#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jm6 s SER 1004N 0.00 6.54 -1.08 0.00 0.01 -1.26 -4.90 113.70 113.01 1jm6 s SER 1004Ca 0.00 2.10 -0.03 0.00 1.31 0.00 0.00 55.95 59.34 1jm6 s SER 1004Cb 0.00 -2.53 0.29 0.00 0.21 0.00 0.00 66.02 63.99 1jm6 s SER 1004CO 0.00 -1.05 1.79 -0.11 0.41 0.00 0.00 173.24 174.27 1jm6 n LEU 1005N 7.65 7.14 0.00 2.44 7.94 -1.26 -3.30 117.00 137.61 1jm6 n LEU 1005Ca 0.18 -5.26 0.00 0.00 -1.11 0.00 0.00 56.01 49.82 1jm6 n LEU 1005Cb 0.43 -1.23 0.00 0.00 0.53 0.00 0.00 43.42 43.15 1jm6 n LEU 1005CO 0.63 1.92 0.00 0.00 -1.11 0.00 0.00 177.39 178.84 1jm6 n ALA 1006N 0.65 0.00 0.55 1.96 0.00 -1.26 -4.67 120.51 117.75 1jm6 n ALA 1006Ca 0.42 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.99 1jm6 n ALA 1006Cb 0.28 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.06 1jm6 n ALA 1006CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jm6 h GLY 1007N 0.00 0.00 -0.99 0.00 0.00 -1.96 -3.36 103.07 96.76 1jm6 h GLY 1007Ca 0.00 0.00 0.34 0.00 0.00 0.00 0.00 47.33 47.67 1jm6 h GLY 1007CO 0.00 0.00 0.27 0.00 0.00 0.00 0.00 176.54 176.81 1jm6 h ALA 1008N 2.44 1.65 -0.09 3.60 0.00 -1.83 0.86 119.26 125.89 1jm6 h ALA 1008Ca 0.00 0.31 0.04 0.00 0.00 0.00 0.00 54.91 55.26 1jm6 h ALA 1008Cb 0.78 0.47 -0.05 0.00 0.00 0.00 0.00 17.79 18.99 1jm6 h ALA 1008CO 0.00 -0.76 -0.25 -1.35 0.00 0.00 0.00 179.25 176.89 1jm6 h PRO 1009N 0.00 -0.32 -0.31 0.00 0.11 -1.96 -1.64 132.00 127.88 1jm6 h PRO 1009Ca 0.72 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.84 1jm6 h PRO 1009Cb 1.73 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.89 1jm6 h PRO 1009CO -0.86 -0.22 0.15 0.87 -0.21 0.00 0.00 178.00 177.74 1jm6 h LYS 1010N -0.34 0.44 -0.27 1.05 1.57 0.25 -1.97 116.57 117.30 1jm6 h LYS 1010Ca 0.09 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 1jm6 h LYS 1010Cb 0.47 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.63 1jm6 h LYS 1010CO -0.28 0.40 -0.11 1.88 -0.57 0.00 0.00 179.45 180.77 1jm6 h TYR 1011N 0.37 -0.27 -0.34 -1.35 0.99 0.05 -2.63 116.97 113.79 1jm6 h TYR 1011Ca 0.11 0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.82 1jm6 h TYR 1011Cb 0.10 0.16 -0.01 0.00 1.00 0.00 0.00 36.73 37.98 1jm6 h TYR 1011CO -0.02 -0.18 0.04 0.82 -0.00 0.00 0.00 178.16 178.82 1jm6 h ILE 1012N -0.07 1.25 -0.60 -2.88 1.08 -1.19 -1.55 117.51 113.54 1jm6 h ILE 1012Ca 0.14 -0.88 0.17 0.00 -0.39 0.00 0.00 64.86 63.90 1jm6 h ILE 1012Cb 0.28 1.15 -0.02 0.00 -3.07 0.00 0.00 36.82 35.16 1jm6 h ILE 1012CO -0.32 0.29 0.50 -0.08 -0.69 0.00 0.00 178.15 177.85 1jm6 h GLU 1013N 0.40 0.00 0.00 2.37 4.57 -1.23 0.91 114.58 121.61 1jm6 h GLU 1013Ca 0.10 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.23 1jm6 h GLU 1013Cb 0.39 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 1jm6 h GLU 1013CO 0.01 0.00 -0.42 1.25 -1.18 0.00 0.00 179.01 178.67 1jm6 h HIS 1014N 0.00 0.00 0.00 0.92 2.76 -1.05 -3.26 115.15 114.52 1jm6 h HIS 1014Ca 0.29 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.44 1jm6 h HIS 1014Cb 1.28 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.24 1jm6 h HIS 1014CO 0.00 0.64 -0.09 0.74 -1.30 0.00 0.00 177.93 177.93 1jm6 h PHE 1015N -1.00 0.00 0.00 5.26 -1.00 -1.10 -1.81 116.94 117.29 1jm6 h PHE 1015Ca -0.08 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.70 1jm6 h PHE 1015Cb 0.71 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.27 1jm6 h PHE 1015CO 0.05 0.09 0.00 0.66 -1.61 0.00 0.00 178.31 177.50 1jm6 h SER 1016N 0.00 0.00 0.74 2.17 4.64 0.72 -1.90 113.55 119.92 1jm6 h SER 1016Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jm6 h SER 1016Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1jm6 h SER 1016CO 0.01 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.26 1jm6 n LYS 1017N -2.59 0.10 -4.01 4.77 5.02 -0.68 -4.75 118.16 116.01 1jm6 n LYS 1017Ca 0.02 0.07 -0.23 0.00 -2.02 0.00 0.00 58.31 56.15 1jm6 n LYS 1017Cb 0.27 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.75 1jm6 n LYS 1017CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1jm6 s PHE 1018N -2.89 3.35 -0.05 2.13 0.40 -0.72 -5.11 117.98 115.09 1jm6 s PHE 1018Ca 0.15 -0.02 0.01 0.00 -0.60 0.00 0.00 56.93 56.47 1jm6 s PHE 1018Cb 0.16 -1.54 -0.03 0.00 0.51 0.00 0.00 43.02 42.12 1jm6 s PHE 1018CO 0.43 0.48 -0.05 0.45 0.70 0.00 0.00 175.22 177.23 1jm6 s SER 1019N -3.75 4.81 0.36 1.36 0.15 -1.26 -4.96 113.70 110.41 1jm6 s SER 1019Ca 0.34 -0.01 -0.24 0.00 0.70 0.00 0.00 55.95 56.73 1jm6 s SER 1019Cb -0.09 -1.23 -0.14 0.00 -1.71 0.00 0.00 66.02 62.85 1jm6 s SER 1019CO 0.27 0.34 0.65 -2.65 1.20 0.00 0.00 173.24 173.06 1jm6 n PRO 1020N 2.01 0.67 -3.97 5.44 -0.02 -1.26 -4.96 135.00 132.91 1jm6 n PRO 1020Ca -0.17 0.24 -0.32 0.00 -2.02 0.00 0.00 63.50 61.22 1jm6 n PRO 1020Cb 0.53 -1.51 -0.14 0.00 -0.02 0.00 0.00 33.50 32.36 1jm6 n PRO 1020CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1jm6 s SER 1021N -0.87 4.85 0.36 2.55 1.04 -1.26 -4.95 113.70 115.43 1jm6 s SER 1021Ca 0.62 -2.07 -0.28 0.00 0.48 0.00 0.00 55.95 54.70 1jm6 s SER 1021Cb -0.67 -1.67 -0.11 0.00 0.10 0.00 0.00 66.02 63.67 1jm6 s SER 1021CO 0.58 -0.40 1.49 -2.84 0.98 0.00 0.00 173.24 173.05 1jm6 s PRO 1022N 0.97 4.13 -0.11 4.02 0.02 -1.26 -5.01 135.00 137.76 1jm6 s PRO 1022Ca 0.09 2.54 -0.04 0.00 0.02 0.00 0.00 61.00 63.61 1jm6 s PRO 1022Cb -0.20 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 1jm6 s PRO 1022CO -0.07 -0.52 0.05 -0.51 -0.33 0.00 0.00 177.00 175.63 1jm6 s LEU 1023N -1.80 3.86 0.95 -5.54 1.02 -1.26 -4.90 118.68 111.00 1jm6 s LEU 1023Ca 0.54 0.24 -0.14 0.00 0.02 0.00 0.00 54.13 54.79 1jm6 s LEU 1023Cb -0.46 -1.92 0.16 0.00 0.02 0.00 0.00 46.19 43.99 1jm6 s LEU 1023CO 0.60 0.36 1.16 -0.94 0.02 0.00 0.00 176.35 177.55 1jm6 s SER 1024N -0.75 3.20 0.34 2.29 1.04 -1.26 -2.73 113.70 115.84 1jm6 s SER 1024Ca 0.12 0.82 0.12 0.00 0.48 0.00 0.00 55.95 57.49 1jm6 s SER 1024Cb -0.12 -1.28 0.61 0.00 0.10 0.00 0.00 66.02 65.34 1jm6 s SER 1024CO 0.03 -2.73 1.76 -0.03 0.98 0.00 0.00 173.24 173.25 1jm6 h MET 1025N -1.62 0.00 0.00 4.02 4.05 -1.66 -1.15 114.93 118.57 1jm6 h MET 1025Ca -0.49 -0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 58.91 1jm6 h MET 1025Cb 1.31 -0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.11 1jm6 h MET 1025CO 0.56 0.44 -0.11 0.87 0.23 0.00 0.00 176.91 178.90 1jm6 h LYS 1026N 0.00 0.00 0.10 0.39 1.57 -1.87 0.48 116.57 117.24 1jm6 h LYS 1026Ca -0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.51 1jm6 h LYS 1026Cb 0.78 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.09 1jm6 h LYS 1026CO 0.06 0.11 -1.21 1.96 -0.57 0.00 0.00 179.45 179.80 1jm6 h GLN 1027N 0.00 0.21 -0.47 3.15 4.20 -1.65 -2.51 115.11 118.04 1jm6 h GLN 1027Ca -0.00 -0.36 -0.12 0.00 0.06 0.00 0.00 58.65 58.23 1jm6 h GLN 1027Cb 0.98 0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.88 1jm6 h GLN 1027CO 0.01 1.17 -0.18 0.74 -0.67 0.00 0.00 178.83 179.90 1jm6 h PHE 1028N 0.06 1.04 -0.19 2.96 0.04 -0.77 -3.26 116.94 116.82 1jm6 h PHE 1028Ca -0.11 -0.23 -0.16 0.00 2.80 0.00 0.00 57.97 60.26 1jm6 h PHE 1028Cb 1.93 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 39.83 1jm6 h PHE 1028CO 0.05 1.02 -0.55 -0.07 -0.60 0.00 0.00 178.31 178.16 1jm6 h LEU 1029N 0.81 0.63 -4.29 1.54 3.38 -0.04 -3.35 115.31 113.98 1jm6 h LEU 1029Ca 0.11 -0.34 -0.33 0.00 0.09 0.00 0.00 57.88 57.42 1jm6 h LEU 1029Cb 0.73 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 1jm6 h LEU 1029CO 0.06 1.05 0.83 0.47 0.09 0.00 0.00 178.44 180.94 1jm6 n ASP 1030N -3.96 6.21 -0.03 -0.43 10.43 -0.95 -3.73 116.55 124.09 1jm6 n ASP 1030Ca -0.03 -2.50 0.04 0.00 2.57 0.00 0.00 54.79 54.87 1jm6 n ASP 1030Cb 0.61 -1.45 0.06 0.00 1.84 0.00 0.00 41.12 42.18 1jm6 n ASP 1030CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 1jm6 n PHE 1031N 2.82 0.00 0.00 1.24 3.01 -1.26 -1.32 117.46 121.95 1jm6 n PHE 1031Ca 0.53 -0.70 0.00 0.00 1.01 0.00 0.00 57.45 58.28 1jm6 n PHE 1031Cb 0.72 -0.09 0.00 0.00 -0.01 0.00 0.00 39.48 40.09 1jm6 n PHE 1031CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jm6 n GLY 1032N -0.89 0.31 0.00 1.37 0.00 -1.24 -4.51 105.19 100.22 1jm6 n GLY 1032Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1jm6 n GLY 1032CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jm6 n ALA 1036N 0.00 0.00 -3.65 4.61 0.00 -0.44 -4.99 120.51 116.04 1jm6 n ALA 1036Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1jm6 n ALA 1036Cb 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 19.45 19.50 1jm6 n ALA 1036CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jm6 h GLU 1038N 2.00 -0.43 -1.03 0.00 5.08 -1.99 -2.64 114.58 115.56 1jm6 h GLU 1038Ca -0.25 0.03 0.30 0.00 -1.00 0.00 0.00 59.36 58.44 1jm6 h GLU 1038Cb 1.21 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 30.52 1jm6 h GLU 1038CO 0.27 -0.29 1.21 0.87 -1.00 0.00 0.00 179.01 180.07 1jm6 h LYS 1039N -0.78 0.00 -0.05 2.33 1.57 -1.98 2.16 116.57 119.83 1jm6 h LYS 1039Ca -0.05 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1jm6 h LYS 1039Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1jm6 h LYS 1039CO 0.08 0.00 -0.13 1.79 -0.57 0.00 0.00 179.45 180.61 1jm6 h THR 1040N 0.00 1.44 0.00 -0.16 1.35 -1.95 0.85 112.91 114.45 1jm6 h THR 1040Ca 0.49 -1.52 -0.01 0.00 -0.55 0.00 0.00 66.41 64.82 1jm6 h THR 1040Cb 2.91 2.33 -0.00 0.00 -1.73 0.00 0.00 68.15 71.65 1jm6 h THR 1040CO -0.01 0.42 -0.05 -1.28 -0.25 0.00 0.00 175.52 174.36 1jm6 h SER 1041N -0.36 0.00 0.00 5.36 0.87 0.37 -2.86 113.55 116.93 1jm6 h SER 1041Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1jm6 h SER 1041Cb 0.75 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 1jm6 h SER 1041CO 0.03 0.05 -0.28 0.15 -0.53 0.00 0.00 176.83 176.25 1jm6 h PHE 1042N 0.00 0.00 -0.90 2.24 3.57 -0.56 -1.94 116.94 119.34 1jm6 h PHE 1042Ca -0.00 0.00 0.30 0.00 3.53 0.00 0.00 57.97 61.80 1jm6 h PHE 1042Cb 0.68 0.00 -0.17 0.00 2.79 0.00 0.00 35.95 39.26 1jm6 h PHE 1042CO 0.00 0.00 0.22 2.41 -2.23 0.00 0.00 178.31 178.71 1jm6 n THR 1043N -3.90 -0.38 0.04 4.41 -1.04 0.29 0.49 114.28 114.20 1jm6 n THR 1043Ca -0.04 1.92 -0.22 0.00 -2.04 0.00 0.00 64.05 63.67 1jm6 n THR 1043Cb 0.15 -2.94 -0.14 0.00 -1.82 0.00 0.00 70.33 65.58 1jm6 n THR 1043CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 1jm6 h PHE 1044N 0.00 0.58 -0.64 -1.42 3.04 -1.67 -3.37 116.94 113.46 1jm6 h PHE 1044Ca 0.64 -0.42 -0.07 0.00 3.98 0.00 0.00 57.97 62.10 1jm6 h PHE 1044Cb 1.52 -0.02 -0.03 0.00 2.56 0.00 0.00 35.95 39.98 1jm6 h PHE 1044CO -0.27 1.64 0.11 -0.07 -2.02 0.00 0.00 178.31 177.70 1jm6 h LEU 1045N -0.07 1.00 0.00 0.59 4.07 -0.06 -0.30 115.31 120.54 1jm6 h LEU 1045Ca -0.34 -0.23 0.00 0.00 0.08 0.00 0.00 57.88 57.39 1jm6 h LEU 1045Cb 1.95 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 43.42 1jm6 h LEU 1045CO 0.12 0.99 0.00 -2.11 -1.08 0.00 0.00 178.44 176.36 1jm6 n ARG 1046N -4.22 0.07 -0.05 1.13 1.85 0.18 -1.76 116.66 113.86 1jm6 n ARG 1046Ca 0.04 0.25 -0.06 0.00 -1.00 0.00 0.00 57.85 57.08 1jm6 n ARG 1046Cb 0.28 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 30.14 1jm6 n ARG 1046CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 1jm6 n GLN 1047N -1.41 1.06 -0.05 2.89 0.00 -1.06 -4.63 117.38 114.20 1jm6 n GLN 1047Ca 0.04 0.04 -0.13 0.00 -0.00 0.00 0.00 57.00 56.95 1jm6 n GLN 1047Cb 0.11 -1.21 -0.07 0.00 0.00 0.00 0.00 30.24 29.06 1jm6 n GLN 1047CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 1jm6 h GLU 1048N 0.00 0.28 -0.42 3.69 4.57 -0.81 -2.48 114.58 119.41 1jm6 h GLU 1048Ca -0.24 -0.14 -0.05 0.00 -1.18 0.00 0.00 59.36 57.75 1jm6 h GLU 1048Cb 1.42 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.99 1jm6 h GLU 1048CO -0.02 0.66 0.06 -0.07 -1.18 0.00 0.00 179.01 178.45 1jm6 h LEU 1049N -0.10 0.68 -1.71 1.64 3.38 -1.58 0.12 115.31 117.74 1jm6 h LEU 1049Ca 0.02 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.73 1jm6 h LEU 1049Cb 0.60 