#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1djp s LEU 1009N 0.00 4.57 0.71 3.14 1.43 -1.26 -5.04 118.68 122.23 1djp s LEU 1009Ca 0.00 1.63 -0.15 0.00 -1.03 0.00 0.00 54.13 54.58 1djp s LEU 1009Cb 0.00 -3.30 0.03 0.00 0.03 0.00 0.00 46.19 42.95 1djp s LEU 1009CO 0.00 0.17 1.18 0.00 0.23 0.00 0.00 176.35 177.93 1djp s ALA 1010N -0.94 2.20 -0.34 4.21 0.00 -1.26 -4.57 121.76 121.06 1djp s ALA 1010Ca 0.37 0.79 -0.13 0.00 0.00 0.00 0.00 51.96 52.99 1djp s ALA 1010Cb -0.23 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 1djp s ALA 1010CO 0.26 -1.72 0.23 -0.80 0.00 0.00 0.00 175.76 173.73 1djp s ASN 1011N -2.18 6.03 -0.10 0.00 0.01 -1.26 -0.98 114.94 116.46 1djp s ASN 1011Ca 0.72 -0.42 0.03 0.00 -0.71 0.00 0.00 52.86 52.48 1djp s ASN 1011Cb -0.27 -2.13 -0.01 0.00 0.41 0.00 0.00 41.25 39.26 1djp s ASN 1011CO 0.44 -0.23 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.90 1djp s VAL 1012N 1.72 2.35 -0.16 1.60 1.01 -0.08 -0.41 120.40 126.42 1djp s VAL 1012Ca 0.06 -0.93 -0.06 0.00 0.00 0.00 0.00 61.98 61.06 1djp s VAL 1012Cb -0.17 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1djp s VAL 1012CO 0.10 0.55 0.02 -0.69 0.00 0.00 0.00 175.10 175.09 1djp s VAL 1013N 0.19 4.45 -0.33 2.92 1.01 -0.94 -1.53 120.40 126.18 1djp s VAL 1013Ca -0.13 -0.16 -0.12 0.00 0.00 0.00 0.00 61.98 61.58 1djp s VAL 1013Cb -0.16 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.23 1djp s VAL 1013CO 0.07 0.49 0.21 -0.63 0.00 0.00 0.00 175.10 175.23 1djp s ILE 1014N 0.25 5.04 -0.58 2.22 1.01 0.14 -0.92 121.20 128.37 1djp s ILE 1014Ca 0.01 -0.26 -0.17 0.00 0.00 0.00 0.00 60.65 60.23 1djp s ILE 1014Cb -0.13 -3.57 0.12 0.00 0.01 0.00 0.00 42.46 38.89 1djp s ILE 1014CO 0.01 0.04 0.59 -0.76 0.00 0.00 0.00 174.94 174.82 1djp s LEU 1015N 1.69 5.90 0.09 2.97 1.02 0.26 -1.09 118.68 129.52 1djp s LEU 1015Ca 0.06 -1.69 -0.29 0.00 0.02 0.00 0.00 54.13 52.22 1djp s LEU 1015Cb -0.17 -2.25 -0.06 0.00 0.02 0.00 0.00 46.19 43.74 1djp s LEU 1015CO 0.09 -0.95 0.92 0.00 0.02 0.00 0.00 176.35 176.43 1djp s ALA 1016N 1.97 3.26 0.00 4.21 0.00 0.52 -2.07 121.76 129.66 1djp s ALA 1016Ca 0.07 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.55 1djp s ALA 1016Cb -0.27 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1djp s ALA 1016CO 0.04 -0.02 0.39 0.25 0.00 0.00 0.00 175.76 176.41 1djp n THR 1017N 2.86 0.12 0.00 0.00 -2.24 -0.81 -1.15 114.28 113.06 1djp n THR 1017Ca 0.02 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1djp n THR 1017Cb 0.49 1.29 0.00 0.00 -2.10 0.00 0.00 70.33 70.01 1djp n THR 1017CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1djp n GLY 1018N -0.06 0.47 2.82 3.38 0.00 -1.23 -1.31 105.19 109.26 1djp n GLY 1018Ca 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1djp n GLY 1018CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1djp n GLY 1019N 0.00 -1.84 0.14 -0.02 0.00 -0.99 -4.12 105.19 98.36 1djp n GLY 1019Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1djp n GLY 1019CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1djp h THR 1020N 0.00 1.29 -0.97 2.61 2.02 -1.86 -1.77 112.91 114.23 1djp h THR 1020Ca 0.00 -2.08 0.03 0.00 0.77 0.00 0.00 66.41 65.13 1djp h THR 1020Cb 0.00 2.16 -0.06 0.00 -1.74 0.00 0.00 68.15 68.51 1djp h THR 1020CO 0.00 0.57 0.64 0.40 0.37 0.00 0.00 175.52 177.50 1djp h ILE 1021N 0.00 1.18 -0.54 3.11 5.03 -1.80 0.18 117.51 124.68 1djp h ILE 1021Ca -0.01 -0.43 -0.02 0.00 -0.12 0.00 0.00 64.86 64.28 1djp h ILE 1021Cb 1.11 -0.17 -0.01 0.00 -3.03 0.00 0.00 36.82 34.72 1djp h ILE 1021CO 0.08 0.23 0.03 0.00 -0.68 0.00 0.00 178.15 177.80 1djp n ALA 1022N -2.37 3.83 -1.95 1.87 0.00 -1.20 -4.20 120.51 116.50 1djp n ALA 1022Ca 0.13 -1.77 -0.26 0.00 0.00 0.00 0.00 53.44 51.53 1djp n ALA 1022Cb 0.08 -1.13 0.12 0.00 0.00 0.00 0.00 19.45 18.51 1djp n ALA 1022CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1djp s GLY 1023N -0.72 1.74 -0.17 0.00 0.00 0.61 0.38 107.32 109.16 1djp s GLY 1023Ca 0.49 -1.25 -0.09 0.00 0.00 0.00 0.00 44.72 43.87 1djp s GLY 1023CO 0.14 -0.69 0.41 0.00 0.00 0.00 0.00 173.10 172.97 1djp s ALA 1024N -3.41 -1.07 0.38 3.20 0.00 0.12 -3.99 121.76 116.99 1djp s ALA 1024Ca 0.66 1.54 0.08 0.00 0.00 0.00 0.00 51.96 54.23 1djp s ALA 1024Cb -0.07 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 22.06 1djp s ALA 1024CO 0.47 -0.32 0.40 0.20 0.00 0.00 0.00 175.76 176.51 1djp s GLY 1025N 1.53 1.94 0.30 0.00 0.00 -1.26 -1.03 107.32 108.80 1djp s GLY 1025Ca -0.09 -1.73 0.05 0.00 0.00 0.00 0.00 44.72 42.95 1djp s GLY 1025CO -0.13 -1.59 1.72 0.00 0.00 0.00 0.00 173.10 173.10 1djp h ALA 1026N 1.01 1.13 -3.76 3.20 0.00 -1.90 -3.47 119.26 115.48 1djp h ALA 1026Ca -0.43 -0.38 -0.22 0.00 0.00 0.00 0.00 54.91 53.89 1djp h ALA 1026Cb 1.26 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 1djp h ALA 1026CO 0.55 0.56 -0.18 -1.13 0.00 0.00 0.00 179.25 179.05 1djp n SER 1027N -4.07 -0.57 0.18 0.00 3.41 -1.26 -5.04 113.62 106.26 1djp n SER 1027Ca -0.01 -2.16 0.06 0.00 -0.26 0.00 0.00 58.87 56.50 1djp n SER 1027Cb 0.44 1.17 0.14 0.00 -0.26 0.00 0.00 64.21 65.71 1djp n SER 1027CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1djp h ALA 1028N 1.68 0.82 -0.00 7.33 0.00 -1.91 -3.11 119.26 124.06 1djp h ALA 1028Ca -0.14 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1djp h ALA 1028Cb 0.68 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1djp h ALA 1028CO 0.20 0.40 -0.05 0.00 0.00 0.00 0.00 179.25 179.80 1djp n ALA 1029N -2.19 2.55 -2.95 0.00 0.00 -1.26 0.19 120.51 116.84 1djp n ALA 1029Ca 0.02 -0.16 -0.44 0.00 0.00 0.00 0.00 53.44 52.86 1djp n ALA 1029Cb 0.63 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.61 1djp n ALA 1029CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1djp s ASN 1030N -2.70 6.38 -0.01 0.00 0.02 -1.18 -4.81 114.94 112.63 1djp s ASN 1030Ca 0.24 -1.56 0.19 0.00 -1.02 0.00 0.00 52.86 50.70 1djp s ASN 1030Cb 0.20 -2.38 -0.26 0.00 0.02 0.00 0.00 41.25 38.83 1djp s ASN 1030CO 0.50 -1.20 0.58 -1.54 0.02 0.00 0.00 177.10 175.46 1djp n SER 1031N 6.83 0.73 0.00 -1.22 3.41 -1.26 -4.38 113.62 117.74 1djp n SER 1031Ca 0.07 -0.41 0.00 0.00 -0.26 0.00 0.00 58.87 58.27 1djp n SER 1031Cb 0.46 1.49 0.00 0.00 -0.26 0.00 0.00 64.21 65.91 1djp n SER 1031CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1djp n ALA 1032N -1.85 1.77 -2.83 7.33 0.00 -1.26 -4.37 120.51 119.30 1djp n ALA 1032Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.03 1djp n ALA 1032Cb 0.41 0.10 -0.11 0.00 0.00 0.00 0.00 19.45 19.84 1djp n ALA 1032CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1djp s THR 1033N -1.77 4.57 0.22 0.00 2.01 -1.26 -5.04 115.64 114.37 1djp s THR 1033Ca 0.00 -0.81 -0.21 0.00 0.31 0.00 0.00 61.69 60.98 1djp s THR 1033Cb 0.00 -3.53 0.07 0.00 0.01 0.00 0.00 72.50 69.06 1djp s THR 1033CO 0.00 -0.20 1.00 -0.72 -0.69 0.00 0.00 174.62 174.01 1djp s TYR 1034N 1.56 0.08 -0.17 4.92 1.13 -1.26 -4.52 117.35 119.09 1djp s TYR 1034Ca 0.02 -0.52 -0.01 0.00 -1.41 0.00 0.00 57.07 55.15 1djp s TYR 1034Cb -0.19 0.72 -0.00 0.00 -1.10 0.00 0.00 41.96 41.39 1djp s TYR 1034CO 0.07 -1.03 -0.12 -0.65 -2.51 0.00 0.00 175.55 171.30 1djp s GLN 1035N -2.20 3.27 0.77 -3.49 -1.52 -0.20 -4.93 119.66 111.36 1djp s GLN 1035Ca 0.21 -0.71 -0.12 0.00 -1.95 0.00 0.00 55.36 52.79 1djp s GLN 1035Cb -0.03 -2.73 0.05 0.00 -0.22 0.00 0.00 33.01 30.08 1djp s GLN 1035CO 0.06 -0.03 1.14 0.00 -0.25 0.00 0.00 175.29 176.21 1djp s ALA 1036N 0.97 2.69 -1.31 6.09 0.00 -1.26 0.15 121.76 129.10 1djp s ALA 1036Ca -0.02 -0.48 -0.01 0.00 0.00 0.00 0.00 51.96 51.45 1djp s ALA 1036Cb -0.15 -3.00 -0.00 0.00 0.00 0.00 0.00 23.12 19.97 1djp s ALA 1036CO -0.02 -1.47 0.67 0.00 0.00 0.00 0.00 175.76 174.95 1djp n ALA 1037N -3.21 -2.04 -0.01 0.00 0.00 -0.69 -4.84 120.51 109.72 1djp n ALA 1037Ca 0.07 -0.18 0.03 0.00 0.00 0.00 0.00 53.44 53.36 1djp n ALA 1037Cb 0.59 -2.02 -0.08 0.00 0.00 0.00 0.00 19.45 17.95 1djp n ALA 1037CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1djp n LYS 1038N -4.26 0.85 -4.22 0.00 4.76 0.16 -4.89 118.16 110.56 1djp n LYS 1038Ca -0.29 -0.07 -0.33 0.00 -2.87 0.00 0.00 58.31 54.75 1djp n LYS 1038Cb 0.68 -1.24 -0.08 0.00 -1.84 0.00 0.00 35.03 32.55 1djp n LYS 1038CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1djp s VAL 1039N -2.58 4.41 0.81 -0.18 1.01 0.14 -5.01 120.40 119.00 1djp s VAL 1039Ca -0.04 -0.48 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 1djp s VAL 1039Cb 0.05 -2.97 0.09 0.00 0.00 0.00 0.00 36.38 33.55 1djp s VAL 1039CO 0.41 0.40 1.18 -0.83 0.00 0.00 0.00 175.10 176.25 1djp s GLY 1040N -1.54 1.63 0.07 4.51 0.00 -1.26 -4.80 107.32 105.93 1djp s GLY 1040Ca 0.20 -0.76 -0.19 0.00 0.00 0.00 0.00 44.72 43.97 1djp s GLY 1040CO 0.11 -0.25 1.47 -0.24 0.00 0.00 0.00 173.10 174.19 1djp h VAL 1041N -1.07 1.28 0.00 1.40 3.04 -1.97 -2.69 116.25 116.23 1djp h VAL 1041Ca -0.46 -1.01 0.00 0.00 -1.01 0.00 0.00 66.70 64.23 1djp h VAL 1041Cb 1.32 1.51 0.00 0.00 -2.01 0.00 0.00 31.29 32.11 1djp h VAL 1041CO 0.62 0.31 0.00 -0.90 -1.01 0.00 0.00 177.57 176.59 1djp n ASP 1042N -4.62 0.00 0.05 3.17 3.85 -1.26 -1.83 116.55 115.92 1djp n ASP 1042Ca -0.04 0.46 -0.12 0.00 -0.71 0.00 0.00 54.79 54.38 1djp n ASP 1042Cb 0.27 -0.49 -0.13 0.00 -1.35 0.00 0.00 41.12 39.42 1djp n ASP 1042CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.20 176.69 1djp h LYS 1043N 0.00 0.12 -0.21 0.11 3.64 -1.93 -2.32 116.57 115.99 1djp h LYS 1043Ca 0.00 -0.21 -0.08 0.00 -1.27 0.00 0.00 60.65 59.09 1djp h LYS 1043Cb 0.39 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1djp h LYS 1043CO 0.00 0.98 -0.18 -0.07 -2.27 0.00 0.00 179.45 177.91 1djp h LEU 1044N 0.03 0.53 -1.17 5.20 3.38 -1.11 -2.78 115.31 119.39 1djp h LEU 1044Ca -0.16 -0.46 -0.06 0.00 0.09 0.00 0.00 57.88 57.29 1djp h LEU 1044Cb 1.93 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 42.51 1djp h LEU 1044CO 0.14 0.87 -0.06 0.40 0.09 0.00 0.00 178.44 179.88 1djp h ILE 1045N 0.18 1.21 0.00 1.22 2.04 -1.43 -2.64 117.51 118.09 1djp h ILE 1045Ca 0.04 -0.89 -0.05 0.00 1.00 0.00 0.00 64.86 64.96 1djp h ILE 1045Cb 0.71 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 1djp h ILE 1045CO 0.05 0.30 -0.24 0.00 0.00 0.00 0.00 178.15 178.26 1djp h ALA 1046N 1.47 1.02 0.00 1.87 0.00 -1.35 -2.93 119.26 119.34 1djp h ALA 1046Ca 0.10 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1djp h ALA 1046Cb 0.41 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1djp h ALA 1046CO 0.02 0.30 0.00 0.78 0.00 0.00 0.00 179.25 180.34 1djp h GLY 1047N 2.09 0.00 -6.56 0.00 0.00 -1.18 -3.35 103.07 94.07 1djp h GLY 1047Ca -0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 1djp h GLY 1047CO 0.03 0.00 -0.63 -0.62 0.00 0.00 0.00 176.54 175.32 1djp n VAL 1048N -2.79 1.70 -0.11 4.60 0.31 -1.10 -4.94 118.33 116.00 1djp n VAL 1048Ca 0.03 -4.91 0.07 0.00 -0.01 0.00 0.00 64.34 59.52 1djp n VAL 1048Cb 0.42 -2.10 0.41 0.00 -0.91 0.00 0.00 33.84 31.66 1djp n VAL 1048CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1djp h PRO 1049N 4.74 0.60 0.00 5.55 0.11 -1.72 -1.69 132.00 139.59 1djp h PRO 1049Ca 0.18 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1djp h PRO 1049Cb 0.72 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.70 1djp h PRO 1049CO 0.74 0.40 0.04 0.39 -0.21 0.00 0.00 178.00 179.36 1djp n GLU 1050N -4.47 0.10 -0.13 1.05 4.71 -1.26 -1.78 120.64 118.85 1djp n GLU 1050Ca 0.08 0.59 0.10 0.00 -0.01 0.00 0.00 57.16 57.91 1djp n GLU 1050Cb 0.21 -1.86 0.43 0.00 -1.01 0.00 0.00 