#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nd5 s GLU 1001N 0.00 2.39 -0.10 1.64 2.02 0.14 -4.93 118.70 119.86 1nd5 s GLU 1001Ca 0.00 -0.99 -0.18 0.00 0.02 0.00 0.00 54.97 53.81 1nd5 s GLU 1001Cb 0.00 -2.41 -0.04 0.00 0.10 0.00 0.00 34.13 31.78 1nd5 s GLU 1001CO 0.00 0.50 0.48 -1.17 0.02 0.00 0.00 175.26 175.09 1nd5 s LEU 1002N -2.56 4.30 -0.10 1.80 2.96 -1.26 -0.70 118.68 123.12 1nd5 s LEU 1002Ca 0.25 0.85 -0.04 0.00 -0.22 0.00 0.00 54.13 54.98 1nd5 s LEU 1002Cb -0.11 -2.71 -0.05 0.00 0.50 0.00 0.00 46.19 43.83 1nd5 s LEU 1002CO 0.17 0.03 -0.12 0.29 -1.32 0.00 0.00 176.35 175.40 1nd5 n LYS 1003N 3.48 0.22 -4.19 1.98 4.76 -0.39 -4.93 118.16 119.09 1nd5 n LYS 1003Ca -0.07 0.09 -0.15 0.00 -2.87 0.00 0.00 58.31 55.31 1nd5 n LYS 1003Cb 0.52 -0.93 -0.11 0.00 -1.84 0.00 0.00 35.03 32.67 1nd5 n LYS 1003CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1nd5 s PHE 1004N -2.19 1.11 0.00 2.13 5.36 -1.16 -4.75 117.98 118.50 1nd5 s PHE 1004Ca -0.14 -0.66 -0.13 0.00 -0.96 0.00 0.00 56.93 55.04 1nd5 s PHE 1004Cb 0.05 -0.60 0.02 0.00 -0.34 0.00 0.00 43.02 42.15 1nd5 s PHE 1004CO 0.19 0.02 0.28 0.54 -1.46 0.00 0.00 175.22 174.78 1nd5 s VAL 1005N -2.54 0.07 -0.17 3.12 0.11 -0.85 -0.97 120.40 119.16 1nd5 s VAL 1005Ca 0.07 -0.57 -0.04 0.00 -2.93 0.00 0.00 61.98 58.51 1nd5 s VAL 1005Cb -0.02 -0.66 0.08 0.00 -1.53 0.00 0.00 36.38 34.25 1nd5 s VAL 1005CO 0.00 -0.31 0.28 -0.89 -3.33 0.00 0.00 175.10 170.85 1nd5 s THR 1006N -1.63 -0.44 -0.27 5.04 2.01 0.66 -2.60 115.64 118.42 1nd5 s THR 1006Ca -0.12 0.12 -0.09 0.00 0.31 0.00 0.00 61.69 61.91 1nd5 s THR 1006Cb -0.05 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.85 1nd5 s THR 1006CO 0.02 -0.00 0.14 -0.76 -0.69 0.00 0.00 174.62 173.33 1nd5 s LEU 1007N 2.43 3.77 -0.38 4.42 1.43 -1.05 -0.85 118.68 128.46 1nd5 s LEU 1007Ca 0.04 -0.10 -0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1nd5 s LEU 1007Cb -0.13 -2.03 0.09 0.00 0.03 0.00 0.00 46.19 44.14 1nd5 s LEU 1007CO -0.11 -0.05 0.15 -0.69 0.23 0.00 0.00 176.35 175.88 1nd5 s VAL 1008N 1.70 3.29 0.30 -1.59 1.01 0.22 -0.78 120.40 124.55 1nd5 s VAL 1008Ca 0.07 -1.79 0.10 0.00 0.00 0.00 0.00 61.98 60.36 1nd5 s VAL 1008Cb -0.16 -3.13 -0.06 0.00 0.00 0.00 0.00 36.38 33.04 1nd5 s VAL 1008CO 0.08 -0.50 -0.14 0.72 0.00 0.00 0.00 175.10 175.25 1nd5 s PHE 1009N 1.20 2.25 -0.02 5.22 -0.12 -0.58 -1.55 117.98 124.38 1nd5 s PHE 1009Ca 0.04 -0.45 -0.06 0.00 -0.05 0.00 0.00 56.93 56.41 1nd5 s PHE 1009Cb -0.22 -1.13 -0.04 0.00 -0.63 0.00 0.00 43.02 41.00 1nd5 s PHE 1009CO -0.03 0.60 0.22 0.50 -0.05 0.00 0.00 175.22 176.46 1nd5 s ARG 1010N -3.58 3.52 1.13 1.99 3.52 -0.75 -1.57 118.95 123.21 1nd5 s ARG 1010Ca 0.30 -0.14 -0.18 0.00 -0.13 0.00 0.00 55.73 55.57 1nd5 s ARG 1010Cb -0.01 -3.11 0.13 0.00 -1.56 0.00 0.00 34.95 30.39 1nd5 s ARG 1010CO 0.15 0.68 0.07 -2.39 -0.81 0.00 0.00 175.30 173.00 1nd5 n HIS 1011N 1.26 -1.44 -2.51 5.12 1.44 -1.05 -2.11 115.22 115.93 1nd5 n HIS 1011Ca -0.13 0.10 -0.24 0.00 -2.01 0.00 0.00 57.72 55.44 1nd5 n HIS 1011Cb 0.53 -1.56 0.13 0.00 0.12 0.00 0.00 29.99 29.21 1nd5 n HIS 1011CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1nd5 s GLY 1012N -1.88 1.76 -0.14 -1.39 0.00 -1.26 -0.61 107.32 103.80 1nd5 s GLY 1012Ca 0.57 -1.73 -0.33 0.00 0.00 0.00 0.00 44.72 43.23 1nd5 s GLY 1012CO 0.65 -1.11 0.97 1.34 0.00 0.00 0.00 173.10 174.95 1nd5 n ASP 1013N -2.99 0.34 -4.33 1.64 -0.08 -1.26 -4.80 116.55 105.06 1nd5 n ASP 1013Ca 0.16 0.89 -0.17 0.00 -1.51 0.00 0.00 54.79 54.16 1nd5 n ASP 1013Cb 0.60 -0.69 -0.10 0.00 2.34 0.00 0.00 41.12 43.27 1nd5 n ASP 1013CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nd5 s ARG 1014N 0.85 1.38 0.79 -0.67 1.70 -1.26 -1.80 118.95 119.94 1nd5 s ARG 1014Ca 0.73 -1.72 -0.11 0.00 -0.47 0.00 0.00 55.73 54.17 1nd5 s ARG 1014Cb -1.03 -0.48 0.09 0.00 -0.57 0.00 0.00 34.95 32.96 1nd5 s ARG 1014CO 0.51 -0.18 1.14 -1.54 -1.08 0.00 0.00 175.30 174.14 1nd5 s SER 1015N -3.32 4.42 0.78 -2.89 1.04 -1.00 -4.89 113.70 107.83 1nd5 s SER 1015Ca 0.32 0.59 -0.13 0.00 0.48 0.00 0.00 55.95 57.21 1nd5 s SER 1015Cb 0.07 -1.07 0.07 0.00 0.10 0.00 0.00 66.02 65.19 1nd5 s SER 1015CO 0.11 -1.92 1.18 -2.16 0.98 0.00 0.00 173.24 171.43 1nd5 s PRO 1016N -5.51 1.89 0.25 4.02 0.04 -1.26 -3.67 135.00 130.76 1nd5 s PRO 1016Ca 0.63 1.64 0.17 0.00 0.04 0.00 0.00 61.00 63.48 1nd5 s PRO 1016Cb -0.10 -1.82 0.06 0.00 0.04 0.00 0.00 34.50 32.68 1nd5 s PRO 1016CO 0.48 -2.00 1.32 0.82 0.04 0.00 0.00 177.00 177.66 1nd5 h ILE 1017N -0.76 0.60 -1.77 0.56 2.04 -1.93 -1.09 117.51 115.17 1nd5 h ILE 1017Ca -0.46 -1.91 0.16 0.00 1.00 0.00 0.00 64.86 63.65 1nd5 h ILE 1017Cb 1.28 2.22 -0.03 0.00 -0.74 0.00 0.00 36.82 39.55 1nd5 h ILE 1017CO 0.48 0.34 0.44 -0.67 0.00 0.00 0.00 178.15 178.74 1nd5 n ASP 1018N -3.10 -0.69 -3.56 1.72 2.03 -1.26 -4.59 116.55 107.09 1nd5 n ASP 1018Ca -0.00 -1.21 -0.06 0.00 0.52 0.00 0.00 54.79 54.04 1nd5 n ASP 1018Cb 0.71 1.09 -0.00 0.00 -0.72 0.00 0.00 41.12 42.20 1nd5 n ASP 1018CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1nd5 s THR 1019N -2.13 0.00 0.39 5.18 -1.32 -1.26 -4.49 115.64 112.01 1nd5 s THR 1019Ca 0.15 -0.91 -0.26 0.00 -1.21 0.00 0.00 61.69 59.46 1nd5 s THR 1019Cb -0.01 -2.29 -0.09 0.00 -1.51 0.00 0.00 72.50 68.60 1nd5 s THR 1019CO 0.00 0.00 1.24 0.72 -2.21 0.00 0.00 174.62 174.37 1nd5 s PHE 1020N -3.26 2.98 0.25 9.09 -0.12 0.59 -4.94 117.98 122.57 1nd5 s PHE 1020Ca 0.13 1.49 -0.12 0.00 -0.05 0.00 0.00 56.93 58.38 1nd5 s PHE 1020Cb -0.05 -3.54 0.35 0.00 -0.63 0.00 0.00 43.02 39.15 1nd5 s PHE 1020CO 0.07 -1.68 1.58 -1.35 -0.05 0.00 0.00 175.22 173.80 1nd5 h PRO 1021N 2.77 -0.01 -0.14 1.99 0.11 -1.86 -0.30 132.00 134.55 1nd5 h PRO 1021Ca -0.49 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.66 1nd5 h PRO 1021Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1nd5 h PRO 1021CO 0.63 -0.01 0.11 1.15 -0.21 0.00 0.00 178.00 179.67 1nd5 h THR 1022N -0.01 0.82 -1.80 -1.15 2.02 -1.28 -3.45 112.91 108.05 1nd5 h THR 1022Ca 0.40 0.00 -0.67 0.00 0.77 0.00 0.00 66.41 66.90 1nd5 h THR 1022Cb 0.62 0.92 0.02 0.00 -1.74 0.00 0.00 68.15 67.97 1nd5 h THR 1022CO -0.89 0.00 0.99 -0.67 0.37 0.00 0.00 175.52 175.32 1nd5 n ASP 1023N -4.33 2.92 0.24 4.18 -0.08 -0.13 -4.85 116.55 114.51 1nd5 n ASP 1023Ca 0.00 1.02 0.13 0.00 -1.51 0.00 0.00 54.79 54.44 1nd5 n ASP 1023Cb 0.24 -1.26 0.50 0.00 2.34 0.00 0.00 41.12 42.94 1nd5 n ASP 1023CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1nd5 h PRO 1024N 8.14 0.00 -4.88 -0.67 0.11 -1.89 -3.37 132.00 129.44 1nd5 h PRO 1024Ca -0.47 0.00 -0.72 0.00 0.11 0.00 0.00 66.00 64.92 1nd5 h PRO 1024Cb 1.29 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.28 1nd5 h PRO 1024CO 0.95 0.10 1.90 -0.89 -0.21 0.00 0.00 178.00 179.85 1nd5 n ILE 1025N -3.21 4.09 -2.00 4.15 5.41 -1.26 -4.99 119.36 121.56 1nd5 n ILE 1025Ca 0.01 -4.32 -0.32 0.00 1.00 0.00 0.00 62.75 59.12 1nd5 n ILE 1025Cb 0.40 -2.43 0.01 0.00 -0.71 0.00 0.00 39.64 36.92 1nd5 n ILE 1025CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1nd5 s LYS 1026N 2.44 3.37 0.00 0.38 1.02 -1.26 -4.82 119.74 120.86 1nd5 s LYS 1026Ca 0.46 1.07 0.00 0.00 0.02 0.00 0.00 55.97 57.53 1nd5 s LYS 1026Cb 0.03 -2.05 0.00 0.00 -0.52 0.00 0.00 37.83 35.29 1nd5 s LYS 1026CO 0.02 -0.76 0.00 -1.91 -0.92 0.00 0.00 175.35 171.78 1nd5 n GLU 1027N -2.23 0.00 0.08 1.68 4.07 -1.26 0.13 120.64 123.11 1nd5 n GLU 1027Ca 0.08 0.00 0.04 0.00 -0.06 0.00 0.00 57.16 57.22 1nd5 n GLU 1027Cb 0.53 0.00 0.21 0.00 -0.06 0.00 0.00 31.44 32.12 1nd5 n GLU 1027CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1nd5 n SER 1028N -3.72 0.20 0.00 4.31 3.41 -1.26 -1.98 113.62 114.58 1nd5 n SER 1028Ca 0.00 0.49 0.11 0.00 -0.26 0.00 0.00 58.87 59.21 1nd5 n SER 1028Cb 0.00 -0.48 0.61 0.00 -0.26 0.00 0.00 64.21 64.08 1nd5 n SER 1028CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1nd5 n SER 1029N -1.73 0.00 -4.44 4.04 7.64 0.35 -4.74 113.62 114.75 1nd5 n SER 1029Ca -0.01 -0.27 -0.32 0.00 1.01 0.00 0.00 58.87 59.29 1nd5 n SER 1029Cb 0.18 -0.19 -0.13 0.00 -1.01 0.00 0.00 64.21 63.06 1nd5 n SER 1029CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1nd5 s TRP 1030N -2.38 2.58 0.00 1.43 0.52 -0.84 -5.05 118.94 115.21 1nd5 s TRP 1030Ca 0.26 -0.25 -0.01 0.00 0.02 0.00 0.00 56.10 56.13 1nd5 s TRP 1030Cb 0.15 -1.55 -0.00 0.00 -1.15 0.00 0.00 33.47 30.93 1nd5 s TRP 1030CO 0.32 0.17 1.01 -1.35 0.02 0.00 0.00 176.95 177.11 1nd5 h PRO 1031N 5.09 -0.00 -1.34 4.98 0.11 -1.89 -2.96 132.00 135.99 1nd5 h PRO 1031Ca -0.46 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 64.98 1nd5 h PRO 1031Cb 1.15 0.00 -0.33 0.00 0.11 0.00 0.00 31.00 31.92 1nd5 h PRO 1031CO 0.49 -0.00 0.33 0.94 -0.21 0.00 0.00 178.00 179.55 1nd5 n GLN 1032N -3.00 3.01 0.00 1.05 -0.06 -1.26 -5.07 117.38 112.05 1nd5 n GLN 1032Ca 0.00 -3.74 0.00 0.00 -2.00 0.00 0.00 57.00 51.26 1nd5 n GLN 1032Cb 0.00 -2.28 0.00 0.00 -4.06 0.00 0.00 30.24 23.91 1nd5 n GLN 1032CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1nd5 n GLY 1033N -0.69 -0.39 3.96 1.69 0.00 -1.12 -4.63 105.19 104.00 1nd5 n GLY 1033Ca 0.53 -1.