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1jm6 h LEU 1049CO 0.02 0.78 0.20 -0.65 0.09 0.00 0.00 178.44 178.88 1jm6 h PRO 1050N 0.56 0.38 -0.28 1.13 0.11 -1.77 0.60 132.00 132.74 1jm6 h PRO 1050Ca 0.13 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.12 1jm6 h PRO 1050Cb 0.40 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 1jm6 h PRO 1050CO 0.01 0.25 -0.19 0.28 -0.21 0.00 0.00 178.00 178.14 1jm6 h VAL 1051N 0.40 1.30 -0.21 3.15 2.07 -0.91 0.41 116.25 122.46 1jm6 h VAL 1051Ca 0.11 -1.32 -0.13 0.00 0.82 0.00 0.00 66.70 66.17 1jm6 h VAL 1051Cb -0.03 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1jm6 h VAL 1051CO -0.02 0.42 -0.39 0.03 0.02 0.00 0.00 177.57 177.62 1jm6 h ARG 1052N 0.35 0.64 -0.17 1.57 3.08 0.44 -2.67 114.38 117.62 1jm6 h ARG 1052Ca 0.05 -0.41 -0.04 0.00 0.07 0.00 0.00 59.98 59.66 1jm6 h ARG 1052Cb 0.73 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 1jm6 h ARG 1052CO 0.05 1.02 -0.05 -0.07 -1.07 0.00 0.00 179.97 179.85 1jm6 h LEU 1053N 0.33 0.33 -1.64 3.04 3.38 0.09 -2.98 115.31 117.87 1jm6 h LEU 1053Ca 0.01 -0.38 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 1jm6 h LEU 1053Cb 0.99 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1jm6 h LEU 1053CO 0.09 0.64 -0.21 0.00 0.09 0.00 0.00 178.44 179.05 1jm6 h ALA 1054N 0.71 1.46 -0.21 1.53 0.00 -0.93 -1.22 119.26 120.60 1jm6 h ALA 1054Ca 0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1jm6 h ALA 1054Cb 0.50 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1jm6 h ALA 1054CO 0.02 0.26 0.09 -0.91 0.00 0.00 0.00 179.25 178.71 1jm6 h ASN 1055N 0.00 0.28 1.34 0.00 2.35 -1.46 -2.23 115.58 115.86 1jm6 h ASN 1055Ca -0.00 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 1jm6 h ASN 1055Cb 0.41 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1jm6 h ASN 1055CO 0.03 0.34 -0.33 -0.29 -1.65 0.00 0.00 177.43 175.53 1jm6 h ILE 1056N 0.19 0.00 0.00 2.81 6.09 -1.36 -2.86 117.51 122.38 1jm6 h ILE 1056Ca 0.07 -0.67 -0.11 0.00 -1.37 0.00 0.00 64.86 62.77 1jm6 h ILE 1056Cb 0.15 1.48 -0.02 0.00 0.47 0.00 0.00 36.82 38.90 1jm6 h ILE 1056CO -0.01 0.00 -0.55 0.24 -3.07 0.00 0.00 178.15 174.77 1jm6 h MET 1057N 0.00 0.00 -0.41 2.19 2.86 -1.17 -2.73 114.93 115.68 1jm6 h MET 1057Ca 0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1jm6 h MET 1057Cb 0.84 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.48 1jm6 h MET 1057CO 0.00 0.55 0.14 -0.22 1.06 0.00 0.00 176.91 178.44 1jm6 h LYS 1058N 0.00 0.58 0.00 1.72 3.64 -1.16 -0.34 116.57 121.01 1jm6 h LYS 1058Ca -0.01 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1jm6 h LYS 1058Cb 1.26 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1jm6 h LYS 1058CO 0.07 0.50 -0.10 0.93 -2.27 0.00 0.00 179.45 178.57 1jm6 h GLU 1059N 0.58 0.00 0.00 1.90 5.08 -1.51 -3.20 114.58 117.43 1jm6 h GLU 1059Ca 0.14 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1jm6 h GLU 1059Cb 0.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1jm6 h GLU 1059CO -0.01 0.00 -0.31 0.82 -1.00 0.00 0.00 179.01 178.50 1jm6 h ILE 1060N 0.00 0.56 -0.55 3.13 2.04 -0.74 -2.29 117.51 119.66 1jm6 h ILE 1060Ca 0.00 -1.69 -0.11 0.00 1.00 0.00 0.00 64.86 64.06 1jm6 h ILE 1060Cb 0.90 2.19 -0.07 0.00 -0.74 0.00 0.00 36.82 39.10 1jm6 h ILE 1060CO 0.00 0.31 0.14 -0.46 0.00 0.00 0.00 178.15 178.14 1jm6 n ASN 1061N -3.21 4.47 -0.11 1.72 2.04 -1.07 -3.57 115.26 115.52 1jm6 n ASN 1061Ca 0.02 -2.89 0.09 0.00 -0.44 0.00 0.00 54.58 51.36 1jm6 n ASN 1061Cb 0.63 -0.68 -0.08 0.00 -2.53 0.00 0.00 39.78 37.11 1jm6 n ASN 1061CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 1jm6 n LEU 1062N 0.14 1.12 -4.77 -4.53 4.32 -0.86 -4.99 117.00 107.44 1jm6 n LEU 1062Ca 0.29 -0.57 -0.32 0.00 -0.02 0.00 0.00 56.01 55.39 1jm6 n LEU 1062Cb 1.13 0.00 0.07 0.00 -1.62 0.00 0.00 43.42 43.00 1jm6 n LEU 1062CO 0.32 0.25 0.72 -0.76 -1.22 0.00 0.00 177.39 176.70 1jm6 s LEU 1063N -2.72 3.20 0.02 2.23 1.02 -1.23 -4.91 118.68 116.29 1jm6 s LEU 1063Ca 0.09 1.92 -0.35 0.00 0.02 0.00 0.00 54.13 55.81 1jm6 s LEU 1063Cb 0.14 -4.54 -0.14 0.00 0.02 0.00 0.00 46.19 41.67 1jm6 s LEU 1063CO 0.69 -1.88 1.62 -2.65 0.02 0.00 0.00 176.35 174.15 1jm6 n PRO 1064N -3.02 1.79 0.32 1.29 -0.02 -1.26 -4.71 135.00 129.39 1jm6 n PRO 1064Ca 0.10 0.65 0.13 0.00 -2.02 0.00 0.00 63.50 62.36 1jm6 n PRO 1064Cb 0.52 -2.40 0.71 0.00 -0.02 0.00 0.00 33.50 32.32 1jm6 n PRO 1064CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1jm6 h ASP 1065N 6.59 0.00 1.32 2.55 3.32 -1.98 0.15 116.42 128.37 1jm6 h ASP 1065Ca -0.47 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.51 1jm6 h ASP 1065Cb 1.29 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.82 1jm6 h ASP 1065CO 0.89 0.00 -0.71 -0.09 -1.72 0.00 0.00 179.24 177.61 1jm6 h ARG 1066N 0.00 0.00 0.00 3.56 2.43 -2.00 -3.25 114.38 115.12 1jm6 h ARG 1066Ca 0.00 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.81 1jm6 h ARG 1066Cb 0.76 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.25 1jm6 h ARG 1066CO 0.00 0.22 -2.37 1.55 -1.51 0.00 0.00 179.97 177.86 1jm6 n VAL 1067N -3.00 1.37 -0.14 0.20 3.14 0.33 -4.24 118.33 115.99 1jm6 n VAL 1067Ca -0.01 -0.82 0.01 0.00 -2.96 0.00 0.00 64.34 60.56 1jm6 n VAL 1067Cb 0.67 -0.54 0.30 0.00 -1.06 0.00 0.00 33.84 33.20 1jm6 n VAL 1067CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 1jm6 h LEU 1068N 0.00 0.74 0.00 6.55 6.46 -1.16 -2.23 115.31 125.66 1jm6 h LEU 1068Ca -0.54 -0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.19 1jm6 h LEU 1068Cb 2.20 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 41.95 1jm6 h LEU 1068CO 0.02 0.55 -0.16 0.28 -0.62 0.00 0.00 178.44 178.51 1jm6 h SER 1069N 0.86 0.00 -3.44 1.25 0.02 -1.76 -3.40 113.55 107.09 1jm6 h SER 1069Ca 0.23 -0.04 -0.57 0.00 -0.84 0.00 0.00 61.79 60.56 1jm6 h SER 1069Cb -0.07 0.00 0.15 0.00 0.14 0.00 0.00 62.40 62.62 1jm6 h SER 1069CO -0.05 0.02 0.15 0.41 -1.14 0.00 0.00 176.83 176.22 1jm6 n THR 1070N -2.35 3.24 0.10 -2.27 -1.04 -0.84 -4.89 114.28 106.22 1jm6 n THR 1070Ca 0.05 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.05 61.43 1jm6 n THR 1070Cb 0.45 -1.17 -0.08 0.00 -1.82 0.00 0.00 70.33 67.71 1jm6 n THR 1070CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1jm6 h PRO 1071N 0.87 -0.19 -1.00 -2.82 0.11 -1.89 -2.87 132.00 124.21 1jm6 h PRO 1071Ca -0.47 0.01 0.18 0.00 0.11 0.00 0.00 66.00 65.83 1jm6 h PRO 1071Cb 1.35 0.04 -0.10 0.00 0.11 0.00 0.00 31.00 32.40 1jm6 h PRO 1071CO 0.53 0.00 0.62 0.77 -0.21 0.00 0.00 178.00 179.71 1jm6 h SER 1072N -0.35 0.78 -0.83 -2.05 0.02 -1.87 0.16 113.55 109.41 1jm6 h SER 1072Ca -0.02 0.09 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1jm6 h SER 1072Cb 0.28 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.73 1jm6 h SER 1072CO 0.03 0.29 0.54 0.58 -1.14 0.00 0.00 176.83 177.13 1jm6 h VAL 1073N 0.77 1.22 0.00 2.27 2.07 -1.77 -1.92 116.25 118.89 1jm6 h VAL 1073Ca 0.57 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.67 1jm6 h VAL 1073Cb 0.88 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1jm6 h VAL 1073CO -0.36 0.21 -0.00 1.56 0.02 0.00 0.00 177.57 179.01 1jm6 h GLN 1074N 1.12 -0.00 -0.78 1.57 4.20 -0.73 -1.73 115.11 118.76 1jm6 h GLN 1074Ca 0.30 0.00 0.09 0.00 0.06 0.00 0.00 58.65 59.11 1jm6 h GLN 1074Cb -0.11 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 27.56 1jm6 h GLN 1074CO -0.06 0.73 -0.39 -0.11 -0.67 0.00 0.00 178.83 178.33 1jm6 n LEU 1075N -4.74 -0.68 0.24 1.46 7.94 0.36 0.17 117.00 121.74 1jm6 n LEU 1075Ca -0.09 1.38 0.08 0.00 -1.11 0.00 0.00 56.01 56.27 1jm6 n LEU 1075Cb 0.36 -0.24 0.58 0.00 0.53 0.00 0.00 43.42 44.65 1jm6 n LEU 1075CO 0.34 -1.18 0.92 0.58 -1.11 0.00 0.00 177.39 176.94 1jm6 h VAL 1076N 0.00 0.95 -0.39 1.96 2.07 -1.19 -0.16 116.25 119.48 1jm6 h VAL 1076Ca 0.19 -0.61 -0.11 0.00 0.82 0.00 0.00 66.70 66.99 1jm6 h VAL 1076Cb 0.39 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1jm6 h VAL 1076CO -0.76 0.16 -0.18 -0.61 0.02 0.00 0.00 177.57 176.21 1jm6 h GLN 1077N 0.00 0.81 -0.99 1.57 4.15 0.26 -2.60 115.11 118.31 1jm6 h GLN 1077Ca -0.00 -0.35 0.16 0.00 0.77 0.00 0.00 58.65 59.23 1jm6 h GLN 1077Cb 0.33 -0.02 -0.09 0.00 0.21 0.00 0.00 27.48 27.91 1jm6 h GLN 1077CO 0.02 0.98 0.62 1.03 -1.93 0.00 0.00 178.83 179.55 1jm6 h SER 1078N 0.62 0.81 -0.08 -0.69 0.87 0.21 -1.41 113.55 113.88 1jm6 h SER 1078Ca 0.09 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1jm6 h SER 1078Cb 0.74 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.61 1jm6 h SER 1078CO 0.06 0.35 0.01 -0.50 -0.53 0.00 0.00 176.83 176.22 1jm6 h TRP 1079N 0.82 0.14 0.00 2.24 6.55 -1.04 -3.15 115.95 121.51 1jm6 h TRP 1079Ca 0.53 -0.02 -0.02 0.00 0.95 0.00 0.00 58.89 60.33 1jm6 h TRP 1079Cb 0.75 -0.04 -0.00 0.00 -0.86 0.00 0.00 29.16 29.01 1jm6 h TRP 1079CO -0.00 0.37 -0.08 1.88 -1.05 0.00 0.00 178.44 179.55 1jm6 h TYR 1080N -0.13 0.00 0.00 0.49 -1.99 -0.89 -1.14 116.97 113.30 1jm6 h TYR 1080Ca 0.02 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.63 1jm6 h TYR 1080Cb 0.31 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.02 1jm6 h TYR 1080CO 0.02 0.08 -0.60 0.28 -0.00 0.00 0.00 178.16 177.95 1jm6 h VAL 1081N 0.00 1.12 0.07 -2.88 2.07 -1.41 -3.01 116.25 112.20 1jm6 h VAL 1081Ca -0.00 -2.33 -0.25 0.00 0.82 0.00 0.00 66.70 64.94 1jm6 h VAL 1081Cb 0.17 2.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1jm6 h VAL 1081CO 0.01 0.59 -1.17 -0.61 0.02 0.00 0.00 177.57 176.40 1jm6 h GLN 1082N 0.00 0.15 -0.50 1.57 5.75 -1.44 -3.16 115.11 117.48 1jm6 h GLN 1082Ca -0.01 -0.26 0.00 0.00 -0.15 0.00 0.00 58.65 58.24 1jm6 h GLN 1082Cb 1.34 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.98 1jm6 h GLN 1082CO 0.08 1.10 0.00 0.43 -2.65 0.00 0.00 178.83 177.79 1jm6 n SER 1083N -3.44 1.54 0.00 -0.69 7.64 -0.46 -1.42 113.62 116.79 1jm6 n SER 1083Ca -0.06 -2.11 0.00 0.00 1.01 0.00 0.00 58.87 57.72 1jm6 n SER 1083Cb 0.99 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.88 1jm6 n SER 1083CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1jm6 n LEU 1084N 0.10 0.91 -0.04 -3.43 7.94 -1.17 -4.44 117.00 116.87 1jm6 n LEU 1084Ca 0.07 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.83 1jm6 n LEU 1084Cb 0.31 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.17 1jm6 n LEU 1084CO 0.06 0.15 0.53 -0.07 -1.11 0.00 0.00 177.39 176.96 1jm6 h LEU 1085N 0.00 0.28 -1.32 -1.96 3.38 -1.50 -2.22 115.31 111.97 1jm6 h LEU 1085Ca 0.00 -0.58 0.09 0.00 0.09 0.00 0.00 57.88 57.48 1jm6 h LEU 1085Cb 0.73 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.35 1jm6 h LEU 1085CO 0.00 0.81 0.53 0.44 0.09 0.00 0.00 178.44 180.30 1jm6 h ASP 1086N -0.23 0.70 1.52 -0.43 3.32 -1.50 0.20 116.42 120.00 1jm6 h ASP 1086Ca 0.00 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.00 1jm6 h ASP 1086Cb 0.76 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 1jm6 h ASP 1086CO 0.04 0.42 -0.30 0.40 -1.72 0.00 0.00 179.24 178.08 1jm6 h ILE 1087N 0.78 0.55 0.00 0.35 1.08 -1.77 -3.25 117.51 115.24 1jm6 h ILE 1087Ca 0.37 -1.65 -0.07 0.00 -0.39 0.00 0.00 64.86 63.12 1jm6 h ILE 1087Cb 0.40 2.17 -0.01 0.00 -3.07 0.00 0.00 36.82 36.31 1jm6 h ILE 1087CO -0.14 0.30 -0.33 0.24 -0.69 0.00 0.00 178.15 177.53 1jm6 h MET 1088N 0.00 0.00 -0.21 2.37 2.86 -0.07 -2.31 114.93 117.57 1jm6 h MET 1088Ca -0.00 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.70 1jm6 h MET 1088Cb 1.