31.44 29.22 1djp n GLU 1050CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1djp h LEU 1051N 0.00 0.51 -1.49 -4.62 5.85 -1.65 -1.63 115.31 112.27 1djp h LEU 1051Ca 0.00 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.75 1djp h LEU 1051Cb 0.08 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 1djp h LEU 1051CO 0.00 0.31 0.37 0.00 -0.34 0.00 0.00 178.44 178.78 1djp h ALA 1052N 1.66 1.68 -0.81 1.25 0.00 -1.54 -2.12 119.26 119.38 1djp h ALA 1052Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1djp h ALA 1052Cb 0.43 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1djp h ALA 1052CO -0.10 0.27 0.52 -0.44 0.00 0.00 0.00 179.25 179.50 1djp h ASP 1053N 0.67 0.94 -0.16 0.00 3.32 -1.51 -3.14 116.42 116.54 1djp h ASP 1053Ca 0.22 -0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 1djp h ASP 1053Cb 0.03 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 1djp h ASP 1053CO -0.05 0.69 -0.22 -0.07 -1.72 0.00 0.00 179.24 177.86 1djp h LEU 1054N 1.10 0.48 -7.98 1.55 3.38 -1.47 -3.49 115.31 108.88 1djp h LEU 1054Ca 0.29 -0.51 0.19 0.00 0.09 0.00 0.00 57.88 57.94 1djp h LEU 1054Cb -0.10 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 1djp h LEU 1054CO -0.06 0.90 0.65 0.00 0.09 0.00 0.00 178.44 180.02 1djp s ALA 1055N -4.18 -1.75 -0.45 1.53 0.00 -1.02 -4.59 121.76 111.29 1djp s ALA 1055Ca -0.14 -0.30 -0.23 0.00 0.00 0.00 0.00 51.96 51.29 1djp s ALA 1055Cb 0.06 0.80 0.03 0.00 0.00 0.00 0.00 23.12 24.01 1djp s ALA 1055CO 0.78 -1.08 0.77 -0.80 0.00 0.00 0.00 175.76 175.43 1djp s ASN 1056N -3.52 6.39 -0.13 0.00 0.01 -0.16 -4.32 114.94 113.22 1djp s ASN 1056Ca 0.24 -0.17 -0.03 0.00 -0.71 0.00 0.00 52.86 52.19 1djp s ASN 1056Cb -0.02 -2.38 -0.03 0.00 0.41 0.00 0.00 41.25 39.23 1djp s ASN 1056CO 0.04 -0.91 -0.03 0.54 -1.51 0.00 0.00 177.10 175.24 1djp s VAL 1057N 3.24 4.02 -0.09 1.60 0.11 -1.26 -0.90 120.40 127.12 1djp s VAL 1057Ca 0.29 -0.33 0.03 0.00 -2.93 0.00 0.00 61.98 59.04 1djp s VAL 1057Cb -0.12 -2.74 -0.01 0.00 -1.53 0.00 0.00 36.38 31.98 1djp s VAL 1057CO 0.22 0.53 -0.20 -0.13 -3.33 0.00 0.00 175.10 172.19 1djp s ARG 1058N -0.04 2.97 -0.06 1.54 0.52 -0.58 -5.00 118.95 118.29 1djp s ARG 1058Ca 0.02 -0.81 -0.05 0.00 -0.52 0.00 0.00 55.73 54.37 1djp s ARG 1058Cb -0.13 -2.38 -0.04 0.00 0.52 0.00 0.00 34.95 32.92 1djp s ARG 1058CO 0.02 0.29 0.17 0.20 0.02 0.00 0.00 175.30 176.00 1djp s GLY 1059N 0.09 2.17 -0.11 -3.53 0.00 -1.26 -0.68 107.32 104.01 1djp s GLY 1059Ca -0.09 -0.70 -0.04 0.00 0.00 0.00 0.00 44.72 43.89 1djp s GLY 1059CO 0.06 -0.51 0.22 1.85 0.00 0.00 0.00 173.10 174.71 1djp s GLU 1060N -1.51 0.12 -0.54 2.90 2.12 -0.25 -4.95 118.70 116.59 1djp s GLU 1060Ca 0.22 0.63 -0.20 0.00 0.36 0.00 0.00 54.97 55.97 1djp s GLU 1060Cb -0.12 -0.13 0.07 0.00 0.26 0.00 0.00 34.13 34.20 1djp s GLU 1060CO 0.12 -0.26 0.70 -1.14 -0.54 0.00 0.00 175.26 174.13 1djp s GLN 1061N 2.08 3.13 0.02 4.30 2.00 -1.26 -0.35 119.66 129.58 1djp s GLN 1061Ca -0.01 -0.90 -0.10 0.00 -2.00 0.00 0.00 55.36 52.35 1djp s GLN 1061Cb -0.12 -4.13 -0.32 0.00 0.80 0.00 0.00 33.01 29.24 1djp s GLN 1061CO -0.07 -1.35 0.96 0.28 -0.50 0.00 0.00 175.29 174.60 1djp h VAL 1062N 5.90 1.26 -2.46 1.34 2.07 -1.48 -3.48 116.25 119.39 1djp h VAL 1062Ca -0.28 -2.78 0.11 0.00 0.82 0.00 0.00 66.70 64.57 1djp h VAL 1062Cb 1.09 2.93 -0.11 0.00 -1.52 0.00 0.00 31.29 33.68 1djp h VAL 1062CO 1.02 0.84 0.43 0.00 0.02 0.00 0.00 177.57 179.88 1djp s MET 1063N -2.61 1.11 -0.53 1.57 0.00 -1.13 -5.04 119.30 112.66 1djp s MET 1063Ca -0.09 -0.52 0.06 0.00 0.00 0.00 0.00 55.69 55.14 1djp s MET 1063Cb 0.05 0.44 0.21 0.00 0.00 0.00 0.00 34.83 35.53 1djp s MET 1063CO 0.90 -0.50 0.52 1.04 0.00 0.00 0.00 175.02 176.98 1djp n GLN 1064N -0.37 1.27 -4.42 3.16 1.13 -1.25 -3.48 117.38 113.42 1djp n GLN 1064Ca -0.08 -3.86 -0.21 0.00 -1.94 0.00 0.00 57.00 50.90 1djp n GLN 1064Cb 0.62 -1.85 -0.10 0.00 0.11 0.00 0.00 30.24 29.01 1djp n GLN 1064CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1djp s ILE 1065N -1.22 1.56 -0.28 5.09 -4.36 -0.43 -4.90 121.20 116.66 1djp s ILE 1065Ca 0.33 -2.11 -0.18 0.00 -0.26 0.00 0.00 60.65 58.43 1djp s ILE 1065Cb 0.08 -2.46 -0.02 0.00 1.25 0.00 0.00 42.46 41.31 1djp s ILE 1065CO -0.13 -0.29 0.52 0.00 0.24 0.00 0.00 174.94 175.29 1djp s ALA 1066N -3.06 3.57 0.59 2.27 0.00 -1.26 -2.36 121.76 121.50 1djp s ALA 1066Ca 0.30 -0.68 0.30 0.00 0.00 0.00 0.00 51.96 51.88 1djp s ALA 1066Cb 0.04 -2.92 1.33 0.00 0.00 0.00 0.00 23.12 21.57 1djp s ALA 1066CO 0.12 -0.85 1.69 0.66 0.00 0.00 0.00 175.76 177.38 1djp h SER 1067N 8.11 0.00 0.77 0.00 4.64 -1.90 0.68 113.55 125.85 1djp h SER 1067Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1djp h SER 1067Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1djp h SER 1067CO 0.73 0.00 0.00 1.05 -0.87 0.00 0.00 176.83 177.74 1djp h GLU 1068N 0.00 0.00 -0.50 4.77 9.09 -1.92 -2.70 114.58 123.32 1djp h GLU 1068Ca 0.37 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.66 1djp h GLU 1068Cb 1.94 0.00 -0.07 0.00 -1.65 0.00 0.00 28.75 28.97 1djp h GLU 1068CO -0.00 0.00 0.10 0.43 0.05 0.00 0.00 179.01 179.58 1djp n SER 1069N -2.44 4.25 -4.80 3.06 7.64 0.23 -5.01 113.62 116.56 1djp n SER 1069Ca 0.02 -3.21 -0.35 0.00 1.01 0.00 0.00 58.87 56.34 1djp n SER 1069Cb 0.24 -0.65 -0.05 0.00 -1.01 0.00 0.00 64.21 62.74 1djp n SER 1069CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 1djp s ILE 1070N -2.96 3.96 0.33 0.44 2.07 -1.02 -4.95 121.20 119.07 1djp s ILE 1070Ca 0.49 1.31 0.09 0.00 -1.41 0.00 0.00 60.65 61.12 1djp s ILE 1070Cb 0.40 -3.58 -0.06 0.00 0.13 0.00 0.00 42.46 39.35 1djp s ILE 1070CO 0.10 -0.18 -0.08 0.42 -1.91 0.00 0.00 174.94 173.29 1djp s THR 1071N -1.93 2.06 0.47 4.00 -4.23 -1.26 -5.03 115.64 109.71 1djp s THR 1071Ca 0.63 -2.18 0.16 0.00 -1.18 0.00 0.00 61.69 59.11 1djp s THR 1071Cb -0.16 -2.60 0.32 0.00 1.34 0.00 0.00 72.50 71.41 1djp s THR 1071CO 0.20 -0.22 2.02 0.78 -0.54 0.00 0.00 174.62 176.86 1djp h ASN 1072N 2.09 0.24 0.40 3.99 4.21 -2.00 -0.95 115.58 123.56 1djp h ASN 1072Ca -0.41 0.00 -0.16 0.00 1.21 0.00 0.00 56.30 56.94 1djp h ASN 1072Cb 1.25 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 38.39 1djp h ASN 1072CO 0.70 0.15 -0.66 0.44 -1.29 0.00 0.00 177.43 176.76 1djp h ASP 1073N 0.27 0.28 -0.53 5.81 3.32 -1.99 -2.50 116.42 121.08 1djp h ASP 1073Ca 0.20 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 1djp h ASP 1073Cb 0.46 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 1djp h ASP 1073CO -0.04 0.86 0.07 0.44 -1.72 0.00 0.00 179.24 178.85 1djp h ASP 1074N 0.17 0.89 -0.42 6.45 3.45 -1.59 -1.04 116.42 124.33 1djp h ASP 1074Ca -0.01 -0.20 -0.02 0.00 0.43 0.00 0.00 57.03 57.22 1djp h ASP 1074Cb 1.20 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 39.71 1djp h ASP 1074CO 0.10 0.91 0.19 -0.07 -1.57 0.00 0.00 179.24 178.81 1djp h LEU 1075N 0.88 0.55 -0.75 1.55 3.38 -1.23 -1.83 115.31 117.86 1djp h LEU 1075Ca 0.18 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1djp h LEU 1075Cb 0.42 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1djp h LEU 1075CO 0.01 0.53 -0.01 -0.07 0.09 0.00 0.00 178.44 178.99 1djp h LEU 1076N 0.53 0.92 0.13 1.67 3.38 -1.20 0.11 115.31 120.85 1djp h LEU 1076Ca 0.14 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1djp h LEU 1076Cb 0.13 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1djp h LEU 1076CO -0.02 0.98 -0.06 0.50 0.09 0.00 0.00 178.44 179.94 1djp h LYS 1077N 0.87 -0.16 -0.40 1.13 3.64 -1.02 -0.55 116.57 120.08 1djp h LYS 1077Ca 0.16 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.52 1djp h LYS 1077Cb 0.53 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1djp h LYS 1077CO 0.03 -0.02 0.13 1.25 -2.27 0.00 0.00 179.45 178.56 1djp h LEU 1078N -0.27 0.58 -1.52 5.20 5.85 -1.28 -0.96 115.31 122.91 1djp h LEU 1078Ca -0.02 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.51 1djp h LEU 1078Cb 0.21 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1djp h LEU 1078CO 0.03 0.63 0.33 1.23 -0.34 0.00 0.00 178.44 180.31 1djp h GLY 1079N 0.50 0.69 1.56 3.75 0.00 -0.67 -0.52 103.07 108.37 1djp h GLY 1079Ca 0.13 -0.25 -0.29 0.00 0.00 0.00 0.00 47.33 46.92 1djp h GLY 1079CO -0.00 0.25 -1.29 0.50 0.00 0.00 0.00 176.54 176.00 1djp h LYS 1080N 0.66 0.33 -0.25 4.80 1.57 -0.85 -2.75 116.57 120.07 1djp h LYS 1080Ca 0.18 -0.56 -0.09 0.00 -1.87 0.00 0.00 60.65 58.31 1djp h LYS 1080Cb -0.06 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1djp h LYS 1080CO -0.04 1.27 -0.23 -0.09 -0.57 0.00 0.00 179.45 179.79 1djp h ARG 1081N 0.09 0.47 -0.33 3.15 9.65 -0.78 -2.17 114.38 124.47 1djp h ARG 1081Ca -0.16 -0.17 -0.10 0.00 -1.10 0.00 0.00 59.98 58.45 1djp h ARG 1081Cb 2.01 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 30.55 1djp h ARG 1081CO 0.22 0.67 -0.20 0.28 2.80 0.00 0.00 179.97 183.74 1djp h VAL 1082N 0.42 1.29 -0.73 0.20 2.07 -1.15 -2.62 116.25 115.74 1djp h VAL 1082Ca 0.07 -1.34 0.02 0.00 0.82 0.00 0.00 66.70 66.26 1djp h VAL 1082Cb 0.63 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.80 1djp h VAL 1082CO 0.05 0.43 0.47 0.00 0.02 0.00 0.00 177.57 178.54 1djp h ALA 1083N 0.76 0.93 -0.42 1.67 0.00 -1.27 0.49 119.26 121.42 1djp h ALA 1083Ca 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1djp h ALA 1083Cb 0.75 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1djp h ALA 1083CO 0.06 0.30 0.23 0.93 0.00 0.00 0.00 179.25 180.77 1djp h GLU 1084N 0.95 0.58 -0.25 0.00 5.08 -1.34 -2.43 114.58 117.17 1djp h GLU 1084Ca 0.28 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.47 1djp h GLU 1084Cb -0.06 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1djp h GLU 1084CO -0.08 0.46 -0.26 -0.07 -1.00 0.00 0.00 179.01 178.06 1djp h LEU 1085N 0.54 0.48 -1.27 1.33 -0.00 -1.07 -3.04 115.31 112.28 1djp h LEU 1085Ca 0.15 -0.17 -0.07 0.00 -0.00 0.00 0.00 57.88 57.80 1djp h LEU 1085Cb 0.05 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 40.57 1djp h LEU 1085CO -0.02 0.74 -0.21 0.00 -0.00 0.00 0.00 178.44 178.94 1djp h ALA 1086N 1.30 1.39 0.00 1.53 0.00 -0.57 -2.77 119.26 120.15 1djp h ALA 1086Ca 0.06 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1djp h ALA 1086Cb 0.68 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1djp h ALA 1086CO 0.05 0.42 -0.14 -0.44 0.00 0.00 0.00 179.25 179.14 1djp h ASP 1087N 0.21 0.00 -3.76 0.00 3.45 -1.33 -3.46 116.42 111.54 1djp h ASP 1087Ca 0.04 -0.04 -0.50 0.00 0.43 0.00 0.00 57.03 56.96 1djp h ASP 1087Cb 0.50 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.26 1djp h ASP 1087CO 0.03 0.02 0.39 -0.55 -1.57 0.00 0.00 179.24 177.56 1djp s SER 1088N -4.62 7.53 0.00 6.45 0.15 -1.05 -4.95 113.70 117.21 1djp s SER 1088Ca 0.09 2.04 0.29 0.00 0.70 0.00 0.00 55.95 59.07 1djp s SER 1088Cb 0.12 -2.61 1.25 0.00 -1.71 0.00 0.00 66.02 63.06 1djp s SER 1088CO 0.63 0.06 1.90 0.59 1.20 0.00 0.00 173.24 177.62 1djp n ASN 1089N 1.45 0.16 -0.59 5.45 3.02 -1.26 -3.09 115.26 120.39 1djp n ASN 1089Ca -0.02 -0.02 0.10 0.00 -0.03 0.00 0.00 54.58 54.61 1djp n ASN 1089Cb 0.46 -0.26 0.33 0.00 -0.61 0.00 0.00 39.78 39.71 1djp n ASN 1089CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1djp n ASP 1090N -1.31 1.77 -4.08 6.41 2.03 -1.26 -4.78 116.55 115.33 1djp n ASP 1090Ca 0.11 -1.77 -0.29 0.00 0.52 0.00 0.00 54.79 53.36 1djp n ASP 1090Cb 0.29 -0.13 -0.17 0.00 -0.72 0.00 0.00 41.12 40.39 1djp n ASP 1090CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1djp s VAL 1091N -1.73 1.61 -0.17 5.18 1.01 -1.18 -4.70 120.40 120.41 