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 1nd5 n GLY 1033CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nd5 s PHE 1034N 0.00 3.17 -0.78 1.61 2.99 -1.26 -4.42 117.98 119.28 1nd5 s PHE 1034Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 56.93 57.11 1nd5 s PHE 1034Cb 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 43.02 40.66 1nd5 s PHE 1034CO 0.00 -0.42 0.00 0.41 -0.00 0.00 0.00 175.22 175.21 1nd5 n GLY 1035N -2.10 0.70 3.83 4.36 0.00 -0.41 -4.93 105.19 106.63 1nd5 n GLY 1035Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1nd5 n GLY 1035CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nd5 s GLN 1036N -2.34 3.76 0.70 1.61 1.11 -1.26 -4.27 119.66 118.97 1nd5 s GLN 1036Ca 0.00 0.04 -0.16 0.00 0.01 0.00 0.00 55.36 55.25 1nd5 s GLN 1036Cb 0.00 -3.26 0.02 0.00 -1.01 0.00 0.00 33.01 28.76 1nd5 s GLN 1036CO 0.00 0.63 1.21 -1.17 0.01 0.00 0.00 175.29 175.97 1nd5 s LEU 1037N -0.67 3.40 0.50 2.90 2.96 -1.26 -2.37 118.68 124.13 1nd5 s LEU 1037Ca 0.17 2.37 0.02 0.00 -0.22 0.00 0.00 54.13 56.48 1nd5 s LEU 1037Cb -0.13 -4.59 -0.02 0.00 0.50 0.00 0.00 46.19 41.95 1nd5 s LEU 1037CO 0.06 -2.09 0.04 0.42 -1.32 0.00 0.00 176.35 173.45 1nd5 s THR 1038N -1.87 1.35 0.12 3.68 -4.23 -0.74 -4.91 115.64 109.04 1nd5 s THR 1038Ca 0.75 -1.95 -0.22 0.00 -1.18 0.00 0.00 61.69 59.09 1nd5 s THR 1038Cb -0.30 -2.30 -0.05 0.00 1.34 0.00 0.00 72.50 71.18 1nd5 s THR 1038CO 0.42 0.00 1.69 1.56 -0.54 0.00 0.00 174.62 177.75 1nd5 h GLN 1039N 1.36 -0.14 -0.83 3.99 1.08 -1.96 0.57 115.11 119.19 1nd5 h GLN 1039Ca -0.43 0.01 0.12 0.00 -1.45 0.00 0.00 58.65 56.90 1nd5 h GLN 1039Cb 1.30 0.03 -0.08 0.00 -0.05 0.00 0.00 27.48 28.68 1nd5 h GLN 1039CO 0.74 -0.09 0.44 1.25 -0.95 0.00 0.00 178.83 180.22 1nd5 h LEU 1040N -0.14 0.58 -0.81 1.46 5.85 -1.95 0.40 115.31 120.69 1nd5 h LEU 1040Ca 0.07 0.07 0.07 0.00 0.84 0.00 0.00 57.88 58.93 1nd5 h LEU 1040Cb 0.24 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 1nd5 h LEU 1040CO -0.17 0.28 0.49 1.23 -0.34 0.00 0.00 178.44 179.94 1nd5 h GLY 1041N 0.68 1.22 1.21 3.75 0.00 -0.62 -0.77 103.07 108.55 1nd5 h GLY 1041Ca 0.43 -0.35 -0.16 0.00 0.00 0.00 0.00 47.33 47.25 1nd5 h GLY 1041CO -0.31 0.22 -0.45 -0.33 0.00 0.00 0.00 176.54 175.67 1nd5 h MET 1042N 0.89 0.85 -0.31 4.80 2.86 0.37 -2.83 114.93 121.56 1nd5 h MET 1042Ca 0.36 -0.48 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 1nd5 h MET 1042Cb 0.20 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1nd5 h MET 1042CO -0.18 1.12 0.05 0.93 1.06 0.00 0.00 176.91 179.88 1nd5 h GLU 1043N 0.68 0.46 0.63 1.72 5.08 0.31 0.13 114.58 123.59 1nd5 h GLU 1043Ca 0.04 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1nd5 h GLU 1043Cb 1.03 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 30.21 1nd5 h GLU 1043CO 0.10 0.45 -0.30 1.96 -1.00 0.00 0.00 179.01 180.22 1nd5 h GLN 1044N 0.45 -0.81 0.00 2.33 4.20 -1.00 -1.94 115.11 118.33 1nd5 h GLN 1044Ca 0.11 0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.84 1nd5 h GLN 1044Cb 0.22 0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.18 1nd5 h GLN 1044CO 0.00 -0.54 -0.15 0.45 -0.67 0.00 0.00 178.83 177.92 1nd5 h HIS 1045N -0.99 0.00 -0.03 2.96 3.86 -1.43 -0.33 115.15 119.20 1nd5 h HIS 1045Ca -0.09 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.01 1nd5 h HIS 1045Cb 0.65 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.10 1nd5 h HIS 1045CO 0.04 0.15 -0.50 -0.92 0.86 0.00 0.00 177.93 177.56 1nd5 h TYR 1046N 0.00 0.09 0.15 2.45 3.20 -0.73 -2.14 116.97 119.99 1nd5 h TYR 1046Ca -0.00 -0.03 -0.31 0.00 3.14 0.00 0.00 58.73 61.53 1nd5 h TYR 1046Cb 0.48 -0.02 0.01 0.00 1.54 0.00 0.00 36.73 38.74 1nd5 h TYR 1046CO 0.00 0.56 -1.49 1.49 -1.64 0.00 0.00 178.16 177.09 1nd5 h GLU 1047N 0.06 0.32 0.03 1.82 4.22 -0.42 -2.81 114.58 117.81 1nd5 h GLU 1047Ca -0.00 -0.55 0.01 0.00 0.08 0.00 0.00 59.36 58.90 1nd5 h GLU 1047Cb 0.91 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 1nd5 h GLU 1047CO 0.07 1.22 -0.11 1.25 -2.18 0.00 0.00 179.01 179.26 1nd5 h LEU 1048N 0.09 -0.30 -1.52 1.64 6.46 -0.98 -1.10 115.31 119.60 1nd5 h LEU 1048Ca -0.23 0.04 -0.00 0.00 -0.12 0.00 0.00 57.88 57.57 1nd5 h LEU 1048Cb 2.04 0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 42.07 1nd5 h LEU 1048CO 0.19 -0.16 0.28 1.23 -0.62 0.00 0.00 178.44 179.36 1nd5 h GLY 1049N -0.20 0.64 2.00 3.75 0.00 -1.49 0.25 103.07 108.02 1nd5 h GLY 1049Ca 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1nd5 h GLY 1049CO -0.08 0.24 0.00 -2.09 0.00 0.00 0.00 176.54 174.61 1nd5 h GLU 1050N 0.61 0.00 0.07 4.80 4.81 -1.05 -1.55 114.58 122.27 1nd5 h GLU 1050Ca 0.16 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 59.04 1nd5 h GLU 1050Cb -0.04 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.31 1nd5 h GLU 1050CO -0.03 0.00 -2.00 0.98 -0.73 0.00 0.00 179.01 177.23 1nd5 n TYR 1051N -2.54 0.86 0.21 0.92 9.36 0.59 -3.73 117.16 122.82 1nd5 n TYR 1051Ca 0.01 0.23 0.07 0.00 3.32 0.00 0.00 57.90 61.53 1nd5 n TYR 1051Cb 0.22 -1.11 0.60 0.00 -0.63 0.00 0.00 39.34 38.42 1nd5 n TYR 1051CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 1nd5 h ILE 1052N -0.25 1.02 -0.36 2.97 2.04 -0.39 0.15 117.51 122.69 1nd5 h ILE 1052Ca -0.47 -0.04 -0.16 0.00 1.00 0.00 0.00 64.86 65.19 1nd5 h ILE 1052Cb 1.83 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 38.80 1nd5 h ILE 1052CO -0.05 0.02 -0.41 -0.09 0.00 0.00 0.00 178.15 177.62 1nd5 h ARG 1053N 0.12 0.91 -0.27 2.37 2.43 -1.45 -2.12 114.38 116.37 1nd5 h ARG 1053Ca 0.03 -0.50 -0.11 0.00 -0.81 0.00 0.00 59.98 58.59 1nd5 h ARG 1053Cb -0.01 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1nd5 h ARG 1053CO -0.01 1.15 -0.26 0.87 -1.51 0.00 0.00 179.97 180.21 1nd5 h LYS 1054N 0.72 0.66 0.00 0.20 1.57 -1.30 0.36 116.57 118.78 1nd5 h LYS 1054Ca 0.05 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.48 1nd5 h LYS 1054Cb 1.00 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 1nd5 h LYS 1054CO 0.10 0.95 -0.03 -0.09 -0.57 0.00 0.00 179.45 179.82 1nd5 h ARG 1055N 0.39 0.00 0.00 3.15 2.43 -0.69 -2.73 114.38 116.93 1nd5 h ARG 1055Ca 0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1nd5 h ARG 1055Cb 0.83 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 1nd5 h ARG 1055CO 0.07 0.03 -0.04 0.66 -1.51 0.00 0.00 179.97 179.17 1nd5 n TYR 1056N -3.43 0.00 -0.65 2.20 0.53 -0.80 -4.83 117.16 110.18 1nd5 n TYR 1056Ca -0.02 -0.74 0.50 0.00 -1.02 0.00 0.00 57.90 56.62 1nd5 n TYR 1056Cb 0.13 -0.11 0.79 0.00 -1.03 0.00 0.00 39.34 39.12 1nd5 n TYR 1056CO 0.00 0.00 0.00 2.89 -1.02 0.00 0.00 176.86 178.73 1nd5 n ARG 1057N -1.01 -0.01 -0.08 -0.72 1.85 0.12 -0.46 116.66 116.36 1nd5 n ARG 1057Ca 0.10 1.12 -0.13 0.00 -1.00 0.00 0.00 57.85 57.94 1nd5 n ARG 1057Cb 0.53 -2.49 -0.14 0.00 -1.05 0.00 0.00 32.46 29.31 1nd5 n ARG 1057CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1nd5 n LYS 1058N -4.10 0.68 -0.02 2.89 5.02 -1.26 -3.89 118.16 117.47 1nd5 n LYS 1058Ca 0.44 0.13 -0.12 0.00 -2.02 0.00 0.00 58.31 56.74 1nd5 n LYS 1058Cb 1.91 -1.61 -0.07 0.00 -0.02 0.00 0.00 35.03 35.24 1nd5 n LYS 1058CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1nd5 h PHE 1059N 0.01 0.15 -1.52 2.13 3.57 -1.13 -3.17 116.94 116.98 1nd5 h PHE 1059Ca -0.48 -0.02 -0.72 0.00 3.53 0.00 0.00 57.97 60.27 1nd5 h PHE 1059Cb 2.09 -0.04 -0.28 0.00 2.79 0.00 0.00 35.95 40.51 1nd5 h PHE 1059CO 0.02 0.36 0.95 1.28 -2.23 0.00 0.00 178.31 178.69 1nd5 n LEU 1060N -4.87 7.58 -0.71 0.59 7.99 -0.71 -4.75 117.00 122.13 1nd5 n LEU 1060Ca -0.06 -4.59 0.00 0.00 -0.01 0.00 0.00 56.01 51.35 1nd5 n LEU 1060Cb 0.17 -1.02 0.00 0.00 -0.11 0.00 0.00 43.42 42.46 1nd5 n LEU 1060CO 0.35 1.63 0.12 -0.46 -1.51 0.00 0.00 177.39 177.52 1nd5 n ASN 1061N -0.72 0.62 -3.80 -1.43 6.94 -1.20 -4.25 115.26 111.42 1nd5 n ASN 1061Ca 0.58 -0.68 -0.30 0.00 -0.02 0.00 0.00 54.58 54.16 1nd5 n ASN 1061Cb 0.44 -0.17 -0.15 0.00 -2.36 0.00 0.00 39.78 37.54 1nd5 n ASN 1061CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1nd5 s GLU 1062N -0.30 0.92 -0.59 -3.83 0.41 -1.26 -5.06 118.70 108.99 1nd5 s GLU 1062Ca 0.00 -1.19 -0.28 0.00 -0.41 0.00 0.00 54.97 53.09 1nd5 s GLU 1062Cb 0.00 -2.27 -0.11 0.00 -1.78 0.00 0.00 34.13 29.97 1nd5 s GLU 1062CO 0.00 -0.93 2.46 0.45 -0.49 0.00 0.00 175.26 176.75 1nd5 n SER 1063N 4.73 1.84 -1.10 -0.19 2.88 -1.26 -4.56 113.62 115.96 1nd5 n SER 1063Ca -0.02 -0.22 0.00 0.00 -1.33 0.00 0.00 58.87 57.30 1nd5 n SER 1063Cb 0.42 -1.39 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 1nd5 n SER 1063CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nd5 n TYR 1064N 13.82 -0.71 -3.19 0.66 9.36 -1.26 -5.08 117.16 130.77 1nd5 n TYR 1064Ca 0.44 0.38 0.05 0.00 3.32 0.00 0.00 57.90 62.09 1nd5 n TYR 1064Cb 0.38 -0.62 -0.03 0.00 -0.63 0.00 0.00 39.34 38.45 1nd5 n TYR 1064CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1nd5 s LYS 1065N -4.16 0.12 0.53 2.98 1.02 -1.26 -5.03 119.74 113.93 1nd5 s LYS 