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 1jm6 h MET 1088CO 0.04 0.33 0.24 1.05 1.06 0.00 0.00 176.91 179.63 1jm6 h GLU 1089N 0.00 0.00 -0.02 1.72 4.11 -0.98 -3.17 114.58 116.25 1jm6 h GLU 1089Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1jm6 h GLU 1089Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1jm6 h GLU 1089CO 0.04 0.00 -0.23 1.19 0.07 0.00 0.00 179.01 180.08 1jm6 n PHE 1090N -3.78 0.00 1.03 2.06 3.01 -0.87 -4.56 117.46 114.35 1jm6 n PHE 1090Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1jm6 n PHE 1090Cb 0.37 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 1jm6 n PHE 1090CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1jm6 n LEU 1091N 0.25 0.19 0.00 4.37 4.77 -1.20 -3.28 117.00 122.10 1jm6 n LEU 1091Ca 0.13 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1jm6 n LEU 1091Cb 0.46 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1jm6 n LEU 1091CO 0.23 0.05 0.00 -0.90 -1.33 0.00 0.00 177.39 175.43 1jm6 n ASP 1092N -0.28 0.00 -4.60 -1.43 5.75 -1.26 -5.12 116.55 109.60 1jm6 n ASP 1092Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 54.79 54.41 1jm6 n ASP 1092Cb 0.05 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.21 1jm6 n ASP 1092CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1jm6 n LYS 1093N -0.28 0.67 -1.79 0.11 5.02 -1.21 -4.91 118.16 115.77 1jm6 n LYS 1093Ca 0.00 0.28 -0.36 0.00 -2.02 0.00 0.00 58.31 56.21 1jm6 n LYS 1093Cb 0.00 -2.16 -0.03 0.00 -0.02 0.00 0.00 35.03 32.82 1jm6 n LYS 1093CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1jm6 s ASP 1094N -1.44 4.79 0.00 4.39 3.68 -1.26 -4.90 116.67 121.93 1jm6 s ASP 1094Ca 0.74 0.63 0.00 0.00 2.13 0.00 0.00 52.55 56.06 1jm6 s ASP 1094Cb -0.38 -2.52 0.00 0.00 -1.45 0.00 0.00 42.92 38.57 1jm6 s ASP 1094CO 0.49 -2.71 0.68 -2.65 0.13 0.00 0.00 175.17 171.11 1jm6 n PRO 1095N 9.07 0.00 -0.83 4.34 -0.02 -1.26 -2.63 135.00 143.68 1jm6 n PRO 1095Ca 0.30 0.20 0.07 0.00 -2.02 0.00 0.00 63.50 62.05 1jm6 n PRO 1095Cb 0.53 -1.75 0.38 0.00 -0.02 0.00 0.00 33.50 32.63 1jm6 n PRO 1095CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1jm6 n GLU 1096N -1.18 4.59 -4.54 -0.52 1.02 -1.26 -4.69 120.64 114.05 1jm6 n GLU 1096Ca 0.00 -2.94 -0.27 0.00 -0.02 0.00 0.00 57.16 53.93 1jm6 n GLU 1096Cb 0.25 -2.20 -0.14 0.00 -0.02 0.00 0.00 31.44 29.34 1jm6 n GLU 1096CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 1jm6 s ASP 1097N -0.74 2.92 0.13 1.62 -4.77 -1.08 -5.04 116.67 109.71 1jm6 s ASP 1097Ca 0.51 -0.65 -0.30 0.00 -3.30 0.00 0.00 52.55 48.81 1jm6 s ASP 1097Cb 0.38 -0.21 -0.09 0.00 -1.09 0.00 0.00 42.92 41.91 1jm6 s ASP 1097CO 0.16 0.17 1.50 -0.74 0.70 0.00 0.00 175.17 176.95 1jm6 h HIS 1098N 4.36 -1.61 -0.32 2.11 -0.00 -1.93 -1.08 115.15 116.67 1jm6 h HIS 1098Ca -0.47 0.09 0.00 0.00 -0.00 0.00 0.00 60.37 59.99 1jm6 h HIS 1098Cb 1.16 0.77 -0.02 0.00 -0.00 0.00 0.00 27.41 29.33 1jm6 h HIS 1098CO 0.55 -0.42 0.21 0.00 -0.00 0.00 0.00 177.93 178.27 1jm6 h ARG 1099N -0.27 0.43 -0.82 5.26 3.08 -1.97 -1.32 114.38 118.76 1jm6 h ARG 1099Ca 0.09 -0.03 0.17 0.00 0.07 0.00 0.00 59.98 60.28 1jm6 h ARG 1099Cb 0.50 -0.10 -0.10 0.00 0.08 0.00 0.00 29.97 30.35 1jm6 h ARG 1099CO -0.63 0.29 0.36 1.15 -1.07 0.00 0.00 179.97 180.07 1jm6 h THR 1100N 0.44 0.62 -0.14 2.04 2.02 -1.46 0.29 112.91 116.71 1jm6 h THR 1100Ca 0.12 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 1jm6 h THR 1100Cb -0.04 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.46 1jm6 h THR 1100CO -0.02 0.09 0.03 -0.07 0.37 0.00 0.00 175.52 175.91 1jm6 h LEU 1101N 0.48 0.23 -0.80 2.58 3.38 -1.31 -1.46 115.31 118.41 1jm6 h LEU 1101Ca 0.47 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1jm6 h LEU 1101Cb 0.76 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1jm6 h LEU 1101CO -0.43 0.42 0.00 0.77 0.09 0.00 0.00 178.44 179.29 1jm6 h SER 1102N 0.03 0.00 0.40 -0.43 4.64 -0.40 -2.75 113.55 115.03 1jm6 h SER 1102Ca 0.04 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.09 1jm6 h SER 1102Cb 0.28 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.39 1jm6 h SER 1102CO 0.00 0.00 -1.20 1.56 -0.87 0.00 0.00 176.83 176.32 1jm6 h GLN 1103N 0.00 0.42 0.25 4.77 4.20 -0.24 -2.71 115.11 121.80 1jm6 h GLN 1103Ca 0.00 -0.60 -0.01 0.00 0.06 0.00 0.00 58.65 58.09 1jm6 h GLN 1103Cb 0.68 0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1jm6 h GLN 1103CO 0.00 1.26 -0.12 0.35 -0.67 0.00 0.00 178.83 179.64 1jm6 h PHE 1104N 0.17 -0.32 -0.82 2.96 3.57 -1.16 0.12 116.94 121.46 1jm6 h PHE 1104Ca -0.15 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.44 1jm6 h PHE 1104Cb 1.89 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 40.68 1jm6 h PHE 1104CO 0.08 -0.07 0.54 1.15 -2.23 0.00 0.00 178.31 177.78 1jm6 h THR 1105N -0.53 0.96 -0.40 4.41 2.02 -1.58 0.26 112.91 118.06 1jm6 h THR 1105Ca -0.03 -0.27 -0.05 0.00 0.77 0.00 0.00 66.41 66.82 1jm6 h THR 1105Cb 0.39 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1jm6 h THR 1105CO 0.06 0.14 0.04 0.44 0.37 0.00 0.00 175.52 176.57 1jm6 h ASP 1106N 0.78 0.65 -0.58 4.18 5.19 -1.24 0.20 116.42 125.61 1jm6 h ASP 1106Ca 0.38 -0.28 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1jm6 h ASP 1106Cb 0.42 -0.17 -0.03 0.00 0.18 0.00 0.00 39.33 39.73 1jm6 h ASP 1106CO -0.15 0.77 0.32 0.00 -3.12 0.00 0.00 179.24 177.06 1jm6 h ALA 1107N 0.91 0.74 -0.58 3.45 0.00 0.98 -2.44 119.26 122.32 1jm6 h ALA 1107Ca 0.12 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1jm6 h ALA 1107Cb 0.41 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1jm6 h ALA 1107CO 0.01 0.26 0.22 -0.07 0.00 0.00 0.00 179.25 179.67 1jm6 h LEU 1108N 0.78 0.80 -0.60 0.00 4.07 -0.23 -1.80 115.31 118.32 1jm6 h LEU 1108Ca 0.20 -0.18 0.09 0.00 0.08 0.00 0.00 57.88 58.08 1jm6 h LEU 1108Cb 0.04 -0.21 -0.07 0.00 1.08 0.00 0.00 40.66 41.51 1jm6 h LEU 1108CO -0.03 0.76 0.23 0.58 -1.08 0.00 0.00 178.44 178.90 1jm6 h VAL 1109N 0.79 0.78 -0.18 1.22 2.07 -0.83 -1.98 116.25 118.14 1jm6 h VAL 1109Ca 0.19 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 1jm6 h VAL 1109Cb 0.22 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1jm6 h VAL 1109CO -0.01 0.08 0.10 0.74 0.02 0.00 0.00 177.57 178.49 1jm6 h THR 1110N 0.42 1.10 -0.83 2.57 2.02 -0.93 -1.58 112.91 115.69 1jm6 h THR 1110Ca 0.30 -0.28 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 1jm6 h THR 1110Cb 0.36 0.97 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 1jm6 h THR 1110CO -0.30 0.10 0.42 0.40 0.37 0.00 0.00 175.52 176.51 1jm6 h ILE 1111N 0.18 1.25 0.00 3.11 2.04 -1.10 0.31 117.51 123.30 1jm6 h ILE 1111Ca 0.06 -0.66 -0.11 0.00 1.00 0.00 0.00 64.86 65.15 1jm6 h ILE 1111Cb 0.07 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.30 1jm6 h ILE 1111CO -0.01 0.29 -0.50 -0.09 0.00 0.00 0.00 178.15 177.84 1jm6 h ARG 1112N 1.16 0.00 0.17 2.37 2.43 -1.31 -1.95 114.38 117.26 1jm6 h ARG 1112Ca 0.29 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 59.13 1jm6 h ARG 1112Cb 0.07 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1jm6 h ARG 1112CO -0.04 0.50 -1.57 -0.91 -1.51 0.00 0.00 179.97 176.44 1jm6 h ASN 1113N 0.00 0.57 -1.01 -3.80 2.35 -1.02 -3.32 115.58 109.35 1jm6 h ASN 1113Ca -0.01 -0.74 0.06 0.00 -0.55 0.00 0.00 56.30 55.07 1jm6 h ASN 1113Cb 1.12 -0.18 -0.07 0.00 0.05 0.00 0.00 38.32 39.24 1jm6 h ASN 1113CO 0.07 1.61 0.65 -0.09 -1.65 0.00 0.00 177.43 178.01 1jm6 h ARG 1114N 0.10 1.15 -0.64 0.81 2.43 -0.76 -2.73 114.38 114.74 1jm6 h ARG 1114Ca -0.27 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1jm6 h ARG 1114Cb 2.07 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 31.36 1jm6 h ARG 1114CO 0.20 0.76 0.00 0.72 -1.51 0.00 0.00 179.97 180.14 1jm6 n HIS 1115N -4.50 1.15 0.49 2.20 8.25 -0.75 -4.43 115.22 117.64 1jm6 n HIS 1115Ca 0.15 -0.44 0.11 0.00 -0.26 0.00 0.00 57.72 57.28 1jm6 n HIS 1115Cb 0.18 -0.25 0.44 0.00 1.12 0.00 0.00 29.99 31.48 1jm6 n HIS 1115CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1jm6 n ASN 1116N 0.62 0.46 -1.37 0.41 3.02 -1.03 -2.12 115.26 115.24 1jm6 n ASN 1116Ca 0.18 0.60 -0.10 0.00 -0.03 0.00 0.00 54.58 55.23 1jm6 n ASN 1116Cb 0.73 -0.70 0.16 0.00 -0.61 0.00 0.00 39.78 39.35 1jm6 n ASN 1116CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1jm6 n ASP 1117N -1.99 3.26 0.22 6.41 8.00 -1.26 -4.74 116.55 126.44 1jm6 n ASP 1117Ca 0.03 -3.80 0.06 0.00 0.71 0.00 0.00 54.79 51.79 1jm6 n ASP 1117Cb 0.24 -0.60 0.50 0.00 -0.02 0.00 0.00 41.12 41.24 1jm6 n ASP 1117CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1jm6 h VAL 1118N 1.21 1.09 0.12 2.53 2.07 -1.76 -2.08 116.25 119.44 1jm6 h VAL 1118Ca 0.26 -0.73 -0.29 0.00 0.82 0.00 0.00 66.70 66.76 1jm6 h VAL 1118Cb 1.51 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1jm6 h VAL 1118CO 0.52 0.21 -1.50 0.58 0.02 0.00 0.00 177.57 177.40 1jm6 h VAL 1119N 0.00 0.97 0.00 2.57 2.07 -1.85 0.10 116.25 120.12 1jm6 h VAL 1119Ca -0.00 -2.39 -0.01 0.00 0.82 0.00 0.00 66.70 65.11 1jm6 h VAL 1119Cb 0.38 2.68 -0.00 0.00 -1.52 0.00 0.00 31.29 32.83 1jm6 h VAL 1119CO 0.03 0.72 -0.06 -0.65 0.02 0.00 0.00 177.57 177.63 1jm6 h PRO 1120N -0.25 0.00 0.00 1.57 0.11 -1.91 0.35 132.00 131.87 1jm6 h PRO 1120Ca -0.32 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.68 1jm6 h PRO 1120Cb 1.80 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.90 1jm6 h PRO 1120CO 0.06 0.06 -0.60 1.15 -0.21 0.00 0.00 178.00 178.46 1jm6 h THR 1121N 0.00 1.22 -0.65 -1.15 2.02 -1.41 -2.79 112.91 110.14 1jm6 h THR 1121Ca -0.00 -2.13 0.02 0.00 0.77 0.00 0.00 66.41 65.07 1jm6 h THR 1121Cb 0.23 2.52 -0.03 0.00 -1.74 0.00 0.00 68.15 69.13 1jm6 h THR 1121CO 0.01 0.41 0.43 0.24 0.37 0.00 0.00 175.52 176.98 1jm6 h MET 1122N -1.00 0.79 -0.07 6.66 2.86 -0.71 -0.70 114.93 122.75 1jm6 h MET 1122Ca -0.16 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 1jm6 h MET 1122Cb 1.06 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 32.54 1jm6 h MET 1122CO -0.10 0.52 0.05 0.00 1.06 0.00 0.00 176.91 178.44 1jm6 h ALA 1123N 1.61 1.94 0.00 6.32 0.00 -0.38 -0.76 119.26 127.99 1jm6 h ALA 1123Ca 0.25 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1jm6 h ALA 1123Cb 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1jm6 h ALA 1123CO -0.07 0.05 -0.12 0.37 0.00 0.00 0.00 179.25 179.49 1jm6 h GLN 1124N 0.10 0.00 0.00 0.00 5.75 -0.86 -1.39 115.11 118.71 1jm6 h GLN 1124Ca 0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1jm6 h GLN 1124Cb -0.01 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.54 1jm6 h GLN 1124CO -0.01 0.09 -0.33 0.78 -2.65 0.00 0.00 178.83 176.71 1jm6 h GLY 1125N 3.91 0.00 0.00 2.39 0.00 -0.66 -3.27 103.07 105.43 1jm6 h GLY 1125Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1jm6 h GLY 1125CO 0.01 0.00 -1.24 -0.62 0.00 0.00 0.00 176.54 174.69 1jm6 n VAL 1126N -2.66 0.00 0.12 4.60 0.31 -0.39 -4.54 118.33 115.76 1jm6 n VAL 1126Ca 0.03 -0.21 -0.24 0.00 -0.01 0.00 0.00 64.34 63.91 1jm6 n VAL 1126Cb 0.50 0.64 -0.16 0.00 -0.91 0.00 0.00 33.84 33.91 1jm6 n VAL 1126CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1jm6 h LEU 1127N 0.00 0.75 -8.25 7.52 6.46 -1.36 -3.37 115.31 117.06 1jm6 h LEU 1127Ca 0.00 -0.93 -0.74 0.00 -0.12 0.00 0.00 57.88 56.10 1jm6 h LEU 1127Cb 0.59 -0.24 -0.24 0.00 -0.73 0.00 0.00 40.66 40.04 1jm6 h LEU 1127CO 0.00 1.64 -0.35 -0.70 -0.62 0.00 0.00 178.44 178.41 1jm6 s GLU 1128N -2.55 2.90 0.00 1.25 -6.30 -1.23 -5.10 118.70 107.66 1jm6 s GLU 1128Ca -0.10 -1.40 0.00 0.00 -2.50 0.00 0.00 54.97 50.96 1jm6 s GLU 1128Cb 0.03 -4.07 0.00 0.00 0.00 0.00 0.00 34.13 30.09 1jm6 s GLU 1128CO 0.92 -1.04 0.24 0.98 0.02 0.00 0.00 175.26 176.38 1jm6 n TYR 1129N 5.15 0.00 -1.97 5.30 9.36 -1.26 -4.47 117.16 129.26 1jm6 n TYR 1129Ca -0.12 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.09 1jm6 n TYR 1129Cb 0.43 0.19 0.00 0.00 -0.63 0.00 0.00 39.34 39.33 1jm6 n TYR 1129CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1jm6 n ASP 1136N 0.00 -3.86 -3.09 2.98 -0.08 -1.26 -5.11 116.55 106.12 1jm6 n ASP 1136Ca 0.00 0.04 -0.06 0.00 -1.51 0.00 0.00 54.79 53.26 1jm6 n ASP 1136Cb 0.38 -2.38 0.06 0.00 2.34 0.00 0.00 41.12 41.52 1jm6 n ASP 1136CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1jm6 n PRO 1137N -0.97 -1.65 -0.36 -0.67 -0.02 -1.26 -5.10 135.00 124.97 1jm6 n PRO 1137Ca 0.01 -0.30 -0.30 0.00 -2.02 0.00 0.00 63.50 60.89 1jm6 n PRO 1137Cb 0.38 -0.46 -0.08 0.00 -0.02 0.00 0.00 33.50 33.32 1jm6 n PRO 1137CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1jm6 n VAL 1138N -3.42 0.00 0.02 -1.45 