1djp s VAL 1091Ca 0.31 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.65 1djp s VAL 1091Cb 0.17 -1.46 -0.15 0.00 0.00 0.00 0.00 36.38 34.94 1djp s VAL 1091CO 0.25 0.46 -0.08 0.47 0.00 0.00 0.00 175.10 176.20 1djp n ASP 1092N 4.18 2.05 -3.85 3.32 8.00 0.45 -4.88 116.55 125.82 1djp n ASP 1092Ca -0.19 -0.06 -0.11 0.00 0.71 0.00 0.00 54.79 55.14 1djp n ASP 1092Cb 0.51 0.17 -0.09 0.00 -0.02 0.00 0.00 41.12 41.69 1djp n ASP 1092CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1djp s GLY 1093N -5.42 0.03 -0.12 0.44 0.00 -1.10 -4.07 107.32 97.07 1djp s GLY 1093Ca -0.18 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.39 1djp s GLY 1093CO 0.51 -0.32 -0.15 -0.42 0.00 0.00 0.00 173.10 172.71 1djp s ILE 1094N -1.88 1.54 -0.13 0.90 1.01 0.46 -2.21 121.20 120.90 1djp s ILE 1094Ca -0.11 -0.65 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 1djp s ILE 1094Cb -0.05 -1.41 -0.02 0.00 0.01 0.00 0.00 42.46 40.99 1djp s ILE 1094CO -0.00 0.45 -0.10 -0.69 0.00 0.00 0.00 174.94 174.59 1djp s VAL 1095N 1.13 3.30 -0.22 2.92 1.01 -0.09 -0.23 120.40 128.21 1djp s VAL 1095Ca -0.03 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.38 1djp s VAL 1095Cb -0.14 -2.39 0.04 0.00 0.00 0.00 0.00 36.38 33.89 1djp s VAL 1095CO -0.04 0.53 -0.13 -0.63 0.00 0.00 0.00 175.10 174.82 1djp s ILE 1096N 0.20 1.97 -0.15 2.22 1.01 0.16 0.93 121.20 127.54 1djp s ILE 1096Ca -0.06 -1.24 -0.28 0.00 0.00 0.00 0.00 60.65 59.07 1djp s ILE 1096Cb -0.15 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.33 1djp s ILE 1096CO 0.04 0.20 0.94 0.42 0.00 0.00 0.00 174.94 176.54 1djp s THR 1097N 1.25 4.81 -0.00 2.92 -4.23 -0.88 -1.02 115.64 118.48 1djp s THR 1097Ca -0.02 1.87 -0.02 0.00 -1.18 0.00 0.00 61.69 62.33 1djp s THR 1097Cb -0.17 -4.24 -0.00 0.00 1.34 0.00 0.00 72.50 69.43 1djp s THR 1097CO -0.08 -0.01 0.04 -2.28 -0.54 0.00 0.00 174.62 171.74 1djp s HIS 1098N 2.24 0.05 0.29 3.99 5.04 -0.08 -1.92 115.29 124.90 1djp s HIS 1098Ca 0.43 -0.10 -0.30 0.00 -1.54 0.00 0.00 55.06 53.56 1djp s HIS 1098Cb -0.17 -0.05 -0.12 0.00 0.04 0.00 0.00 32.58 32.28 1djp s HIS 1098CO 0.14 -0.12 1.54 0.41 -2.34 0.00 0.00 174.74 174.37 1djp n GLY 1099N 2.38 1.20 0.26 1.59 0.00 -1.26 -4.13 105.19 105.22 1djp n GLY 1099Ca -0.17 0.45 0.08 0.00 0.00 0.00 0.00 46.02 46.38 1djp n GLY 1099CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1djp h THR 1100N 3.23 0.98 -0.50 2.61 1.35 -1.94 -2.99 112.91 115.66 1djp h THR 1100Ca -0.47 -0.11 0.10 0.00 -0.55 0.00 0.00 66.41 65.38 1djp h THR 1100Cb 1.24 1.06 -0.08 0.00 -1.73 0.00 0.00 68.15 68.63 1djp h THR 1100CO 0.77 0.03 -0.02 0.44 -0.25 0.00 0.00 175.52 176.48 1djp h ASP 1101N 0.00 -0.26 0.00 5.36 3.45 -1.93 -3.00 116.42 120.04 1djp h ASP 1101Ca -0.00 0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.58 1djp h ASP 1101Cb 0.06 0.23 -0.00 0.00 -0.56 0.00 0.00 39.33 39.05 1djp h ASP 1101CO 0.00 -0.09 -0.14 0.35 -1.57 0.00 0.00 179.24 177.79 1djp n THR 1102N -5.26 1.88 -0.33 0.35 -2.24 -1.24 -4.75 114.28 102.71 1djp n THR 1102Ca 0.05 -2.40 -0.01 0.00 -2.27 0.00 0.00 64.05 59.42 1djp n THR 1102Cb 0.27 -0.20 0.16 0.00 -2.10 0.00 0.00 70.33 68.45 1djp n THR 1102CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1djp h LEU 1103N 0.23 1.06 -1.82 3.22 6.46 -1.37 -1.70 115.31 121.39 1djp h LEU 1103Ca -0.00 -0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 57.70 1djp h LEU 1103Cb 1.02 -0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 40.68 1djp h LEU 1103CO 0.00 0.77 -0.14 1.05 -0.62 0.00 0.00 178.44 179.50 1djp h GLU 1104N 1.25 0.00 0.01 1.25 4.11 -1.85 0.07 114.58 119.41 1djp h GLU 1104Ca 0.34 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.75 1djp h GLU 1104Cb -0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.11 1djp h GLU 1104CO -0.07 0.14 -0.08 0.93 0.07 0.00 0.00 179.01 180.00 1djp h GLU 1105N 0.00 0.04 -0.25 1.06 5.08 -1.68 -2.98 114.58 115.84 1djp h GLU 1105Ca -0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1djp h GLU 1105Cb 0.29 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1djp h GLU 1105CO 0.02 0.89 0.10 1.15 -1.00 0.00 0.00 179.01 180.18 1djp h THR 1106N -0.79 1.17 -1.01 1.13 2.02 -1.31 -1.39 112.91 112.74 1djp h THR 1106Ca -0.01 -0.50 0.09 0.00 0.77 0.00 0.00 66.41 66.76 1djp h THR 1106Cb 0.92 1.03 -0.08 0.00 -1.74 0.00 0.00 68.15 68.29 1djp h THR 1106CO 0.01 0.17 0.64 0.00 0.37 0.00 0.00 175.52 176.71 1djp h ALA 1107N 0.95 1.47 -0.14 6.16 0.00 -1.11 -1.02 119.26 125.57 1djp h ALA 1107Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 1djp h ALA 1107Cb 0.17 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1djp h ALA 1107CO -0.01 0.33 -0.65 -0.92 0.00 0.00 0.00 179.25 178.00 1djp h TYR 1108N 1.08 0.70 0.13 0.00 3.20 -1.33 -2.31 116.97 118.44 1djp h TYR 1108Ca 0.47 -0.28 -0.00 0.00 3.14 0.00 0.00 58.73 62.06 1djp h TYR 1108Cb 0.34 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1djp h TYR 1108CO -0.00 1.04 -0.10 0.35 -1.64 0.00 0.00 178.16 177.81 1djp h PHE 1109N 0.39 -0.25 -0.24 -3.82 3.57 -0.30 -2.10 116.94 114.20 1djp h PHE 1109Ca -0.02 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 1djp h PHE 1109Cb 1.22 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 1djp h PHE 1109CO 0.05 -0.15 0.05 -0.07 -2.23 0.00 0.00 178.31 175.96 1djp h LEU 1110N -0.23 0.30 -1.60 0.59 3.38 -1.23 -1.16 115.31 115.36 1djp h LEU 1110Ca -0.01 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1djp h LEU 1110Cb 0.21 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1djp h LEU 1110CO -0.01 0.32 -0.21 -1.13 0.09 0.00 0.00 178.44 177.50 1djp h ASN 1111N 0.33 0.00 0.25 -0.43 -1.24 -0.82 -2.30 115.58 111.38 1djp h ASN 1111Ca 0.08 0.00 -0.34 0.00 0.71 0.00 0.00 56.30 56.75 1djp h ASN 1111Cb 0.14 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.15 1djp h ASN 1111CO -0.00 0.21 -1.96 0.18 -1.29 0.00 0.00 177.43 174.57 1djp n LEU 1112N -3.85 1.72 -0.16 0.34 4.77 -0.54 -0.37 117.00 118.91 1djp n LEU 1112Ca -0.02 0.24 0.08 0.00 -0.03 0.00 0.00 56.01 56.28 1djp n LEU 1112Cb 0.31 -0.43 -0.05 0.00 -2.33 0.00 0.00 43.42 40.91 1djp n LEU 1112CO 0.34 0.64 0.09 1.33 -1.33 0.00 0.00 177.39 178.46 1djp n VAL 1113N -3.22 0.00 -3.13 4.08 0.24 -0.62 -4.37 118.33 111.31 1djp n VAL 1113Ca -0.27 -0.22 -0.43 0.00 -2.04 0.00 0.00 64.34 61.37 1djp n VAL 1113Cb 1.05 1.08 -0.06 0.00 -1.47 0.00 0.00 33.84 34.44 1djp n VAL 1113CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1djp s GLN 1114N -2.21 3.16 -1.34 7.34 -1.52 -0.87 -1.26 119.66 122.96 1djp s GLN 1114Ca 0.09 -0.75 -0.15 0.00 -1.95 0.00 0.00 55.36 52.61 1djp s GLN 1114Cb 0.12 -4.06 0.09 0.00 -0.22 0.00 0.00 33.01 28.94 1djp s GLN 1114CO 0.53 -1.19 1.89 1.63 -0.25 0.00 0.00 175.29 177.90 1djp n LYS 1115N 6.27 3.16 -3.55 2.91 4.76 -1.26 -4.03 118.16 126.42 1djp n LYS 1115Ca -0.05 -3.15 -0.16 0.00 -2.87 0.00 0.00 58.31 52.07 1djp n LYS 1115Cb 0.46 -3.28 -0.06 0.00 -1.84 0.00 0.00 35.03 30.31 1djp n LYS 1115CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1djp s THR 1116N 2.94 0.01 -2.37 -0.18 -1.32 -1.26 -4.82 115.64 108.63 1djp s THR 1116Ca 0.48 -0.09 0.22 0.00 -1.21 0.00 0.00 61.69 61.09 1djp s THR 1116Cb 0.07 -0.95 0.07 0.00 -1.51 0.00 0.00 72.50 70.18 1djp s THR 1116CO -0.00 -0.05 1.14 -0.90 -2.21 0.00 0.00 174.62 172.59 1djp n ASP 1117N 0.74 2.40 -4.77 8.08 3.85 -1.26 -3.89 116.55 121.70 1djp n ASP 1117Ca -0.19 -1.70 -0.40 0.00 -0.71 0.00 0.00 54.79 51.79 1djp n ASP 1117Cb 0.58 0.27 -0.02 0.00 -1.35 0.00 0.00 41.12 40.60 1djp n ASP 1117CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1djp s LYS 1118N -2.20 4.32 0.20 0.11 1.02 -1.26 -1.67 119.74 120.26 1djp s LYS 1118Ca 0.22 2.10 -0.32 0.00 0.02 0.00 0.00 55.97 57.99 1djp s LYS 1118Cb 0.18 -3.01 -0.13 0.00 -0.52 0.00 0.00 37.83 34.36 1djp s LYS 1118CO 0.44 -0.17 1.67 -2.30 -0.92 0.00 0.00 175.35 174.06 1djp n PRO 1119N 0.70 2.59 -3.94 -1.68 -0.02 -1.26 -4.88 135.00 126.51 1djp n PRO 1119Ca 0.01 0.93 -0.30 0.00 -2.02 0.00 0.00 63.50 62.12 1djp n PRO 1119Cb 0.43 -2.75 -0.16 0.00 -0.02 0.00 0.00 33.50 31.00 1djp n PRO 1119CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1djp s ILE 1120N 0.98 1.43 -0.16 4.25 1.01 -1.26 -0.40 121.20 127.07 1djp s ILE 1120Ca 0.75 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 60.46 1djp s ILE 1120Cb -0.55 -1.61 0.01 0.00 0.01 0.00 0.00 42.46 40.32 1djp s ILE 1120CO 0.35 0.06 -0.20 -0.69 0.00 0.00 0.00 174.94 174.47 1djp s VAL 1121N 1.47 2.16 -0.17 2.92 1.01 0.68 -1.32 120.40 127.16 1djp s VAL 1121Ca -0.02 -0.93 -0.08 0.00 0.00 0.00 0.00 61.98 60.95 1djp s VAL 1121Cb -0.17 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 1djp s VAL 1121CO -0.07 0.54 0.09 -0.69 0.00 0.00 0.00 175.10 174.97 1djp s VAL 1122N 0.97 5.09 0.02 2.92 1.01 0.27 -0.67 120.40 130.01 1djp s VAL 1122Ca -0.03 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.02 1djp s VAL 1122Cb -0.15 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.94 1djp s VAL 1122CO -0.05 0.50 -0.03 0.54 0.00 0.00 0.00 175.10 176.05 1djp s VAL 1123N -0.01 0.15 0.00 2.92 0.11 -0.19 -3.12 120.40 120.27 1djp s VAL 1123Ca 0.08 -0.93 0.00 0.00 -2.93 0.00 0.00 61.98 58.19 1djp s VAL 1123Cb -0.12 -0.31 0.00 0.00 -1.53 0.00 0.00 36.38 34.43 1djp s VAL 1123CO 0.00 -0.49 0.00 0.61 -3.33 0.00 0.00 175.10 171.89 1djp n GLY 1124N 1.57 4.07 3.42 6.54 0.00 -1.26 -0.91 105.19 118.63 1djp n GLY 1124Ca -0.24 -1.28 -0.16 0.00 0.00 0.00 0.00 46.02 44.34 1djp n GLY 1124CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1djp s SER 1125N 0.53 -0.50 0.14 1.61 1.04 -1.26 -4.80 113.70 110.47 1djp s SER 1125Ca 0.00 0.40 0.23 0.00 0.48 0.00 0.00 55.95 57.07 1djp s SER 1125Cb 0.00 0.48 0.17 0.00 0.10 0.00 0.00 66.02 66.77 1djp s SER 1125CO 0.00 -0.62 1.17 0.24 0.98 0.00 0.00 173.24 175.01 1djp h MET 1126N 3.07 0.00 -6.19 4.02 2.86 -1.91 -3.41 114.93 113.37 1djp h MET 1126Ca -0.29 0.00 -0.62 0.00 -2.06 0.00 0.00 59.70 56.73 1djp h MET 1126Cb 1.17 0.00 -0.28 0.00 0.06 0.00 0.00 31.60 32.55 1djp h MET 1126CO 0.40 0.00 -0.86 1.03 1.06 0.00 0.00 176.91 178.54 1djp s ARG 1127N -3.24 1.68 0.55 1.72 0.52 -1.26 -4.80 118.95 114.11 1djp s ARG 1127Ca 0.03 -0.85 -0.19 0.00 -0.52 0.00 0.00 55.73 54.20 1djp s ARG 1127Cb 0.12 -1.69 -0.06 0.00 0.52 0.00 0.00 34.95 33.85 1djp s ARG 1127CO 0.76 0.45 1.14 -1.25 0.02 0.00 0.00 175.30 176.42 1djp s PRO 1128N -0.74 3.33 0.39 3.54 0.04 -1.26 -4.40 135.00 135.90 1djp s PRO 1128Ca 0.08 1.63 0.23 0.00 0.04 0.00 0.00 61.00 62.99 1djp s PRO 1128Cb -0.09 -2.01 1.27 0.00 0.04 0.00 0.00 34.50 33.71 1djp s PRO 1128CO 0.00 -0.87 1.69 0.78 0.04 0.00 0.00 177.00 178.64 1djp h GLY 1129N 1.19 0.00 1.44 0.56 0.00 -1.72 -1.07 103.07 103.47 1djp h GLY 1129Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1djp h GLY 1129CO 0.57 0.00 -0.30 -1.30 0.00 0.00 0.00 176.54 175.51 1djp n THR 1130N -2.35 0.06 -2.29 4.70 -2.24 -1.26 -4.88 114.28 106.01 1djp n THR 1130Ca -0.02 -0.04 -0.28 0.00 -2.27 0.00 0.00 64.05 61.45 1djp n THR 1130Cb 0.12 -0.11 0.03 0.00 -2.10 0.00 0.00 70.33 68.27 1djp n THR 1130CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1djp s ALA 1131N -3.02 3.22 0.24 6.98 0.00 -0.41 -3.86 121.76 124.92 1djp s ALA 1131Ca 0.12 -0.56 -0.30 0.00 0.00 0.00 0.00 51.96 51.22 1djp s ALA 1131Cb 0.17 -2.71 -0.09 0.00 0.00 0.00 0.00 23.12 20.49 1djp s ALA 1131CO 0.63 -0.80 1.20 -1.64 0.00 0.00 0.00 175.76 175.15 1djp s MET 1132N -5.04 4.50 -1.47 0.00 -1.94 0.13 -3.30 119.30 112.19 1djp s MET 1132Ca 0.54 1.93 -0.12 0.00 -1.71 