1065Ca 0.00 0.24 0.15 0.00 0.02 0.00 0.00 55.97 56.38 1nd5 s LYS 1065Cb 0.00 0.14 0.83 0.00 -0.52 0.00 0.00 37.83 38.28 1nd5 s LYS 1065CO 0.00 -0.09 1.41 1.12 -0.92 0.00 0.00 175.35 176.87 1nd5 h HIS 1066N 7.67 0.00 0.00 3.18 2.07 -1.98 0.29 115.15 126.38 1nd5 h HIS 1066Ca -0.13 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 57.23 1nd5 h HIS 1066Cb 1.15 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.11 1nd5 h HIS 1066CO 0.13 0.00 -1.28 1.05 -3.07 0.00 0.00 177.93 174.76 1nd5 h GLU 1067N 0.00 0.00 0.03 5.12 9.09 -1.99 -3.39 114.58 123.44 1nd5 h GLU 1067Ca 0.00 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.16 1nd5 h GLU 1067Cb 1.04 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.11 1nd5 h GLU 1067CO 0.00 0.35 -1.38 1.96 0.05 0.00 0.00 179.01 179.99 1nd5 h GLN 1068N 0.00 0.07 -6.31 1.06 4.20 -0.76 -3.36 115.11 110.00 1nd5 h GLN 1068Ca -0.14 -0.12 -0.66 0.00 0.06 0.00 0.00 58.65 57.78 1nd5 h GLN 1068Cb 1.58 0.04 -0.15 0.00 0.30 0.00 0.00 27.48 29.26 1nd5 h GLN 1068CO 0.05 1.06 -0.68 0.08 -0.67 0.00 0.00 178.83 178.67 1nd5 s VAL 1069N -2.41 3.83 -0.03 -0.54 1.01 -0.78 0.85 120.40 122.33 1nd5 s VAL 1069Ca -0.27 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 1nd5 s VAL 1069Cb 0.06 -2.74 0.03 0.00 0.00 0.00 0.00 36.38 33.73 1nd5 s VAL 1069CO 0.64 0.27 0.06 -0.47 0.00 0.00 0.00 175.10 175.61 1nd5 s TYR 1070N -1.14 -0.03 -0.17 5.22 5.04 -1.09 -4.55 117.35 120.63 1nd5 s TYR 1070Ca 0.21 0.23 0.01 0.00 -2.44 0.00 0.00 57.07 55.07 1nd5 s TYR 1070Cb -0.11 -0.18 0.02 0.00 0.35 0.00 0.00 41.96 42.04 1nd5 s TYR 1070CO 0.12 -0.11 -0.17 0.42 -1.34 0.00 0.00 175.55 174.47 1nd5 s ILE 1071N 1.05 1.86 0.03 3.14 1.09 -1.26 -1.78 121.20 125.32 1nd5 s ILE 1071Ca -0.09 -0.85 0.06 0.00 -1.10 0.00 0.00 60.65 58.67 1nd5 s ILE 1071Cb -0.12 -1.72 -0.03 0.00 -1.06 0.00 0.00 42.46 39.53 1nd5 s ILE 1071CO -0.04 0.47 -0.14 -0.60 -0.10 0.00 0.00 174.94 174.53 1nd5 s ARG 1072N 1.36 2.23 0.10 2.79 3.52 -0.05 -0.39 118.95 128.51 1nd5 s ARG 1072Ca 0.04 -0.90 -0.01 0.00 -0.13 0.00 0.00 55.73 54.74 1nd5 s ARG 1072Cb -0.13 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.92 1nd5 s ARG 1072CO -0.12 0.56 0.01 0.45 -0.81 0.00 0.00 175.30 175.39 1nd5 s SER 1073N -1.48 0.54 0.71 -2.12 0.15 -0.01 -0.86 113.70 110.62 1nd5 s SER 1073Ca 0.16 -1.10 -0.11 0.00 0.70 0.00 0.00 55.95 55.59 1nd5 s SER 1073Cb -0.11 0.22 0.02 0.00 -1.71 0.00 0.00 66.02 64.44 1nd5 s SER 1073CO 0.07 -0.64 1.07 0.42 1.20 0.00 0.00 173.24 175.36 1nd5 s THR 1074N -3.92 3.82 -1.31 6.45 -4.23 -0.99 -3.92 115.64 111.53 1nd5 s THR 1074Ca 0.16 0.59 -0.12 0.00 -1.18 0.00 0.00 61.69 61.14 1nd5 s THR 1074Cb 0.07 -3.43 0.13 0.00 1.34 0.00 0.00 72.50 70.61 1nd5 s THR 1074CO -0.03 -0.77 1.87 -0.67 -0.54 0.00 0.00 174.62 174.48 1nd5 n ASP 1075N -3.11 4.80 -3.78 3.99 2.03 -1.22 -4.40 116.55 114.86 1nd5 n ASP 1075Ca 0.07 -3.00 -0.14 0.00 0.52 0.00 0.00 54.79 52.24 1nd5 n ASP 1075Cb 0.55 -1.57 -0.15 0.00 -0.72 0.00 0.00 41.12 39.23 1nd5 n ASP 1075CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1nd5 s VAL 1076N 1.69 -0.04 0.12 5.18 1.01 -1.26 -4.74 120.40 122.36 1nd5 s VAL 1076Ca 0.43 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 62.28 1nd5 s VAL 1076Cb 0.08 -0.13 -0.07 0.00 0.00 0.00 0.00 36.38 36.26 1nd5 s VAL 1076CO -0.01 0.06 1.60 0.44 0.00 0.00 0.00 175.10 177.19 1nd5 h ASP 1077N 6.96 -1.15 -0.95 3.32 3.45 -1.91 0.91 116.42 127.06 1nd5 h ASP 1077Ca -0.40 0.14 0.20 0.00 0.43 0.00 0.00 57.03 57.41 1nd5 h ASP 1077Cb 1.15 0.45 -0.08 0.00 -0.56 0.00 0.00 39.33 40.29 1nd5 h ASP 1077CO 0.46 -0.43 0.61 -0.09 -1.57 0.00 0.00 179.24 178.22 1nd5 h ARG 1078N -0.54 0.54 0.18 3.56 2.43 -1.96 0.61 114.38 119.20 1nd5 h ARG 1078Ca 0.05 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1nd5 h ARG 1078Cb 0.62 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1nd5 h ARG 1078CO -0.30 0.36 -0.08 1.79 -1.51 0.00 0.00 179.97 180.23 1nd5 h THR 1079N 0.56 0.45 -0.77 0.20 1.35 -1.69 -2.60 112.91 110.42 1nd5 h THR 1079Ca 0.52 -1.05 0.18 0.00 -0.55 0.00 0.00 66.41 65.51 1nd5 h THR 1079Cb 1.06 0.78 -0.13 0.00 -1.73 0.00 0.00 68.15 68.14 1nd5 h THR 1079CO -0.26 0.13 0.09 -0.07 -0.25 0.00 0.00 175.52 175.17 1nd5 h LEU 1080N -1.00 -0.18 -0.91 3.87 3.38 -0.24 0.07 115.31 120.29 1nd5 h LEU 1080Ca -0.02 0.18 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 1nd5 h LEU 1080Cb 0.39 0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1nd5 h LEU 1080CO 0.04 -0.13 0.23 0.24 0.09 0.00 0.00 178.44 178.91 1nd5 h MET 1081N 0.17 1.03 0.10 1.13 2.86 0.14 -2.21 114.93 118.15 1nd5 h MET 1081Ca 0.43 -0.20 -0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1nd5 h MET 1081Cb 0.78 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.28 1nd5 h MET 1081CO -0.61 0.87 -0.05 0.77 1.06 0.00 0.00 176.91 178.94 1nd5 h SER 1082N 1.00 -0.12 -0.64 1.22 0.02 -0.60 -0.87 113.55 113.57 1nd5 h SER 1082Ca 0.23 -0.04 0.12 0.00 -0.84 0.00 0.00 61.79 61.26 1nd5 h SER 1082Cb 0.25 0.03 -0.09 0.00 0.14 0.00 0.00 62.40 62.73 1nd5 h SER 1082CO -0.01 -0.04 0.14 0.00 -1.14 0.00 0.00 176.83 175.77 1nd5 h ALA 1083N 0.71 0.76 0.18 3.77 0.00 -1.12 0.25 119.26 123.82 1nd5 h ALA 1083Ca -0.01 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1nd5 h ALA 1083Cb 0.15 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1nd5 h ALA 1083CO 0.02 -0.31 -0.09 0.52 0.00 0.00 0.00 179.25 179.39 1nd5 h MET 1084N 0.26 -0.23 -0.96 0.00 2.86 -1.09 -0.84 114.93 114.93 1nd5 h MET 1084Ca 0.34 0.02 0.10 0.00 -2.06 0.00 0.00 59.70 58.09 1nd5 h MET 1084Cb 0.52 0.05 -0.07 0.00 0.06 0.00 0.00 31.60 32.17 1nd5 h MET 1084CO -0.43 -0.04 0.61 1.15 1.06 0.00 0.00 176.91 179.26 1nd5 h THR 1085N -0.38 0.98 0.77 2.22 2.02 -0.62 -0.72 112.91 117.19 1nd5 h THR 1085Ca -0.02 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 66.78 1nd5 h THR 1085Cb 0.30 -0.10 0.01 0.00 -1.74 0.00 0.00 68.15 66.62 1nd5 h THR 1085CO 0.04 0.18 -0.37 -1.13 0.37 0.00 0.00 175.52 174.61 1nd5 h ASN 1086N 0.99 -0.88 -0.02 4.18 -0.73 -0.19 -2.70 115.58 116.23 1nd5 h ASN 1086Ca 0.45 0.02 0.01 0.00 1.87 0.00 0.00 56.30 58.64 1nd5 h ASN 1086Cb 0.38 0.23 -0.00 0.00 0.27 0.00 0.00 38.32 39.20 1nd5 h ASN 1086CO -0.20 -0.60 0.02 -0.07 -0.37 0.00 0.00 177.43 176.21 1nd5 h LEU 1087N -1.09 0.00 -2.05 0.34 3.38 -0.76 0.47 115.31 115.60 1nd5 h LEU 1087Ca -0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1nd5 h LEU 1087Cb 0.81 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1nd5 h LEU 1087CO 0.17 0.00 -0.05 0.00 0.09 0.00 0.00 178.44 178.65 1nd5 h ALA 1088N 1.98 1.11 0.01 1.53 0.00 -0.82 0.11 119.26 123.18 1nd5 h ALA 1088Ca 0.01 -0.05 -0.40 0.00 0.00 0.00 0.00 54.91 54.47 1nd5 h ALA 1088Cb 0.05 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1nd5 h ALA 1088CO -0.00 0.07 -2.25 0.00 0.00 0.00 0.00 179.25 177.07 1nd5 n ALA 1089N -2.16 1.15 0.37 0.00 0.00 0.12 -4.17 120.51 115.82 1nd5 n ALA 1089Ca -0.01 -0.95 -0.19 0.00 0.00 0.00 0.00 53.44 52.29 1nd5 n ALA 1089Cb 0.22 -0.12 -0.10 0.00 0.00 0.00 0.00 19.45 19.45 1nd5 n ALA 1089CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1nd5 h LEU 1090N -0.68 -1.26 -6.79 0.00 6.46 -0.15 -3.35 115.31 109.55 1nd5 h LEU 1090Ca -0.59 0.08 -0.69 0.00 -0.12 0.00 0.00 57.88 56.56 1nd5 h LEU 1090Cb 1.66 0.39 -0.36 0.00 -0.73 0.00 0.00 40.66 41.62 1nd5 h LEU 1090CO -0.27 -0.71 -0.03 0.49 -0.62 0.00 0.00 178.44 177.31 1nd5 n PHE 1091N -5.59 3.44 -2.31 1.25 3.01 0.37 -4.82 117.46 112.80 1nd5 n PHE 1091Ca -0.14 -3.70 -0.42 0.00 1.01 0.00 0.00 57.45 54.20 1nd5 n PHE 1091Cb 0.48 -0.95 -0.03 0.00 -0.01 0.00 0.00 39.48 38.97 1nd5 n PHE 1091CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1nd5 s PRO 1092N -2.19 4.40 0.21 -1.08 0.04 -1.26 -4.76 135.00 130.36 1nd5 s PRO 1092Ca 0.33 1.92 -0.31 0.00 0.04 0.00 0.00 61.00 62.98 1nd5 s PRO 1092Cb 0.04 -3.28 -0.10 0.00 0.04 0.00 0.00 34.50 31.20 1nd5 s PRO 1092CO -0.02 -0.29 1.52 -1.25 0.04 0.00 0.00 177.00 177.00 1nd5 s PRO 1093N 0.77 4.23 0.20 0.56 0.04 -1.26 -5.00 135.00 134.53 1nd5 s PRO 1093Ca 0.60 2.36 -0.16 0.00 0.04 0.00 0.00 61.00 63.83 1nd5 s PRO 1093Cb -0.33 -3.13 0.02 0.00 0.04 0.00 0.00 34.50 31.10 1nd5 s PRO 1093CO 0.31 -0.54 0.50 -1.83 0.04 0.00 0.00 177.00 175.49 1nd5 s GLU 1094N 0.43 1.39 6.74 4.56 -1.05 -1.24 -4.83 118.70 124.69 1nd5 s GLU 1094Ca 0.65 -0.93 0.00 0.00 -0.15 0.00 0.00 54.97 54.54 1nd5 s GLU 1094Cb -0.43 0.50 0.00 0.00 -0.44 0.00 0.00 34.13 33.76 1nd5 s GLU 1094CO 0.37 -0.58 0.00 0.41 0.95 0.00 0.00 175.26 176.41 1nd5 n GLY 1095N -0.33 1.93 0.16 -3.83 0.00 -1.26 -2.73 105.19 99.12 1nd5 n GLY 1095Ca -0.09 -0.43 0.13 0.00 0.00 0.00 0.00 46.02 45.63 1nd5 n GLY 1095CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nd5 h VAL 1096N 0.00 0.00 -2.15 1.61 2.07 -2.04 -3.32 116.25 112.42 1nd5 h VAL 1096Ca 0.00 -0.41 -0.78 0.00 0.82 0.00 0.00 66.70 66.33 1nd5 h VAL 1096Cb 0.00 1.28 -0.28 0.00 -1.52 0.00 0.00 31.29 30.77 1nd5 h VAL 1096CO 0.00 0.00 0.90 -1.54 0.02 0.00 0.00 177.57 176.95 1nd5 n SER 1097N -2.47 7.18 -3.10 0.57 3.41 -1.11 -4.71 113.62 113.39 1nd5 n SER 1097Ca 0.03 -3.74 -0.24 0.00 -0.26 0.00 0.00 58.87 54.66 1nd5 n SER 1097Cb 0.32 -1.08 -0.05 0.00 -0.26 0.00 0.00 64.21 63.15 1nd5 n SER 1097CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1nd5 n ILE 1098N -0.24 1.73 -0.50 -1.33 5.41 -1.25 -3.68 119.36 119.50 1nd5 n ILE 1098Ca 0.48 -5.12 0.41 0.00 1.00 0.00 0.00 62.75 59.52 1nd5 n ILE 1098Cb 0.27 -1.21 0.69 0.00 -0.71 0.00 0.00 39.64 38.69 1nd5 n ILE 1098CO 0.00 0.00 0.00 4.11 0.00 0.00 0.00 176.55 180.66 1nd5 h TRP 1099N 3.23 0.44 -3.18 1.39 5.08 -1.91 -3.35 115.95 117.65 1nd5 h TRP 1099Ca 0.13 0.02 -0.54 0.00 1.08 0.00 0.00 58.89 59.58 1nd5 h TRP 1099Cb 0.69 -0.10 -0.37 0.00 -3.00 0.00 0.00 29.16 26.38 1nd5 h TRP 1099CO 0.67 -0.22 -0.81 1.21 -1.28 0.00 0.00 178.44 178.01 1nd5 s ASN 1100N -4.29 2.28 0.00 0.11 2.47 -1.26 -5.01 114.94 109.23 1nd5 s ASN 1100Ca -0.07 -0.34 0.30 0.00 0.42 0.00 0.00 52.86 53.17 1nd5 s ASN 1100Cb 0.30 -0.89 1.56 0.00 -1.45 0.00 0.00 41.25 40.78 1nd5 s ASN 1100CO 0.83 -0.11 2.07 -2.65 -3.72 0.00 0.00 177.10 173.52 1nd5 n PRO 1101N 4.92 0.49 -0.06 0.43 -0.02 -1.26 -3.48 135.00 136.02 1nd5 n PRO 1101Ca -0.13 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.27 1nd5 n PRO 1101Cb 0.50 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.33 1nd5 n PRO 1101CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1nd5 n ILE 1102N -1.26 1.38 -4.00 4.25 2.08 -1.26 -4.83 119.36 115.72 1nd5 n ILE 1102Ca 0.15 -0.81 -0.31 0.00 0.56 0.00 0.00 62.75 62.34 1nd5 n ILE 1102Cb 0.23 -0.63 -0.16 0.00 -0.75 0.00 0.00 39.64 38.32 1nd5 n ILE 1102CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1nd5 s LEU 1103N -5.65 2.26 -1.38 1.39 2.96 -1.23 -5.03 118.68 112.00 1nd5 s LEU 1103Ca -0.08 -0.87 -0.07 0.00 -0.22 0.00 0.00 54.13 52.90 1nd5 s LEU 1103Cb 0.07 -1.24 0.08 0.00 0.50 0.00 0.00 46.19 45.61 1nd5 s LEU 1103CO 0.83 -0.14 2.42 0.18 -1.32 0.00 0.00 176.35 178.33 1nd5 n LEU 1104N 4.68 7.98 -3.97 -0.68 4.77 -1.26 -4.61 117.00 123.91 1nd5 n LEU 1104Ca -0.15 -4.74 -0.09 0.00 -0.03 0.00 0.00 56.01 51.00 1nd5 n LEU 1104Cb 0.47 -1.42 -0.11 0.00 -2.33 0.00 0.00 43.42 40.03 1nd5 n LEU 1104CO 0.20 1.95 -0.35 0.86 -1.33 0.00 0.00 177.39 178.73 1nd5 s TRP 1105N -0.21 0.24 -0.01 -1.77 -0.00 -1.26 -4.31 118.94 111.62 1nd5 s TRP 1105Ca 0.55 -0.49 0.01 0.00 -0.00 0.00 0.00 56.10 56.16 1nd5 s TRP 1105Cb 0.17 -0.18 0.00 0.00 -0.00 0.00 0.00 33.47 33.46 1nd5 s TRP 1105CO -0.08 -0.20 -0.03 1.14 -0.00 0.00 0.00 176.95 177.79 1nd5 s GLN 1106N -1.44 0.31 0.25 5.86 -2.07 -1.26 -4.84 119.66 116.47 1nd5 s GLN 1106Ca -0.16 -0.11 -0.30 0.00 -1.82 0.00 0.00 55.36 52.97 1nd5 s GLN 1106Cb -0.10 -0.32 -0.09 0.00 -1.09 0.00 0.00 33.01 31.41 1nd5 s GLN 1106CO -0.01 0.06 1.28 -1.25 -1.32 0.00 0.00 175.29 174.05 1nd5 s PRO 1107N 0.03 4.41 -0.02 9.60 0.04 -1.26 -4.96 135.00 142.84 1nd5 s PRO 1107Ca 0.00 2.07 0.01 0.00 0.04 0.00 0.00 61.00 63.13 1nd5 s PRO 1107Cb -0.03 -3.16 0.01 0.00 0.04 0.00 0.00 34.50 31.36 1nd5 s PRO 1107CO -0.00 -0.18 -0.05 0.42 0.04 0.00 0.00 177.00 177.23 1nd5 s ILE 1108N -0.39 0.46 0.45 0.56 1.01 -1.26 -5.14 121.20 116.88 1nd5 s ILE 1108Ca 0.53 -0.18 -0.22 0.00 0.00 0.00 0.00 60.65 60.78 1nd5 s ILE 1108Cb -0.37 -0.44 -0.08 0.00 0.01 0.00 0.00 42.46 41.58 1nd5 s ILE 1108CO 0.43 0.16 1.08 -2.16 0.00 0.00 0.00 174.94 174.45 1nd5 s PRO 1109N 0.32 3.90 -0.17 2.79 0.04 -1.26 -5.01 135.00 135.61 1nd5 s PRO 1109Ca -0.04 1.55 -0.02 0.00 0.04 0.00 0.00 61.00 62.54 1nd5 s PRO 1109Cb -0.08 -2.35 0.05 0.00 0.04 0.00 0.00 34.50 32.16 1nd5 s PRO 1109CO -0.00 -0.38 0.01 0.08 0.04 0.00 0.00 177.00 176.75 1nd5 s VAL 1110N -1.72 0.68 0.08 -0.36 1.01 -1.26 -4.43 120.40 114.40 1nd5 s VAL 1110Ca 0.63 -0.51 -0.21 0.00 0.00 0.00 0.00 61.98 61.88 1nd5 s VAL 1110Cb -0.22 -1.05 -0.07 0.00 0.00 0.00 0.00 36.38 35.03 1nd5 s VAL 1110CO 0.27 -0.07 0.63 -1.00 0.00 0.00 0.00 175.10 174.94 1nd5 s HIS 1111N 1.80 3.80 0.24 5.22 3.76 0.48 -4.90 115.29 125.69 1nd5 s HIS 1111Ca -0.00 1.36 0.03 0.00 -0.15 0.00 0.00 55.06 56.30 1nd5 s HIS 1111Cb -0.16 -2.60 -0.01 0.00 1.11 0.00 0.00 32.58 30.92 1nd5 s HIS 1111CO -0.07 0.51 0.11 -2.37 -0.85 0.00 0.00 174.74 172.07 1nd5 n THR 1112N 1.95 0.00 -3.78 1.30 5.66 -1.26 -0.83 114.28 117.32 1nd5 n THR 1112Ca -0.08 -1.47 -0.13 0.00 -3.05 0.00 0.00 64.05 59.32 1nd5 n THR 1112Cb 0.50 0.59 -0.11 0.00 -1.55 0.00 0.00 70.33 69.75 1nd5 n THR 1112CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1nd5 s VAL 1113N -2.58 -0.00 0.23 1.08 1.01 -1.25 -4.97 120.40 113.90 1nd5 s VAL 1113Ca 0.16 0.01 -0.32 0.00 0.00 0.00 0.00 61.98 61.83 1nd5 s VAL 1113Cb 0.01 -0.38 -0.12 0.00 0.00 0.00 0.00 36.38 35.88 1nd5 s VAL 1113CO 0.11 0.00 1.63 -0.81 0.00 0.00 0.00 175.10 176.04 1nd5 n PRO 1114N 3.04 2.58 -0.35 2.72 -0.04 -1.26 -3.40 135.00 138.28 1nd5 n PRO 1114Ca -0.14 0.92 -0.09 0.00 -0.04 0.00 0.00 63.50 64.16 1nd5 n PRO 1114Cb 0.58 -2.72 -0.08 0.00 -0.04 0.00 0.00 33.50 31.23 1nd5 n PRO 1114CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1nd5 n LEU 1115N 3.18 -0.88 0.20 1.53 4.77 -1.26 -0.50 117.00 124.04 1nd5 n LEU 1115Ca 0.14 1.54 0.08 0.00 -0.03 0.00 0.00 56.01 57.74 1nd5 n LEU 1115Cb 0.34 -0.22 0.45 0.00 -2.33 0.00 0.00 43.42 41.66 1nd5 n LEU 1115CO 0.64 -1.24 0.86 0.77 -1.33 0.00 0.00 177.39 177.09 1nd5 h SER 1116N 0.00 0.00 0.00 -1.43 4.64 -2.00 -0.45 113.55 114.30 1nd5 h SER 1116Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1nd5 h SER 1116Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1nd5 h SER 1116CO -0.78 0.00 -1.22 -0.62 -0.87 0.00 0.00 176.83 173.33 1nd5 n GLU 1117N -2.22 1.28 -1.68 4.77 1.02 0.35 -4.99 120.64 119.16 1nd5 n GLU 1117Ca -0.01 -0.07 -0.48 0.00 -0.02 0.00 0.00 57.16 56.57 1nd5 n GLU 1117Cb 0.33 -1.21 -0.05 0.00 -0.02 0.00 0.00 31.44 30.49 1nd5 n GLU 1117CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1nd5 n ASP 1118N -1.71 3.47 -0.68 1.62 4.64 -0.18 -4.87 116.55 118.84 1nd5 n ASP 1118Ca -0.01 0.97 0.04 0.00 -1.38 0.00 0.00 54.79 54.41 1nd5 n ASP 1118Cb 0.27 -1.38 0.20 0.00 -1.04 0.00 0.00 41.12 39.18 1nd5 n ASP 1118CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1nd5 n GLN 1119N 6.67 1.65 0.00 -0.67 6.02 -1.26 -4.74 117.38 125.05 1nd5 n GLN 1119Ca 0.23 -3.20 0.00 0.00 -0.01 0.00 0.00 57.00 54.02 1nd5 n GLN 1119Cb 0.30 -1.66 0.00 0.00 1.02 0.00 0.00 30.24 29.90 1nd5 n GLN 1119CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1nd5 n LEU 1120N -1.14 0.00 -0.04 1.08 7.94 -1.26 -4.90 117.00 118.67 1nd5 n LEU 1120Ca 0.22 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 55.09 1nd5 n LEU 1120Cb 0.77 0.08 -0.10 0.00 0.53 0.00 0.00 43.42 44.70 1nd5 n LEU 1120CO 0.02 -0.44 -0.83 0.18 -1.11 0.00 0.00 177.39 175.22 1nd5 n LEU 1121N -2.37 0.00 -3.77 -1.96 4.77 -1.26 -4.56 117.00 107.84 1nd5 n LEU 1121Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1nd5 n LEU 1121Cb 0.00 0.22 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 1nd5 n LEU 1121CO 0.00 0.22 2.53 0.00 -1.33 0.00 0.00 177.39 178.81 1nd5 n TYR 1122N -2.31 3.30 -3.24 -1.77 4.19 -1.26 -4.63 117.16 111.43 1nd5 n TYR 1122Ca -0.15 -2.74 -0.33 0.00 3.31 0.00 0.00 57.90 57.99 1nd5 n TYR 1122Cb 0.74 -2.41 -0.06 0.00 0.49 0.00 0.00 39.34 38.10 1nd5 n TYR 1122CO 0.00 0.00 0.00 -0.51 0.91 0.00 0.00 176.86 177.26 1nd5 s LEU 1123N 2.24 4.16 0.12 2.98 1.43 -1.26 -4.04 118.68 124.31 1nd5 s LEU 1123Ca 0.50 1.17 -0.27 0.00 -1.03 0.00 0.00 54.13 54.49 1nd5 s LEU 1123Cb 0.13 -3.80 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 1nd5 s LEU 1123CO -0.04 -0.10 0.86 -2.16 0.23 0.00 0.00 176.35 175.14 1nd5 s PRO 1124N -2.69 4.63 0.30 1.29 0.04 -1.26 -4.57 135.00 132.75 1nd5 s PRO 1124Ca 0.49 1.28 -0.29 0.00 0.04 0.00 0.00 61.00 62.51 1nd5 s PRO 1124Cb -0.12 -3.33 -0.11 0.00 0.04 0.00 0.00 34.50 30.98 1nd5 s PRO 1124CO 0.19 0.35 1.47 -0.06 0.04 0.00 0.00 177.00 178.99 1nd5 s PHE 1125N -0.43 2.86 -0.01 0.56 0.08 -1.26 -4.90 117.98 114.88 1nd5 s PHE 1125Ca 0.41 1.07 0.02 0.00 0.12 0.00 0.00 56.93 58.54 1nd5 s PHE 1125Cb -0.23 -3.90 0.02 0.00 -0.57 0.00 0.00 43.02 38.34 1nd5 s PHE 1125CO 0.27 -2.83 0.97 0.54 -0.10 0.00 0.00 175.22 174.07 1nd5 n ARG 1126N 1.60 2.54 -1.59 0.44 1.74 -1.26 -4.63 116.66 115.49 1nd5 n ARG 1126Ca 0.05 -1.49 -0.36 0.00 -0.77 0.00 0.00 57.85 55.28 1nd5 n ARG 1126Cb 0.40 -0.99 0.05 0.00 -1.02 0.00 0.00 32.46 30.89 1nd5 n ARG 1126CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1nd5 n ASN 1127N -0.53 7.45 -3.51 0.55 2.04 -1.26 -4.78 115.26 115.23 1nd5 n ASN 1127Ca 0.01 -3.72 -0.29 0.00 -0.44 0.00 0.00 54.58 50.14 1nd5 n ASN 1127Cb 0.31 -1.05 -0.12 0.00 -2.53 0.00 0.00 39.78 36.39 1nd5 n ASN 1127CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1nd5 n PRO 1129N 3.96 -0.14 -0.50 0.00 -0.02 -1.19 -2.75 135.00 134.36 1nd5 n PRO 1129Ca 0.11 1.36 -0.05 0.00 -2.02 0.00 0.00 63.50 62.90 1nd5 n PRO 1129Cb 0.37 -2.02 -0.08 0.00 -0.02 0.00 0.00 33.50 31.75 1nd5 n PRO 1129CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1nd5 