0.31 -1.26 -4.93 118.33 107.61 1jm6 n VAL 1138Ca 0.03 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1jm6 n VAL 1138Cb 0.12 -1.78 0.00 0.00 -0.91 0.00 0.00 33.84 31.27 1jm6 n VAL 1138CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1jm6 n SER 1139N 7.59 0.05 -4.06 4.52 2.88 -1.26 -4.98 113.62 118.37 1jm6 n SER 1139Ca 0.31 0.08 -0.39 0.00 -1.33 0.00 0.00 58.87 57.54 1jm6 n SER 1139Cb 0.28 0.03 -0.04 0.00 -0.75 0.00 0.00 64.21 63.74 1jm6 n SER 1139CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1jm6 n ASN 1140N -2.84 4.93 -3.97 -3.46 3.02 -1.26 -4.96 115.26 106.72 1jm6 n ASN 1140Ca 0.00 -3.21 -0.42 0.00 -0.03 0.00 0.00 54.58 50.92 1jm6 n ASN 1140Cb 0.14 -1.13 0.00 0.00 -0.61 0.00 0.00 39.78 38.18 1jm6 n ASN 1140CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jm6 n GLN 1141N 2.01 3.03 0.00 3.52 6.02 -1.26 -4.57 117.38 126.13 1jm6 n GLN 1141Ca 0.24 -2.90 0.00 0.00 -0.01 0.00 0.00 57.00 54.33 1jm6 n GLN 1141Cb 0.37 -3.29 0.00 0.00 1.02 0.00 0.00 30.24 28.34 1jm6 n GLN 1141CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1jm6 n ASN 1142N 6.39 0.29 0.22 1.08 3.02 -1.26 -3.03 115.26 121.96 1jm6 n ASN 1142Ca 0.49 -1.86 0.11 0.00 -0.03 0.00 0.00 54.58 53.29 1jm6 n ASN 1142Cb 0.40 -0.15 0.35 0.00 -0.61 0.00 0.00 39.78 39.78 1jm6 n ASN 1142CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1jm6 h ILE 1143N 0.00 0.35 0.30 2.41 2.04 -2.01 -3.29 117.51 117.31 1jm6 h ILE 1143Ca 0.00 -1.17 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1jm6 h ILE 1143Cb 0.15 1.90 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 1jm6 h ILE 1143CO 0.00 0.17 -0.15 -0.61 0.00 0.00 0.00 178.15 177.56 1jm6 h GLN 1144N 0.00 -0.39 -0.12 2.37 5.75 -1.94 -2.65 115.11 118.12 1jm6 h GLN 1144Ca -0.00 0.03 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 1jm6 h GLN 1144Cb 0.89 0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.50 1jm6 h GLN 1144CO 0.02 -0.06 -0.03 -0.92 -2.65 0.00 0.00 178.83 175.19 1jm6 h TYR 1145N -0.80 -0.06 -0.57 3.99 3.20 -1.83 -1.62 116.97 119.29 1jm6 h TYR 1145Ca -0.04 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.77 1jm6 h TYR 1145Cb 0.51 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 1jm6 h TYR 1145CO 0.03 -0.05 0.09 0.35 -1.64 0.00 0.00 178.16 176.94 1jm6 h PHE 1146N 0.00 1.01 -0.26 -3.82 3.57 -1.69 -3.13 116.94 112.62 1jm6 h PHE 1146Ca 0.06 -0.14 -0.08 0.00 3.53 0.00 0.00 57.97 61.33 1jm6 h PHE 1146Cb 0.09 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 1jm6 h PHE 1146CO -0.16 0.88 -0.20 -0.07 -2.23 0.00 0.00 178.31 176.53 1jm6 h LEU 1147N 0.84 0.47 -0.32 0.59 4.07 -1.08 1.21 115.31 121.09 1jm6 h LEU 1147Ca 0.17 -0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1jm6 h LEU 1147Cb 0.42 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 42.02 1jm6 h LEU 1147CO 0.01 0.68 0.20 0.44 -1.08 0.00 0.00 178.44 178.70 1jm6 h ASP 1148N 0.43 0.38 -0.22 -0.43 3.32 -1.30 -0.34 116.42 118.26 1jm6 h ASP 1148Ca 0.07 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 1jm6 h ASP 1148Cb 0.59 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1jm6 h ASP 1148CO 0.04 0.29 -0.10 0.03 -1.72 0.00 0.00 179.24 177.78 1jm6 h ARG 1149N 0.42 0.45 -0.51 3.56 3.08 -1.34 -1.10 114.38 118.95 1jm6 h ARG 1149Ca 0.12 -0.19 0.02 0.00 0.07 0.00 0.00 59.98 59.99 1jm6 h ARG 1149Cb -0.02 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 1jm6 h ARG 1149CO -0.02 0.73 0.31 0.35 -1.07 0.00 0.00 179.97 180.26 1jm6 h PHE 1150N 0.15 0.58 0.00 3.04 3.57 0.15 -1.86 116.94 122.58 1jm6 h PHE 1150Ca 0.05 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.43 1jm6 h PHE 1150Cb 0.59 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.12 1jm6 h PHE 1150CO 0.06 0.34 -0.64 1.88 -2.23 0.00 0.00 178.31 177.72 1jm6 h TYR 1151N 0.62 0.00 -0.23 0.41 0.99 -1.03 -1.47 116.97 116.26 1jm6 h TYR 1151Ca 0.20 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.75 1jm6 h TYR 1151Cb 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 37.73 1jm6 h TYR 1151CO -0.06 0.64 -0.58 1.25 -0.00 0.00 0.00 178.16 179.41 1jm6 h LEU 1152N 0.00 0.82 -0.67 3.88 6.46 -1.00 -1.90 115.31 122.90 1jm6 h LEU 1152Ca -0.01 -0.45 -0.06 0.00 -0.12 0.00 0.00 57.88 57.24 1jm6 h LEU 1152Cb 1.29 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.95 1jm6 h LEU 1152CO 0.08 1.22 0.18 0.77 -0.62 0.00 0.00 178.44 180.07 1jm6 h SER 1153N 0.55 1.00 -0.33 1.25 4.64 -1.32 -2.54 113.55 116.81 1jm6 h SER 1153Ca 0.00 -0.23 -0.02 0.00 -0.47 0.00 0.00 61.79 61.08 1jm6 h SER 1153Cb 1.17 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.98 1jm6 h SER 1153CO 0.12 0.97 0.13 -0.09 -0.87 0.00 0.00 176.83 177.09 1jm6 h ARG 1154N 0.99 0.49 -0.75 4.77 2.43 -1.06 -1.49 114.38 119.75 1jm6 h ARG 1154Ca 0.21 -0.09 0.06 0.00 -0.81 0.00 0.00 59.98 59.35 1jm6 h ARG 1154Cb 0.35 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 29.76 1jm6 h ARG 1154CO -0.00 0.49 0.45 0.82 -1.51 0.00 0.00 179.97 180.22 1jm6 h ILE 1155N 0.38 1.02 0.00 1.20 2.04 -1.25 -0.57 117.51 120.32 1jm6 h ILE 1155Ca 0.11 -0.28 -0.09 0.00 1.00 0.00 0.00 64.86 65.60 1jm6 h ILE 1155Cb 0.19 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 1jm6 h ILE 1155CO -0.01 0.15 -0.42 0.77 0.00 0.00 0.00 178.15 178.64 1jm6 h SER 1156N 0.83 0.00 0.49 1.72 4.64 -1.19 0.87 113.55 120.91 1jm6 h SER 1156Ca 0.33 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.38 1jm6 h SER 1156Cb 0.16 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1jm6 h SER 1156CO -0.17 0.42 -1.19 0.40 -0.87 0.00 0.00 176.83 175.43 1jm6 h ILE 1157N 0.00 1.44 0.00 0.95 2.04 -0.70 -2.67 117.51 118.58 1jm6 h ILE 1157Ca -0.00 -2.83 -0.08 0.00 1.00 0.00 0.00 64.86 62.94 1jm6 h ILE 1157Cb 0.81 2.80 -0.01 0.00 -0.74 0.00 0.00 36.82 39.69 1jm6 h ILE 1157CO 0.05 0.83 -0.38 0.03 0.00 0.00 0.00 178.15 178.69 1jm6 h ARG 1158N 0.13 0.00 0.78 2.37 3.08 -0.78 -1.23 114.38 118.73 1jm6 h ARG 1158Ca -0.14 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 1jm6 h ARG 1158Cb 1.88 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.94 1jm6 h ARG 1158CO 0.20 0.38 -0.39 1.98 -1.07 0.00 0.00 179.97 181.08 1jm6 h MET 1159N 0.00 -1.03 -0.34 0.04 4.05 -0.81 -1.61 114.93 115.24 1jm6 h MET 1159Ca -0.00 0.07 0.06 0.00 -0.28 0.00 0.00 59.70 59.54 1jm6 h MET 1159Cb 0.87 0.23 -0.05 0.00 -0.80 0.00 0.00 31.60 31.85 1jm6 h MET 1159CO 0.05 -0.68 0.03 -0.07 0.23 0.00 0.00 176.91 176.46 1jm6 h LEU 1160N -1.07 -0.07 0.04 3.39 3.38 -1.24 -1.54 115.31 118.20 1jm6 h LEU 1160Ca -0.11 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1jm6 h LEU 1160Cb 0.82 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1jm6 h LEU 1160CO 0.17 -0.00 -0.02 0.40 0.09 0.00 0.00 178.44 179.08 1jm6 h ILE 1161N 0.13 1.13 -0.42 1.22 2.04 -1.28 -3.00 117.51 117.34 1jm6 h ILE 1161Ca 0.16 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.48 1jm6 h ILE 1161Cb 0.21 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1jm6 h ILE 1161CO -0.25 0.14 0.28 0.78 0.00 0.00 0.00 178.15 179.10 1jm6 h ASN 1162N -0.30 0.45 -0.14 1.72 -0.26 -1.14 0.10 115.58 116.01 1jm6 h ASN 1162Ca -0.01 -0.01 -0.08 0.00 -0.56 0.00 0.00 56.30 55.64 1jm6 h ASN 1162Cb 0.27 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.41 1jm6 h ASN 1162CO 0.01 0.32 -0.16 1.56 -1.06 0.00 0.00 177.43 178.10 1jm6 h GLN 1163N 0.53 0.53 0.06 0.81 1.08 -1.15 0.45 115.11 117.42 1jm6 h GLN 1163Ca 0.16 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1jm6 h GLN 1163Cb -0.01 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.38 1jm6 h GLN 1163CO -0.04 0.68 -0.03 1.25 -0.95 0.00 0.00 178.83 179.74 1jm6 h HIS 1164N 0.48 -0.08 -0.17 2.96 2.76 -1.27 -0.63 115.15 119.20 1jm6 h HIS 1164Ca 0.08 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.30 1jm6 h HIS 1164Cb 0.56 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.54 1jm6 h HIS 1164CO 0.02 0.26 0.15 1.15 -1.30 0.00 0.00 177.93 178.20 1jm6 h THR 1165N -0.99 0.71 0.14 6.26 2.02 -0.83 -1.20 112.91 119.02 1jm6 h THR 1165Ca -0.01 0.00 -0.34 0.00 0.77 0.00 0.00 66.41 66.83 1jm6 h THR 1165Cb 0.37 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 1jm6 h THR 1165CO 0.01 0.00 -1.80 -0.07 0.37 0.00 0.00 175.52 174.03 1jm6 h LEU 1166N 0.00 0.48 -0.88 2.58 3.38 -0.07 -3.13 115.31 117.67 1jm6 h LEU 1166Ca 0.08 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.13 1jm6 h LEU 1166Cb 0.37 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1jm6 h LEU 1166CO -0.00 1.79 0.00 0.40 0.09 0.00 0.00 178.44 180.72 1jm6 h ILE 1167N -0.00 0.00 0.00 1.22 2.04 -0.74 -3.34 117.51 116.69 1jm6 h ILE 1167Ca -0.38 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1jm6 h ILE 1167Cb 2.00 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 39.41 1jm6 h ILE 1167CO 0.11 0.00 -0.98 0.49 0.00 0.00 0.00 178.15 177.76 1jm6 n PHE 1168N -2.67 0.00 0.00 1.37 3.01 -0.49 -5.06 117.46 113.63 1jm6 n PHE 1168Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1jm6 n PHE 1168Cb 0.31 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.78 1jm6 n PHE 1168CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1jm6 n ASP 1169N -1.98 0.00 0.00 4.37 5.75 -1.18 -5.09 116.55 118.42 1jm6 n ASP 1169Ca 0.00 0.48 0.00 0.00 -0.01 0.00 0.00 54.79 55.26 1jm6 n ASP 1169Cb 0.49 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1jm6 n ASP 1169CO 0.00 0.00 0.00 -2.65 -0.11 0.00 0.00 177.20 174.44 1jm6 n PRO 1177N -2.04 0.00 -2.82 0.11 -0.02 -1.26 -5.14 135.00 123.83 1jm6 n PRO 1177Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.37 1jm6 n PRO 1177Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 33.54 1jm6 n PRO 1177CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1jm6 n LYS 1178N 0.00 0.98 -2.89 -0.52 3.00 -1.26 -5.14 118.16 112.33 1jm6 n LYS 1178Ca 0.00 -2.19 -0.37 0.00 -0.00 0.00 0.00 58.31 55.75 1jm6 n LYS 1178Cb 0.00 -1.19 -0.06 0.00 0.00 0.00 0.00 35.03 33.77 1jm6 n LYS 1178CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1jm6 s HIS 1179N -0.20 3.71 -0.97 5.64 3.76 -1.26 -4.80 115.29 121.17 1jm6 s HIS 1179Ca 0.26 1.66 -0.08 0.00 -0.15 0.00 0.00 55.06 56.75 1jm6 s HIS 1179Cb 0.29 -2.82 0.25 0.00 1.11 0.00 0.00 32.58 31.41 1jm6 s HIS 1179CO -0.07 0.29 0.92 0.42 -0.85 0.00 0.00 174.74 175.45 1jm6 s ILE 1180N -1.53 5.44 0.00 0.60 1.09 -0.23 -4.94 121.20 121.63 1jm6 s ILE 1180Ca 0.46 -3.27 0.00 0.00 -1.10 0.00 0.00 60.65 56.74 1jm6 s ILE 1180Cb -0.19 -4.32 0.00 0.00 -1.06 0.00 0.00 42.46 36.90 1jm6 s ILE 1180CO 0.23 -1.11 0.00 0.61 -0.10 0.00 0.00 174.94 174.57 1jm6 n GLY 1181N 2.96 0.57 0.45 6.18 0.00 -1.26 -3.34 105.19 110.74 1jm6 n GLY 1181Ca 0.20 -1.02 0.12 0.00 0.00 0.00 0.00 46.02 45.32 1jm6 n GLY 1181CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jm6 n SER 1182N 3.93 1.37 -4.71 1.61 3.41 -1.26 -4.86 113.62 113.10 1jm6 n SER 1182Ca 0.00 -1.56 -0.38 0.00 -0.26 0.00 0.00 58.87 56.67 1jm6 n SER 1182Cb 0.00 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 63.83 1jm6 n SER 1182CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1jm6 s ILE 1183N -1.90 5.22 -0.27 -1.33 1.01 -1.21 -3.87 121.20 118.86 1jm6 s ILE 1183Ca 0.35 0.80 -0.06 0.00 0.00 0.00 0.00 60.65 61.74 1jm6 s ILE 1183Cb 0.19 -3.75 0.00 0.00 0.01 0.00 0.00 42.46 38.91 1jm6 s ILE 1183CO 0.29 0.33 0.04 -0.62 0.00 0.00 0.00 174.94 174.98 1jm6 s ASP 1184N 0.67 4.88 0.47 3.58 3.68 0.03 -1.06 116.67 128.91 1jm6 s ASP 1184Ca 0.22 -0.60 0.27 0.00 2.13 0.00 0.00 52.55 54.57 1jm6 s ASP 1184Cb -0.14 -1.83 0.98 0.00 -1.45 0.00 0.00 42.92 40.47 1jm6 s ASP 1184CO 0.08 -0.13 1.84 -0.65 0.13 0.00 0.00 175.17 176.44 1jm6 h PRO 1185N 8.19 0.00 -2.60 4.34 0.11 -1.81 -2.53 132.00 137.70 1jm6 h PRO 1185Ca -0.34 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.17 1jm6 h PRO 1185Cb 1.14 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.85 1jm6 h PRO 1185CO 0.60 0.14 -0.81 0.27 -0.21 0.00 0.00 178.00 177.98 1jm6 n ASN 1186N -3.25 1.16 -4.68 -2.05 6.94 -1.25 -3.84 115.26 108.29 1jm6 n ASN 1186Ca 0.01 -2.78 -0.37 0.00 -0.02 0.00 0.00 54.58 51.41 1jm6 n ASN 1186Cb 0.41 -0.64 -0.08 0.00 -2.36 0.00 0.00 39.78 37.11 1jm6 n ASN 1186CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1jm6 s SER 1188N 0.90 6.27 0.24 0.00 0.15 -1.26 -0.87 113.70 119.13 1jm6 s SER 1188Ca 0.16 -0.84 -0.14 0.00 0.70 0.00 0.00 55.95 55.83 1jm6 s SER 1188Cb -0.14 -2.54 0.31 0.00 -1.71 0.00 0.00 66.02 61.94 1jm6 s SER 1188CO 0.06 -1.68 1.57 0.58 1.20 0.00 0.00 173.24 174.96 1jm6 h VAL 1189N 6.23 0.05 -0.59 4.45 2.07 -1.89 -0.71 116.25 125.86 1jm6 h VAL 1189Ca -0.13 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.47 1jm6 h VAL 1189Cb 1.04 0.