0.00 0.00 55.69 56.33 1djp s MET 1132Cb -0.11 -3.19 0.06 0.00 2.01 0.00 0.00 34.83 33.60 1djp s MET 1132CO 0.47 -0.03 1.05 0.43 -0.01 0.00 0.00 175.02 176.93 1djp n SER 1133N 1.85 -5.48 -4.75 3.03 7.64 -1.26 -4.90 113.62 109.75 1djp n SER 1133Ca 0.02 -0.67 -0.41 0.00 1.01 0.00 0.00 58.87 58.82 1djp n SER 1133Cb 0.44 -4.34 -0.01 0.00 -1.01 0.00 0.00 64.21 59.28 1djp n SER 1133CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1djp s ALA 1134N -3.30 3.72 -1.84 -0.43 0.00 -1.21 -4.91 121.76 113.80 1djp s ALA 1134Ca 0.63 1.57 0.28 0.00 0.00 0.00 0.00 51.96 54.44 1djp s ALA 1134Cb -0.30 -3.64 1.10 0.00 0.00 0.00 0.00 23.12 20.28 1djp s ALA 1134CO 0.77 -0.99 1.78 -0.40 0.00 0.00 0.00 175.76 176.92 1djp n ASP 1135N 1.92 0.77 0.01 0.00 5.75 -1.26 -4.46 116.55 119.28 1djp n ASP 1135Ca 0.07 -0.84 -0.12 0.00 -0.01 0.00 0.00 54.79 53.88 1djp n ASP 1135Cb 0.38 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.39 1djp n ASP 1135CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1djp h GLY 1136N 4.94 0.03 0.39 6.12 0.00 -1.87 -2.90 103.07 109.78 1djp h GLY 1136Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 47.33 47.37 1djp h GLY 1136CO 0.00 0.01 -0.10 -0.33 0.00 0.00 0.00 176.54 176.12 1djp h MET 1137N -0.17 -0.05 -0.40 4.80 2.86 -1.97 -0.27 114.93 119.73 1djp h MET 1137Ca 0.01 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.55 1djp h MET 1137Cb 0.20 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 1djp h MET 1137CO -0.00 -0.03 -0.16 1.25 1.06 0.00 0.00 176.91 179.03 1djp h LEU 1138N -0.05 0.74 -0.81 1.22 5.85 -1.87 -1.66 115.31 118.72 1djp h LEU 1138Ca 0.14 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 1djp h LEU 1138Cb 0.26 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 1djp h LEU 1138CO -0.30 0.90 0.47 0.78 -0.34 0.00 0.00 178.44 179.95 1djp h ASN 1139N 0.66 0.99 -0.36 1.25 2.35 -1.20 -0.44 115.58 118.84 1djp h ASN 1139Ca 0.11 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.65 1djp h ASN 1139Cb 0.64 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.75 1djp h ASN 1139CO 0.04 0.78 -0.26 0.25 -1.65 0.00 0.00 177.43 176.59 1djp h LEU 1140N 1.12 0.85 -0.28 1.61 6.46 -0.85 -1.68 115.31 122.54 1djp h LEU 1140Ca 0.29 -0.44 0.02 0.00 -0.12 0.00 0.00 57.88 57.63 1djp h LEU 1140Cb -0.01 -0.24 -0.02 0.00 -0.73 0.00 0.00 40.66 39.66 1djp h LEU 1140CO -0.05 1.11 0.14 0.22 -0.62 0.00 0.00 178.44 179.24 1djp h TYR 1141N 0.60 0.26 -0.38 1.25 3.20 -0.96 -1.97 116.97 118.97 1djp h TYR 1141Ca 0.07 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.88 1djp h TYR 1141Cb 0.83 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 1djp h TYR 1141CO 0.06 0.15 -0.07 -0.91 -1.64 0.00 0.00 178.16 175.75 1djp h ASN 1142N 0.30 0.62 -0.03 -2.11 2.35 -1.03 -0.87 115.58 114.80 1djp h ASN 1142Ca 0.11 -0.16 0.01 0.00 -0.55 0.00 0.00 56.30 55.72 1djp h ASN 1142Cb 0.03 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 1djp h ASN 1142CO -0.08 0.74 -0.03 0.00 -1.65 0.00 0.00 177.43 176.41 1djp h ALA 1143N 1.33 -0.00 -0.34 -0.83 0.00 -0.79 0.10 119.26 118.73 1djp h ALA 1143Ca 0.11 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1djp h ALA 1143Cb 0.48 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1djp h ALA 1143CO 0.03 -0.52 -0.24 0.28 0.00 0.00 0.00 179.25 178.80 1djp h VAL 1144N -0.04 1.27 -0.71 0.00 2.07 -1.25 -0.19 116.25 117.40 1djp h VAL 1144Ca 0.02 -1.32 -0.00 0.00 0.82 0.00 0.00 66.70 66.22 1djp h VAL 1144Cb 0.08 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1djp h VAL 1144CO -0.06 0.43 0.44 0.00 0.02 0.00 0.00 177.57 178.40 1djp h ALA 1145N 1.16 0.90 -0.05 1.67 0.00 -0.68 -0.03 119.26 122.22 1djp h ALA 1145Ca 0.08 -0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.71 1djp h ALA 1145Cb 0.72 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1djp h ALA 1145CO 0.06 0.36 -0.84 0.28 0.00 0.00 0.00 179.25 179.11 1djp h VAL 1146N 0.96 1.37 -0.03 0.00 2.07 -0.58 -3.08 116.25 116.96 1djp h VAL 1146Ca 0.25 -2.25 -0.12 0.00 0.82 0.00 0.00 66.70 65.41 1djp h VAL 1146Cb -0.05 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 1djp h VAL 1146CO -0.05 0.68 -0.55 0.00 0.02 0.00 0.00 177.57 177.67 1djp h ALA 1147N 0.78 1.02 -0.01 1.67 0.00 -0.76 -2.91 119.26 119.05 1djp h ALA 1147Ca -0.06 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1djp h ALA 1147Cb 1.45 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1djp h ALA 1147CO 0.15 0.69 -0.11 -1.13 0.00 0.00 0.00 179.25 178.85 1djp n SER 1148N -3.89 0.77 -4.66 0.00 3.41 -0.05 -4.12 113.62 105.07 1djp n SER 1148Ca -0.02 -0.89 -0.39 0.00 -0.26 0.00 0.00 58.87 57.31 1djp n SER 1148Cb 0.57 -0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.45 1djp n SER 1148CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1djp s ASN 1149N -2.33 6.60 0.53 4.04 3.04 -1.10 -4.85 114.94 120.88 1djp s ASN 1149Ca 0.32 0.73 0.18 0.00 0.04 0.00 0.00 52.86 54.13 1djp s ASN 1149Cb 0.20 -2.31 1.36 0.00 -1.54 0.00 0.00 41.25 38.96 1djp s ASN 1149CO 0.44 -0.21 2.16 0.50 -3.04 0.00 0.00 177.10 176.95 1djp h LYS 1150N 7.48 0.00 0.00 0.43 1.63 -1.88 -1.69 116.57 122.54 1djp h LYS 1150Ca -0.33 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.47 1djp h LYS 1150Cb 1.15 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 1djp h LYS 1150CO 0.75 0.00 0.00 -0.44 -3.45 0.00 0.00 179.45 176.31 1djp h ASP 1151N 0.00 0.00 1.25 4.20 3.45 -1.93 -2.82 116.42 120.57 1djp h ASP 1151Ca 0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 1djp h ASP 1151Cb 0.03 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.80 1djp h ASP 1151CO -0.00 0.00 0.00 -1.20 -1.57 0.00 0.00 179.24 176.47 1djp n SER 1152N -2.64 0.56 -4.77 6.45 7.64 -0.64 -4.89 113.62 115.34 1djp n SER 1152Ca 0.00 0.56 -0.37 0.00 1.01 0.00 0.00 58.87 60.08 1djp n SER 1152Cb 0.21 -0.71 -0.01 0.00 -1.01 0.00 0.00 64.21 62.69 1djp n SER 1152CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1djp s ARG 1153N -3.09 3.75 -0.57 1.43 0.52 -1.07 -3.59 118.95 116.33 1djp s ARG 1153Ca 0.11 1.78 0.00 0.00 -0.52 0.00 0.00 55.73 57.10 1djp s ARG 1153Cb 0.14 -2.40 0.00 0.00 0.52 0.00 0.00 34.95 33.21 1djp s ARG 1153CO 0.55 -0.56 0.00 0.41 0.02 0.00 0.00 175.30 175.71 1djp n GLY 1154N 0.44 0.73 0.55 -3.53 0.00 -0.67 -4.88 105.19 97.83 1djp n GLY 1154Ca 0.07 -0.29 0.05 0.00 0.00 0.00 0.00 46.02 45.86 1djp n GLY 1154CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1djp n LYS 1155N -1.88 2.89 0.00 1.61 5.02 -1.24 -5.03 118.16 119.53 1djp n LYS 1155Ca -0.05 -1.99 0.00 0.00 -2.02 0.00 0.00 58.31 54.24 1djp n LYS 1155Cb 0.30 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 1djp n LYS 1155CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1djp n GLY 1156N 0.32 -2.15 3.75 0.72 0.00 -1.26 -4.82 105.19 101.75 1djp n GLY 1156Ca 0.10 -1.46 -0.41 0.00 0.00 0.00 0.00 46.02 44.25 1djp n GLY 1156CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1djp s VAL 1157N -0.24 3.43 0.11 1.61 1.01 -1.26 -4.56 120.40 120.50 1djp s VAL 1157Ca 0.00 1.29 0.09 0.00 0.00 0.00 0.00 61.98 63.36 1djp s VAL 1157Cb 0.00 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1djp s VAL 1157CO 0.00 0.25 -0.23 -0.76 0.00 0.00 0.00 175.10 174.36 1djp s LEU 1158N -0.79 2.30 -0.10 3.92 2.01 -0.43 -0.46 118.68 125.12 1djp s LEU 1158Ca 0.50 -0.70 0.03 0.00 0.01 0.00 0.00 54.13 53.97 1djp s LEU 1158Cb -0.33 -0.99 0.01 0.00 0.01 0.00 0.00 46.19 44.88 1djp s LEU 1158CO 0.40 0.10 -0.20 0.68 1.01 0.00 0.00 176.35 178.34 1djp s VAL 1159N -1.12 1.81 -0.50 -1.59 -7.23 0.29 -0.57 120.40 111.49 1djp s VAL 1159Ca 0.09 -0.86 0.01 0.00 -1.81 0.00 0.00 61.98 59.41 1djp s VAL 1159Cb -0.10 -1.60 0.13 0.00 0.56 0.00 0.00 36.38 35.38 1djp s VAL 1159CO 0.05 0.50 0.27 0.42 -0.31 0.00 0.00 175.10 176.03 1djp s THR 1160N 0.59 2.95 0.05 5.32 -4.23 -1.18 -0.60 115.64 118.54 1djp s THR 1160Ca -0.14 -2.87 -0.00 0.00 -1.18 0.00 0.00 61.69 57.50 1djp s THR 1160Cb -0.17 -3.02 -0.03 0.00 1.34 0.00 0.00 72.50 70.62 1djp s THR 1160CO 0.04 -0.77 -0.04 -0.04 -0.54 0.00 0.00 174.62 173.27 1djp s MET 1161N 0.18 0.57 -1.46 3.99 -1.94 -1.22 -4.69 119.30 114.73 1djp s MET 1161Ca 0.15 -1.06 -0.11 0.00 -1.71 0.00 0.00 55.69 52.96 1djp s MET 1161Cb -0.23 0.08 0.05 0.00 2.01 0.00 0.00 34.83 36.74 1djp s MET 1161CO -0.03 -0.07 1.02 -1.71 -0.01 0.00 0.00 175.02 174.22 1djp n ASN 1162N 0.54 -5.52 -0.31 3.03 5.15 -1.26 -1.67 115.26 115.22 1djp n ASN 1162Ca -0.17 -0.63 -0.04 0.00 -0.60 0.00 0.00 54.58 53.14 1djp n ASN 1162Cb 0.59 -4.39 -0.02 0.00 -0.53 0.00 0.00 39.78 35.44 1djp n ASN 1162CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1djp n ASP 1163N -2.86 -5.72 -4.82 1.20 10.43 -1.26 -4.97 116.55 108.55 1djp n ASP 1163Ca 0.02 0.10 -0.22 0.00 2.57 0.00 0.00 54.79 57.26 1djp n ASP 1163Cb 0.55 -3.58 -0.04 0.00 1.84 0.00 0.00 41.12 39.89 1djp n ASP 1163CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 1djp s GLU 1164N -2.24 2.62 -0.33 -1.24 2.02 -0.67 -0.82 118.70 118.04 1djp s GLU 1164Ca 0.00 -1.37 0.02 0.00 0.02 0.00 0.00 54.97 53.64 1djp s GLU 1164Cb 0.00 -2.39 0.09 0.00 0.10 0.00 0.00 34.13 31.92 1djp s GLU 1164CO 0.00 0.08 0.03 0.42 0.02 0.00 0.00 175.26 175.81 1djp s ILE 1165N -2.34 2.46 0.08 -1.63 1.01 0.20 -3.39 121.20 117.59 1djp s ILE 1165Ca 0.40 -2.05 0.02 0.00 0.00 0.00 0.00 60.65 59.02 1djp s ILE 1165Cb -0.05 -2.67 -0.04 0.00 0.01 0.00 0.00 42.46 39.71 1djp s ILE 1165CO 0.26 -0.43 0.15 -1.10 0.00 0.00 0.00 174.94 173.81 1djp s GLN 1166N 1.01 3.15 0.07 2.79 -1.52 0.23 -0.12 119.66 125.27 1djp s GLN 1166Ca 0.04 -0.60 -0.29 0.00 -1.95 0.00 0.00 55.36 52.57 1djp s GLN 1166Cb -0.20 -2.86 -0.05 0.00 -0.22 0.00 0.00 33.01 29.68 1djp s GLN 1166CO -0.06 0.57 0.92 0.45 -0.25 0.00 0.00 175.29 176.92 1djp s SER 1167N -2.55 7.40 0.58 5.90 0.15 -1.26 -0.55 113.70 123.36 1djp s SER 1167Ca 0.32 1.68 0.34 0.00 0.70 0.00 0.00 55.95 58.99 1djp s SER 1167Cb -0.12 -2.56 1.77 0.00 -1.71 0.00 0.00 66.02 63.40 1djp s SER 1167CO 0.25 -0.10 2.16 1.23 1.20 0.00 0.00 173.24 177.98 1djp h GLY 1168N 5.93 0.00 0.64 9.45 0.00 -1.08 -2.06 103.07 115.95 1djp h GLY 1168Ca -0.43 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 1djp h GLY 1168CO 0.73 0.00 -0.31 -0.09 0.00 0.00 0.00 176.54 176.87 1djp h ARG 1169N 0.00 -0.83 -0.27 4.80 2.43 -1.84 -3.19 114.38 115.48 1djp h ARG 1169Ca -0.00 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1djp h ARG 1169Cb 0.24 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1djp h ARG 1169CO 0.01 -0.55 0.00 -0.40 -1.51 0.00 0.00 179.97 177.51 1djp n ASP 1170N -4.40 2.78 -4.77 -3.80 3.85 -1.22 -4.81 116.55 104.18 1djp n ASP 1170Ca -0.11 -1.84 -0.39 0.00 -0.71 0.00 0.00 54.79 51.75 1djp n ASP 1170Cb 0.34 -0.18 -0.02 0.00 -1.35 0.00 0.00 41.12 39.91 1djp n ASP 1170CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1djp s VAL 1171N -1.07 3.14 -0.01 2.12 0.11 -0.78 -4.43 120.40 119.48 1djp s VAL 1171Ca 0.24 1.01 -0.07 0.00 -2.93 0.00 0.00 61.98 60.23 1djp s VAL 1171Cb 0.14 -3.60 0.00 0.00 -1.53 0.00 0.00 36.38 31.40 1djp s VAL 1171CO 0.19 0.15 0.15 -0.55 -3.33 0.00 0.00 175.10 171.71 1djp s SER 1172N -0.99 -0.02 -0.67 3.54 0.15 0.12 -4.76 113.70 111.08 1djp s SER 1172Ca 0.54 -0.11 -0.27 0.00 0.70 0.00 0.00 55.95 56.80 1djp s SER 1172Cb -0.32 0.23 0.02 0.00 -1.71 0.00 0.00 66.02 64.24 1djp s SER 1172CO 0.41 -0.33 1.39 -0.75 1.20 0.00 0.00 173.24 175.16 1djp s LYS 1173N -1.16 3.16 -0.02 5.44 2.20 -1.26 -0.12 119.74 127.98 1djp s LYS 1173Ca -0.12 0.09 0.14 0.00 -0.36 0.00 0.00 55.97 55.71 