n ARG 1130N -5.36 1.00 0.00 -0.52 3.00 0.14 -1.41 116.66 113.52 1nd5 n ARG 1130Ca 0.12 -0.44 0.00 0.00 -0.00 0.00 0.00 57.85 57.52 1nd5 n ARG 1130Cb 0.40 -1.66 0.00 0.00 0.00 0.00 0.00 32.46 31.19 1nd5 n ARG 1130CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1nd5 n GLN 1131N 2.51 0.00 0.05 -0.14 1.13 -1.11 -2.17 117.38 117.65 1nd5 n GLN 1131Ca 0.19 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 55.14 1nd5 n GLN 1131Cb 0.47 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.77 1nd5 n GLN 1131CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1nd5 h GLU 1132N 0.00 -0.28 -1.02 -1.09 5.08 -1.51 0.57 114.58 116.33 1nd5 h GLU 1132Ca 0.00 0.02 0.26 0.00 -1.00 0.00 0.00 59.36 58.64 1nd5 h GLU 1132Cb 0.00 0.06 -0.12 0.00 0.50 0.00 0.00 28.75 29.20 1nd5 h GLU 1132CO 0.00 -0.19 0.62 -0.07 -1.00 0.00 0.00 179.01 178.38 1nd5 h LEU 1133N -0.29 0.60 0.91 1.33 3.38 -1.71 0.22 115.31 119.76 1nd5 h LEU 1133Ca 0.06 0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 1nd5 h LEU 1133Cb 0.37 0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.16 1nd5 h LEU 1133CO -0.19 0.09 -0.44 -0.08 0.09 0.00 0.00 178.44 177.91 1nd5 h GLU 1134N 0.52 -1.18 -0.72 1.13 4.81 -1.22 -1.80 114.58 116.11 1nd5 h GLU 1134Ca 0.64 0.08 0.14 0.00 -0.13 0.00 0.00 59.36 60.09 1nd5 h GLU 1134Cb 1.34 0.27 -0.14 0.00 0.63 0.00 0.00 28.75 30.85 1nd5 h GLU 1134CO -0.43 -0.79 -0.19 0.77 -0.73 0.00 0.00 179.01 177.65 1nd5 h SER 1135N -1.24 -0.69 -0.55 1.04 0.02 0.93 0.19 113.55 113.25 1nd5 h SER 1135Ca -0.13 0.22 0.09 0.00 -0.84 0.00 0.00 61.79 61.14 1nd5 h SER 1135Cb 0.94 0.45 -0.07 0.00 0.14 0.00 0.00 62.40 63.86 1nd5 h SER 1135CO 0.21 -0.24 0.14 -0.33 -1.14 0.00 0.00 176.83 175.47 1nd5 h GLU 1136N -0.00 0.28 -0.96 3.45 5.08 -0.53 -1.56 114.58 120.34 1nd5 h GLU 1136Ca 0.34 -0.02 0.18 0.00 -1.00 0.00 0.00 59.36 58.87 1nd5 h GLU 1136Cb 0.53 -0.06 -0.10 0.00 0.50 0.00 0.00 28.75 29.61 1nd5 h GLU 1136CO -0.74 0.19 0.55 1.15 -1.00 0.00 0.00 179.01 179.15 1nd5 h THR 1137N 0.29 0.70 -0.80 1.13 2.02 0.27 0.22 112.91 116.74 1nd5 h THR 1137Ca 0.28 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.22 1nd5 h THR 1137Cb 0.38 -0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 66.68 1nd5 h THR 1137CO -0.34 0.13 0.51 -0.07 0.37 0.00 0.00 175.52 176.13 1nd5 h LEU 1138N 0.71 0.93 0.00 2.58 -0.00 -1.07 -3.24 115.31 115.21 1nd5 h LEU 1138Ca 0.55 -0.03 0.00 0.00 -0.00 0.00 0.00 57.88 58.39 1nd5 h LEU 1138Cb 0.83 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 41.26 1nd5 h LEU 1138CO -0.38 0.69 0.00 0.29 -0.00 0.00 0.00 178.44 179.03 1nd5 n LYS 1139N -4.40 0.00 0.00 1.13 4.01 0.63 -4.64 118.16 114.88 1nd5 n LYS 1139Ca 0.09 0.16 0.00 0.00 -0.51 0.00 0.00 58.31 58.05 1nd5 n LYS 1139Cb 0.04 -0.93 0.00 0.00 -0.51 0.00 0.00 35.03 33.63 1nd5 n LYS 1139CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1nd5 n SER 1140N -0.98 0.00 0.24 4.39 3.41 -0.36 -4.55 113.62 115.77 1nd5 n SER 1140Ca 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.79 1nd5 n SER 1140Cb 0.00 0.00 0.83 0.00 -0.26 0.00 0.00 64.21 64.78 1nd5 n SER 1140CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1nd5 h GLU 1141N 0.00 0.00 -0.02 4.33 4.81 -1.88 -0.37 114.58 121.44 1nd5 h GLU 1141Ca 0.00 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1nd5 h GLU 1141Cb 0.00 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.33 1nd5 h GLU 1141CO 0.00 0.00 -0.24 1.49 -0.73 0.00 0.00 179.01 179.53 1nd5 h GLU 1142N 0.00 -0.35 -0.62 1.92 4.57 -1.90 0.51 114.58 118.71 1nd5 h GLU 1142Ca 0.08 0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.30 1nd5 h GLU 1142Cb 0.70 0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.33 1nd5 h GLU 1142CO -0.00 -0.23 0.41 0.35 -1.18 0.00 0.00 179.01 178.36 1nd5 h PHE 1143N -0.37 0.74 -0.50 0.92 3.57 -1.24 -2.54 116.94 117.51 1nd5 h PHE 1143Ca 0.07 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.46 1nd5 h PHE 1143Cb 0.46 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 1nd5 h PHE 1143CO -0.29 0.44 -0.19 1.96 -2.23 0.00 0.00 178.31 178.00 1nd5 h GLN 1144N 0.77 1.02 -0.20 1.11 1.08 -0.97 -1.73 115.11 116.19 1nd5 h GLN 1144Ca 0.24 -0.42 0.06 0.00 -1.45 0.00 0.00 58.65 57.08 1nd5 h GLN 1144Cb 0.02 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 1nd5 h GLN 1144CO -0.06 1.11 0.16 -0.22 -0.95 0.00 0.00 178.83 178.86 1nd5 h LYS 1145N 0.88 0.00 0.02 1.46 1.63 0.38 -0.28 116.57 120.67 1nd5 h LYS 1145Ca 0.12 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 59.78 1nd5 h LYS 1145Cb 0.77 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.39 1nd5 h LYS 1145CO 0.06 0.00 -0.72 0.00 -3.45 0.00 0.00 179.45 175.34 1nd5 h ARG 1146N 0.00 0.05 0.73 1.90 3.08 -1.43 -3.40 114.38 115.31 1nd5 h ARG 1146Ca 0.10 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1nd5 h ARG 1146Cb 0.41 0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.50 1nd5 h ARG 1146CO -0.00 1.04 -0.35 1.25 -1.07 0.00 0.00 179.97 180.84 1nd5 h LEU 1147N -0.87 -0.83 0.00 3.04 5.85 -1.00 -3.33 115.31 118.16 1nd5 h LEU 1147Ca -0.18 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1nd5 h LEU 1147Cb 1.26 0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.50 1nd5 h LEU 1147CO -0.06 -0.58 0.00 1.57 -0.34 0.00 0.00 178.44 179.02 1nd5 n HIS 1148N -4.70 0.00 0.14 1.25 -0.00 -0.14 0.18 115.22 111.95 1nd5 n HIS 1148Ca -0.12 0.00 0.19 0.00 0.46 0.00 0.00 57.72 58.25 1nd5 n HIS 1148Cb 0.39 -0.38 0.77 0.00 -0.12 0.00 0.00 29.99 30.65 1nd5 n HIS 1148CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1nd5 h PRO 1149N 0.00 0.00 -0.53 1.57 0.11 -1.80 0.90 132.00 132.24 1nd5 h PRO 1149Ca 0.00 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.99 1nd5 h PRO 1149Cb 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.04 1nd5 h PRO 1149CO 0.00 0.00 0.12 0.66 -0.21 0.00 0.00 178.00 178.57 1nd5 n TYR 1150N -3.64 1.81 -0.02 0.65 4.02 0.49 -4.63 117.16 115.83 1nd5 n TYR 1150Ca 0.05 -1.10 -0.13 0.00 -0.01 0.00 0.00 57.90 56.71 1nd5 n TYR 1150Cb 0.54 -0.54 -0.10 0.00 -0.02 0.00 0.00 39.34 39.21 1nd5 n TYR 1150CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1nd5 h LYS 1151N 2.38 -0.01 -0.16 -0.72 1.63 -0.86 -2.93 116.57 115.90 1nd5 h LYS 1151Ca 0.15 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.93 1nd5 h LYS 1151Cb 1.96 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.58 1nd5 h LYS 1151CO 0.52 0.57 0.01 0.22 -3.45 0.00 0.00 179.45 177.32 1nd5 h ASP 1152N -0.59 0.26 -0.53 4.20 3.58 -1.82 -2.89 116.42 118.63 1nd5 h ASP 1152Ca -0.00 -0.29 0.08 0.00 0.42 0.00 0.00 57.03 57.24 1nd5 h ASP 1152Cb 0.58 -0.07 -0.10 0.00 1.72 0.00 0.00 39.33 41.46 1nd5 h ASP 1152CO 0.00 0.49 -0.45 0.15 -2.88 0.00 0.00 179.24 176.54 1nd5 h PHE 1153N 0.03 -1.34 0.00 0.28 3.57 -1.86 -0.68 116.94 116.95 1nd5 h PHE 1153Ca 0.05 0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 1nd5 h PHE 1153Cb 0.34 0.66 -0.00 0.00 2.79 0.00 0.00 35.95 39.74 1nd5 h PHE 1153CO 0.03 -0.43 -0.17 -0.84 -2.23 0.00 0.00 178.31 174.67 1nd5 h ILE 1154N -0.26 0.94 0.03 1.41 3.07 -1.55 -2.43 117.51 118.72 1nd5 h ILE 1154Ca 0.16 -0.61 0.03 0.00 1.55 0.00 0.00 64.86 65.99 1nd5 h ILE 1154Cb 0.57 1.34 -0.04 0.00 -0.27 0.00 0.00 36.82 38.42 1nd5 h ILE 1154CO -0.66 0.16 -0.25 0.00 -1.05 0.00 0.00 178.15 176.36 1nd5 h ALA 1155N 1.83 -0.36 -0.07 0.16 0.00 -0.90 -1.41 119.26 118.52 1nd5 h ALA 1155Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1nd5 h ALA 1155Cb 0.33 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1nd5 h ALA 1155CO 0.02 -0.76 -0.03 1.79 0.00 0.00 0.00 179.25 180.28 1nd5 h THR 1156N -0.40 1.32 -0.94 0.00 1.35 -1.40 -3.20 112.91 109.63 1nd5 h THR 1156Ca 0.05 -1.01 0.29 0.00 -0.55 0.00 0.00 66.41 65.19 1nd5 h THR 1156Cb 0.47 1.85 -0.16 0.00 -1.73 0.00 0.00 68.15 68.58 1nd5 h THR 1156CO -0.20 0.28 0.28 0.25 -0.25 0.00 0.00 175.52 175.88 1nd5 h LEU 1157N -0.23 0.01 -2.54 3.87 5.85 -1.19 0.68 115.31 121.77 1nd5 h LEU 1157Ca 0.02 0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 1nd5 h LEU 1157Cb 0.46 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 41.79 1nd5 h LEU 1157CO 0.01 -0.25 -0.00 1.23 -0.34 0.00 0.00 178.44 179.09 1nd5 h GLY 1158N 0.14 0.00 0.70 3.75 0.00 -1.25 -1.58 103.07 104.83 1nd5 h GLY 1158Ca 0.64 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.97 1nd5 h GLY 1158CO -0.73 0.00 -0.73 1.17 0.00 0.00 0.00 176.54 176.26 1nd5 n LYS 1159N -3.71 0.07 -0.01 4.80 4.81 0.24 -3.00 118.16 121.35 1nd5 n LYS 1159Ca -0.03 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.46 1nd5 n LYS 1159Cb 0.08 -1.53 -0.13 0.00 0.02 0.00 0.00 35.03 33.47 1nd5 n LYS 1159CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1nd5 n LEU 1160N -1.62 0.23 -0.06 3.14 4.77 -0.67 -4.56 117.00 118.24 1nd5 n LEU 1160Ca 0.04 0.10 -0.21 0.00 -0.03 0.00 0.00 56.01 55.91 1nd5 n LEU 1160Cb 0.36 0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 41.45 1nd5 n LEU 1160CO 0.38 0.12 -0.97 -1.54 -1.33 0.00 0.00 177.39 174.06 1nd5 n SER 1161N -2.53 2.04 0.00 -1.43 3.41 -0.75 -4.79 113.62 109.58 1nd5 n SER 1161Ca -0.12 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1nd5 n SER 1161Cb 0.76 -0.75 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1nd5 n SER 1161CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nd5 n GLY 1162N 1.93 1.55 3.70 5.00 0.00 -1.16 -0.81 105.19 115.40 1nd5 n GLY 1162Ca -0.38 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 1nd5 n GLY 1162CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nd5 s LEU 1163N 0.00 4.32 -0.82 0.99 1.43 -1.25 -4.86 118.68 118.50 1nd5 s LEU 1163Ca 0.00 1.58 0.00 0.00 -1.03 0.00 0.00 54.13 54.69 1nd5 s LEU 1163Cb 0.00 -3.53 0.35 0.00 0.03 0.00 0.00 46.19 43.03 1nd5 s LEU 1163CO 0.00 -0.31 1.66 1.41 0.23 0.00 0.00 176.35 179.33 1nd5 n HIS 1164N 4.27 3.13 -3.77 0.29 8.25 -1.26 -4.54 115.22 121.59 1nd5 n HIS 1164Ca 0.06 -2.79 -0.13 0.00 -0.26 0.00 0.00 57.72 54.61 1nd5 n HIS 1164Cb 0.50 -0.94 -0.13 0.00 1.12 0.00 0.00 29.99 30.55 1nd5 n HIS 1164CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1nd5 s GLY 1165N -1.89 -0.13 0.00 -1.41 0.00 -1.26 -4.99 107.32 97.64 1nd5 s GLY 1165Ca 0.46 0.70 0.00 0.00 0.00 0.00 0.00 44.72 45.88 1nd5 s GLY 1165CO -0.23 0.78 0.51 -1.06 0.00 0.00 0.00 173.10 173.09 1nd5 n GLN 1166N 3.53 0.93 -1.73 2.90 3.00 -1.26 -4.82 117.38 119.92 1nd5 n GLN 1166Ca -0.18 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.42 1nd5 n GLN 1166Cb 0.56 -1.42 -0.03 0.00 0.00 0.00 0.00 30.24 29.35 1nd5 n GLN 1166CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1nd5 s ASP 1167N 0.02 5.03 0.17 1.08 2.15 -1.26 -4.89 116.67 118.97 1nd5 s ASP 1167Ca 0.00 1.14 -0.24 0.00 0.43 0.00 0.00 52.55 53.89 1nd5 s ASP 1167Cb 0.00 -2.51 0.07 0.00 -0.30 0.00 0.00 42.92 40.18 1nd5 s ASP 1167CO 0.00 -2.42 1.58 -0.07 -0.17 0.00 0.00 175.17 174.09 1nd5 h LEU 1168N 17.16 -1.35 -0.70 -1.34 3.38 -1.98 0.10 115.31 130.59 1nd5 h LEU 1168Ca -0.30 0.23 0.15 0.00 0.09 0.00 0.00 57.88 58.06 1nd5 h LEU 1168Cb 1.23 0.63 -0.12 0.00 0.09 0.00 0.00 40.66 42.49 1nd5 h LEU 1168CO 1.11 -0.33 0.05 0.15 0.09 0.00 0.00 178.44 179.51 1nd5 h PHE 1169N -0.21 0.04 -0.99 1.13 3.57 -1.93 0.22 116.94 118.77 1nd5 h PHE 1169Ca 0.20 0.05 0.09 0.00 3.53 0.00 0.00 57.97 61.83 1nd5 h PHE 1169Cb 0.56 0.09 -0.07 0.00 2.79 0.00 0.00 35.95 39.32 1nd5 h PHE 1169CO -0.67 -0.18 0.64 0.78 -2.23 0.00 0.00 178.31 176.65 1nd5 h GLY 1170N 0.15 1.54 0.74 2.40 0.00 -1.19 0.40 103.07 107.11 1nd5 h GLY 1170Ca 0.38 -0.45 0.04 0.00 0.00 0.00 0.00 47.33 47.30 1nd5 h GLY 1170CO -0.58 0.27 0.15 -2.22 0.00 0.00 0.00 176.54 174.15 1nd5 h ILE 1171N 1.09 0.93 0.57 2.60 1.08 -0.38 0.18 117.51 123.57 1nd5 h ILE 1171Ca 0.45 -0.11 -0.03 0.00 -0.39 0.00 0.00 64.86 64.79 1nd5 h ILE 1171Cb 0.30 0.59 0.01 0.00 -3.07 0.00 0.00 36.82 34.64 1nd5 h ILE 1171CO -0.20 0.06 -0.27 -0.25 -0.69 0.00 0.00 178.15 176.79 1nd5 h TRP 1172N 0.31 -0.71 -0.47 1.37 7.01 -0.93 0.12 115.95 122.65 1nd5 h TRP 1172Ca 0.16 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.13 1nd5 h TRP 1172Cb 0.11 0.23 -0.02 0.00 -2.10 0.00 0.00 29.16 27.38 1nd5 h TRP 1172CO -0.13 -0.40 0.24 0.66 -2.79 0.00 0.00 178.44 176.02 1nd5 h SER 1173N -1.15 0.61 -0.02 2.65 4.64 -0.23 -0.44 113.55 119.61 1nd5 h SER 1173Ca -0.08 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1nd5 h SER 1173Cb 0.62 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1nd5 h SER 1173CO 0.13 0.55 -0.17 0.29 -0.87 0.00 0.00 176.83 176.75 1nd5 n LYS 1174N -4.65 1.75 0.08 4.77 5.02 0.62 -4.47 118.16 121.29 1nd5 n LYS 1174Ca 0.01 -1.45 0.00 0.00 -2.02 0.00 0.00 58.31 54.86 1nd5 n LYS 1174Cb 0.10 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1nd5 n LYS 1174CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1nd5 n VAL 1175N 0.71 0.55 -0.14 -0.18 0.31 -0.56 -0.30 118.33 118.72 1nd5 n VAL 1175Ca 0.11 0.18 -0.08 0.00 -0.01 0.00 0.00 64.34 64.54 1nd5 n VAL 1175Cb 0.50 -0.99 0.00 0.00 -0.91 0.00 0.00 33.84 32.44 1nd5 n VAL 1175CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1nd5 h TYR 1176N 0.00 0.55 0.02 3.52 3.20 -0.75 -2.62 116.97 120.89 1nd5 h TYR 1176Ca 0.00 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1nd5 h TYR 1176Cb 0.00 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.09 1nd5 h TYR 1176CO 0.00 0.40 -0.01 0.22 -1.64 0.00 0.00 178.16 177.13 1nd5 h ASP 1177N 0.55 -0.02 -0.15 -2.11 3.58 -1.30 -0.54 116.42 116.42 1nd5 h ASP 1177Ca 0.15 -0.07 0.01 0.00 0.42 0.00 0.00 57.03 57.54 1nd5 h ASP 1177Cb 0.01 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 1nd5 h ASP 1177CO -0.03 0.06 0.06 -0.65 -2.88 0.00 0.00 179.24 175.80 1nd5 h PRO 1178N -0.10 0.14 -0.44 0.28 0.11 -1.77 0.10 132.00 130.32 1nd5 h PRO 1178Ca -0.00 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.14 1nd5 h PRO 1178Cb 0.09 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 31.13 1nd5 h PRO 1178CO 0.00 0.09 0.20 -0.07 -0.21 0.00 0.00 178.00 178.02 1nd5 h LEU 1179N 0.14 0.27 -0.11 2.35 3.38 -1.42 0.25 115.31 120.18 1nd5 h LEU 1179Ca 0.06 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1nd5 h LEU 1179Cb 0.02 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1nd5 h LEU 1179CO -0.05 0.20 0.05 0.22 0.09 0.00 0.00 178.44 178.95 1nd5 h TYR 1180N 0.41 0.16 0.07 1.13 3.20 -0.77 0.45 116.97 121.62 1nd5 h TYR 1180Ca 0.20 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.06 1nd5 h TYR 1180Cb 0.13 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1nd5 h TYR 1180CO -0.12 0.22 -0.08 0.00 -1.64 0.00 0.00 178.16 176.54 1nd5 h GLU 1182N -0.18 0.71 0.15 0.00 5.08 -0.38 -2.05 114.58 117.91 1nd5 h GLU 1182Ca 0.01 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1nd5 h GLU 1182Cb 0.18 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 1nd5 h GLU 1182CO -0.04 0.47 -0.33 1.03 -1.00 0.00 0.00 179.01 179.14 1nd5 h SER 1183N 0.74 -0.96 -0.40 1.42 0.87 0.55 0.81 113.55 116.58 1nd5 h SER 1183Ca 0.30 0.11 0.06 0.00 -1.23 0.00 0.00 61.79 61.03 1nd5 h SER 1183Cb 0.16 0.36 -0.09 0.00 -0.44 0.00 0.00 62.40 62.39 1nd5 h SER 1183CO -0.17 -0.43 -0.49 0.58 -0.53 0.00 0.00 176.83 175.80 1nd5 h VAL 1184N -0.58 0.06 0.00 2.23 2.07 -0.15 0.20 116.25 120.08 1nd5 h VAL 1184Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1nd5 h VAL 1184Cb 0.60 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1nd5 h VAL 1184CO -0.18 0.00 0.00 1.41 0.02 0.00 0.00 177.57 178.82 1nd5 n HIS 1185N -5.40 0.00 -1.16 1.57 8.25 -0.82 -4.85 115.22 112.81 1nd5 n HIS 1185Ca -0.02 -0.01 -0.06 0.00 -0.26 0.00 0.00 57.72 57.38 1nd5 n HIS 1185Cb 0.35 -0.09 -0.02 0.00 1.12 0.00 0.00 29.99 31.35 1nd5 n HIS 1185CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1nd5 n ASN 1186N 0.06 -5.67 -4.69 0.41 3.02 0.70 -4.95 115.26 104.14 1nd5 n ASN 1186Ca 0.00 0.14 -0.44 0.00 -0.03 0.00 0.00 54.58 54.25 1nd5 n ASN 1186Cb 0.23 -3.66 -0.02 0.00 -0.61 0.00 0.00 39.78 35.71 1nd5 n ASN 1186CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1nd5 n PHE 1187N -2.17 2.33 -1.68 3.10 3.72 0.18 -4.82 117.46 118.12 1nd5 n PHE 1187Ca -0.06 0.41 -0.49 0.00 -0.05 0.00 0.00 57.45 57.26 1nd5 n PHE 1187Cb 0.52 -2.49 -0.05 0.00 -0.94 0.00 0.00 39.48 36.52 1nd5 n PHE 1187CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 1nd5 n THR 1188N 1.78 0.50 -3.50 4.37 5.66 -1.26 -4.59 114.28 117.24 1nd5 n THR 1188Ca 0.10 -0.09 -0.33 0.00 -3.05 0.00 0.00 64.05 60.69 1nd5 n THR 1188Cb 0.33 -1.77 -0.05 0.00 -1.55 0.00 0.00 70.33 67.29 1nd5 n THR 1188CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1nd5 s LEU 1189N 3.74 4.24 0.16 1.09 2.96 -1.26 -5.04 118.68 124.58 1nd5 s LEU 1189Ca 0.92 0.83 -0.34 0.00 -0.22 0.00 0.00 54.13 55.33 1nd5 s LEU 1189Cb -0.74 -3.42 -0.13 0.00 0.50 0.00 0.00 46.19 42.39 1nd5 s LEU 1189CO 0.52 0.02 1.61 -0.81 -1.32 0.00 0.00 176.35 176.37 1nd5 n PRO 1190N 0.20 2.27 -0.62 0.98 -0.04 -1.26 -4.86 135.00 131.67 1nd5 n PRO 1190Ca -0.02 0.82 0.48 0.00 -0.04 0.00 0.00 63.50 64.74 1nd5 n PRO 1190Cb 0.52 -2.60 0.77 0.00 -0.04 0.00 0.00 33.50 32.15 1nd5 n PRO 1190CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1nd5 h SER 1191N 6.17 0.08 -0.35 3.54 4.64 -2.05 0.64 113.55 126.22 1nd5 h SER 1191Ca -0.45 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1nd5 h SER 1191Cb 1.24 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1nd5 h SER 1191CO 0.90 -0.11 0.00 -2.67 -0.87 0.00 0.00 176.83 174.09 1nd5 n TRP 1192N -4.26 0.57 -3.33 4.77 4.27 -1.26 -4.56 117.44 113.64 1nd5 n TRP 1192Ca 0.43 -0.26 -0.45 0.00 -3.89 0.00 0.00 57.50 53.33 1nd5 n TRP 1192Cb 1.85 -0.05 -0.00 0.00 -1.36 0.00 0.00 31.31 31.75 1nd5 n TRP 1192CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1nd5 s ALA 1193N -1.57 4.73 0.30 -1.67 0.00 0.22 -4.85 121.76 118.92 1nd5 s ALA 1193Ca 0.25 -3.84 -0.03 0.00 0.00 0.00 0.00 51.96 48.34 1nd5 s ALA 1193Cb 0.14 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 1nd5 s ALA 1193CO 0.15 -2.22 0.54 0.95 0.00 0.00 0.00 175.76 175.19 1nd5 s THR 1194N -1.20 5.07 0.46 0.00 -4.23 -1.26 -4.86 115.64 109.61 1nd5 s THR 1194Ca 