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.79 1jm6 h VAL 1189CO 1.30 0.00 0.22 0.28 0.02 0.00 0.00 177.57 179.40 1jm6 h SER 1190N -0.02 0.23 -0.49 0.57 0.02 -1.91 -0.90 113.55 111.05 1jm6 h SER 1190Ca 0.38 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 1jm6 h SER 1190Cb 0.63 0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.19 1jm6 h SER 1190CO -0.94 0.14 0.32 0.44 -1.14 0.00 0.00 176.83 175.66 1jm6 h ASP 1191N 0.41 0.56 -0.51 3.07 3.32 -1.55 0.12 116.42 121.84 1jm6 h ASP 1191Ca 0.29 -0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.38 1jm6 h ASP 1191Cb 0.34 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.70 1jm6 h ASP 1191CO -0.29 0.41 0.22 0.58 -1.72 0.00 0.00 179.24 178.45 1jm6 h VAL 1192N 0.66 0.90 -0.72 -1.35 2.07 -0.73 0.13 116.25 117.21 1jm6 h VAL 1192Ca 0.18 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 1jm6 h VAL 1192Cb -0.07 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 1jm6 h VAL 1192CO -0.04 0.08 0.45 0.58 0.02 0.00 0.00 177.57 178.66 1jm6 h VAL 1193N 0.44 1.20 -0.10 2.57 2.07 -0.36 0.28 116.25 122.35 1jm6 h VAL 1193Ca 0.23 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 1jm6 h VAL 1193Cb 0.19 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.14 1jm6 h VAL 1193CO -0.20 0.20 -0.06 0.11 0.02 0.00 0.00 177.57 177.65 1jm6 h LYS 1194N 0.98 0.22 -0.74 1.57 1.57 -0.21 -0.12 116.57 119.84 1jm6 h LYS 1194Ca 0.26 -0.10 0.09 0.00 -1.87 0.00 0.00 60.65 59.04 1jm6 h LYS 1194Cb -0.06 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.18 1jm6 h LYS 1194CO -0.05 0.58 0.38 -0.44 -0.57 0.00 0.00 179.45 179.36 1jm6 h ASP 1195N -0.15 0.51 0.78 0.86 5.19 -0.56 -0.70 116.42 122.34 1jm6 h ASP 1195Ca 0.02 0.06 -0.11 0.00 -0.62 0.00 0.00 57.03 56.38 1jm6 h ASP 1195Cb 0.52 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.99 1jm6 h ASP 1195CO 0.02 0.29 -0.54 0.00 -3.12 0.00 0.00 179.24 175.89 1jm6 h ALA 1196N 1.44 0.93 -0.26 3.45 0.00 -0.83 -2.43 119.26 121.57 1jm6 h ALA 1196Ca 0.36 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1jm6 h ALA 1196Cb 0.37 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1jm6 h ALA 1196CO -0.27 0.68 -0.05 -0.92 0.00 0.00 0.00 179.25 178.69 1jm6 h TYR 1197N 0.00 0.55 -0.20 0.00 3.20 -0.14 -2.15 116.97 118.23 1jm6 h TYR 1197Ca -0.01 -0.11 0.03 0.00 3.14 0.00 0.00 58.73 61.78 1jm6 h TYR 1197Cb 1.08 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 39.18 1jm6 h TYR 1197CO 0.00 0.70 0.01 -0.44 -1.64 0.00 0.00 178.16 176.78 1jm6 h ASP 1198N 0.24 -0.06 0.83 -2.11 3.32 -0.98 0.53 116.42 118.19 1jm6 h ASP 1198Ca 0.07 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.12 1jm6 h ASP 1198Cb 0.51 0.07 0.01 0.00 0.22 0.00 0.00 39.33 40.14 1jm6 h ASP 1198CO 0.02 -0.00 -0.40 0.24 -1.72 0.00 0.00 179.24 177.38 1jm6 h MET 1199N 0.08 -1.08 -0.50 3.56 2.86 -1.47 -1.44 114.93 116.95 1jm6 h MET 1199Ca 0.09 0.07 0.10 0.00 -2.06 0.00 0.00 59.70 57.91 1jm6 h MET 1199Cb 0.11 0.24 -0.10 0.00 0.06 0.00 0.00 31.60 31.92 1jm6 h MET 1199CO -0.15 -0.71 -0.20 0.00 1.06 0.00 0.00 176.91 176.90 1jm6 h ALA 1200N -1.06 0.18 -0.72 6.32 0.00 -1.27 -1.53 119.26 121.18 1jm6 h ALA 1200Ca -0.11 0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1jm6 h ALA 1200Cb 0.86 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 1jm6 h ALA 1200CO 0.19 -0.53 0.47 -0.22 0.00 0.00 0.00 179.25 179.15 1jm6 h LYS 1201N -0.09 0.86 -0.87 0.00 3.64 0.20 -1.67 116.57 118.63 1jm6 h LYS 1201Ca 0.23 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.62 1jm6 h LYS 1201Cb 0.45 -0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.02 1jm6 h LYS 1201CO -0.56 0.57 0.54 1.25 -2.27 0.00 0.00 179.45 178.98 1jm6 h LEU 1202N 0.89 0.85 -0.47 5.20 5.85 -0.20 -0.63 115.31 126.80 1jm6 h LEU 1202Ca 0.28 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.91 1jm6 h LEU 1202Cb 0.03 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1jm6 h LEU 1202CO -0.08 0.55 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.38 1jm6 h LEU 1203N 0.99 0.92 0.57 2.25 3.38 -1.13 -2.05 115.31 120.23 1jm6 h LEU 1203Ca 0.38 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1jm6 h LEU 1203Cb 0.17 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 40.68 1jm6 h LEU 1203CO -0.17 1.07 -0.27 0.00 0.09 0.00 0.00 178.44 179.15 1jm6 h ASP 1205N -0.79 0.81 0.39 0.00 3.45 -1.18 0.76 116.42 119.86 1jm6 h ASP 1205Ca -0.08 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.36 1jm6 h ASP 1205Cb 0.60 -0.20 0.00 0.00 -0.56 0.00 0.00 39.33 39.17 1jm6 h ASP 1205CO 0.13 0.58 0.00 0.29 -1.57 0.00 0.00 179.24 178.66 1jm6 n LYS 1206N -4.44 0.31 0.01 3.56 5.02 -0.77 -1.47 118.16 120.39 1jm6 n LYS 1206Ca 0.08 0.08 -0.00 0.00 -2.02 0.00 0.00 58.31 56.45 1jm6 n LYS 1206Cb 0.06 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.57 1jm6 n LYS 1206CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1jm6 n TYR 1207N -1.28 0.00 0.62 2.13 9.36 -0.36 -4.82 117.16 122.81 1jm6 n TYR 1207Ca 0.10 0.00 0.10 0.00 3.32 0.00 0.00 57.90 61.43 1jm6 n TYR 1207Cb 0.17 -0.01 -0.13 0.00 -0.63 0.00 0.00 39.34 38.74 1jm6 n TYR 1207CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1jm6 n TYR 1208N -3.14 0.02 -2.03 2.98 4.01 0.25 -4.96 117.16 114.30 1jm6 n TYR 1208Ca -0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.58 1jm6 n TYR 1208Cb 0.38 -0.20 -0.03 0.00 -0.31 0.00 0.00 39.34 39.18 1jm6 n TYR 1208CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1jm6 n MET 1209N -1.80 -1.25 -3.56 -0.72 2.81 -0.54 -4.96 117.12 107.12 1jm6 n MET 1209Ca 0.01 0.89 -0.14 0.00 -1.81 0.00 0.00 57.70 56.65 1jm6 n MET 1209Cb 0.42 -5.22 -0.06 0.00 -0.71 0.00 0.00 33.22 27.65 1jm6 n MET 1209CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1jm6 s ALA 1210N -2.74 -1.86 -0.06 3.04 0.00 -1.26 -4.96 121.76 113.92 1jm6 s ALA 1210Ca 0.00 1.49 -0.30 0.00 0.00 0.00 0.00 51.96 53.15 1jm6 s ALA 1210Cb 0.00 -0.43 0.08 0.00 0.00 0.00 0.00 23.12 22.77 1jm6 s ALA 1210CO 0.00 -0.33 0.75 -1.54 0.00 0.00 0.00 175.76 174.63 1jm6 s SER 1211N -1.06 -0.59 0.85 0.00 1.04 -1.26 -4.21 113.70 108.46 1jm6 s SER 1211Ca -0.06 0.61 -0.11 0.00 0.48 0.00 0.00 55.95 56.87 1jm6 s SER 1211Cb -0.01 0.49 0.10 0.00 0.10 0.00 0.00 66.02 66.71 1jm6 s SER 1211CO 0.05 -0.57 1.09 -2.84 0.98 0.00 0.00 173.24 171.95 1jm6 s PRO 1212N -1.33 1.63 0.00 4.02 0.02 -1.26 -4.99 135.00 133.09 1jm6 s PRO 1212Ca -0.08 1.06 0.00 0.00 0.02 0.00 0.00 61.00 61.99 1jm6 s PRO 1212Cb -0.00 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.69 1jm6 s PRO 1212CO 0.07 -2.05 0.00 -0.25 -0.33 0.00 0.00 177.00 174.44 1jm6 n ASP 1213N -3.78 0.00 -4.09 2.53 9.92 -1.26 -4.74 116.55 115.13 1jm6 n ASP 1213Ca 0.08 -0.83 -0.20 0.00 -0.53 0.00 0.00 54.79 53.31 1jm6 n ASP 1213Cb 0.54 0.00 -0.14 0.00 -0.64 0.00 0.00 41.12 40.88 1jm6 n ASP 1213CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1jm6 s LEU 1214N 0.00 2.08 -0.05 0.64 2.96 -1.26 -0.18 118.68 122.87 1jm6 s LEU 1214Ca 0.00 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.62 1jm6 s LEU 1214Cb 0.00 -0.58 0.01 0.00 0.50 0.00 0.00 46.19 46.13 1jm6 s LEU 1214CO 0.00 0.09 -0.08 -1.61 -1.32 0.00 0.00 176.35 173.43 1jm6 s GLU 1215N -0.61 1.13 -0.05 1.98 2.02 -0.74 -4.91 118.70 117.51 1jm6 s GLU 1215Ca 0.03 -0.25 0.04 0.00 0.02 0.00 0.00 54.97 54.81 1jm6 s GLU 1215Cb -0.06 -1.02 -0.02 0.00 0.10 0.00 0.00 34.13 33.13 1jm6 s GLU 1215CO 0.00 0.00 -0.16 0.42 0.02 0.00 0.00 175.26 175.54 1jm6 s ILE 1216N 0.65 2.90 0.01 -1.63 1.01 -1.26 -0.46 121.20 122.42 1jm6 s ILE 1216Ca -0.11 -0.78 0.02 0.00 0.00 0.00 0.00 60.65 59.79 1jm6 s ILE 1216Cb -0.13 -2.13 -0.01 0.00 0.01 0.00 0.00 42.46 40.20 1jm6 s ILE 1216CO 0.01 0.58 -0.07 -1.58 0.00 0.00 0.00 174.94 173.89 1jm6 s GLN 1217N -0.61 0.53 0.00 2.79 2.00 -0.43 -4.96 119.66 118.99 1jm6 s GLN 1217Ca 0.09 -0.39 0.05 0.00 -2.00 0.00 0.00 55.36 53.11 1jm6 s GLN 1217Cb -0.11 -0.46 -0.02 0.00 0.80 0.00 0.00 33.01 33.22 1jm6 s GLN 1217CO 0.01 0.12 -0.16 -1.21 -0.50 0.00 0.00 175.29 173.54 1jm6 s GLU 1218N -0.57 1.26 -0.33 1.67 2.02 -1.26 0.13 118.70 121.63 1jm6 s GLU 1218Ca -0.01 -0.65 -0.02 0.00 0.02 0.00 0.00 54.97 54.32 1jm6 s GLU 1218Cb -0.05 -1.24 0.12 0.00 0.10 0.00 0.00 34.13 33.06 1jm6 s GLU 1218CO 0.00 0.33 0.16 0.08 0.02 0.00 0.00 175.26 175.85 1jm6 s VAL 1219N -0.50 0.30 -0.59 2.63 1.01 0.12 -4.93 120.40 118.43 1jm6 s VAL 1219Ca 0.06 -1.35 -0.24 0.00 0.00 0.00 0.00 61.98 60.45 1jm6 s VAL 1219Cb -0.07 -1.24 0.05 0.00 0.00 0.00 0.00 36.38 35.13 1jm6 s VAL 1219CO -0.00 -0.82 0.95 0.21 0.00 0.00 0.00 175.10 175.44 1jm6 s ASN 1220N 1.52 6.27 0.23 3.32 3.84 -1.26 -1.21 114.94 127.65 1jm6 s ASN 1220Ca 0.13 -0.59 0.05 0.00 0.21 0.00 0.00 52.86 52.66 1jm6 s ASN 1220Cb -0.19 -2.43 0.21 0.00 -0.55 0.00 0.00 41.25 38.29 1jm6 s ASN 1220CO -0.19 -1.32 1.53 0.00 -2.79 0.00 0.00 177.10 174.33 1jm6 h ALA 1221N 9.42 0.80 0.00 1.71 0.00 -1.28 -2.78 119.26 127.13 1jm6 h ALA 1221Ca -0.27 -0.59 -0.19 0.00 0.00 0.00 0.00 54.91 53.86 1jm6 h ALA 1221Cb 1.07 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1jm6 h ALA 1221CO 1.12 0.78 -0.91 1.15 0.00 0.00 0.00 179.25 181.40 1jm6 h THR 1222N 0.12 1.63 -2.11 0.00 2.02 -1.87 -3.41 112.91 109.30 1jm6 h THR 1222Ca -0.01 -3.14 -0.44 0.00 0.77 0.00 0.00 66.41 63.59 1jm6 h THR 1222Cb 1.19 2.70 -0.33 0.00 -1.74 0.00 0.00 68.15 69.98 1jm6 h THR 1222CO 0.10 0.89 -0.75 0.21 0.37 0.00 0.00 175.52 176.34 1jm6 s ASN 1223N -6.72 1.51 0.62 4.18 2.47 -1.20 -5.02 114.94 110.78 1jm6 s ASN 1223Ca 0.01 -1.94 0.02 0.00 0.42 0.00 0.00 52.86 51.37 1jm6 s ASN 1223Cb 0.10 0.27 0.13 0.00 -1.45 0.00 0.00 41.25 40.30 1jm6 s ASN 1223CO 0.81 -0.25 1.05 0.00 -3.72 0.00 0.00 177.10 174.98 1jm6 h ALA 1224N 6.76 1.88 0.00 1.71 0.00 -1.73 0.70 119.26 128.58 1jm6 h ALA 1224Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1jm6 h ALA 1224Cb 1.02 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.73 1jm6 h ALA 1224CO 0.22 -0.88 -0.51 2.41 0.00 0.00 0.00 179.25 180.49 1jm6 n THR 1225N -2.44 0.00 -5.10 0.00 -1.04 -1.26 -4.80 114.28 99.64 1jm6 n THR 1225Ca -0.00 -0.18 -0.31 0.00 -2.04 0.00 0.00 64.05 61.52 1jm6 n THR 1225Cb 0.91 0.51 -0.15 0.00 -1.82 0.00 0.00 70.33 69.79 1jm6 n THR 1225CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1jm6 s GLN 1226N 0.00 2.08 0.47 -2.82 0.74 0.24 -5.09 119.66 115.27 1jm6 s GLN 1226Ca 0.06 -0.95 -0.23 0.00 0.05 0.00 0.00 55.36 54.29 1jm6 s GLN 1226Cb 0.07 -2.08 -0.09 0.00 1.10 0.00 0.00 33.01 32.01 1jm6 s GLN 1226CO -0.03 0.55 1.03 -2.30 -0.55 0.00 0.00 175.29 173.99 1jm6 n PRO 1227N 2.18 1.32 -2.88 1.67 -0.02 -1.26 -4.78 135.00 131.22 1jm6 n PRO 1227Ca -0.16 0.48 -0.42 0.00 -2.02 0.00 0.00 63.50 61.38 1jm6 n PRO 1227Cb 0.51 -2.12 -0.04 0.00 -0.02 0.00 0.00 33.50 31.83 1jm6 n PRO 1227CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1jm6 s ILE 1228N -1.33 4.81 0.32 4.25 1.01 -1.26 -5.03 121.20 123.96 1jm6 s ILE 1228Ca 0.66 1.53 0.07 0.00 0.00 0.00 0.00 60.65 62.91 1jm6 s ILE 1228Cb -0.51 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 37.76 1jm6 s ILE 1228CO 0.55 -0.12 -0.05 -1.00 0.00 0.00 0.00 174.94 174.31 1jm6 s HIS 1229N 2.91 2.17 0.23 3.97 3.76 -1.26 -2.91 115.29 124.17 1jm6 s HIS 1229Ca 0.35 -0.65 -0.22 0.00 -0.15 0.00 0.00 55.06 54.39 1jm6 