1djp s LYS 1173Cb -0.07 -4.18 -0.20 0.00 -1.51 0.00 0.00 37.83 31.87 1djp s LYS 1173CO 0.01 -2.14 0.36 0.43 -0.36 0.00 0.00 175.35 173.65 1djp n SER 1174N 9.83 1.58 -3.98 1.43 7.64 0.44 -4.97 113.62 125.58 1djp n SER 1174Ca 0.08 -0.16 -0.24 0.00 1.01 0.00 0.00 58.87 59.56 1djp n SER 1174Cb 0.49 1.52 -0.17 0.00 -1.01 0.00 0.00 64.21 65.05 1djp n SER 1174CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1djp s ILE 1175N -2.84 1.00 0.38 0.44 1.01 -0.88 -5.07 121.20 115.24 1djp s ILE 1175Ca -0.03 -0.37 -0.15 0.00 0.00 0.00 0.00 60.65 60.10 1djp s ILE 1175Cb 0.09 -0.95 -0.08 0.00 0.01 0.00 0.00 42.46 41.53 1djp s ILE 1175CO 0.58 0.33 0.80 0.20 0.00 0.00 0.00 174.94 176.85 1djp s ASN 1176N 0.92 6.71 0.00 3.58 0.01 -1.26 -4.24 114.94 120.66 1djp s ASN 1176Ca -0.10 1.32 0.00 0.00 -0.71 0.00 0.00 52.86 53.37 1djp s ASN 1176Cb -0.15 -2.40 0.00 0.00 0.41 0.00 0.00 41.25 39.12 1djp s ASN 1176CO 0.01 -0.32 0.00 -0.38 -1.51 0.00 0.00 177.10 174.89 1djp n ILE 1177N -0.80 0.00 -2.06 0.60 5.41 -1.26 -4.94 119.36 116.30 1djp n ILE 1177Ca 0.04 0.00 -0.37 0.00 1.00 0.00 0.00 62.75 63.42 1djp n ILE 1177Cb 0.54 0.00 0.02 0.00 -0.71 0.00 0.00 39.64 39.49 1djp n ILE 1177CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1djp s LYS 1178N 0.00 3.22 0.48 0.38 1.02 -1.26 -4.88 119.74 118.70 1djp s LYS 1178Ca 0.00 1.86 0.32 0.00 0.02 0.00 0.00 55.97 58.18 1djp s LYS 1178Cb 0.00 -2.10 1.59 0.00 -0.52 0.00 0.00 37.83 36.79 1djp s LYS 1178CO 0.00 -1.01 1.98 1.79 -0.92 0.00 0.00 175.35 177.19 1djp h THR 1179N 1.25 0.00 -0.45 2.17 1.35 -1.93 -2.04 112.91 113.26 1djp h THR 1179Ca -0.50 -0.17 -0.16 0.00 -0.55 0.00 0.00 66.41 65.02 1djp h THR 1179Cb 1.28 0.99 -0.10 0.00 -1.73 0.00 0.00 68.15 68.60 1djp h THR 1179CO 0.57 0.00 0.20 -1.84 -0.25 0.00 0.00 175.52 174.20 1djp n GLU 1180N -2.72 2.31 -0.33 4.72 0.28 -1.26 -4.45 120.64 119.19 1djp n GLU 1180Ca -0.01 -1.68 0.16 0.00 -0.16 0.00 0.00 57.16 55.48 1djp n GLU 1180Cb 0.15 -1.76 0.36 0.00 1.43 0.00 0.00 31.44 31.62 1djp n GLU 1180CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1djp h ALA 1181N 2.16 1.67 -2.67 -1.84 0.00 -1.54 -3.42 119.26 113.63 1djp h ALA 1181Ca 0.20 0.14 -0.59 0.00 0.00 0.00 0.00 54.91 54.66 1djp h ALA 1181Cb 1.72 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 19.48 1djp h ALA 1181CO 0.46 -0.29 0.04 -0.06 0.00 0.00 0.00 179.25 179.40 1djp s PHE 1182N -5.81 3.42 0.04 0.00 0.40 -1.26 -0.42 117.98 114.35 1djp s PHE 1182Ca -0.11 0.93 0.01 0.00 -0.60 0.00 0.00 56.93 57.17 1djp s PHE 1182Cb 0.27 -2.73 -0.03 0.00 0.51 0.00 0.00 43.02 41.04 1djp s PHE 1182CO 0.79 -0.07 -0.06 0.15 0.70 0.00 0.00 175.22 176.73 1djp s LYS 1183N 1.50 0.49 -0.03 0.44 3.01 0.82 -4.86 119.74 121.10 1djp s LYS 1183Ca 0.29 -0.78 0.04 0.00 -1.01 0.00 0.00 55.97 54.50 1djp s LYS 1183Cb -0.16 -0.13 -0.00 0.00 -1.01 0.00 0.00 37.83 36.53 1djp s LYS 1183CO 0.11 0.00 -0.15 0.45 0.51 0.00 0.00 175.35 176.27 1djp s SER 1184N -1.73 1.90 0.59 2.83 0.15 -1.26 0.11 113.70 116.28 1djp s SER 1184Ca -0.09 -0.30 0.39 0.00 0.70 0.00 0.00 55.95 56.65 1djp s SER 1184Cb -0.08 -0.47 2.07 0.00 -1.71 0.00 0.00 66.02 65.83 1djp s SER 1184CO -0.01 0.14 2.20 0.00 1.20 0.00 0.00 173.24 176.77 1djp h ALA 1185N 6.20 1.00 -0.27 5.45 0.00 -1.78 -1.95 119.26 127.91 1djp h ALA 1185Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1djp h ALA 1185Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1djp h ALA 1185CO 0.48 0.00 0.00 0.91 0.00 0.00 0.00 179.25 180.64 1djp n TRP 1186N -2.95 0.34 0.00 0.00 7.02 -1.26 -4.95 117.44 115.64 1djp n TRP 1186Ca -0.02 -0.20 0.00 0.00 -1.02 0.00 0.00 57.50 56.26 1djp n TRP 1186Cb 0.11 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.00 1djp n TRP 1186CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1djp n GLY 1187N 1.23 -0.89 3.82 6.99 0.00 -0.73 -4.97 105.19 110.62 1djp n GLY 1187Ca 0.16 -1.66 -0.32 0.00 0.00 0.00 0.00 46.02 44.19 1djp n GLY 1187CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1djp s PRO 1188N -1.96 3.31 0.05 1.61 0.02 -1.26 -4.77 135.00 132.00 1djp s PRO 1188Ca 0.00 1.07 0.01 0.00 0.02 0.00 0.00 61.00 62.10 1djp s PRO 1188Cb 0.00 -2.04 -0.26 0.00 0.02 0.00 0.00 34.50 32.22 1djp s PRO 1188CO 0.00 -0.81 1.02 -0.07 -0.33 0.00 0.00 177.00 176.82 1djp h LEU 1189N 0.14 0.27 0.00 -5.54 3.38 -0.82 -3.43 115.31 109.30 1djp h LEU 1189Ca -0.46 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.18 1djp h LEU 1189Cb 1.21 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1djp h LEU 1189CO 0.58 1.27 0.00 0.61 0.09 0.00 0.00 178.44 180.99 1djp n GLY 1190N 1.54 1.90 3.09 0.83 0.00 -1.00 -0.69 105.19 110.86 1djp n GLY 1190Ca -0.10 -0.69 -0.08 0.00 0.00 0.00 0.00 46.02 45.15 1djp n GLY 1190CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1djp s MET 1191N 0.85 0.58 -0.18 1.61 -1.94 0.17 -0.62 119.30 119.77 1djp s MET 1191Ca 0.00 -1.04 0.01 0.00 -1.71 0.00 0.00 55.69 52.94 1djp s MET 1191Cb 0.00 0.21 0.04 0.00 2.01 0.00 0.00 34.83 37.09 1djp s MET 1191CO 0.00 -0.12 -0.12 0.08 -0.01 0.00 0.00 175.02 174.85 1djp s VAL 1192N -3.37 1.65 -0.07 -6.03 1.01 -0.00 -0.17 120.40 113.41 1djp s VAL 1192Ca 0.02 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.11 1djp s VAL 1192Cb 0.04 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 34.78 1djp s VAL 1192CO -0.08 0.28 -0.08 -0.69 0.00 0.00 0.00 175.10 174.53 1djp s VAL 1193N 1.42 0.85 -1.29 2.92 1.01 0.49 -4.71 120.40 121.09 1djp s VAL 1193Ca 0.01 -0.26 -0.17 0.00 0.00 0.00 0.00 61.98 61.56 1djp s VAL 1193Cb -0.15 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.40 1djp s VAL 1193CO -0.09 0.31 0.55 -0.62 0.00 0.00 0.00 175.10 175.25 1djp n GLU 1194N 4.27 -1.43 -0.66 2.72 1.02 -1.26 -0.83 120.64 124.48 1djp n GLU 1194Ca -0.20 0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 1djp n GLU 1194Cb 0.51 -3.68 0.00 0.00 -0.02 0.00 0.00 31.44 28.25 1djp n GLU 1194CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1djp n GLY 1195N -2.01 0.73 3.63 0.62 0.00 -1.26 -4.99 105.19 101.92 1djp n GLY 1195Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 1djp n GLY 1195CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1djp s LYS 1196N -0.37 3.31 -0.12 1.61 1.02 -0.01 -4.88 119.74 120.31 1djp s LYS 1196Ca 0.00 -0.42 -0.13 0.00 0.02 0.00 0.00 55.97 55.44 1djp s LYS 1196Cb 0.00 -2.89 -0.05 0.00 -0.52 0.00 0.00 37.83 34.37 1djp s LYS 1196CO 0.00 0.53 0.29 -1.12 -0.92 0.00 0.00 175.35 174.13 1djp s SER 1197N -0.39 6.51 -0.16 2.83 0.01 -1.26 -0.38 113.70 120.86 1djp s SER 1197Ca 0.08 0.60 0.00 0.00 1.31 0.00 0.00 55.95 57.94 1djp s SER 1197Cb -0.12 -2.18 0.03 0.00 0.21 0.00 0.00 66.02 63.96 1djp s SER 1197CO 0.02 0.20 -0.14 -0.31 0.41 0.00 0.00 173.24 173.43 1djp s TYR 1198N -0.14 2.26 -0.15 2.43 1.51 0.76 -5.00 117.35 119.02 1djp s TYR 1198Ca 0.18 -1.32 -0.08 0.00 -1.01 0.00 0.00 57.07 54.83 1djp s TYR 1198Cb -0.14 -1.62 -0.04 0.00 -0.11 0.00 0.00 41.96 40.05 1djp s TYR 1198CO 0.06 -0.69 0.14 -1.58 -1.11 0.00 0.00 175.55 172.37 1djp s TRP 1199N 1.46 3.53 0.00 2.71 0.52 -1.26 -0.66 118.94 125.24 1djp s TRP 1199Ca 0.04 0.46 0.00 0.00 0.02 0.00 0.00 56.10 56.62 1djp s TRP 1199Cb -0.14 -2.04 0.00 0.00 -1.15 0.00 0.00 33.47 30.15 1djp s TRP 1199CO -0.10 0.56 0.00 1.19 0.02 0.00 0.00 176.95 178.61 1djp n PHE 1200N 2.60 0.00 -3.90 -1.98 3.01 0.13 -4.97 117.46 112.35 1djp n PHE 1200Ca -0.18 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.18 1djp n PHE 1200Cb 0.54 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.92 1djp n PHE 1200CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1djp s ARG 1201N -1.11 0.62 0.10 -1.08 3.00 0.11 -5.02 118.95 115.56 1djp s ARG 1201Ca 0.00 -0.70 0.09 0.00 0.00 0.00 0.00 55.73 55.13 1djp s ARG 1201Cb 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 34.95 35.16 1djp s ARG 1201CO 0.00 -0.16 -0.24 -0.51 0.00 0.00 0.00 175.30 174.39 1djp s LEU 1202N -2.08 2.28 0.36 2.53 1.43 -1.26 -4.75 118.68 117.19 1djp s LEU 1202Ca -0.05 -0.68 -0.27 0.00 -1.03 0.00 0.00 54.13 52.09 1djp s LEU 1202Cb -0.01 -1.06 -0.10 0.00 0.03 0.00 0.00 46.19 45.05 1djp s LEU 1202CO -0.04 0.14 1.28 -2.84 0.23 0.00 0.00 176.35 175.12 1djp s PRO 1203N -1.79 4.20 -0.04 1.29 0.02 -1.26 -4.94 135.00 132.48 1djp s PRO 1203Ca 0.10 2.14 0.19 0.00 0.02 0.00 0.00 61.00 63.45 1djp s PRO 1203Cb -0.10 -2.92 -0.30 0.00 0.02 0.00 0.00 34.50 31.20 1djp s PRO 1203CO 0.04 -0.29 0.40 0.00 -0.33 0.00 0.00 177.00 176.83 1djp n ALA 1204N 0.50 2.64 -2.30 -1.55 0.00 -1.26 -5.01 120.51 113.53 1djp n ALA 1204Ca 0.02 -0.52 -0.29 0.00 0.00 0.00 0.00 53.44 52.65 1djp n ALA 1204Cb 0.43 -0.63 -0.02 0.00 0.00 0.00 0.00 19.45 19.23 1djp n ALA 1204CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1djp s LYS 1205N -3.29 3.66 0.32 0.00 -0.14 -1.26 -5.05 119.74 113.98 1djp s LYS 1205Ca -0.07 0.26 -0.29 0.00 -1.36 0.00 0.00 55.97 54.50 1djp s LYS 1205Cb 0.12 -2.45 -0.10 0.00 -1.68 0.00 0.00 37.83 33.72 1djp s LYS 1205CO 0.81 -0.03 1.34 1.03 -0.76 0.00 0.00 175.35 177.74 1djp s ARG 1206N -4.09 4.32 0.28 1.68 0.52 -0.48 -5.00 118.95 116.18 1djp s ARG 1206Ca 0.48 2.26 -0.18 0.00 -0.52 0.00 0.00 55.73 57.77 1djp s ARG 1206Cb -0.10 -3.07 0.01 0.00 0.52 0.00 0.00 34.95 32.31 1djp s ARG 1206CO 0.35 -0.26 0.65 -3.38 0.02 0.00 0.00 175.30 172.68 1djp s HIS 1207N -0.93 0.03 0.00 -0.53 -3.43 -1.26 -4.68 115.29 104.48 1djp s HIS 1207Ca 0.51 -0.47 0.00 0.00 -0.80 0.00 0.00 55.06 54.30 1djp s HIS 1207Cb -0.41 0.54 0.00 0.00 -1.43 0.00 0.00 32.58 31.29 1djp s HIS 1207CO 0.52 -1.19 0.00 0.25 -2.00 0.00 0.00 174.74 172.32 1djp n THR 1208N -0.44 0.00 -0.28 -5.38 -2.24 0.50 -1.23 114.28 105.21 1djp n THR 1208Ca -0.03 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.80 1djp n THR 1208Cb 0.60 0.00 0.19 0.00 -2.10 0.00 0.00 70.33 69.02 1djp n THR 1208CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1djp h VAL 1209N 0.00 0.76 -0.60 2.28 -1.51 -1.70 -1.83 116.25 113.64 1djp h VAL 1209Ca 0.00 -0.21 -0.15 0.00 -1.23 0.00 0.00 66.70 65.11 1djp h VAL 1209Cb 0.00 0.10 -0.09 0.00 -2.13 0.00 0.00 31.29 29.17 1djp h VAL 1209CO 0.00 0.11 0.20 -0.46 -1.23 0.00 0.00 177.57 176.19 1djp n ASN 1210N -4.88 4.47 -4.82 4.19 6.94 -0.36 -4.92 115.26 115.88 1djp n ASN 1210Ca 0.15 -2.97 -0.37 0.00 -0.02 0.00 0.00 54.58 51.37 1djp n ASN 1210Cb 0.38 -0.70 -0.06 0.00 -2.36 0.00 0.00 39.78 37.04 1djp n ASN 1210CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1djp s SER 1211N -0.73 7.03 0.00 0.53 0.15 -0.69 -4.59 113.70 115.40 1djp s SER 1211Ca 0.46 1.33 0.28 0.00 0.70 0.00 0.00 55.95 58.72 1djp s SER 1211Cb 0.36 -2.38 1.40 0.00 -1.71 0.00 0.00 66.02 63.69 1djp s SER 1211CO 0.12 0.11 1.94 -1.84 1.20 0.00 0.00 173.24 174.76 1djp n GLU 1212N 1.00 1.33 -4.09 5.44 0.28 -1.26 -4.84 120.64 118.50 1djp n GLU 1212Ca -0.05 -0.49 -0.26 0.00 -0.16 0.00 0.00 57.16 56.20 1djp n GLU 1212Cb 0.51 -1.47 -0.05 0.00 1.43 0.00 0.00 31.44 31.86 1djp n GLU 1212CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1djp s PHE 1213N -1.98 3.14 -0.20 -1.84 0.40 -1.26 -5.12 117.98 111.12 1djp s PHE 1213Ca 0.41 -0.02 -0.08 0.00 -0.60 0.00 0.00 56.93 56.64 1djp s PHE 1213Cb 0.21 -1.51 0.08 0.00 0.51 0.00 0.00 43.02 42.31 1djp s PHE 1213CO 0.34 0.52 0.44 0.34 0.70 0.00 0.00 175.22 177.56 1djp s ASP 1214N -3.13 -0.41 0.55 1.36 3.68 -1.26 -4.66 116.67 112.80 1djp s ASP 1214Ca 0.31 1.02 0.23 0.00 2.13 0.00 0.00 52.55 56.24 1djp s ASP 1214Cb -0.10 1.23 1.46 0.00 -1.45 0.00 0.00 42.92 44.06 1djp s ASP 1214CO 0.23 -0.22 2.11 -0.29 0.13 