0.00 54.97 55.65 1wc0 s GLU 1179Cb -0.15 0.36 -0.03 0.00 0.26 0.00 0.00 34.13 34.56 1wc0 s GLU 1179CO 0.05 -0.13 0.68 -0.06 -0.54 0.00 0.00 175.26 175.26 1wc0 s PHE 1180N -0.07 3.54 0.02 5.30 0.40 -1.26 -1.41 117.98 124.49 1wc0 s PHE 1180Ca -0.01 1.18 0.05 0.00 -0.60 0.00 0.00 56.93 57.55 1wc0 s PHE 1180Cb -0.04 -2.79 -0.02 0.00 0.51 0.00 0.00 43.02 40.68 1wc0 s PHE 1180CO 0.00 0.04 -0.14 -0.51 0.70 0.00 0.00 175.22 175.31 1wc0 s LEU 1181N 1.01 2.11 -0.45 -0.37 1.43 -0.68 -4.96 118.68 116.77 1wc0 s LEU 1181Ca 0.35 -0.37 -0.19 0.00 -1.03 0.00 0.00 54.13 52.90 1wc0 s LEU 1181Cb -0.17 -0.66 0.03 0.00 0.03 0.00 0.00 46.19 45.42 1wc0 s LEU 1181CO 0.16 0.10 0.55 -0.70 0.23 0.00 0.00 176.35 176.69 1wc0 s GLU 1182N -0.79 3.16 0.37 1.70 2.12 -1.26 -1.03 118.70 122.98 1wc0 s GLU 1182Ca 0.03 -0.66 -0.13 0.00 0.36 0.00 0.00 54.97 54.58 1wc0 s GLU 1182Cb -0.07 -3.99 -0.08 0.00 0.26 0.00 0.00 34.13 30.25 1wc0 s GLU 1182CO 0.00 -0.99 0.76 -0.51 -0.54 0.00 0.00 175.26 173.99 1wc0 s LEU 1183N 2.48 3.92 0.82 2.70 1.43 -1.26 -5.02 118.68 123.75 1wc0 s LEU 1183Ca 0.16 1.21 -0.13 0.00 -1.03 0.00 0.00 54.13 54.34 1wc0 s LEU 1183Cb -0.17 -4.06 0.08 0.00 0.03 0.00 0.00 46.19 42.07 1wc0 s LEU 1183CO 0.15 -0.32 1.10 1.17 0.23 0.00 0.00 176.35 178.68 1wc0 n LYS 1184N -0.90 0.10 -1.20 1.70 4.81 -1.26 -3.08 118.16 118.33 1wc0 n LYS 1184Ca 0.03 0.11 -0.08 0.00 -0.87 0.00 0.00 58.31 57.50 1wc0 n LYS 1184Cb 0.54 -2.35 -0.03 0.00 0.02 0.00 0.00 35.03 33.20 1wc0 n LYS 1184CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wc0 n GLY 1185N 0.67 0.72 2.79 3.14 0.00 -1.26 -4.90 105.19 106.35 1wc0 n GLY 1185Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1wc0 n GLY 1185CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wc0 s ILE 1186N -1.62 0.48 0.18 -0.61 -1.09 -1.18 -5.06 121.20 112.29 1wc0 s ILE 1186Ca 0.00 0.06 -0.15 0.00 -2.23 0.00 0.00 60.65 58.33 1wc0 s ILE 1186Cb 0.00 -0.62 0.09 0.00 -1.58 0.00 0.00 42.46 40.36 1wc0 s ILE 1186CO 0.00 0.28 1.70 0.44 -1.23 0.00 0.00 174.94 176.12 1wc0 h ASP 1187N 8.30 -0.14 -3.60 3.58 3.32 -1.90 -3.42 116.42 122.55 1wc0 h ASP 1187Ca -0.21 0.10 -0.62 0.00 0.02 0.00 0.00 57.03 56.32 1wc0 h ASP 1187Cb 1.13 0.17 -0.14 0.00 0.22 0.00 0.00 39.33 40.71 1wc0 h ASP 1187CO 0.28 -0.04 -0.33 -1.61 -1.72 0.00 0.00 179.24 175.83 1wc0 s GLU 1188N -6.17 4.09 0.75 3.56 0.41 -1.26 -5.05 118.70 115.02 1wc0 s GLU 1188Ca -0.13 -0.02 -0.16 0.00 -0.41 0.00 0.00 54.97 54.24 1wc0 s GLU 1188Cb 0.15 -3.58 -0.07 0.00 -1.78 0.00 0.00 34.13 28.85 1wc0 s GLU 1188CO 0.72 -0.08 0.15 -2.30 -0.49 0.00 0.00 175.26 173.26 1wc0 n PRO 1189N 4.67 0.13 -4.76 0.39 -0.02 -1.26 -4.88 135.00 129.26 1wc0 n PRO 1189Ca -0.11 0.07 -0.33 0.00 -2.02 0.00 0.00 63.50 61.11 1wc0 n PRO 1189Cb 0.51 -1.52 -0.13 0.00 -0.02 0.00 0.00 33.50 32.35 1wc0 n PRO 1189CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1wc0 s VAL 1190N -1.99 3.32 -0.41 -1.45 1.01 -0.20 -4.94 120.40 115.75 1wc0 s VAL 1190Ca 0.58 -0.62 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 1wc0 s VAL 1190Cb -0.34 -2.34 0.02 0.00 0.00 0.00 0.00 36.38 33.73 1wc0 s VAL 1190CO 0.65 0.58 1.14 -0.32 0.00 0.00 0.00 175.10 177.15 1wc0 s MET 1191N -0.60 3.85 0.02 2.72 1.75 -1.26 -1.69 119.30 124.10 1wc0 s MET 1191Ca 0.09 0.81 -0.00 0.00 -1.25 0.00 0.00 55.69 55.33 1wc0 s MET 1191Cb -0.11 -3.85 -0.04 0.00 2.84 0.00 0.00 34.83 33.67 1wc0 s MET 1191CO 0.01 -1.20 0.14 0.95 -0.65 0.00 0.00 175.02 174.27 1wc0 s THR 1192N 4.21 5.05 -0.12 10.11 -4.23 -0.50 -2.68 115.64 127.47 1wc0 s THR 1192Ca 0.48 -0.38 -0.03 0.00 -1.18 0.00 0.00 61.69 60.57 1wc0 s THR 1192Cb -0.10 -3.38 0.05 0.00 1.34 0.00 0.00 72.50 70.41 1wc0 s THR 1192CO 0.25 0.26 0.06 0.00 -0.54 0.00 0.00 174.62 174.66 1wc0 s VAL 1194N 2.09 4.72 0.33 0.00 1.01 -0.14 -1.08 120.40 127.33 1wc0 s VAL 1194Ca 0.03 1.74 -0.07 0.00 0.00 0.00 0.00 61.98 63.68 1wc0 s VAL 1194Cb -0.14 -4.24 -0.06 0.00 0.00 0.00 0.00 36.38 31.94 1wc0 s VAL 1194CO -0.07 -0.19 0.63 0.27 0.00 0.00 0.00 175.10 175.74 1wc0 s ILE 1195N 3.11 4.94 0.14 2.22 -4.36 -0.58 -0.10 121.20 126.57 1wc0 s ILE 1195Ca 0.40 0.26 -0.31 0.00 -0.26 0.00 0.00 60.65 60.74 1wc0 s ILE 1195Cb -0.15 -3.73 -0.08 0.00 1.25 0.00 0.00 42.46 39.75 1wc0 s ILE 1195CO 0.08 -0.39 1.34 0.21 0.24 0.00 0.00 174.94 176.42 1wc0 s ASN 1196N -3.15 6.89 0.01 4.36 3.84 0.94 -4.54 114.94 123.28 1wc0 s ASN 1196Ca 0.46 2.31 0.05 0.00 0.21 0.00 0.00 52.86 55.89 1wc0 s ASN 1196Cb -0.11 -2.59 0.21 0.00 -0.55 0.00 0.00 41.25 38.22 1wc0 s ASN 1196CO 0.30 -0.58 1.16 -2.65 -2.79 0.00 0.00 177.10 172.54 1wc0 n PRO 1197N 3.49 0.01 -4.99 0.43 -0.02 -1.26 -4.61 135.00 128.04 1wc0 n PRO 1197Ca 0.09 0.43 -0.28 0.00 -2.02 0.00 0.00 63.50 61.72 1wc0 n PRO 1197Cb 0.43 -1.51 -0.15 0.00 -0.02 0.00 0.00 33.50 32.24 1wc0 n PRO 1197CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1wc0 s ASN 1198N -3.04 2.74 0.95 2.55 0.01 -1.26 -4.82 114.94 112.07 1wc0 s ASN 1198Ca 0.02 -0.47 -0.13 0.00 -0.71 0.00 0.00 52.86 51.57 1wc0 s ASN 1198Cb 0.03 -0.28 0.16 0.00 0.41 0.00 0.00 41.25 41.57 1wc0 s ASN 1198CO 0.08 0.25 1.14 -0.32 -1.51 0.00 0.00 177.10 176.74 1wc0 s MET 1199N -0.81 0.79 0.00 -0.60 -2.45 -1.26 -5.01 119.30 109.96 1wc0 s MET 1199Ca 0.09 0.25 0.00 0.00 -1.25 0.00 0.00 55.69 54.78 1wc0 s MET 1199Cb -0.09 -1.80 0.00 0.00 1.25 0.00 0.00 34.83 34.19 1wc0 s MET 1199CO 0.00 -2.42 0.00 1.28 1.05 0.00 0.00 175.02 174.93