s HIS 1229Cb -0.15 -1.29 0.04 0.00 1.11 0.00 0.00 32.58 32.29 1jm6 s HIS 1229CO 0.08 0.38 0.82 0.00 -0.85 0.00 0.00 174.74 175.18 1jm6 s MET 1230N -3.70 1.56 -0.50 1.40 0.23 -0.05 -4.85 119.30 113.40 1jm6 s MET 1230Ca 0.32 -0.87 -0.22 0.00 -1.03 0.00 0.00 55.69 53.89 1jm6 s MET 1230Cb 0.04 0.53 0.04 0.00 -1.53 0.00 0.00 34.83 33.91 1jm6 s MET 1230CO 0.14 -0.71 0.79 0.08 -2.03 0.00 0.00 175.02 173.29 1jm6 s VAL 1231N -3.59 4.62 0.18 5.16 1.01 -1.25 -0.62 120.40 125.90 1jm6 s VAL 1231Ca 0.12 0.13 -0.24 0.00 0.00 0.00 0.00 61.98 61.99 1jm6 s VAL 1231Cb -0.04 -4.38 0.06 0.00 0.00 0.00 0.00 36.38 32.02 1jm6 s VAL 1231CO 0.05 -0.87 0.96 -0.47 0.00 0.00 0.00 175.10 174.77 1jm6 s TYR 1232N 3.33 -0.07 -0.56 5.22 5.04 -0.95 -4.87 117.35 124.50 1jm6 s TYR 1232Ca 0.26 -0.29 -0.18 0.00 -2.44 0.00 0.00 57.07 54.42 1jm6 s TYR 1232Cb -0.14 0.67 0.10 0.00 0.35 0.00 0.00 41.96 42.94 1jm6 s TYR 1232CO 0.18 -0.91 0.62 0.08 -1.34 0.00 0.00 175.55 174.18 1jm6 s VAL 1233N -2.98 4.94 0.42 3.14 1.01 -1.26 -0.79 120.40 124.87 1jm6 s VAL 1233Ca 0.15 -1.03 0.16 0.00 0.00 0.00 0.00 61.98 61.26 1jm6 s VAL 1233Cb -0.02 -4.40 0.37 0.00 0.00 0.00 0.00 36.38 32.33 1jm6 s VAL 1233CO 0.04 -0.98 1.88 -0.65 0.00 0.00 0.00 175.10 175.39 1jm6 h PRO 1234N 9.06 0.41 -0.76 2.72 0.11 -1.91 -1.26 132.00 140.37 1jm6 h PRO 1234Ca -0.29 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.75 1jm6 h PRO 1234Cb 1.09 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.08 1jm6 h PRO 1234CO 1.05 0.27 0.29 0.66 -0.21 0.00 0.00 178.00 180.06 1jm6 h SER 1235N 0.43 1.06 -0.04 -2.05 4.64 -1.93 0.22 113.55 115.87 1jm6 h SER 1235Ca 0.43 -0.17 -0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1jm6 h SER 1235Cb 1.01 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1jm6 h SER 1235CO -0.15 0.95 0.02 0.45 -0.87 0.00 0.00 176.83 177.23 1jm6 h HIS 1236N 1.11 0.06 -0.44 4.77 3.86 -1.62 -0.49 115.15 122.41 1jm6 h HIS 1236Ca 0.25 -0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.47 1jm6 h HIS 1236Cb 0.23 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 1jm6 h HIS 1236CO 0.02 0.15 0.28 1.25 0.86 0.00 0.00 177.93 180.50 1jm6 h LEU 1237N -0.06 0.48 -0.76 2.43 5.85 -1.29 -1.89 115.31 120.06 1jm6 h LEU 1237Ca 0.01 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.79 1jm6 h LEU 1237Cb 0.12 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 1jm6 h LEU 1237CO -0.00 0.35 0.45 0.22 -0.34 0.00 0.00 178.44 179.12 1jm6 h TYR 1238N 0.57 0.84 -0.08 1.25 3.20 -0.42 -0.57 116.97 121.75 1jm6 h TYR 1238Ca 0.17 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.07 1jm6 h TYR 1238Cb -0.04 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 37.95 1jm6 h TYR 1238CO -0.05 0.42 0.04 1.25 -1.64 0.00 0.00 178.16 178.17 1jm6 h HIS 1239N 0.83 0.07 0.40 -3.82 2.76 -0.69 0.13 115.15 114.83 1jm6 h HIS 1239Ca 0.34 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.49 1jm6 h HIS 1239Cb 0.18 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.12 1jm6 h HIS 1239CO -0.05 0.04 -0.19 0.52 -1.30 0.00 0.00 177.93 176.95 1jm6 h MET 1240N 0.09 -0.51 -0.49 5.26 2.86 -0.99 -2.52 114.93 118.62 1jm6 h MET 1240Ca 0.03 0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1jm6 h MET 1240Cb 0.01 0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 1jm6 h MET 1240CO -0.02 -0.32 0.17 -0.07 1.06 0.00 0.00 176.91 177.72 1jm6 h LEU 1241N -0.56 0.65 0.06 1.22 3.38 -1.01 -2.29 115.31 116.76 1jm6 h LEU 1241Ca -0.05 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1jm6 h LEU 1241Cb 0.43 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1jm6 h LEU 1241CO 0.09 0.61 -0.03 0.15 0.09 0.00 0.00 178.44 179.35 1jm6 h PHE 1242N 0.70 -0.08 -0.60 1.13 3.57 -0.72 0.39 116.94 121.34 1jm6 h PHE 1242Ca 0.17 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.74 1jm6 h PHE 1242Cb 0.19 0.03 -0.06 0.00 2.79 0.00 0.00 35.95 38.89 1jm6 h PHE 1242CO 0.01 0.30 0.26 0.93 -2.23 0.00 0.00 178.31 177.57 1jm6 h GLU 1243N -0.46 0.46 -0.19 1.11 4.39 -1.35 -0.51 114.58 118.02 1jm6 h GLU 1243Ca -0.01 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 1jm6 h GLU 1243Cb 0.41 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1jm6 h GLU 1243CO 0.01 0.30 -0.04 -0.07 -1.16 0.00 0.00 179.01 178.06 1jm6 h LEU 1244N 0.47 0.37 -0.82 1.33 3.38 -1.45 -2.82 115.31 115.78 1jm6 h LEU 1244Ca 0.29 -0.36 0.04 0.00 0.09 0.00 0.00 57.88 57.94 1jm6 h LEU 1244Cb 0.30 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.90 1jm6 h LEU 1244CO -0.26 0.64 0.52 -0.26 0.09 0.00 0.00 178.44 179.18 1jm6 h PHE 1245N 0.09 0.97 -0.99 1.13 -1.00 -0.38 -0.06 116.94 116.71 1jm6 h PHE 1245Ca 0.05 0.03 0.04 0.00 2.81 0.00 0.00 57.97 60.89 1jm6 h PHE 1245Cb 0.48 -0.32 -0.06 0.00 3.61 0.00 0.00 35.95 39.66 1jm6 h PHE 1245CO 0.05 0.54 0.65 0.87 -1.61 0.00 0.00 178.31 178.81 1jm6 h LYS 1246N 1.00 1.21 -0.43 1.51 1.57 -1.09 0.17 116.57 120.50 1jm6 h LYS 1246Ca 0.34 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.96 1jm6 h LYS 1246Cb 0.05 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 1jm6 h LYS 1246CO -0.13 0.80 -0.07 -0.91 -0.57 0.00 0.00 179.45 178.57 1jm6 h ASN 1247N 1.25 0.81 0.25 0.86 2.35 -1.13 -2.51 115.58 117.45 1jm6 h ASN 1247Ca 0.39 -0.35 -0.16 0.00 -0.55 0.00 0.00 56.30 55.63 1jm6 h ASN 1247Cb 0.00 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 1jm6 h ASN 1247CO -0.12 0.96 -0.64 0.00 -1.65 0.00 0.00 177.43 175.98 1jm6 h ALA 1248N 0.87 0.72 -0.01 -0.83 0.00 -0.42 -1.84 119.26 117.75 1jm6 h ALA 1248Ca 0.11 -0.56 -0.18 0.00 0.00 0.00 0.00 54.91 54.28 1jm6 h ALA 1248Cb 0.59 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1jm6 h ALA 1248CO 0.04 0.74 -0.80 0.52 0.00 0.00 0.00 179.25 179.74 1jm6 h MET 1249N 0.27 0.12 0.07 0.00 2.86 -0.70 -1.93 114.93 115.62 1jm6 h MET 1249Ca -0.01 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1jm6 h MET 1249Cb 1.18 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.88 1jm6 h MET 1249CO 0.11 0.86 -0.04 -0.09 1.06 0.00 0.00 176.91 178.81 1jm6 h ARG 1250N 0.07 -0.09 -0.45 1.72 2.43 -1.41 -1.61 114.38 115.03 1jm6 h ARG 1250Ca -0.03 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 1jm6 h ARG 1250Cb 1.41 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.91 1jm6 h ARG 1250CO 0.12 0.20 0.07 0.00 -1.51 0.00 0.00 179.97 178.84 1jm6 h ALA 1251N 0.51 0.48 0.36 2.80 0.00 -1.36 -0.72 119.26 121.33 1jm6 h ALA 1251Ca -0.01 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1jm6 h ALA 1251Cb 0.34 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1jm6 h ALA 1251CO 0.02 -0.34 -0.24 1.15 0.00 0.00 0.00 179.25 179.84 1jm6 h THR 1252N 0.19 0.50 -0.42 0.00 2.02 -1.31 -2.42 112.91 111.48 1jm6 h THR 1252Ca 0.22 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.44 1jm6 h THR 1252Cb 0.30 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 67.17 1jm6 h THR 1252CO -0.31 0.00 0.19 0.58 0.37 0.00 0.00 175.52 176.35 1jm6 h VAL 1253N -0.58 0.95 0.00 3.16 2.07 -1.09 -2.30 116.25 118.45 1jm6 h VAL 1253Ca -0.04 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1jm6 h VAL 1253Cb 0.49 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1jm6 h VAL 1253CO 0.03 0.07 0.00 -0.33 0.02 0.00 0.00 177.57 177.36 1jm6 h GLU 1254N 0.39 0.00 0.00 1.57 5.08 -1.07 -3.02 114.58 117.53 1jm6 h GLU 1254Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1jm6 h GLU 1254Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1jm6 h GLU 1254CO -0.14 0.00 -1.07 0.43 -1.00 0.00 0.00 179.01 177.23 1jm6 n SER 1255N -2.34 0.69 -4.63 1.42 7.64 -0.88 -4.98 113.62 110.54 1jm6 n SER 1255Ca 0.02 -0.53 -0.31 0.00 1.01 0.00 0.00 58.87 59.06 1jm6 n SER 1255Cb 0.25 0.96 -0.06 0.00 -1.01 0.00 0.00 64.21 64.36 1jm6 n SER 1255CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1jm6 n HIS 1256N -1.74 0.95 -0.01 1.43 8.25 -1.12 -5.00 115.22 117.98 1jm6 n HIS 1256Ca 0.03 -2.42 -0.01 0.00 -0.26 0.00 0.00 57.72 55.05 1jm6 n HIS 1256Cb 0.39 -0.34 -0.01 0.00 1.12 0.00 0.00 29.99 31.16 1jm6 n HIS 1256CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1jm6 n GLU 1257N -1.29 0.18 -3.92 -0.41 -0.00 -1.26 -4.97 120.64 108.96 1jm6 n GLU 1257Ca -0.18 0.01 -0.35 0.00 -0.00 0.00 0.00 57.16 56.63 1jm6 n GLU 1257Cb 0.62 -1.04 -0.11 0.00 -0.00 0.00 0.00 31.44 30.91 1jm6 n GLU 1257CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1jm6 s SER 1258N -4.15 5.34 0.00 -1.84 0.15 -1.26 -4.96 113.70 106.98 1jm6 s SER 1258Ca -0.03 -0.08 0.25 0.00 0.70 0.00 0.00 55.95 56.80 1jm6 s SER 1258Cb 0.01 -1.94 1.50 0.00 -1.71 0.00 0.00 66.02 63.88 1jm6 s SER 1258CO 0.04 0.07 1.88 -1.54 1.20 0.00 0.00 173.24 174.89 1jm6 n SER 1259N 4.24 0.00 -0.62 5.45 3.41 -1.26 -2.66 113.62 122.18 1jm6 n SER 1259Ca -0.16 -0.87 0.11 0.00 -0.26 0.00 0.00 58.87 57.69 1jm6 n SER 1259Cb 0.52 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.50 1jm6 n SER 1259CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1jm6 n LEU 1260N -0.98 2.26 -1.55 1.04 4.77 -1.26 -4.47 117.00 116.82 1jm6 n LEU 1260Ca 0.19 -0.84 0.03 0.00 -0.03 0.00 0.00 56.01 55.36 1jm6 n LEU 1260Cb 0.09 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.22 1jm6 n LEU 1260CO 0.14 0.41 0.08 0.35 -1.33 0.00 0.00 177.39 177.04 1jm6 n THR 1261N 0.41 0.37 -2.39 -5.08 -2.24 -1.09 -5.07 114.28 99.19 1jm6 n THR 1261Ca 0.10 -1.44 -0.42 0.00 -2.27 0.00 0.00 64.05 60.01 1jm6 n THR 1261Cb 0.48 0.89 -0.03 0.00 -2.10 0.00 0.00 70.33 69.57 1jm6 n THR 1261CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1jm6 s LEU 1262N -0.73 4.26 0.26 3.22 1.02 -1.24 -4.97 118.68 120.49 1jm6 s LEU 1262Ca 0.34 1.86 -0.31 0.00 0.02 0.00 0.00 54.13 56.04 1jm6 s LEU 1262Cb 0.38 -3.55 -0.12 0.00 0.02 0.00 0.00 46.19 42.92 1jm6 s LEU 1262CO -0.14 -0.67 1.66 -2.84 0.02 0.00 0.00 176.35 174.37 1jm6 s PRO 1263N 2.65 4.12 0.77 1.29 0.02 -1.26 -4.51 135.00 138.07 1jm6 s PRO 1263Ca 0.58 2.60 -0.13 0.00 0.02 0.00 0.00 61.00 64.07 1jm6 s PRO 1263Cb -0.25 -3.04 0.06 0.00 0.02 0.00 0.00 34.50 31.29 1jm6 s PRO 1263CO 0.21 -0.69 1.15 -1.25 -0.33 0.00 0.00 177.00 176.09 1jm6 s PRO 1264N 0.19 2.03 -0.08 5.54 0.04 -1.26 -4.43 135.00 137.02 1jm6 s PRO 1264Ca 0.68 1.52 -0.20 0.00 0.04 0.00 0.00 61.00 63.04 1jm6 s PRO 1264Cb -0.49 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 1jm6 s PRO 1264CO 0.42 -1.87 0.55 0.42 0.04 0.00 0.00 177.00 176.55 1jm6 s ILE 1265N -2.40 5.11 -0.12 0.56 1.01 0.75 -4.70 121.20 121.40 1jm6 s ILE 1265Ca 0.68 1.12 -0.02 0.00 0.00 0.00 0.00 60.65 62.43 1jm6 s ILE 1265Cb -0.23 -3.89 -0.03 0.00 0.01 0.00 0.00 42.46 38.32 1jm6 s ILE 1265CO 0.50 0.33 -0.03 -0.54 0.00 0.00 0.00 174.94 175.19 1jm6 s LYS 1266N 0.50 3.32 -0.03 2.79 1.02 -0.35 -1.78 119.74 125.21 1jm6 s LYS 1266Ca 0.30 -0.49 0.02 0.00 0.02 0.00 0.00 55.97 55.81 1jm6 s LYS 1266Cb -0.16 -2.83 -0.03 0.00 -0.52 0.00 0.00 37.83 34.29 1jm6 s LYS 1266CO 0.13 0.45 -0.06 0.42 -0.92 0.00 0.00 175.35 175.37 1jm6 s ILE 1267N -0.19 3.75 -0.11 2.17 -1.09 0.39 0.16 121.20 126.28 1jm6 s ILE 1267Ca 0.04 -0.61 -0.00 0.00 -2.23 0.00 0.00 60.65 57.84 1jm6 s ILE 1267Cb -0.13 -2.59 0.02 0.00 -1.58 0.00 0.00 42.46 38.19 1jm6 s ILE 1267CO 0.02 0.49 -0.08 -0.32 -1.23 0.00 0.00 174.94 173.83 1jm6 s MET 1268N -1.15 1.51 -0.26 2.79 1.75 0.54 -1.31 119.30 123.17 1jm6 s MET 1268Ca 0.15 -0.25 -0.08 0.00 -1.25 0.00 0.00 55.69 54.26 1jm6 s MET 1268Cb -0.11 -1.57 -0.03 0.00 2.84 0.00 0.00 34.83 35.96 1jm6 s MET 1268CO 0.05 -0.26 0.09 0.08 -0.65 0.00 0.00 175.02 174.33 1jm6 s VAL 1269N 1.68 4.47 -0.14 10.11 1.01 0.35 -0.47 120.40 137.42 1jm6 s VAL 1269Ca 0.04 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.90 1jm6 s VAL 1269Cb -0.13 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 33.16 1jm6 s VAL 1269CO -0.08 0.31 -0.18 0.00 0.00 0.00 0.00 175.10 175.15 1jm6 s ALA 1270N 1.64 2.04 -0.19 5.51 0.00 0.15 0.15 121.76 131.06 1jm6 s ALA 1270Ca 0.06 -0.99 -0.06 0.00 0.00 0.00 0.00 51.96 50.97 1jm6 s ALA 1270Cb -0.15 -1.00 -0.03 0.00 0.00 0.00 0.00 23.12 21.93 1jm6 s ALA 1270CO 0.05 -0.18 0.04 -1.17 0.00 0.00 0.00 175.76 174.50 1jm6 s LEU 1271N 1.09 3.57 0.00 0.00 2.96 -0.35 -0.58 118.68 125.37 1jm6 s LEU 1271Ca -0.02 -0.05 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 1jm6 s LEU 1271Cb -0.14 -1.90 0.01 0.00 0.50 0.00 0.00 46.19 44.66 1jm6 s LEU 1271CO -0.06 0.12 0.12 0.61 -1.32 0.00 0.00 176.35 175.83 1jm6 n GLY 1272N 3.86 3.35 0.26 7.98 0.00 0.36 -0.68 105.19 120.31 1jm6 n GLY 1272Ca -0.17 -2.32 0.14 0.00 0.00 0.00 0.00 46.02 43.68 1jm6 n GLY 1272CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1jm6 h GLU 1273N 0.00 0.00 0.00 1.61 3.07 -1.97 -3.36 114.58 113.92 1jm6 h GLU 1273Ca -0.32 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.54 1jm6 h GLU 1273Cb 1.