0.00 0.00 175.17 177.13 1djp h ILE 1215N 5.93 0.75 0.00 4.11 6.09 -1.54 -1.57 117.51 131.27 1djp h ILE 1215Ca -0.23 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.23 1djp h ILE 1215Cb 1.14 0.89 -0.00 0.00 0.47 0.00 0.00 36.82 39.31 1djp h ILE 1215CO 0.17 0.00 -0.16 0.11 -3.07 0.00 0.00 178.15 175.20 1djp h LYS 1216N 0.00 0.00 -0.03 2.19 1.57 -1.94 -2.67 116.57 115.70 1djp h LYS 1216Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1djp h LYS 1216Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1djp h LYS 1216CO -0.00 0.16 -0.06 1.04 -0.57 0.00 0.00 179.45 180.02 1djp n GLN 1217N -3.40 2.08 -3.59 3.15 6.02 -0.60 -4.88 117.38 116.16 1djp n GLN 1217Ca -0.00 -1.76 -0.39 0.00 -0.01 0.00 0.00 57.00 54.83 1djp n GLN 1217Cb 0.35 -1.44 -0.11 0.00 1.02 0.00 0.00 30.24 30.06 1djp n GLN 1217CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1djp s ILE 1218N -1.98 4.97 -0.19 5.09 1.01 -1.01 -4.94 121.20 124.15 1djp s ILE 1218Ca 0.26 -0.31 0.10 0.00 0.00 0.00 0.00 60.65 60.70 1djp s ILE 1218Cb 0.19 -3.55 -0.19 0.00 0.01 0.00 0.00 42.46 38.93 1djp s ILE 1218CO 0.32 0.03 -0.05 -1.54 0.00 0.00 0.00 174.94 173.70 1djp n SER 1219N 5.05 1.34 -3.87 3.58 3.41 -1.26 -4.94 113.62 116.93 1djp n SER 1219Ca -0.13 -0.05 -0.11 0.00 -0.26 0.00 0.00 58.87 58.32 1djp n SER 1219Cb 0.49 0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 64.75 1djp n SER 1219CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1djp s SER 1220N -5.57 0.05 -0.12 4.04 1.04 -1.26 -5.12 113.70 106.76 1djp s SER 1220Ca -0.18 -0.30 -0.01 0.00 0.48 0.00 0.00 55.95 55.94 1djp s SER 1220Cb 0.06 0.23 -0.02 0.00 0.10 0.00 0.00 66.02 66.39 1djp s SER 1220CO 0.63 -0.44 -0.09 -0.76 0.98 0.00 0.00 173.24 173.56 1djp s LEU 1221N -1.69 2.94 0.57 2.42 2.01 -1.26 -4.97 118.68 118.69 1djp s LEU 1221Ca -0.11 -0.21 -0.19 0.00 0.01 0.00 0.00 54.13 53.63 1djp s LEU 1221Cb -0.05 -1.67 -0.05 0.00 0.01 0.00 0.00 46.19 44.44 1djp s LEU 1221CO -0.01 0.21 1.17 -2.16 1.01 0.00 0.00 176.35 176.57 1djp s PRO 1222N 0.10 3.17 -0.07 1.29 0.04 -1.26 -4.96 135.00 133.31 1djp s PRO 1222Ca -0.04 1.72 -0.30 0.00 0.04 0.00 0.00 61.00 62.43 1djp s PRO 1222Cb -0.14 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 1djp s PRO 1222CO 0.04 -1.02 1.28 -1.14 0.04 0.00 0.00 177.00 176.20 1djp s GLN 1223N -3.30 4.30 -0.05 4.56 0.74 -1.26 -4.82 119.66 119.83 1djp s GLN 1223Ca 0.75 1.76 0.02 0.00 0.05 0.00 0.00 55.36 57.94 1djp s GLN 1223Cb -0.27 -3.63 0.01 0.00 1.10 0.00 0.00 33.01 30.22 1djp s GLN 1223CO 0.30 -0.56 -0.11 0.08 -0.55 0.00 0.00 175.29 174.46 1djp s VAL 1224N 2.64 1.00 0.32 1.34 1.01 -1.26 -0.61 120.40 124.84 1djp s VAL 1224Ca 0.58 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 62.21 1djp s VAL 1224Cb -0.26 -0.91 -0.06 0.00 0.00 0.00 0.00 36.38 35.15 1djp s VAL 1224CO 0.22 0.32 -0.05 -1.81 0.00 0.00 0.00 175.10 173.77 1djp s ASP 1225N 0.54 3.18 -0.08 3.32 1.01 -0.85 -5.01 116.67 118.79 1djp s ASP 1225Ca -0.11 -1.23 0.03 0.00 0.71 0.00 0.00 52.55 51.96 1djp s ASP 1225Cb -0.14 -0.25 0.00 0.00 1.01 0.00 0.00 42.92 43.55 1djp s ASP 1225CO 0.02 -0.33 -0.19 -0.63 0.21 0.00 0.00 175.17 174.25 1djp s ILE 1226N -2.87 1.64 -0.10 0.77 1.01 -1.26 -0.13 121.20 120.26 1djp s ILE 1226Ca 0.32 -0.78 0.02 0.00 0.00 0.00 0.00 60.65 60.20 1djp s ILE 1226Cb 0.04 -1.44 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 1djp s ILE 1226CO 0.14 0.47 -0.14 0.00 0.00 0.00 0.00 174.94 175.41 1djp s ALA 1227N 0.42 2.60 0.06 9.38 0.00 -0.60 -4.95 121.76 128.68 1djp s ALA 1227Ca -0.15 -0.93 -0.18 0.00 0.00 0.00 0.00 51.96 50.69 1djp s ALA 1227Cb -0.16 -1.09 -0.06 0.00 0.00 0.00 0.00 23.12 21.80 1djp s ALA 1227CO 0.06 0.36 0.54 -0.47 0.00 0.00 0.00 175.76 176.25 1djp s TYR 1228N -0.05 3.79 0.01 0.00 5.04 -1.26 -1.08 117.35 123.80 1djp s TYR 1228Ca -0.03 1.22 0.05 0.00 -2.44 0.00 0.00 57.07 55.86 1djp s TYR 1228Cb -0.14 -2.45 -0.03 0.00 0.35 0.00 0.00 41.96 39.68 1djp s TYR 1228CO 0.04 0.60 -0.13 0.45 -1.34 0.00 0.00 175.55 175.17 1djp s SER 1229N -1.11 4.17 0.10 4.32 0.15 -0.55 -4.91 113.70 115.86 1djp s SER 1229Ca 0.28 -0.27 -0.07 0.00 0.70 0.00 0.00 55.95 56.59 1djp s SER 1229Cb -0.19 -0.84 0.02 0.00 -1.71 0.00 0.00 66.02 63.30 1djp s SER 1229CO 0.18 0.28 0.33 0.00 1.20 0.00 0.00 173.24 175.24 1djp n TYR 1230N 1.70 -1.13 -1.88 3.44 4.11 -1.26 -4.39 117.16 117.74 1djp n TYR 1230Ca -0.16 -0.55 -0.42 0.00 -0.00 0.00 0.00 57.90 56.78 1djp n TYR 1230Cb 0.52 0.27 -0.02 0.00 -0.00 0.00 0.00 39.34 40.11 1djp n TYR 1230CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.86 177.06 1djp s GLY 1231N -2.13 1.92 -1.53 -7.48 0.00 -1.26 -2.44 107.32 94.39 1djp s GLY 1231Ca 0.07 1.45 0.00 0.00 0.00 0.00 0.00 44.72 46.24 1djp s GLY 1231CO 0.03 2.53 0.00 -2.01 0.00 0.00 0.00 173.10 173.65 1djp n ASN 1232N 2.92 -4.90 -4.77 1.64 5.15 -1.26 -4.98 115.26 109.06 1djp n ASN 1232Ca 0.10 0.15 -0.38 0.00 -0.60 0.00 0.00 54.58 53.86 1djp n ASN 1232Cb 0.38 -3.94 -0.02 0.00 -0.53 0.00 0.00 39.78 35.67 1djp n ASN 1232CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1djp s VAL 1233N -2.73 3.27 0.48 3.44 0.11 -1.02 -5.06 120.40 118.89 1djp s VAL 1233Ca 0.00 1.02 0.05 0.00 -2.93 0.00 0.00 61.98 60.12 1djp s VAL 1233Cb 0.00 -3.55 -0.02 0.00 -1.53 0.00 0.00 36.38 31.28 1djp s VAL 1233CO 0.00 0.05 0.18 0.42 -3.33 0.00 0.00 175.10 172.42 1djp s THR 1234N -1.50 1.78 -2.11 5.04 -4.23 -1.26 -4.80 115.64 108.55 1djp s THR 1234Ca 0.59 -1.75 0.27 0.00 -1.18 0.00 0.00 61.69 59.62 1djp s THR 1234Cb -0.28 -2.53 0.70 0.00 1.34 0.00 0.00 72.50 71.73 1djp s THR 1234CO 0.35 0.00 1.94 -0.90 -0.54 0.00 0.00 174.62 175.47 1djp n ASP 1235N -1.37 0.43 -0.16 3.99 5.68 -1.26 -4.50 116.55 119.35 1djp n ASP 1235Ca -0.07 -1.27 -0.09 0.00 -0.50 0.00 0.00 54.79 52.86 1djp n ASP 1235Cb 0.65 -0.01 -0.07 0.00 -1.14 0.00 0.00 41.12 40.55 1djp n ASP 1235CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 1djp h THR 1236N 0.63 0.00 -0.24 2.12 2.02 -1.99 -1.14 112.91 114.30 1djp h THR 1236Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1djp h THR 1236Cb 0.14 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.53 1djp h THR 1236CO 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 175.52 175.88 1djp h ALA 1237N -0.26 1.53 -0.03 6.16 0.00 -1.99 -0.73 119.26 123.95 1djp h ALA 1237Ca 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1djp h ALA 1237Cb 0.38 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1djp h ALA 1237CO -0.50 0.34 0.01 1.88 0.00 0.00 0.00 179.25 180.98 1djp h TYR 1238N 0.35 0.04 -0.21 0.00 -1.99 -1.65 -0.86 116.97 112.64 1djp h TYR 1238Ca 0.08 -0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.75 1djp h TYR 1238Cb 0.26 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.97 1djp h TYR 1238CO 0.01 0.16 -0.08 0.87 -0.00 0.00 0.00 178.16 179.12 1djp h LYS 1239N -0.09 0.43 -0.39 4.88 1.57 -1.07 -2.46 116.57 119.44 1djp h LYS 1239Ca 0.01 -0.18 0.07 0.00 -1.87 0.00 0.00 60.65 58.68 1djp h LYS 1239Cb 0.13 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 1djp h LYS 1239CO -0.00 0.69 0.02 0.00 -0.57 0.00 0.00 179.45 179.59 1djp h ALA 1240N 0.72 0.38 -0.81 3.86 0.00 -1.07 0.17 119.26 122.50 1djp h ALA 1240Ca 0.05 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1djp h ALA 1240Cb 0.55 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1djp h ALA 1240CO 0.03 -0.38 0.39 -0.07 0.00 0.00 0.00 179.25 179.22 1djp h LEU 1241N 0.13 1.07 -0.56 0.00 4.07 -1.16 -2.00 115.31 116.86 1djp h LEU 1241Ca 0.19 -0.14 -0.12 0.00 0.08 0.00 0.00 57.88 57.90 1djp h LEU 1241Cb 0.26 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 41.71 1djp h LEU 1241CO -0.31 0.90 -0.16 0.00 -1.08 0.00 0.00 178.44 177.80 1djp h ALA 1242N 1.20 0.76 0.00 1.53 0.00 -0.87 -2.29 119.26 119.58 1djp h ALA 1242Ca 0.28 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1djp h ALA 1242Cb 0.12 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1djp h ALA 1242CO -0.03 0.67 -0.07 1.96 0.00 0.00 0.00 179.25 181.77 1djp h GLN 1243N 0.87 0.00 -0.64 0.00 4.20 -0.45 -3.03 115.11 116.07 1djp h GLN 1243Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1djp h GLN 1243Cb 0.72 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.50 1djp h GLN 1243CO 0.06 0.07 0.00 0.09 -0.67 0.00 0.00 178.83 178.38 1djp n ASN 1244N -3.23 4.78 0.00 1.46 4.13 -0.77 -4.93 115.26 116.70 1djp n ASN 1244Ca -0.00 -2.59 0.00 0.00 1.68 0.00 0.00 54.58 53.67 1djp n ASN 1244Cb 0.32 -0.60 0.00 0.00 -1.54 0.00 0.00 39.78 37.95 1djp n ASN 1244CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1djp n GLY 1245N 0.86 1.07 3.65 7.41 0.00 -1.14 -5.05 105.19 111.98 1djp n GLY 1245Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 1djp n GLY 1245CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1djp s ALA 1246N -2.00 3.44 -0.39 4.61 0.00 -0.89 -4.64 121.76 121.90 1djp s ALA 1246Ca 0.00 1.18 0.23 0.00 0.00 0.00 0.00 51.96 53.37 1djp s ALA 1246Cb 0.00 -3.87 0.24 0.00 0.00 0.00 0.00 23.12 19.49 1djp s ALA 1246CO 0.00 -1.76 1.40 0.87 0.00 0.00 0.00 175.76 176.27 1djp h LYS 1247N 11.20 0.00 -2.74 0.00 1.79 -1.21 -3.44 116.57 122.18 1djp h LYS 1247Ca -0.47 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 57.89 1djp h LYS 1247Cb 1.23 0.00 -0.22 0.00 -1.58 0.00 0.00 32.23 31.66 1djp h LYS 1247CO 0.95 0.00 -0.20 0.00 -1.08 0.00 0.00 179.45 179.12 1djp s ALA 1248N -3.26 -1.04 -0.11 3.86 0.00 -1.24 -1.69 121.76 118.29 1djp s ALA 1248Ca 0.04 0.95 0.03 0.00 0.00 0.00 0.00 51.96 52.99 1djp s ALA 1248Cb 0.07 -0.41 -0.00 0.00 0.00 0.00 0.00 23.12 22.78 1djp s ALA 1248CO 0.71 -0.23 -0.22 -0.51 0.00 0.00 0.00 175.76 175.51 1djp s LEU 1249N -0.36 2.19 -0.39 0.00 1.43 -0.28 -2.00 118.68 119.28 1djp s LEU 1249Ca -0.05 -0.53 -0.18 0.00 -1.03 0.00 0.00 54.13 52.34 1djp s LEU 1249Cb -0.03 -1.45 0.01 0.00 0.03 0.00 0.00 46.19 44.75 1djp s LEU 1249CO 0.02 0.15 0.51 -0.63 0.23 0.00 0.00 176.35 176.64 1djp s ILE 1250N 0.39 5.00 -0.48 -0.59 -1.09 0.81 -2.00 121.20 123.25 1djp s ILE 1250Ca -0.17 0.07 -0.25 0.00 -2.23 0.00 0.00 60.65 58.08 1djp s ILE 1250Cb -0.17 -4.03 0.03 0.00 -1.58 0.00 0.00 42.46 36.71 1djp s ILE 1250CO 0.07 -0.35 0.90 -2.28 -1.23 0.00 0.00 174.94 172.05 1djp s HIS 1251N 2.39 2.91 -1.24 3.97 5.65 0.16 -1.55 115.29 127.58 1djp s HIS 1251Ca 0.17 0.26 -0.11 0.00 0.25 0.00 0.00 55.06 55.63 1djp s HIS 1251Cb -0.16 -3.92 0.18 0.00 -1.18 0.00 0.00 32.58 27.50 1djp s HIS 1251CO 0.15 -1.12 1.68 0.00 -0.65 0.00 0.00 174.74 174.79 1djp n ALA 1252N 7.12 4.77 -1.57 1.58 0.00 -0.24 -0.18 120.51 131.99 1djp n ALA 1252Ca 0.04 -4.32 -0.29 0.00 0.00 0.00 0.00 53.44 48.88 1djp n ALA 1252Cb 0.48 -2.97 0.13 0.00 0.00 0.00 0.00 19.45 17.09 1djp n ALA 1252CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1djp s GLY 1253N 1.51 1.58 0.46 0.00 0.00 -1.11 -1.48 107.32 108.27 1djp s GLY 1253Ca 0.40 -0.54 -0.16 0.00 0.00 0.00 0.00 44.72 44.42 1djp s GLY 1253CO 0.01 0.01 0.91 -0.51 0.00 0.00 0.00 173.10 173.52 1djp s THR 1254N -3.31 4.57 0.00 0.90 -4.23 -1.25 -1.36 115.64 110.96 1djp s THR 1254Ca 0.64 1.12 0.00 0.00 -1.18 0.00 0.00 61.69 62.27 1djp s THR 1254Cb -0.14 -3.69 0.00 0.00 1.34 0.00 0.00 72.50 70.01 1djp s THR 1254CO 0.53 -0.53 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1djp n GLY 1255N -1.22 2.54 2.25 3.99 0.00 -1.26 -1.48 105.19 110.01 1djp n GLY 1255Ca 0.05 -0.24 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 1djp n GLY 1255CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1djp n ASN 1256N 0.83 6.74 -2.26 1.61 