0.31 -0.13 0.26 0.00 -1.18 0.00 0.00 61.69 60.95 1nd5 s THR 1194Cb -0.10 -3.77 0.46 0.00 1.34 0.00 0.00 72.50 70.43 1nd5 s THR 1194CO -0.08 -0.39 1.79 -0.08 -0.54 0.00 0.00 174.62 175.32 1nd5 h GLU 1195N 1.41 0.21 0.00 3.99 4.81 -1.99 1.93 114.58 124.95 1nd5 h GLU 1195Ca -0.48 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 58.61 1nd5 h GLU 1195Cb 1.20 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 1nd5 h GLU 1195CO 0.65 0.14 -0.60 0.22 -0.73 0.00 0.00 179.01 178.69 1nd5 h ASP 1196N 0.22 0.00 -0.07 1.04 3.58 -1.99 -2.14 116.42 117.06 1nd5 h ASP 1196Ca 0.58 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.95 1nd5 h ASP 1196Cb 1.82 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.88 1nd5 h ASP 1196CO -0.18 0.60 -0.28 0.74 -2.88 0.00 0.00 179.24 177.24 1nd5 h THR 1197N 0.00 1.42 -0.66 2.25 2.02 0.25 -1.91 112.91 116.28 1nd5 h THR 1197Ca -0.01 -1.68 0.03 0.00 0.77 0.00 0.00 66.41 65.53 1nd5 h THR 1197Cb 1.36 2.31 -0.04 0.00 -1.74 0.00 0.00 68.15 70.03 1nd5 h THR 1197CO 0.08 0.48 0.41 0.24 0.37 0.00 0.00 175.52 177.10 1nd5 h MET 1198N -0.17 0.77 -0.75 6.66 2.86 -0.42 -1.44 114.93 122.45 1nd5 h MET 1198Ca -0.02 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 1nd5 h MET 1198Cb 0.93 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 32.38 1nd5 h MET 1198CO 0.06 0.51 0.23 1.15 1.06 0.00 0.00 176.91 179.92 1nd5 h THR 1199N 0.80 1.26 -0.55 2.22 2.02 -1.37 0.31 112.91 117.60 1nd5 h THR 1199Ca 0.27 -0.91 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 1nd5 h THR 1199Cb 0.04 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 66.86 1nd5 h THR 1199CO -0.11 0.36 0.26 0.11 0.37 0.00 0.00 175.52 176.50 1nd5 h LYS 1200N 1.11 0.80 0.60 6.66 1.79 -0.81 -1.87 116.57 124.86 1nd5 h LYS 1200Ca 0.24 -0.12 -0.03 0.00 -2.18 0.00 0.00 60.65 58.56 1nd5 h LYS 1200Cb 0.31 -0.14 0.01 0.00 -1.58 0.00 0.00 32.23 30.82 1nd5 h LYS 1200CO -0.01 0.66 -0.29 -0.07 -1.08 0.00 0.00 179.45 178.67 1nd5 h LEU 1201N 0.74 -0.68 -0.76 2.94 3.38 -0.91 -2.36 115.31 117.66 1nd5 h LEU 1201Ca 0.19 0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.31 1nd5 h LEU 1201Cb 0.13 0.18 -0.14 0.00 0.09 0.00 0.00 40.66 40.92 1nd5 h LEU 1201CO -0.02 -0.37 -0.34 -0.09 0.09 0.00 0.00 178.44 177.71 1nd5 h ARG 1202N -1.05 -0.08 -0.31 1.13 2.43 -0.42 1.14 114.38 117.21 1nd5 h ARG 1202Ca -0.08 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.15 1nd5 h ARG 1202Cb 0.62 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 1nd5 h ARG 1202CO 0.14 -0.05 0.22 0.93 -1.51 0.00 0.00 179.97 179.69 1nd5 h GLU 1203N -0.08 0.18 -0.03 0.20 5.08 -1.40 0.14 114.58 118.67 1nd5 h GLU 1203Ca 0.29 -0.01 -0.17 0.00 -1.00 0.00 0.00 59.36 58.47 1nd5 h GLU 1203Cb 0.57 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1nd5 h GLU 1203CO -0.81 0.12 -0.75 -0.07 -1.00 0.00 0.00 179.01 176.49 1nd5 h LEU 1204N 0.18 0.25 -0.40 1.33 3.38 0.16 -1.24 115.31 118.98 1nd5 h LEU 1204Ca 0.14 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.77 1nd5 h LEU 1204Cb 0.33 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1nd5 h LEU 1204CO -0.02 0.92 -0.37 0.28 0.09 0.00 0.00 178.44 179.33 1nd5 h SER 1205N 0.13 1.01 -0.26 -0.43 0.02 0.23 -0.68 113.55 113.58 1nd5 h SER 1205Ca -0.03 -0.46 -0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1nd5 h SER 1205Cb 1.33 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 1nd5 h SER 1205CO 0.12 1.26 0.15 -0.33 -1.14 0.00 0.00 176.83 176.89 1nd5 h GLU 1206N 0.78 0.36 0.00 3.45 5.08 -0.83 0.25 114.58 123.67 1nd5 h GLU 1206Ca 0.07 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1nd5 h GLU 1206Cb 0.97 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 1nd5 h GLU 1206CO 0.09 0.30 -0.14 1.25 -1.00 0.00 0.00 179.01 179.52 1nd5 h LEU 1207N 0.33 0.00 0.17 1.33 5.85 -1.06 0.39 115.31 122.31 1nd5 h LEU 1207Ca 0.09 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1nd5 h LEU 1207Cb 0.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1nd5 h LEU 1207CO -0.02 0.14 -0.08 -1.28 -0.34 0.00 0.00 178.44 176.86 1nd5 h SER 1208N 0.00 -0.19 0.26 1.25 0.87 -0.20 -2.39 113.55 113.15 1nd5 h SER 1208Ca -0.00 -0.30 -0.00 0.00 -1.23 0.00 0.00 61.79 60.25 1nd5 h SER 1208Cb 0.26 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.26 1nd5 h SER 1208CO 0.02 0.38 -0.21 0.25 -0.53 0.00 0.00 176.83 176.74 1nd5 h LEU 1209N -0.94 -0.54 -1.64 2.23 5.85 -0.86 -2.29 115.31 117.13 1nd5 h LEU 1209Ca -0.02 0.04 0.29 0.00 0.84 0.00 0.00 57.88 59.03 1nd5 h LEU 1209Cb 0.48 0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.61 1nd5 h LEU 1209CO 0.04 -0.32 0.73 0.25 -0.34 0.00 0.00 178.44 178.80 1nd5 h LEU 1210N -0.48 0.25 -0.06 2.25 7.12 -0.33 0.37 115.31 124.42 1nd5 h LEU 1210Ca -0.02 0.05 0.00 0.00 0.13 0.00 0.00 57.88 58.04 1nd5 h LEU 1210Cb 0.42 0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.56 1nd5 h LEU 1210CO -0.01 0.05 -0.30 -1.54 -0.13 0.00 0.00 178.44 176.50 1nd5 n SER 1211N -4.45 0.40 -0.08 1.25 3.41 -0.90 -1.50 113.62 111.76 1nd5 n SER 1211Ca 0.25 -0.13 -0.12 0.00 -0.26 0.00 0.00 58.87 58.61 1nd5 n SER 1211Cb 1.01 -0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.91 1nd5 n SER 1211CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1nd5 h LEU 1212N 0.16 0.42 0.00 1.04 6.46 0.19 -3.35 115.31 120.22 1nd5 h LEU 1212Ca 0.00 -0.35 0.00 0.00 -0.12 0.00 0.00 57.88 57.41 1nd5 h LEU 1212Cb 0.48 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.30 1nd5 h LEU 1212CO 0.00 0.67 -1.38 -1.22 -0.62 0.00 0.00 178.44 175.89 1nd5 n TYR 1213N -4.62 0.00 -1.41 1.25 0.53 -1.24 -4.95 117.16 106.72 1nd5 n TYR 1213Ca -0.04 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.84 1nd5 n TYR 1213Cb 0.27 -0.22 0.00 0.00 -1.03 0.00 0.00 39.34 38.36 1nd5 n TYR 1213CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1nd5 n GLY 1214N 1.78 5.18 5.56 2.72 0.00 -0.56 -4.15 105.19 115.71 1nd5 n GLY 1214Ca -0.01 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.39 1nd5 n GLY 1214CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nd5 n ILE 1215N 0.00 0.00 -4.45 -0.61 2.08 -1.25 -4.57 119.36 110.56 1nd5 n ILE 1215Ca 0.00 0.00 -0.34 0.00 0.56 0.00 0.00 62.75 62.97 1nd5 n ILE 1215Cb 0.00 0.00 -0.14 0.00 -0.75 0.00 0.00 39.64 38.75 1nd5 n ILE 1215CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 1nd5 s HIS 1216N 0.00 2.87 -1.36 1.39 2.46 -1.26 -4.72 115.29 114.67 1nd5 s HIS 1216Ca 0.00 -0.75 -0.05 0.00 0.47 0.00 0.00 55.06 54.73 1nd5 s HIS 1216Cb 0.00 -1.94 0.02 0.00 -0.13 0.00 0.00 32.58 30.54 1nd5 s HIS 1216CO 0.00 -0.33 0.84 1.63 -2.47 0.00 0.00 174.74 174.42 1nd5 n LYS 1217N 3.96 -5.48 -0.08 2.88 5.02 -1.26 -4.88 118.16 118.32 1nd5 n LYS 1217Ca -0.18 0.65 -0.08 0.00 -2.02 0.00 0.00 58.31 56.68 1nd5 n LYS 1217Cb 0.52 -5.38 -0.06 0.00 -0.02 0.00 0.00 35.03 30.09 1nd5 n LYS 1217CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1nd5 h GLN 1218N -2.00 -0.23 -0.26 1.97 4.15 -1.83 -0.95 115.11 115.95 1nd5 h GLN 1218Ca -0.60 0.02 0.03 0.00 0.77 0.00 0.00 58.65 58.87 1nd5 h GLN 1218Cb 1.36 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 29.06 1nd5 h GLN 1218CO 0.59 -0.16 -0.34 0.87 -1.93 0.00 0.00 178.83 177.87 1nd5 h LYS 1219N -0.24 -0.22 -0.87 1.69 6.56 -1.92 0.12 116.57 121.69 1nd5 h LYS 1219Ca 0.04 0.01 0.23 0.00 -1.06 0.00 0.00 60.65 59.87 1nd5 h LYS 1219Cb 0.35 0.05 -0.15 0.00 -0.57 0.00 0.00 32.23 31.92 1nd5 h LYS 1219CO -0.35 -0.15 0.15 1.49 -2.06 0.00 0.00 179.45 178.53 1nd5 h GLU 1220N -0.23 0.14 0.33 3.15 4.81 -1.87 0.11 114.58 121.02 1nd5 h GLU 1220Ca 0.05 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1nd5 h GLU 1220Cb 0.35 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.70 1nd5 h GLU 1220CO -0.37 0.09 -0.16 0.87 -0.73 0.00 0.00 179.01 178.71 1nd5 h LYS 1221N 0.14 -0.43 -0.97 1.92 1.57 -0.26 -3.08 116.57 115.47 1nd5 h LYS 1221Ca 0.53 0.03 0.31 0.00 -1.87 0.00 0.00 60.65 59.65 1nd5 h LYS 1221Cb 1.05 0.10 -0.17 0.00 0.08 0.00 0.00 32.23 33.29 1nd5 h LYS 1221CO -0.71 -0.19 0.26 0.77 -0.57 0.00 0.00 179.45 179.01 1nd5 h SER 1222N -0.59 -0.08 -0.86 0.86 0.02 0.18 0.51 113.55 113.60 1nd5 h SER 1222Ca -0.05 0.25 0.16 0.00 -0.84 0.00 0.00 61.79 61.32 1nd5 h SER 1222Cb 0.43 0.36 -0.07 0.00 0.14 0.00 0.00 62.40 63.26 1nd5 h SER 1222CO 0.07 -0.33 0.56 0.03 -1.14 0.00 0.00 176.83 176.03 1nd5 h ARG 1223N 0.07 0.53 0.00 3.45 3.08 -1.31 0.10 114.38 120.31 1nd5 h ARG 1223Ca 0.67 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.69 1nd5 h ARG 1223Cb 1.54 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.47 1nd5 h ARG 1223CO -0.80 0.35 -0.60 1.28 -1.07 0.00 0.00 179.97 179.13 1nd5 n LEU 1224N -4.53 0.57 0.00 3.04 4.77 0.17 -4.14 117.00 116.88 1nd5 n LEU 1224Ca 0.17 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1nd5 n LEU 1224Cb 0.55 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1nd5 n LEU 1224CO 0.30 0.10 0.00 0.00 -1.33 0.00 0.00 177.39 176.46 1nd5 n GLN 1225N -1.63 0.00 -0.37 3.23 1.13 -0.28 -4.79 117.38 114.68 1nd5 n GLN 1225Ca 0.05 0.00 0.31 