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.95 1jm6 h GLU 1273CO 0.52 0.10 -0.86 -1.91 -1.40 0.00 0.00 179.01 175.46 1jm6 n GLU 1274N -3.25 2.15 -4.39 2.33 2.13 -1.26 -4.74 120.64 113.62 1jm6 n GLU 1274Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 1jm6 n GLU 1274Cb 0.35 -0.93 -0.12 0.00 0.27 0.00 0.00 31.44 31.01 1jm6 n GLU 1274CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1jm6 s ASP 1275N -3.14 3.87 -0.30 4.31 1.01 -1.26 -1.00 116.67 120.16 1jm6 s ASP 1275Ca 0.00 -0.52 -0.03 0.00 0.71 0.00 0.00 52.55 52.71 1jm6 s ASP 1275Cb 0.00 -0.56 0.04 0.00 1.01 0.00 0.00 42.92 43.41 1jm6 s ASP 1275CO 0.00 0.20 0.01 -0.22 0.21 0.00 0.00 175.17 175.37 1jm6 s LEU 1276N -1.97 3.86 -0.11 1.23 1.98 0.43 -0.49 118.68 123.62 1jm6 s LEU 1276Ca 0.17 -1.16 0.00 0.00 -2.89 0.00 0.00 54.13 50.25 1jm6 s LEU 1276Cb -0.11 -1.74 -0.02 0.00 0.66 0.00 0.00 46.19 44.98 1jm6 s LEU 1276CO 0.09 -0.25 -0.11 -0.44 -1.89 0.00 0.00 176.35 173.75 1jm6 s SER 1277N 1.30 4.23 -0.18 3.68 0.01 0.26 -1.20 113.70 121.79 1jm6 s SER 1277Ca -0.04 -0.23 0.01 0.00 1.31 0.00 0.00 55.95 57.01 1jm6 s SER 1277Cb -0.19 -1.41 0.03 0.00 0.21 0.00 0.00 66.02 64.66 1jm6 s SER 1277CO -0.01 0.23 -0.13 -0.63 0.41 0.00 0.00 173.24 173.12 1jm6 s ILE 1278N -0.04 1.69 -0.20 1.44 1.01 -0.89 0.34 121.20 124.55 1jm6 s ILE 1278Ca -0.02 -0.91 -0.05 0.00 0.00 0.00 0.00 60.65 59.67 1jm6 s ILE 1278Cb -0.14 -1.69 -0.02 0.00 0.01 0.00 0.00 42.46 40.62 1jm6 s ILE 1278CO 0.04 0.29 -0.01 -0.75 0.00 0.00 0.00 174.94 174.51 1jm6 s LYS 1279N 1.40 3.58 -0.38 2.79 2.20 0.38 -1.19 119.74 128.53 1jm6 s LYS 1279Ca 0.01 -0.54 -0.11 0.00 -0.36 0.00 0.00 55.97 54.97 1jm6 s LYS 1279Cb -0.15 -3.06 0.03 0.00 -1.51 0.00 0.00 37.83 33.14 1jm6 s LYS 1279CO -0.09 -0.01 0.22 1.41 -0.36 0.00 0.00 175.35 176.52 1jm6 s MET 1280N 1.04 2.85 -0.14 4.03 -2.45 0.11 -0.34 119.30 124.41 1jm6 s MET 1280Ca 0.02 -1.07 -0.04 0.00 -1.25 0.00 0.00 55.69 53.35 1jm6 s MET 1280Cb -0.14 -3.76 -0.03 0.00 1.25 0.00 0.00 34.83 32.15 1jm6 s MET 1280CO 0.01 -0.70 -0.02 -1.12 1.05 0.00 0.00 175.02 174.25 1jm6 s SER 1281N 1.57 5.00 0.22 1.11 0.01 0.12 -0.99 113.70 120.75 1jm6 s SER 1281Ca 0.02 -0.03 0.06 0.00 1.31 0.00 0.00 55.95 57.31 1jm6 s SER 1281Cb -0.19 -1.70 -0.05 0.00 0.21 0.00 0.00 66.02 64.28 1jm6 s SER 1281CO 0.07 0.23 -0.08 1.51 0.41 0.00 0.00 173.24 175.38 1jm6 s ASP 1282N 0.02 2.27 -0.55 2.44 -4.77 -0.51 -1.21 116.67 114.36 1jm6 s ASP 1282Ca 0.02 -1.11 0.01 0.00 -3.30 0.00 0.00 52.55 48.16 1jm6 s ASP 1282Cb -0.13 -0.08 0.45 0.00 -1.09 0.00 0.00 42.92 42.07 1jm6 s ASP 1282CO 0.02 -0.34 1.75 0.54 0.70 0.00 0.00 175.17 177.84 1jm6 n ARG 1283N -0.41 3.01 0.00 2.11 1.74 -1.26 -1.84 116.66 120.01 1jm6 n ARG 1283Ca -0.07 -3.61 0.00 0.00 -0.77 0.00 0.00 57.85 53.40 1jm6 n ARG 1283Cb 0.62 -2.29 0.00 0.00 -1.02 0.00 0.00 32.46 29.78 1jm6 n ARG 1283CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jm6 n GLY 1284N -0.83 1.04 1.61 -0.13 0.00 -1.24 -4.70 105.19 100.94 1jm6 n GLY 1284Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1jm6 n GLY 1284CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jm6 n GLY 1285N 0.10 2.57 4.23 -0.02 0.00 -0.93 -4.53 105.19 106.62 1jm6 n GLY 1285Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1jm6 n GLY 1285CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jm6 n GLY 1286N -2.00 -1.69 2.91 -0.02 0.00 -1.25 -0.00 105.19 103.14 1jm6 n GLY 1286Ca 0.00 -1.23 -0.12 0.00 0.00 0.00 0.00 46.02 44.67 1jm6 n GLY 1286CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jm6 s VAL 1287N -0.79 0.01 0.51 1.61 1.01 -1.26 -4.73 120.40 116.77 1jm6 s VAL 1287Ca 0.00 -0.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.70 1jm6 s VAL 1287Cb 0.00 -0.08 -0.08 0.00 0.00 0.00 0.00 36.38 36.22 1jm6 s VAL 1287CO 0.00 -0.04 0.91 -0.81 0.00 0.00 0.00 175.10 175.17 1jm6 n PRO 1288N 2.94 1.04 0.16 2.72 -0.04 -1.26 -4.07 135.00 136.50 1jm6 n PRO 1288Ca -0.13 0.39 0.15 0.00 -0.04 0.00 0.00 63.50 63.86 1jm6 n PRO 1288Cb 0.59 -2.03 0.71 0.00 -0.04 0.00 0.00 33.50 32.73 1jm6 n PRO 1288CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1jm6 h LEU 1289N 0.93 0.00 -1.85 1.53 5.85 -2.01 -0.42 115.31 119.34 1jm6 h LEU 1289Ca -0.46 0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.33 1jm6 h LEU 1289Cb 1.36 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.37 1jm6 h LEU 1289CO 0.53 0.00 0.25 -0.09 -0.34 0.00 0.00 178.44 178.79 1jm6 h ARG 1290N 0.00 0.18 -0.35 1.25 2.43 -2.03 -3.14 114.38 112.72 1jm6 h ARG 1290Ca 0.11 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1jm6 h ARG 1290Cb 0.46 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1jm6 h ARG 1290CO -0.00 0.12 0.00 1.63 -1.51 0.00 0.00 179.97 180.21 1jm6 n LYS 1291N -4.47 2.33 0.05 0.20 5.02 -0.17 -4.62 118.16 116.49 1jm6 n LYS 1291Ca 0.05 -2.04 -0.09 0.00 -2.02 0.00 0.00 58.31 54.21 1jm6 n LYS 1291Cb 0.30 -1.37 0.04 0.00 -0.02 0.00 0.00 35.03 33.99 1jm6 n LYS 1291CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1jm6 h ILE 1292N 3.03 1.37 -0.25 -0.18 1.08 -1.56 -2.88 117.51 118.12 1jm6 h ILE 1292Ca 0.00 -2.08 -0.11 0.00 -0.39 0.00 0.00 64.86 62.28 1jm6 h ILE 1292Cb 0.79 2.06 -0.00 0.00 -3.07 0.00 0.00 36.82 36.59 1jm6 h ILE 1292CO 0.00 0.63 -0.26 -0.33 -0.69 0.00 0.00 178.15 177.49 1jm6 h GLU 1293N 0.28 0.63 -0.90 2.37 5.08 -1.82 -2.97 114.58 117.24 1jm6 h GLU 1293Ca -0.02 -0.33 0.18 0.00 -1.00 0.00 0.00 59.36 58.18 1jm6 h GLU 1293Cb 1.25 0.01 -0.17 0.00 0.50 0.00 0.00 28.75 30.34 1jm6 h GLU 1293CO 0.12 0.94 -0.24 0.54 -1.00 0.00 0.00 179.01 179.37 1jm6 n ARG 1294N -4.32 -0.09 0.00 2.33 1.74 -1.17 -1.37 116.66 113.78 1jm6 n ARG 1294Ca -0.04 1.41 0.00 0.00 -0.77 0.00 0.00 57.85 58.44 1jm6 n ARG 1294Cb 0.45 -2.10 0.00 0.00 -1.02 0.00 0.00 32.46 29.79 1jm6 n ARG 1294CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1jm6 n LEU 1295N -5.46 0.00 -0.15 0.55 4.77 -1.10 0.11 117.00 115.73 1jm6 n LEU 1295Ca 0.14 0.09 0.01 0.00 -0.03 0.00 0.00 56.01 56.22 1jm6 n LEU 1295Cb 0.44 -0.09 0.03 0.00 -2.33 0.00 0.00 43.42 41.48 1jm6 n LEU 1295CO -0.11 -0.09 0.52 0.49 -1.33 0.00 0.00 177.39 176.88 1jm6 n PHE 1296N -1.00 0.10 -2.42 -1.77 3.72 -0.47 -4.68 117.46 110.95 1jm6 n PHE 1296Ca 0.00 -0.49 -0.42 0.00 -0.05 0.00 0.00 57.45 56.50 1jm6 n PHE 1296Cb 0.30 -0.04 -0.03 0.00 -0.94 0.00 0.00 39.48 38.76 1jm6 n PHE 1296CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1jm6 s SER 1297N -0.98 7.10 0.51 4.37 0.15 0.30 -4.40 113.70 120.76 1jm6 s SER 1297Ca 0.05 2.08 0.34 0.00 0.70 0.00 0.00 55.95 59.12 1jm6 s SER 1297Cb 0.03 -2.59 1.58 0.00 -1.71 0.00 0.00 66.02 63.33 1jm6 s SER 1297CO 0.04 -0.42 2.01 1.88 1.20 0.00 0.00 173.24 177.96 1jm6 h TYR 1298N 6.21 0.00 -0.00 3.44 -1.99 -1.88 -1.02 116.97 121.73 1jm6 h TYR 1298Ca -0.43 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.30 1jm6 h TYR 1298Cb 1.21 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.94 1jm6 h TYR 1298CO 0.65 0.00 -0.45 -1.33 -0.00 0.00 0.00 178.16 177.04 1jm6 n MET 1299N -2.86 0.10 -4.55 4.88 2.81 -1.26 -4.70 117.12 111.53 1jm6 n MET 1299Ca -0.00 -0.06 -0.34 0.00 -1.81 0.00 0.00 57.70 55.49 1jm6 n MET 1299Cb 0.20 -1.50 -0.12 0.00 -0.71 0.00 0.00 33.22 31.09 1jm6 n MET 1299CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 1jm6 s TYR 1300N -2.94 2.95 -0.28 2.03 5.04 -0.39 -5.04 117.35 118.71 1jm6 s TYR 1300Ca 0.13 -0.29 -0.16 0.00 -2.44 0.00 0.00 57.07 54.31 1jm6 s TYR 1300Cb 0.18 -1.86 0.11 0.00 0.35 0.00 0.00 41.96 40.74 1jm6 s TYR 1300CO 0.67 0.02 0.84 0.45 -1.34 0.00 0.00 175.55 176.20 1jm6 s SER 1301N 0.04 -0.71 -0.14 4.32 0.15 -1.26 -4.29 113.70 111.80 1jm6 s SER 1301Ca -0.01 1.14 0.07 0.00 0.70 0.00 0.00 55.95 57.85 1jm6 s SER 1301Cb -0.14 1.29 0.45 0.00 -1.71 0.00 0.00 66.02 65.91 1jm6 s SER 1301CO 0.03 -0.18 1.23 0.41 1.20 0.00 0.00 173.24 175.93 1jm6 n THR 1302N 3.94 1.60 -4.48 6.45 -1.04 -1.26 -4.94 114.28 114.56 1jm6 n THR 1302Ca -0.19 -0.80 -0.31 0.00 -2.04 0.00 0.00 64.05 60.71 1jm6 n THR 1302Cb 0.58 -0.42 -0.11 0.00 -1.82 0.00 0.00 70.33 68.56 1jm6 n THR 1302CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1jm6 s ALA 1303N -1.96 2.83 -0.70 2.41 0.00 -1.26 -5.02 121.76 118.05 1jm6 s ALA 1303Ca 0.30 -1.15 -0.28 0.00 0.00 0.00 0.00 51.96 50.83 1jm6 s ALA 1303Cb 0.23 -0.91 -0.13 0.00 0.00 0.00 0.00 23.12 22.31 1jm6 s ALA 1303CO 0.08 0.60 2.53 -2.30 0.00 0.00 0.00 175.76 176.68 1jm6 n PRO 1304N 1.33 0.61 -0.97 0.00 -0.02 -1.26 -4.84 135.00 129.84 1jm6 n PRO 1304Ca -0.15 -0.01 -0.34 0.00 -2.02 0.00 0.00 63.50 60.97 1jm6 n PRO 1304Cb 0.52 -2.65 0.03 0.00 -0.02 0.00 0.00 33.50 31.38 1jm6 n PRO 1304CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1jm6 n THR 1305N 7.80 0.00 -1.53 3.45 -1.04 -1.26 -4.83 114.28 116.87 1jm6 n THR 1305Ca 0.49 -0.47 -0.49 0.00 -2.04 0.00 0.00 64.05 61.54 1jm6 n THR 1305Cb 0.34 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.79 1jm6 n THR 1305CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1jm6 n PRO 1306N 2.23 1.49 -1.22 -2.82 -0.02 -1.26 -5.08 135.00 128.32 1jm6 n PRO 1306Ca -0.01 0.44 -0.29 0.00 -2.02 0.00 0.00 63.50 61.63 1jm6 n PRO 1306Cb 0.52 -2.69 0.17 0.00 -0.02 0.00 0.00 33.50 31.48 1jm6 n PRO 1306CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jm6 s ALA 1316N 6.95 1.04 -0.38 3.55 0.00 -1.26 -5.21 121.76 126.45 1jm6 s ALA 1316Ca 1.04 -0.40 0.11 0.00 0.00 0.00 0.00 51.96 52.71 1jm6 s ALA 1316Cb -0.70 -3.10 0.40 0.00 0.00 0.00 0.00 23.12 19.72 1jm6 s ALA 1316CO 0.46 -2.78 1.38 0.41 0.00 0.00 0.00 175.76 175.23 1jm6 n GLY 1317N -1.26 1.52 0.39 0.00 0.00 -1.26 -4.75 105.19 99.83 1jm6 n GLY 1317Ca 0.05 -0.22 0.05 0.00 0.00 0.00 0.00 46.02 45.90 1jm6 n GLY 1317CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1jm6 n PHE 1318N -0.80 0.00 -3.25 1.61 1.16 -1.26 -4.58 117.46 110.35 1jm6 n PHE 1318Ca -0.06 -0.56 -0.16 0.00 -1.87 0.00 0.00 57.45 54.80 1jm6 n PHE 1318Cb 0.85 -0.11 -0.03 0.00 -1.61 0.00 0.00 39.48 38.58 1jm6 n PHE 1318CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1jm6 n GLY 1319N -0.67 -0.45 0.00 4.97 0.00 -1.26 -4.73 105.19 103.06 1jm6 n GLY 1319Ca 0.09 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1jm6 n GLY 1319CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1jm6 n TYR 1320N -3.05 0.00 -0.32 1.61 0.18 -1.26 -4.19 117.16 110.13 1jm6 n TYR 1320Ca 0.05 0.00 0.10 0.00 1.88 0.00 0.00 57.90 59.92 1jm6 n TYR 1320Cb 0.47 0.00 0.26 0.00 -0.38 0.00 0.00 39.34 39.70 1jm6 n TYR 1320CO 0.00 0.00 0.00 0.78 -2.08 0.00 0.00 176.86 175.56 1jm6 h GLY 1321N 0.00 1.55 0.67 -7.48 0.00 -1.95 -2.77 103.07 93.09 1jm6 h GLY 1321Ca 0.00 -0.30 -0.20 0.00 0.00 0.00 0.00 47.33 46.83 1jm6 h GLY 1321CO 0.00 -0.05 -0.93 1.41 0.00 0.00 0.00 176.54 176.97 1jm6 h LEU 1322N 0.68 0.46 -0.90 3.11 3.38 -1.85 -2.98 115.31 117.20 1jm6 h LEU 1322Ca 0.51 -0.93 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 1jm6 h LEU 1322Cb 0.76 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1jm6 h LEU 1322CO -0.38 1.44 -0.14 -0.65 0.09 0.00 0.00 178.44 178.80 1jm6 h PRO 1323N -0.36 0.66 -0.21 1.13 0.11 -1.75 -2.79 132.00 128.79 1jm6 h PRO 1323Ca -0.17 -0.22 -0.20 0.00 0.11 0.00 