2.85 -1.26 -4.51 115.26 119.25 1djp n ASN 1256Ca 0.00 -2.47 -0.20 0.00 -0.11 0.00 0.00 54.58 51.80 1djp n ASN 1256Cb 0.00 -1.39 -0.01 0.00 1.24 0.00 0.00 39.78 39.62 1djp n ASN 1256CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1djp n GLY 1257N 3.22 -0.40 3.74 8.20 0.00 -1.15 -4.60 105.19 114.20 1djp n GLY 1257Ca 0.59 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 46.21 1djp n GLY 1257CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1djp s SER 1258N -2.11 4.81 -0.08 1.61 0.01 -0.55 -4.80 113.70 112.58 1djp s SER 1258Ca 0.00 2.44 0.03 0.00 1.31 0.00 0.00 55.95 59.72 1djp s SER 1258Cb 0.00 -2.60 0.01 0.00 0.21 0.00 0.00 66.02 63.64 1djp s SER 1258CO 0.00 -1.85 -0.16 -0.69 0.41 0.00 0.00 173.24 170.95 1djp s VAL 1259N -1.64 1.46 0.37 3.43 1.01 -1.26 -3.91 120.40 119.86 1djp s VAL 1259Ca 0.78 -0.66 -0.28 0.00 0.00 0.00 0.00 61.98 61.82 1djp s VAL 1259Cb -0.32 -1.30 -0.11 0.00 0.00 0.00 0.00 36.38 34.65 1djp s VAL 1259CO 0.38 0.43 1.50 -0.55 0.00 0.00 0.00 175.10 176.85 1djp s SER 1260N 0.63 6.33 0.64 3.32 0.15 -1.26 -4.84 113.70 118.68 1djp s SER 1260Ca -0.14 3.06 0.28 0.00 0.70 0.00 0.00 55.95 59.84 1djp s SER 1260Cb -0.16 -2.67 1.48 0.00 -1.71 0.00 0.00 66.02 62.96 1djp s SER 1260CO 0.04 -0.89 1.85 0.77 1.20 0.00 0.00 173.24 176.22 1djp h SER 1261N 3.10 0.00 1.34 5.45 4.64 -1.99 0.15 113.55 126.24 1djp h SER 1261Ca -0.51 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.71 1djp h SER 1261Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 1djp h SER 1261CO 0.65 0.00 -0.68 0.03 -0.87 0.00 0.00 176.83 175.96 1djp h ARG 1262N 0.00 0.00 0.00 4.77 3.08 -1.92 -3.32 114.38 116.99 1djp h ARG 1262Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1djp h ARG 1262Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1djp h ARG 1262CO -0.00 0.37 -1.05 0.28 -1.07 0.00 0.00 179.97 178.50 1djp n VAL 1263N -3.10 0.07 0.25 2.04 0.31 0.49 -4.56 118.33 113.83 1djp n VAL 1263Ca -0.00 -0.15 -0.16 0.00 -0.01 0.00 0.00 64.34 64.02 1djp n VAL 1263Cb 0.72 0.48 -0.08 0.00 -0.91 0.00 0.00 33.84 34.06 1djp n VAL 1263CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1djp h VAL 1264N 0.00 0.39 -0.60 2.52 2.07 -1.56 -2.22 116.25 116.84 1djp h VAL 1264Ca 0.00 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.62 1djp h VAL 1264Cb 0.64 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1djp h VAL 1264CO 0.00 0.00 0.41 1.55 0.02 0.00 0.00 177.57 179.55 1djp h PRO 1265N -0.69 0.37 -0.26 1.57 0.13 -1.80 -0.98 132.00 130.34 1djp h PRO 1265Ca -0.04 -0.02 -0.12 0.00 -0.87 0.00 0.00 66.00 64.95 1djp h PRO 1265Cb 0.59 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.63 1djp h PRO 1265CO 0.01 0.25 -0.29 0.00 -0.23 0.00 0.00 178.00 177.74 1djp h ALA 1266N 1.70 0.38 -0.63 -0.56 0.00 -1.79 -1.71 119.26 116.66 1djp h ALA 1266Ca 0.28 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1djp h ALA 1266Cb 0.59 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1djp h ALA 1266CO -0.08 0.40 0.30 -0.07 0.00 0.00 0.00 179.25 179.80 1djp h LEU 1267N 0.38 0.81 -0.39 0.00 4.07 -0.73 -0.64 115.31 118.80 1djp h LEU 1267Ca 0.04 -0.08 -0.05 0.00 0.08 0.00 0.00 57.88 57.86 1djp h LEU 1267Cb 0.86 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.38 1djp h LEU 1267CO 0.07 0.69 0.04 1.56 -1.08 0.00 0.00 178.44 179.72 1djp h GLN 1268N 0.89 0.65 -0.65 1.13 4.20 -1.02 -1.77 115.11 118.55 1djp h GLN 1268Ca 0.22 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.66 1djp h GLN 1268Cb 0.10 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 1djp h GLN 1268CO -0.03 0.72 0.08 1.96 -0.67 0.00 0.00 178.83 180.89 1djp h GLN 1269N 0.49 1.08 0.00 1.46 7.50 -0.89 -1.80 115.11 122.95 1djp h GLN 1269Ca 0.11 -0.30 -0.05 0.00 0.50 0.00 0.00 58.65 58.92 1djp h GLN 1269Cb 0.40 -0.12 -0.01 0.00 0.05 0.00 0.00 27.48 27.80 1djp h GLN 1269CO 0.01 1.01 -0.22 -0.07 -1.50 0.00 0.00 178.83 178.06 1djp h LEU 1270N 1.01 0.00 -0.05 1.46 3.38 -1.05 -2.05 115.31 118.01 1djp h LEU 1270Ca 0.19 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.07 1djp h LEU 1270Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1djp h LEU 1270CO 0.02 0.22 -0.33 -0.09 0.09 0.00 0.00 178.44 178.35 1djp h ARG 1271N 0.00 0.31 -0.48 1.13 9.65 -0.75 0.07 114.38 124.32 1djp h ARG 1271Ca -0.00 -0.27 0.01 0.00 -1.10 0.00 0.00 59.98 58.62 1djp h ARG 1271Cb 0.57 0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.19 1djp h ARG 1271CO 0.03 0.92 0.32 0.87 2.80 0.00 0.00 179.97 184.91 1djp h LYS 1272N -0.21 0.60 0.00 0.20 1.57 -1.10 0.16 116.57 117.79 1djp h LYS 1272Ca -0.03 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1djp h LYS 1272Cb 1.00 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1djp h LYS 1272CO 0.07 0.40 0.00 0.09 -0.57 0.00 0.00 179.45 179.43 1djp n ASN 1273N -4.47 0.00 0.00 0.86 5.03 -0.79 -4.88 115.26 111.01 1djp n ASN 1273Ca 0.05 -0.70 0.00 0.00 0.87 0.00 0.00 54.58 54.80 1djp n ASN 1273Cb 0.08 -0.03 0.00 0.00 -1.02 0.00 0.00 39.78 38.81 1djp n ASN 1273CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1djp n GLY 1274N 0.59 0.83 3.67 7.41 0.00 0.05 -5.06 105.19 112.68 1djp n GLY 1274Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1djp n GLY 1274CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1djp s THR 1275N -2.09 5.03 0.15 2.61 2.01 -0.00 -4.91 115.64 118.44 1djp s THR 1275Ca 0.00 1.20 -0.30 0.00 0.31 0.00 0.00 61.69 62.89 1djp s THR 1275Cb 0.00 -3.95 -0.08 0.00 0.01 0.00 0.00 72.50 68.48 1djp s THR 1275CO 0.00 0.13 1.31 -1.10 -0.69 0.00 0.00 174.62 174.27 1djp s GLN 1276N 1.79 4.38 -0.37 4.92 -1.52 -0.68 -4.03 119.66 124.15 1djp s GLN 1276Ca 0.29 2.00 -0.08 0.00 -1.95 0.00 0.00 55.36 55.63 1djp s GLN 1276Cb -0.16 -3.24 0.05 0.00 -0.22 0.00 0.00 33.01 29.45 1djp s GLN 1276CO 0.11 -0.29 0.18 0.42 -0.25 0.00 0.00 175.29 175.45 1djp s ILE 1277N 0.53 4.07 -0.31 1.08 -1.09 -1.26 -1.12 121.20 123.09 1djp s ILE 1277Ca 0.59 -1.20 -0.07 0.00 -2.23 0.00 0.00 60.65 57.74 1djp s ILE 1277Cb -0.35 -3.37 0.02 0.00 -1.58 0.00 0.00 42.46 37.17 1djp s ILE 1277CO 0.34 -0.31 0.10 -0.63 -1.23 0.00 0.00 174.94 173.21 1djp s ILE 1278N 1.43 4.02 -0.41 2.92 1.01 -0.85 -0.72 121.20 128.61 1djp s ILE 1278Ca 0.01 -0.80 -0.26 0.00 0.00 0.00 0.00 60.65 59.60 1djp s ILE 1278Cb -0.21 -3.14 0.02 0.00 0.01 0.00 0.00 42.46 39.14 1djp s ILE 1278CO 0.03 -0.02 0.93 -0.13 0.00 0.00 0.00 174.94 175.75 1djp s ARG 1279N 1.49 3.70 0.00 2.79 0.52 0.12 -0.67 118.95 126.90 1djp s ARG 1279Ca 0.02 0.39 0.00 0.00 -0.52 0.00 0.00 55.73 55.62 1djp s ARG 1279Cb -0.18 -3.86 0.00 0.00 0.52 0.00 0.00 34.95 31.43 1djp s ARG 1279CO 0.03 -1.08 0.00 0.45 0.02 0.00 0.00 175.30 174.72 1djp n SER 1280N 6.99 1.58 -3.77 0.23 2.88 0.75 -0.59 113.62 121.69 1djp n SER 1280Ca 0.07 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.54 1djp n SER 1280Cb 0.48 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.92 1djp n SER 1280CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1djp s SER 1281N 0.84 -0.26 -0.47 -3.46 1.04 -1.25 -2.76 113.70 107.37 1djp s SER 1281Ca 0.00 -0.46 0.03 0.00 0.48 0.00 0.00 55.95 55.99 1djp s SER 1281Cb 0.00 0.62 0.47 0.00 0.10 0.00 0.00 66.02 67.21 1djp s SER 1281CO 0.00 -1.14 1.64 0.00 0.98 0.00 0.00 173.24 174.72 1djp n HIS 1282N -0.45 2.82 -3.73 5.02 1.44 -0.46 -4.19 115.22 115.66 1djp n HIS 1282Ca -0.06 -2.52 -0.28 0.00 -2.01 0.00 0.00 57.72 52.85 1djp n HIS 1282Cb 0.60 -0.90 -0.11 0.00 0.12 0.00 0.00 29.99 29.70 1djp n HIS 1282CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 1djp n VAL 1283N -0.87 1.12 -1.18 0.61 0.31 -1.26 -4.97 118.33 112.09 1djp n VAL 1283Ca 0.52 -4.62 -0.06 0.00 -0.01 0.00 0.00 64.34 60.17 1djp n VAL 1283Cb 0.86 -2.07 0.25 0.00 -0.91 0.00 0.00 33.84 31.97 1djp n VAL 1283CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1djp n ASN 1284N 1.98 3.86 -0.06 4.52 5.03 -1.26 -4.48 115.26 124.84 1djp n ASN 1284Ca 0.23 -3.41 -0.02 0.00 0.87 0.00 0.00 54.58 52.25 1djp n ASN 1284Cb 0.39 -0.70 -0.16 0.00 -1.02 0.00 0.00 39.78 38.29 1djp n ASN 1284CO 0.00 0.00 0.00 1.67 -1.83 0.00 0.00 177.26 177.10 1djp n GLN 1285N -0.66 0.67 -3.87 3.52 7.27 -1.26 -4.89 117.38 118.17 1djp n GLN 1285Ca 0.39 -0.05 0.01 0.00 0.07 0.00 0.00 57.00 57.42 1djp n GLN 1285Cb 1.27 -1.54 0.01 0.00 2.41 0.00 0.00 30.24 32.38 1djp n GLN 1285CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 1djp s GLY 1286N -5.11 -0.15 0.00 1.69 0.00 -1.26 -4.46 107.32 98.03 1djp s GLY 1286Ca -0.09 0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.76 1djp s GLY 1286CO 0.86 3.42 0.00 0.61 0.00 0.00 0.00 173.10 177.99 1djp n GLY 1287N -0.74 -1.72 3.59 0.20 0.00 -1.26 -5.02 105.19 100.23 1djp n GLY 1287Ca -0.01 -1.30 -0.09 0.00 0.00 0.00 0.00 46.02 44.61 1djp n GLY 1287CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1djp s PHE 1288N 0.00 -0.17 -0.16 1.61 -0.12 -1.26 -4.65 117.98 113.23 1djp s PHE 1288Ca 0.00 -0.18 -0.24 0.00 -0.05 0.00 0.00 56.93 56.46 1djp s PHE 1288Cb 0.00 0.48 -0.02 0.00 -0.63 0.00 0.00 43.02 42.85 1djp s PHE 1288CO 0.00 -0.99 0.76 0.08 -0.05 0.00 0.00 175.22 175.02 1djp s VAL 1289N -3.88 4.94 -0.07 -2.49 1.01 0.26 -4.93 120.40 115.24 1djp s VAL 1289Ca 0.09 1.49 -0.17 0.00 0.00 0.00 0.00 61.98 63.39 1djp s VAL 1289Cb -0.02 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.23 1djp s VAL 1289CO -0.01 0.08 0.47 -0.22 0.00 0.00 0.00 175.10 175.42 1djp s LEU 1290N 1.88 4.35 0.24 3.92 2.96 -1.26 -3.97 118.68 126.79 1djp s LEU 1290Ca 0.36 0.89 -0.30 0.00 -0.22 0.00 0.00 54.13 54.86 1djp s LEU 1290Cb -0.17 -2.68 -0.09 0.00 0.50 0.00 0.00 46.19 43.75 1djp s LEU 1290CO 0.13 0.11 1.29 -0.60 -1.32 0.00 0.00 176.35 175.96 1djp s ARG 1291N 0.05 4.40 -0.08 1.98 3.52 -1.26 -3.17 118.95 124.39 1djp s ARG 1291Ca 0.26 2.07 0.00 0.00 -0.13 0.00 0.00 55.73 57.93 1djp s ARG 1291Cb -0.16 -3.16 0.00 0.00 -1.56 0.00 0.00 34.95 30.07 1djp s ARG 1291CO 0.12 -0.19 0.00 0.09 -0.81 0.00 0.00 175.30 174.50 1djp n ASN 1292N 2.06 -4.89 -0.00 -2.12 3.02 -1.23 -4.91 115.26 107.20 1djp n ASN 1292Ca 0.04 0.02 -0.00 0.00 -0.03 0.00 0.00 54.58 54.61 1djp n ASN 1292Cb 0.43 -2.45 -0.00 0.00 -0.61 0.00 0.00 39.78 37.15 1djp n ASN 1292CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1djp h ALA 1293N 0.00 0.00 0.00 5.41 0.00 -1.94 -3.41 119.26 119.33 1djp h ALA 1293Ca -0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1djp h ALA 1293Cb 0.65 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1djp h ALA 1293CO 0.02 0.00 -0.04 0.93 0.00 0.00 0.00 179.25 180.16 1djp h GLU 1294N -0.00 0.00 -3.07 0.00 4.39 -1.81 -3.46 114.58 110.62 1djp h GLU 1294Ca 0.00 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 1djp h GLU 1294Cb 0.00 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 28.45 1djp h GLU 1294CO 0.00 0.02 -0.29 -0.65 -1.16 0.00 0.00 179.01 176.93 1djp s GLN 1295N -3.20 0.66 -1.26 2.33 -1.52 -1.26 -4.81 119.66 110.59 1djp s GLN 1295Ca 0.07 -0.22 -0.18 0.00 -1.95 0.00 0.00 55.36 53.08 1djp s GLN 1295Cb 0.05 0.29 0.07 0.00 -0.22 0.00 0.00 33.01 33.21 1djp s GLN 1295CO 0.68 -0.18 1.68 -1.25 -0.25 0.00 0.00 175.29 175.97 1djp s PRO 1296N -1.37 3.94 0.47 2.91 0.04 -1.26 -3.47 135.00 136.26 1djp s PRO 1296Ca -0.13 -1.92 0.13 0.00 0.04 0.00 0.00 61.00 59.12 1djp s PRO 1296Cb -0.05 -5.49 1.10 0.00 0.04 0.00 0.00 34.50 30.10 1djp s PRO 1296CO 0.04 -2.22 2.07 -0.44 0.04 0.00 0.00 177.00 176.49 1djp h ASP 1297N 7.82 0.23 -0.05 6.66 3.32 -1.89 -1.43 116.42 131.09 1djp h ASP 1297Ca 0.41 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.45 