0.00 66.00 65.52 1jm6 h PRO 1323Cb 1.67 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.73 1jm6 h PRO 1323CO 0.14 0.78 -0.65 0.82 -0.21 0.00 0.00 178.00 178.87 1jm6 h ILE 1324N 0.60 1.28 -0.53 4.15 2.04 -1.63 -1.57 117.51 121.86 1jm6 h ILE 1324Ca 0.10 -1.86 -0.03 0.00 1.00 0.00 0.00 64.86 64.08 1jm6 h ILE 1324Cb 0.58 1.81 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 1jm6 h ILE 1324CO 0.04 0.59 0.22 0.28 0.00 0.00 0.00 178.15 179.28 1jm6 h SER 1325N 0.58 0.72 -0.90 1.72 0.02 -1.49 -0.45 113.55 113.75 1jm6 h SER 1325Ca -0.02 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 60.76 1jm6 h SER 1325Cb 1.26 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.57 1jm6 h SER 1325CO 0.14 0.69 0.54 -0.09 -1.14 0.00 0.00 176.83 176.96 1jm6 h ARG 1326N 0.71 1.23 -0.77 3.45 2.43 -1.42 -0.69 114.38 119.32 1jm6 h ARG 1326Ca 0.18 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1jm6 h ARG 1326Cb 0.19 -0.26 -0.04 0.00 -0.42 0.00 0.00 29.97 29.44 1jm6 h ARG 1326CO -0.02 0.87 0.49 -0.07 -1.51 0.00 0.00 179.97 179.73 1jm6 h LEU 1327N 1.25 0.90 -0.95 3.80 3.38 -0.80 0.18 115.31 123.06 1jm6 h LEU 1327Ca 0.32 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.19 1jm6 h LEU 1327Cb -0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1jm6 h LEU 1327CO -0.06 0.67 0.02 1.88 0.09 0.00 0.00 178.44 181.04 1jm6 h TYR 1328N 1.05 0.83 -0.23 1.13 -1.99 -0.35 -1.46 116.97 115.95 1jm6 h TYR 1328Ca 0.28 -0.11 -0.17 0.00 2.00 0.00 0.00 58.73 60.73 1jm6 h TYR 1328Cb -0.08 -0.23 0.00 0.00 2.00 0.00 0.00 36.73 38.42 1jm6 h TYR 1328CO 0.00 0.76 -0.53 0.00 -0.00 0.00 0.00 178.16 178.39 1jm6 h ALA 1329N 1.28 0.37 0.00 3.88 0.00 0.36 -3.13 119.26 122.02 1jm6 h ALA 1329Ca 0.15 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1jm6 h ALA 1329Cb 0.42 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1jm6 h ALA 1329CO 0.02 0.57 -0.05 0.87 0.00 0.00 0.00 179.25 180.66 1jm6 h LYS 1330N 0.50 0.00 -0.93 0.00 1.57 -0.64 0.28 116.57 117.35 1jm6 h LYS 1330Ca -0.00 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1jm6 h LYS 1330Cb 1.14 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.40 1jm6 h LYS 1330CO 0.12 0.05 0.60 -0.92 -0.57 0.00 0.00 179.45 178.72 1jm6 h TYR 1331N 0.00 1.13 -0.85 -1.35 3.20 -1.20 -2.37 116.97 115.52 1jm6 h TYR 1331Ca -0.00 0.03 -0.59 0.00 3.14 0.00 0.00 58.73 61.31 1jm6 h TYR 1331Cb 0.52 -0.37 -0.34 0.00 1.54 0.00 0.00 36.73 38.08 1jm6 h TYR 1331CO 0.00 0.64 0.09 1.19 -1.64 0.00 0.00 178.16 178.44 1jm6 n PHE 1332N -4.50 2.88 -2.31 -3.82 3.01 -1.23 -0.08 117.46 111.41 1jm6 n PHE 1332Ca 0.12 -2.56 -0.06 0.00 1.01 0.00 0.00 57.45 55.96 1jm6 n PHE 1332Cb 0.10 -0.91 0.00 0.00 -0.01 0.00 0.00 39.48 38.67 1jm6 n PHE 1332CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1jm6 n GLN 1333N -0.85 -0.94 -1.15 -1.08 1.13 -0.89 -4.07 117.38 109.52 1jm6 n GLN 1333Ca 0.53 0.25 0.00 0.00 -1.94 0.00 0.00 57.00 55.84 1jm6 n GLN 1333Cb 0.84 -3.86 0.00 0.00 0.11 0.00 0.00 30.24 27.33 1jm6 n GLN 1333CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1jm6 n GLY 1334N -0.97 3.95 3.57 1.08 0.00 0.99 -4.53 105.19 109.28 1jm6 n GLY 1334Ca -0.04 -2.14 -0.09 0.00 0.00 0.00 0.00 46.02 43.75 1jm6 n GLY 1334CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1jm6 s ASP 1335N -0.65 -0.42 -0.05 1.61 2.15 -0.79 -3.06 116.67 115.47 1jm6 s ASP 1335Ca 0.00 -0.19 -0.01 0.00 0.43 0.00 0.00 52.55 52.79 1jm6 s ASP 1335Cb 0.00 0.58 0.03 0.00 -0.30 0.00 0.00 42.92 43.23 1jm6 s ASP 1335CO 0.00 -0.99 0.01 -0.22 -0.17 0.00 0.00 175.17 173.80 1jm6 s LEU 1336N -2.76 0.79 0.02 -1.34 0.20 -1.26 -0.56 118.68 113.76 1jm6 s LEU 1336Ca 0.05 -0.03 0.03 0.00 0.69 0.00 0.00 54.13 54.88 1jm6 s LEU 1336Cb -0.02 -0.29 -0.02 0.00 -0.43 0.00 0.00 46.19 45.43 1jm6 s LEU 1336CO -0.06 -0.16 -0.10 -1.10 -0.29 0.00 0.00 176.35 174.64 1jm6 s GLN 1337N 1.54 0.72 -0.13 1.98 -0.21 -0.74 -4.89 119.66 117.93 1jm6 s GLN 1337Ca -0.02 -0.55 0.00 0.00 0.02 0.00 0.00 55.36 54.81 1jm6 s GLN 1337Cb -0.13 -0.66 -0.01 0.00 1.00 0.00 0.00 33.01 33.21 1jm6 s GLN 1337CO -0.03 0.16 -0.14 -0.51 -2.12 0.00 0.00 175.29 172.65 1jm6 s LEU 1338N -0.83 2.64 -0.12 2.90 1.02 -1.26 -0.61 118.68 122.42 1jm6 s LEU 1338Ca -0.00 -0.36 0.00 0.00 0.02 0.00 0.00 54.13 53.79 1jm6 s LEU 1338Cb -0.06 -1.59 0.02 0.00 0.02 0.00 0.00 46.19 44.58 1jm6 s LEU 1338CO 0.00 0.16 -0.10 -0.36 0.02 0.00 0.00 176.35 176.08 1jm6 s PHE 1339N 0.37 1.64 0.27 0.29 0.40 0.43 -4.98 117.98 116.41 1jm6 s PHE 1339Ca -0.12 -0.83 0.11 0.00 -0.60 0.00 0.00 56.93 55.49 1jm6 s PHE 1339Cb -0.16 -1.30 -0.05 0.00 0.51 0.00 0.00 43.02 42.02 1jm6 s PHE 1339CO 0.06 -0.53 -0.11 0.45 0.70 0.00 0.00 175.22 175.80 1jm6 s SER 1340N 1.55 4.05 -0.33 1.36 0.15 -1.26 0.14 113.70 119.36 1jm6 s SER 1340Ca 0.03 -0.84 0.01 0.00 0.70 0.00 0.00 55.95 55.85 1jm6 s SER 1340Cb -0.13 -0.56 0.10 0.00 -1.71 0.00 0.00 66.02 63.72 1jm6 s SER 1340CO -0.08 0.02 0.10 -0.04 1.20 0.00 0.00 173.24 174.44 1jm6 s MET 1341N -3.58 1.04 0.16 5.44 -1.94 0.09 -4.90 119.30 115.61 1jm6 s MET 1341Ca 0.31 -1.45 -0.34 0.00 -1.71 0.00 0.00 55.69 52.50 1jm6 s MET 1341Cb -0.06 -2.45 -0.14 0.00 2.01 0.00 0.00 34.83 34.19 1jm6 s MET 1341CO 0.17 -0.99 1.53 -1.91 -0.01 0.00 0.00 175.02 173.81 1jm6 n GLU 1342N 4.51 2.02 -0.03 2.03 2.13 -1.26 -0.51 120.64 129.53 1jm6 n GLU 1342Ca 0.01 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.56 1jm6 n GLU 1342Cb 0.41 -2.47 0.00 0.00 0.27 0.00 0.00 31.44 29.65 1jm6 n GLU 1342CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jm6 n GLY 1343N 3.15 0.82 1.07 8.31 0.00 0.99 -4.87 105.19 114.67 1jm6 n GLY 1343Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1jm6 n GLY 1343CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1jm6 n PHE 1344N -2.00 0.00 -3.28 1.61 7.35 0.33 -4.77 117.46 116.70 1jm6 n PHE 1344Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1jm6 n PHE 1344Cb 0.00 0.10 0.00 0.00 0.35 0.00 0.00 39.48 39.93 1jm6 n PHE 1344CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1jm6 n GLY 1345N 3.06 0.94 2.99 7.13 0.00 -0.93 -2.18 105.19 116.20 1jm6 n GLY 1345Ca 0.00 -0.73 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 1jm6 n GLY 1345CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jm6 s THR 1346N -2.19 0.11 -0.22 2.61 2.01 -0.77 -0.73 115.64 116.45 1jm6 s THR 1346Ca 0.00 -0.87 0.02 0.00 0.31 0.00 0.00 61.69 61.15 1jm6 s THR 1346Cb 0.00 -0.28 0.04 0.00 0.01 0.00 0.00 72.50 72.27 1jm6 s THR 1346CO 0.00 -0.48 -0.15 -1.81 -0.69 0.00 0.00 174.62 171.49 1jm6 s ASP 1347N -1.43 3.82 -0.24 3.53 -0.00 0.12 -1.43 116.67 121.04 1jm6 s ASP 1347Ca -0.16 -1.04 -0.09 0.00 -0.00 0.00 0.00 52.55 51.26 1jm6 s ASP 1347Cb -0.10 -1.52 -0.04 0.00 -0.00 0.00 0.00 42.92 41.26 1jm6 s ASP 1347CO -0.01 -0.10 0.13 0.00 -0.00 0.00 0.00 175.17 175.20 1jm6 s ALA 1348N 1.19 3.46 -0.08 5.23 0.00 -0.16 -0.43 121.76 130.98 1jm6 s ALA 1348Ca -0.02 -0.97 0.05 0.00 0.00 0.00 0.00 51.96 51.01 1jm6 s ALA 1348Cb -0.17 -2.25 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 1jm6 s ALA 1348CO -0.09 -0.30 -0.24 0.08 0.00 0.00 0.00 175.76 175.22 1jm6 s VAL 1349N 1.26 2.13 -0.25 0.00 1.01 0.22 0.09 120.40 124.86 1jm6 s VAL 1349Ca 0.06 -1.02 -0.10 0.00 0.00 0.00 0.00 61.98 60.92 1jm6 s VAL 1349Cb -0.14 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 1jm6 s VAL 1349CO 0.05 0.56 0.15 -0.63 0.00 0.00 0.00 175.10 175.24 1jm6 s ILE 1350N 0.03 5.17 -0.21 2.22 1.01 -0.33 -1.79 121.20 127.30 1jm6 s ILE 1350Ca -0.09 0.12 -0.04 0.00 0.00 0.00 0.00 60.65 60.63 1jm6 s ILE 1350Cb -0.15 -3.42 -0.02 0.00 0.01 0.00 0.00 42.46 38.88 1jm6 s ILE 1350CO 0.06 0.33 -0.02 -0.31 0.00 0.00 0.00 174.94 174.99 1jm6 s TYR 1351N 1.27 2.99 0.19 3.97 1.51 0.27 -2.10 117.35 125.46 1jm6 s TYR 1351Ca 0.07 -0.66 0.10 0.00 -1.01 0.00 0.00 57.07 55.57 1jm6 s TYR 1351Cb -0.14 -2.09 -0.04 0.00 -0.11 0.00 0.00 41.96 39.57 1jm6 s TYR 1351CO 0.06 -0.37 -0.20 -0.51 -1.11 0.00 0.00 175.55 173.41 1jm6 s LEU 1352N 1.20 2.46 0.05 -1.29 1.43 -0.34 -1.88 118.68 120.32 1jm6 s LEU 1352Ca 0.03 -0.90 -0.30 0.00 -1.03 0.00 0.00 54.13 51.93 1jm6 s LEU 1352Cb -0.14 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.06 1jm6 s LEU 1352CO 0.00 0.02 0.98 -0.54 0.23 0.00 0.00 176.35 177.04 1jm6 s LYS 1353N -2.90 4.62 0.28 1.70 1.02 -1.26 -0.43 119.74 122.77 1jm6 s LYS 1353Ca 0.20 1.45 0.05 0.00 0.02 0.00 0.00 55.97 57.68 1jm6 s LYS 1353Cb -0.06 -3.42 0.40 0.00 -0.52 0.00 0.00 37.83 34.23 1jm6 s LYS 1353CO 0.09 0.07 1.67 0.00 -0.92 0.00 0.00 175.35 176.26 1jm6 h ALA 1354N 6.21 1.05 -3.14 5.17 0.00 -1.32 -3.44 119.26 123.79 1jm6 h ALA 1354Ca -0.42 -0.42 -0.64 0.00 0.00 0.00 0.00 54.91 53.43 1jm6 h ALA 1354Cb 1.22 -0.09 -0.22 0.00 0.00 0.00 0.00 17.79 18.69 1jm6 h ALA 1354CO 0.74 0.61 -0.65 -0.51 0.00 0.00 0.00 179.25 179.43 1jm6 s LEU 1355N -8.30 3.31 0.34 0.00 1.43 -1.26 -4.82 118.68 109.39 1jm6 s LEU 1355Ca -0.05 -0.17 0.15 0.00 -1.03 0.00 0.00 54.13 53.03 1jm6 s LEU 1355Cb 0.13 -1.84 1.13 0.00 0.03 0.00 0.00 46.19 45.64 1jm6 s LEU 1355CO 0.78 0.08 1.63 0.77 0.23 0.00 0.00 176.35 179.84 1jm6 h SER 1356N 7.40 0.34 -0.80 2.29 4.64 -1.89 0.78 113.55 126.31 1jm6 h SER 1356Ca -0.36 0.22 0.23 0.00 -0.47 0.00 0.00 61.79 61.42 1jm6 h SER 1356Cb 1.18 0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 63.45 1jm6 h SER 1356CO 0.62 -0.26 0.57 0.71 -0.87 0.00 0.00 176.83 177.60 1jm6 h THR 1357N 0.18 0.60 0.00 2.95 1.35 -1.97 -2.09 112.91 113.93 1jm6 h THR 1357Ca 0.75 -0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 66.58 1jm6 h THR 1357Cb 1.80 0.60 -0.01 0.00 -1.73 0.00 0.00 68.15 68.81 1jm6 h THR 1357CO -0.69 0.00 -1.84 0.47 -0.25 0.00 0.00 175.52 173.22 1jm6 n ASP 1358N -4.30 0.17 -4.56 5.36 8.00 0.27 -4.81 116.55 116.68 1jm6 n ASP 1358Ca 0.16 0.07 -0.35 0.00 0.71 0.00 0.00 54.79 55.38 1jm6 n ASP 1358Cb 0.86 1.61 -0.04 0.00 -0.02 0.00 0.00 41.12 43.54 1jm6 n ASP 1358CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1jm6 s SER 1359N -4.77 5.58 0.03 -2.24 0.01 -0.78 -4.81 113.70 106.72 1jm6 s SER 1359Ca -0.07 -0.54 0.07 0.00 1.31 0.00 0.00 55.95 56.72 1jm6 s SER 1359Cb 0.13 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 1jm6 s SER 1359CO 0.88 -2.28 -0.18 -0.69 0.41 0.00 0.00 173.24 171.38 1jm6 s VAL 1360N 8.21 2.78 0.15 3.43 1.01 -1.26 -2.31 120.40 132.42 1jm6 s VAL 1360Ca 0.60 -1.15 -0.31 0.00 0.00 0.00 0.00 61.98 61.11 1jm6 s VAL 1360Cb -0.07 -2.16 -0.10 0.00 0.00 0.00 0.00 36.38 34.05 1jm6 s VAL 1360CO 0.05 0.36 1.69 -1.61 0.00 0.00 0.00 175.10 175.60 1jm6 s GLU 1361N -1.36 4.16 -0.20 2.72 2.02 -1.10 -3.68 118.70 121.26 1jm6 s GLU 1361Ca 0.14 2.49 -0.09 0.00 0.02 0.00 0.00 54.97 57.53 1jm6 s GLU 1361Cb -0.10 -3.32 -0.04 0.00 0.10 0.00 0.00 34.13 30.77 1jm6 s GLU 1361CO 0.05 -0.73 0.10 0.50 0.02 0.00 0.00 175.26 175.19 1jm6 s ARG 1362N 1.81 4.03 0.05 1.61 3.52 0.89 -4.80 118.95 126.06 1jm6 s ARG 1362Ca 0.75 -0.31 0.01 0.00 -0.13 0.00 0.00 55.73 56.05 1jm6 s ARG 1362Cb -0.45 -3.34 -0.03 0.00 -1.56 0.00 0.00 34.95 29.56 1jm6 s ARG 1362CO 0.33 0.21 -0.05 -0.51 -0.81 0.00 0.00 175.30 174.46 1jm6 s LEU 1363N 0.59 2.37 0.67 -0.88 1.43 -1.26 -4.78 118.68 116.81 1jm6 s LEU 1363Ca 0.05 -0.75 -0.17 0.00 -1.03 0.00 0.00 54.13 52.23 1jm6 s LEU 1363Cb -0.12 0.01 -0.08 0.00 0.03 0.00 0.00 46.19 46.02 1jm6 s LEU 1363CO 0.01 -0.38 0.29 -2.65 0.23 0.00 0.00 176.35 173.85 1jm6 n PRO 1364N 0.82 0.27 -1.34 1.29 -0.02 -1.26 -4.73 135.00 130.03 1jm6 n PRO 1364Ca -0.18 0.12 -0.53 0.00 -2.02 0.00 0.00 63.50 60.89 1jm6 n PRO 1364Cb 0.58 -1.57 -0.07 0.00 -0.02 0.00 0.00 33.50 32.41 1jm6 n PRO 1364CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1jm6 n VAL 1365N -2.06 0.00 -1.47 -1.45 0.31 -1.26 -4.96 118.33 107.44 1jm6 n VAL 1365Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 1jm6 n VAL 1365Cb 0.49 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.31 1jm6 n VAL 1365CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51