1djp h ASP 1297Cb 0.89 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.38 1djp h ASP 1297CO 1.44 0.16 -0.01 0.44 -1.72 0.00 0.00 179.24 179.55 1djp h ASP 1298N 0.27 0.10 -0.26 6.45 3.32 -1.86 0.11 116.42 124.55 1djp h ASP 1298Ca 0.13 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.79 1djp h ASP 1298Cb 0.17 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1djp h ASP 1298CO -0.03 0.45 0.13 0.11 -1.72 0.00 0.00 179.24 178.18 1djp h LYS 1299N -0.25 0.38 -0.00 3.56 6.56 -1.84 -3.05 116.57 121.92 1djp h LYS 1299Ca 0.01 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 1djp h LYS 1299Cb 0.41 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 1djp h LYS 1299CO 0.01 0.38 -0.11 0.09 -2.06 0.00 0.00 179.45 177.75 1djp n ASN 1300N -4.81 0.22 -3.51 0.86 3.02 -0.58 -4.94 115.26 105.51 1djp n ASN 1300Ca -0.02 -0.05 -0.20 0.00 -0.03 0.00 0.00 54.58 54.28 1djp n ASN 1300Cb 0.10 -0.21 0.08 0.00 -0.61 0.00 0.00 39.78 39.14 1djp n ASN 1300CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1djp n ASP 1301N -1.31 -3.52 -4.92 6.41 4.64 0.23 -4.98 116.55 113.10 1djp n ASP 1301Ca 0.10 -0.61 -0.20 0.00 -1.38 0.00 0.00 54.79 52.71 1djp n ASP 1301Cb 0.30 -5.03 -0.02 0.00 -1.04 0.00 0.00 41.12 35.34 1djp n ASP 1301CO 0.00 0.00 0.00 0.26 -0.82 0.00 0.00 177.20 176.64 1djp s TRP 1302N -3.36 3.03 0.03 -0.67 0.51 -0.32 -4.79 118.94 113.38 1djp s TRP 1302Ca 0.21 -0.24 0.07 0.00 -2.12 0.00 0.00 56.10 54.01 1djp s TRP 1302Cb -0.09 -1.87 -0.03 0.00 -0.81 0.00 0.00 33.47 30.67 1djp s TRP 1302CO 0.74 0.12 -0.17 0.08 -0.51 0.00 0.00 176.95 177.20 1djp s VAL 1303N -2.22 2.89 -0.14 4.03 1.01 0.10 -4.74 120.40 121.33 1djp s VAL 1303Ca 0.42 -1.12 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1djp s VAL 1303Cb -0.08 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 1djp s VAL 1303CO 0.29 0.35 -0.02 -0.69 0.00 0.00 0.00 175.10 175.03 1djp s VAL 1304N -0.92 4.05 -2.00 2.92 1.01 -1.26 0.14 120.40 124.33 1djp s VAL 1304Ca 0.15 -0.31 0.06 0.00 0.00 0.00 0.00 61.98 61.87 1djp s VAL 1304Cb -0.11 -2.75 0.16 0.00 0.00 0.00 0.00 36.38 33.68 1djp s VAL 1304CO 0.05 0.52 1.15 0.00 0.00 0.00 0.00 175.10 176.82 1djp n ALA 1305N 3.15 2.46 -0.95 5.51 0.00 0.24 -4.87 120.51 126.05 1djp n ALA 1305Ca -0.18 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1djp n ALA 1305Cb 0.53 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1djp n ALA 1305CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1djp n HIS 1306N -0.60 0.00 1.00 0.00 -0.00 -1.25 -2.17 115.22 112.21 1djp n HIS 1306Ca 0.04 0.00 0.10 0.00 0.46 0.00 0.00 57.72 58.33 1djp n HIS 1306Cb 0.02 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 29.81 1djp n HIS 1306CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 1djp n ASP 1307N 9.19 1.08 -4.74 0.26 3.85 -1.26 0.89 116.55 125.82 1djp n ASP 1307Ca 0.00 -1.01 -0.41 0.00 -0.71 0.00 0.00 54.79 52.66 1djp n ASP 1307Cb 0.00 0.89 -0.03 0.00 -1.35 0.00 0.00 41.12 40.63 1djp n ASP 1307CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1djp s LEU 1308N -2.94 4.41 1.09 -2.12 1.43 -0.92 -4.93 118.68 114.71 1djp s LEU 1308Ca 0.09 2.51 -0.17 0.00 -1.03 0.00 0.00 54.13 55.54 1djp s LEU 1308Cb 0.16 -3.62 0.24 0.00 0.03 0.00 0.00 46.19 43.00 1djp s LEU 1308CO 0.82 -0.56 1.15 0.54 0.23 0.00 0.00 176.35 178.54 1djp s ASN 1309N 0.18 1.87 0.13 2.29 2.20 -1.26 -4.62 114.94 115.74 1djp s ASN 1309Ca 0.56 0.67 -0.25 0.00 -0.94 0.00 0.00 52.86 52.90 1djp s ASN 1309Cb -0.38 -0.96 -0.03 0.00 -2.00 0.00 0.00 41.25 37.88 1djp s ASN 1309CO 0.42 -3.54 1.64 -0.65 -2.94 0.00 0.00 177.10 172.03 1djp h PRO 1310N -2.18 -0.33 -0.21 3.55 0.11 -1.96 -0.05 132.00 130.94 1djp h PRO 1310Ca -0.47 0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.62 1djp h PRO 1310Cb 1.29 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.46 1djp h PRO 1310CO 0.41 -0.22 -0.07 1.05 -0.21 0.00 0.00 178.00 178.96 1djp h GLU 1311N -0.34 0.32 -0.22 1.05 9.09 -1.96 -1.04 114.58 121.47 1djp h GLU 1311Ca 0.09 -0.07 -0.17 0.00 0.05 0.00 0.00 59.36 59.25 1djp h GLU 1311Cb 0.46 -0.05 0.00 0.00 -1.65 0.00 0.00 28.75 27.52 1djp h GLU 1311CO -0.28 0.41 -0.54 0.87 0.05 0.00 0.00 179.01 179.52 1djp h LYS 1312N 0.31 0.76 -0.08 1.06 6.56 -1.83 -2.90 116.57 120.45 1djp h LYS 1312Ca 0.07 -0.52 -0.07 0.00 -1.06 0.00 0.00 60.65 59.06 1djp h LYS 1312Cb 0.33 0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.06 1djp h LYS 1312CO 0.02 1.15 -0.28 0.00 -2.06 0.00 0.00 179.45 178.27 1djp h ALA 1313N 0.61 1.38 -0.04 3.86 0.00 -0.70 -2.45 119.26 121.94 1djp h ALA 1313Ca -0.00 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1djp h ALA 1313Cb 1.16 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1djp h ALA 1313CO 0.12 0.44 0.01 -0.09 0.00 0.00 0.00 179.25 179.73 1djp h ARG 1314N 0.13 0.06 -0.44 0.00 2.43 -1.11 -0.88 114.38 114.56 1djp h ARG 1314Ca 0.02 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1djp h ARG 1314Cb 0.57 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1djp h ARG 1314CO 0.04 0.23 0.24 0.82 -1.51 0.00 0.00 179.97 179.79 1djp h ILE 1315N -0.12 1.01 -0.75 1.20 1.08 -1.31 -0.55 117.51 118.08 1djp h ILE 1315Ca 0.01 -0.17 -0.05 0.00 -0.39 0.00 0.00 64.86 64.26 1djp h ILE 1315Cb 0.19 0.48 -0.03 0.00 -3.07 0.00 0.00 36.82 34.39 1djp h ILE 1315CO -0.00 0.09 0.27 0.25 -0.69 0.00 0.00 178.15 178.07 1djp h LEU 1316N 0.49 1.07 -0.10 1.44 5.85 -1.36 -2.28 115.31 120.41 1djp h LEU 1316Ca 0.18 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1djp h LEU 1316Cb 0.05 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 1djp h LEU 1316CO -0.10 0.97 0.06 0.00 -0.34 0.00 0.00 178.44 179.03 1djp h ALA 1317N 1.14 0.13 0.23 1.25 0.00 -0.71 0.35 119.26 121.64 1djp h ALA 1317Ca 0.25 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1djp h ALA 1317Cb 0.26 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1djp h ALA 1317CO -0.01 -0.34 -0.50 0.52 0.00 0.00 0.00 179.25 178.91 1djp h MET 1318N 0.08 -0.78 -0.42 0.00 2.86 -0.93 -0.07 114.93 115.68 1djp h MET 1318Ca 0.04 0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.77 1djp h MET 1318Cb 0.06 0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 1djp h MET 1318CO -0.01 -0.52 0.18 0.28 1.06 0.00 0.00 176.91 177.90 1djp h VAL 1319N -0.81 0.93 -0.54 -2.22 2.07 -1.35 -2.85 116.25 111.48 1djp h VAL 1319Ca -0.02 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.38 1djp h VAL 1319Cb 0.78 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 1djp h VAL 1319CO -0.22 0.07 0.34 0.00 0.02 0.00 0.00 177.57 177.78 1djp h ALA 1320N 1.24 0.69 0.00 1.67 0.00 -0.70 -2.66 119.26 119.50 1djp h ALA 1320Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1djp h ALA 1320Cb 0.13 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1djp h ALA 1320CO -0.16 0.15 0.00 -1.33 0.00 0.00 0.00 179.25 177.91 1djp n MET 1321N -4.68 0.19 0.00 0.00 2.81 -0.06 -1.15 117.12 114.23 1djp n MET 1321Ca 0.03 0.13 0.13 0.00 -1.81 0.00 0.00 57.70 56.19 1djp n MET 1321Cb 0.04 -1.50 0.46 0.00 -0.71 0.00 0.00 33.22 31.51 1djp n MET 1321CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1djp n THR 1322N -1.19 0.00 -0.02 2.03 -2.24 -1.00 -4.09 114.28 107.76 1djp n THR 1322Ca 0.05 -0.01 -0.02 0.00 -2.27 0.00 0.00 64.05 61.80 1djp n THR 1322Cb 0.06 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.14 1djp n THR 1322CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1djp n LYS 1323N -1.42 2.99 -3.56 -0.78 4.76 -0.30 -5.09 118.16 114.76 1djp n LYS 1323Ca 0.07 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.37 1djp n LYS 1323Cb 0.33 -1.11 -0.05 0.00 -1.84 0.00 0.00 35.03 32.36 1djp n LYS 1323CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1djp s THR 1324N -2.10 0.02 0.00 -0.18 -1.32 -0.92 -5.01 115.64 106.14 1djp s THR 1324Ca -0.03 -0.20 0.00 0.00 -1.21 0.00 0.00 61.69 60.26 1djp s THR 1324Cb 0.01 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 70.04 1djp s THR 1324CO 0.16 -0.11 0.86 1.67 -2.21 0.00 0.00 174.62 174.99 1djp n GLN 1325N 0.49 2.10 -2.56 7.08 0.00 -1.26 -4.01 117.38 119.21 1djp n GLN 1325Ca -0.18 -1.22 -0.43 0.00 -0.00 0.00 0.00 57.00 55.16 1djp n GLN 1325Cb 0.60 -0.92 -0.02 0.00 0.00 0.00 0.00 30.24 29.90 1djp n GLN 1325CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1djp s ASP 1326N -0.73 7.06 0.35 1.69 -1.08 -1.26 -4.93 116.67 117.77 1djp s ASP 1326Ca 0.00 1.55 0.05 0.00 -0.52 0.00 0.00 52.55 53.63 1djp s ASP 1326Cb 0.00 -2.54 0.65 0.00 -1.46 0.00 0.00 42.92 39.56 1djp s ASP 1326CO 0.00 -0.66 1.91 0.28 0.52 0.00 0.00 175.17 177.22 1djp h SER 1327N 7.65 0.50 0.00 -0.34 0.02 -1.94 -0.53 113.55 118.91 1djp h SER 1327Ca -0.25 -0.08 -0.14 0.00 -0.84 0.00 0.00 61.79 60.48 1djp h SER 1327Cb 1.10 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.50 1djp h SER 1327CO 0.95 0.53 -0.47 0.11 -1.14 0.00 0.00 176.83 176.80 1djp h LYS 1328N 0.53 0.54 -0.32 3.45 6.56 -1.95 -1.00 116.57 124.38 1djp h LYS 1328Ca 0.12 -0.31 -0.16 0.00 -1.06 0.00 0.00 60.65 59.25 1djp h LYS 1328Cb 0.24 0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 31.91 1djp h LYS 1328CO -0.00 0.90 -0.43 0.93 -2.06 0.00 0.00 179.45 178.79 1djp h GLU 1329N 0.43 0.82 -0.74 3.15 4.39 -1.89 -2.42 114.58 118.33 1djp h GLU 1329Ca 0.02 -0.45 -0.01 0.00 0.34 0.00 0.00 59.36 59.26 1djp h GLU 1329Cb 0.99 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.63 1djp h GLU 1329CO 0.09 1.08 0.40 1.25 -1.16 0.00 0.00 179.01 180.68 1djp h LEU 1330N 0.66 0.91 -0.56 1.33 5.85 -0.88 -1.75 115.31 120.87 1djp h LEU 1330Ca 0.05 -0.07 -0.14 0.00 0.84 0.00 0.00 57.88 58.56 1djp h LEU 1330Cb 1.00 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 1djp h LEU 1330CO 0.10 0.73 -0.30 -0.61 -0.34 0.00 0.00 178.44 178.01 1djp h GLN 1331N 1.02 0.83 -0.24 1.25 5.75 -1.01 -2.33 115.11 120.39 1djp h GLN 1331Ca 0.26 -0.38 -0.00 0.00 -0.15 0.00 0.00 58.65 58.37 1djp h GLN 1331Cb 0.02 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 1djp h GLN 1331CO -0.04 1.02 0.14 -0.09 -2.65 0.00 0.00 178.83 177.20 1djp h ARG 1332N 0.70 0.33 -0.98 1.69 2.43 -1.06 -2.28 114.38 115.21 1djp h ARG 1332Ca 0.08 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1djp h ARG 1332Cb 0.85 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 30.28 1djp h ARG 1332CO 0.07 0.29 0.64 0.82 -1.51 0.00 0.00 179.97 180.29 1djp h ILE 1333N 0.29 1.18 0.00 1.20 2.04 -1.24 -1.22 117.51 119.76 1djp h ILE 1333Ca 0.09 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1djp h ILE 1333Cb 0.05 -0.18 0.00 0.00 -0.74 0.00 0.00 36.82 35.94 1djp h ILE 1333CO -0.01 0.23 0.00 -0.26 0.00 0.00 0.00 178.15 178.10 1djp h PHE 1334N 1.25 0.00 0.00 1.37 0.04 -1.11 -1.61 116.94 116.89 1djp h PHE 1334Ca 0.39 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.16 1djp h PHE 1334Cb -0.02 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.13 1djp h PHE 1334CO -0.00 0.00 -0.95 0.91 -0.60 0.00 0.00 178.31 177.67 1djp n TRP 1335N -2.49 0.03 -0.01 -0.55 8.01 -0.55 -4.50 117.44 117.38 1djp n TRP 1335Ca 0.02 0.01 0.03 0.00 -1.31 0.00 0.00 57.50 56.25 1djp n TRP 1335Cb 0.28 -0.12 -0.06 0.00 -2.01 0.00 0.00 31.31 29.40 1djp n TRP 1335CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 1djp n GLU 1336N -1.59 0.46 0.00 -0.99 1.02 -0.66 -5.06 120.64 113.82 1djp n GLU 1336Ca 0.04 -0.06 0.05 0.00 -0.02 0.00 0.00 57.16 57.16 1djp n GLU 1336Cb 0.35 -1.18 0.04 0.00 -0.02 0.00 0.00 31.44 30.63 1djp n GLU 1336CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97