0.00 -1.94 0.00 0.00 57.00 55.41 1nd5 n GLN 1225Cb 0.36 0.00 0.62 0.00 0.11 0.00 0.00 30.24 31.33 1nd5 n GLN 1225CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1nd5 h GLY 1226N 0.00 0.83 0.38 1.08 0.00 -1.68 -1.81 103.07 101.86 1nd5 h GLY 1226Ca 0.00 -0.12 0.12 0.00 0.00 0.00 0.00 47.33 47.33 1nd5 h GLY 1226CO 0.00 -0.15 0.47 -1.33 0.00 0.00 0.00 176.54 175.54 1nd5 h GLY 1227N 0.20 1.36 0.10 4.60 0.00 -1.22 -1.92 103.07 106.19 1nd5 h GLY 1227Ca 0.65 -0.30 0.09 0.00 0.00 0.00 0.00 47.33 47.78 1nd5 h GLY 1227CO -0.23 0.06 -0.08 -2.08 0.00 0.00 0.00 176.54 174.21 1nd5 h VAL 1228N 0.73 0.56 -0.04 4.60 2.07 -1.53 0.15 116.25 122.79 1nd5 h VAL 1228Ca 0.44 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.94 1nd5 h VAL 1228Cb 0.51 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1nd5 h VAL 1228CO -0.30 0.01 0.02 0.25 0.02 0.00 0.00 177.57 177.56 1nd5 h LEU 1229N 0.04 0.06 -0.86 2.57 5.85 -1.61 -2.66 115.31 118.70 1nd5 h LEU 1229Ca 0.23 -0.16 0.21 0.00 0.84 0.00 0.00 57.88 59.00 1nd5 h LEU 1229Cb 0.35 -0.02 -0.15 0.00 0.37 0.00 0.00 40.66 41.22 1nd5 h LEU 1229CO -0.46 0.20 0.04 0.58 -0.34 0.00 0.00 178.44 178.46 1nd5 h VAL 1230N -0.09 0.23 -0.25 1.05 2.07 -0.37 0.14 116.25 119.03 1nd5 h VAL 1230Ca 0.01 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 1nd5 h VAL 1230Cb 0.16 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1nd5 h VAL 1230CO -0.00 0.02 0.14 -1.13 0.02 0.00 0.00 177.57 176.61 1nd5 h ASN 1231N 0.09 0.31 -0.57 0.57 -0.00 -0.85 0.30 115.58 115.42 1nd5 h ASN 1231Ca 0.49 -0.08 0.11 0.00 -0.00 0.00 0.00 56.30 56.83 1nd5 h ASN 1231Cb 0.93 -0.08 -0.11 0.00 -0.00 0.00 0.00 38.32 39.06 1nd5 h ASN 1231CO -0.76 0.30 -0.20 -0.08 -0.00 0.00 0.00 177.43 176.69 1nd5 h GLU 1232N 0.30 -0.06 -0.44 6.67 4.57 -0.40 0.17 114.58 125.38 1nd5 h GLU 1232Ca 0.09 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.14 1nd5 h GLU 1232Cb 0.06 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 1nd5 h GLU 1232CO -0.01 -0.04 -0.23 0.82 -1.18 0.00 0.00 179.01 178.37 1nd5 h ILE 1233N -0.06 1.27 -0.28 2.32 2.04 -1.03 -2.31 117.51 119.46 1nd5 h ILE 1233Ca 0.27 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 64.74 1nd5 h ILE 1233Cb 0.47 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1nd5 h ILE 1233CO -0.62 0.47 0.18 0.25 0.00 0.00 0.00 178.15 178.44 1nd5 h LEU 1234N 0.77 0.33 -0.12 1.44 5.85 0.20 -1.57 115.31 122.21 1nd5 h LEU 1234Ca 0.10 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1nd5 h LEU 1234Cb 0.81 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1nd5 h LEU 1234CO 0.07 0.25 0.07 0.78 -0.34 0.00 0.00 178.44 179.28 1nd5 h ASN 1235N 0.38 0.15 -0.37 1.25 4.21 -0.66 0.68 115.58 121.22 1nd5 h ASN 1235Ca 0.10 -0.06 0.07 0.00 1.21 0.00 0.00 56.30 57.63 1nd5 h ASN 1235Cb -0.03 -0.04 -0.07 0.00 -1.12 0.00 0.00 38.32 37.07 1nd5 h ASN 1235CO -0.02 0.16 -0.06 0.45 -1.29 0.00 0.00 177.43 176.67 1nd5 h HIS 1236N 0.13 -0.13 -0.64 1.19 3.86 -1.29 0.57 115.15 118.83 1nd5 h HIS 1236Ca 0.04 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.31 1nd5 h HIS 1236Cb 0.04 0.12 -0.04 0.00 1.06 0.00 0.00 27.41 28.59 1nd5 h HIS 1236CO -0.05 -0.13 0.41 0.52 0.86 0.00 0.00 177.93 179.53 1nd5 h MET 1237N 0.03 0.78 -0.69 2.45 2.86 -0.95 -0.40 114.93 119.02 1nd5 h MET 1237Ca 0.18 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 1nd5 h MET 1237Cb 0.27 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.72 1nd5 h MET 1237CO -0.35 0.52 0.23 -0.22 1.06 0.00 0.00 176.91 178.15 1nd5 h LYS 1238N 0.81 1.05 -0.46 1.72 3.64 0.12 -2.92 116.57 120.53 1nd5 h LYS 1238Ca 0.25 -0.21 -0.11 0.00 -1.27 0.00 0.00 60.65 59.32 1nd5 h LYS 1238Cb -0.01 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1nd5 h LYS 1238CO -0.09 0.89 -0.13 0.00 -2.27 0.00 0.00 179.45 177.85 1nd5 h ARG 1239N 1.02 0.90 0.00 1.90 3.08 0.97 -2.07 114.38 120.17 1nd5 h ARG 1239Ca 0.23 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1nd5 h ARG 1239Cb 0.26 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1nd5 h ARG 1239CO -0.01 1.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.89 1nd5 n ALA 1240N -2.48 1.20 -0.01 0.04 0.00 -0.24 0.11 120.51 119.14 1nd5 n ALA 1240Ca -0.00 0.10 -0.11 0.00 0.00 0.00 0.00 53.44 53.44 1nd5 n ALA 1240Cb 0.39 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.47 1nd5 n ALA 1240CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nd5 h THR 1241N 0.00 0.90 0.00 0.00 1.03 -1.23 -3.39 112.91 110.22 1nd5 h THR 1241Ca 0.00 -2.72 -0.04 0.00 -0.01 0.00 0.00 66.41 63.64 1nd5 h THR 1241Cb 0.09 2.48 -0.01 0.00 -1.07 0.00 0.00 68.15 69.64 1nd5 h THR 1241CO 0.00 0.59 -1.86 1.67 -0.01 0.00 0.00 175.52 175.91 1nd5 n GLN 1242N -3.15 0.63 -3.84 0.00 7.27 0.12 -4.95 117.38 113.46 1nd5 n GLN 1242Ca -0.17 -0.15 -0.36 0.00 0.07 0.00 0.00 57.00 56.39 1nd5 n GLN 1242Cb 1.04 -1.43 -0.12 0.00 2.41 0.00 0.00 30.24 32.14 1nd5 n GLN 1242CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 1nd5 s ILE 1243N -3.15 4.39 1.44 1.69 1.01 0.31 -5.10 121.20 121.79 1nd5 s ILE 1243Ca -0.07 -0.15 -0.23 0.00 0.00 0.00 0.00 60.65 60.20 1nd5 s ILE 1243Cb 0.11 -3.03 0.37 0.00 0.01 0.00 0.00 42.46 39.92 1nd5 s ILE 1243CO 0.74 0.37 0.92 -2.84 0.00 0.00 0.00 174.94 174.13 1nd5 s PRO 1244N 1.33 -3.07 0.00 2.79 0.02 -1.26 -3.63 135.00 131.17 1nd5 s PRO 1244Ca 0.05 0.13 0.00 0.00 0.02 0.00 0.00 61.00 61.20 1nd5 s PRO 1244Cb -0.15 -1.36 0.00 0.00 0.02 0.00 0.00 34.50 33.01 1nd5 s PRO 1244CO 0.03 -4.97 0.00 0.45 -0.33 0.00 0.00 177.00 172.19 1nd5 n SER 1245N -5.70 0.00 -4.02 2.53 2.88 -1.26 -4.85 113.62 103.21 1nd5 n SER 1245Ca 0.13 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.37 1nd5 n SER 1245Cb 0.60 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.26 1nd5 n SER 1245CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1nd5 s TYR 1246N -2.04 1.34 0.94 0.66 6.14 -1.24 -5.02 117.35 118.13 1nd5 s TYR 1246Ca 0.00 0.21 -0.10 0.00 0.64 0.00 0.00 57.07 57.81 1nd5 s TYR 1246Cb 0.00 -4.18 0.16 0.00 0.42 0.00 0.00 41.96 38.36 1nd5 s TYR 1246CO 0.00 -2.77 1.13 0.15 0.64 0.00 0.00 175.55 174.70 1nd5 s LYS 1247N -5.91 0.85 -0.19 4.97 3.01 -1.26 -4.83 119.74 116.37 1nd5 s LYS 1247Ca 0.76 1.43 -0.06 0.00 -1.01 0.00 0.00 55.97 57.10 1nd5 s LYS 1247Cb -0.03 -1.72 -0.10 0.00 -1.01 0.00 0.00 37.83 34.98 1nd5 s LYS 1247CO 0.53 -2.71 -0.22 1.63 0.51 0.00 0.00 175.35 175.09 1nd5 n LYS 1248N -4.28 0.44 -4.39 1.68 4.76 0.25 -4.86 118.16 111.75 1nd5 n LYS 1248Ca 0.11 0.15 -0.20 0.00 -2.87 0.00 0.00 58.31 55.50 1nd5 n LYS 1248Cb 0.52 -1.27 -0.15 0.00 -1.84 0.00 0.00 35.03 32.29 1nd5 n LYS 1248CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1nd5 s LEU 1249N -6.69 1.80 -0.18 -0.35 2.96 -1.10 -2.01 118.68 113.11 1nd5 s LEU 1249Ca -0.27 -0.19 -0.00 0.00 -0.22 0.00 0.00 54.13 53.46 1nd5 s LEU 1249Cb 0.09 -0.55 0.04 0.00 0.50 0.00 0.00 46.19 46.28 1nd5 s LEU 1249CO 0.38 0.07 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.78 1nd5 s ILE 1250N 0.17 1.26 -0.23 6.68 1.01 -1.07 -2.68 121.20 126.35 1nd5 s ILE 1250Ca -0.03 -0.78 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 1nd5 s ILE 1250Cb -0.08 -1.43 -0.05 0.00 0.01 0.00 0.00 42.46 40.91 1nd5 s ILE 1250CO 0.00 0.10 0.20 -0.04 0.00 0.00 0.00 174.94 175.21 1nd5 s MET 1251N 1.56 4.10 -0.23 2.79 -1.94 -0.73 -2.51 119.30 122.33 1nd5 s MET 1251Ca -0.00 -0.18 -0.06 0.00 -1.71 0.00 0.00 55.69 53.74 1nd5 s MET 1251Cb -0.16 -3.52 -0.02 0.00 2.01 0.00 0.00 34.83 33.13 1nd5 s MET 1251CO -0.08 0.08 0.03 0.71 -0.01 0.00 0.00 175.02 175.75 1nd5 s TYR 1252N 1.01 3.05 -0.52 -0.03 1.51 0.04 -0.87 117.35 121.55 1nd5 s TYR 1252Ca 0.10 -0.54 -0.05 0.00 -1.01 0.00 0.00 57.07 55.57 1nd5 s TYR 1252Cb -0.13 -2.18 0.14 0.00 -0.11 0.00 0.00 41.96 39.67 1nd5 s TYR 1252CO 0.04 -0.37 0.34 0.45 -1.11 0.00 0.00 175.55 174.90 1nd5 s SER 1253N 1.46 5.40 0.00 2.29 0.15 -0.04 -1.52 113.70 121.44 1nd5 s SER 1253Ca 0.05 -2.34 0.00 0.00 0.70 0.00 0.00 55.95 54.37 1nd5 s SER 1253Cb -0.15 -1.89 0.00 0.00 -1.71 0.00 0.00 66.02 62.27 1nd5 s SER 1253CO 0.02 -0.51 0.00 0.00 1.20 0.00 0.00 173.24 173.95 1nd5 n ALA 1254N 4.23 0.00 -4.01 5.45 0.00 -0.61 -2.33 120.51 123.23 1nd5 n ALA 1254Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.29 1nd5 n ALA 1254Cb 0.40 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.84 1nd5 n ALA 1254CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1nd5 n HIS 1255N 0.00 -0.30 0.44 0.00 8.25 -1.26 -2.53 115.22 119.81 1nd5 n HIS 1255Ca 0.00 -1.26 0.13 0.00 -0.26 0.00 0.00 57.72 56.33 1nd5 n HIS 1255Cb 0.00 -0.21 0.44 0.00 1.12 0.00 0.00 29.99 31.34 1nd5 n HIS 1255CO 0.00 0.00 0.00 0.38 0.64 0.00 0.00 176.34 177.36 1nd5 h ASP 1256N 0.47 0.00 1.12 0.41 -0.00 -1.93 -2.02 116.42 114.47 1nd5 h ASP 1256Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.83 1nd5 h ASP 1256Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.00 1nd5 h ASP 1256CO 0.32 0.00 -0.22 0.35 -0.00 0.00 0.00 179.24 179.69 1nd5 n THR 1257N -2.51 0.35 -0.06 1.15 -2.24 -1.26 -2.08 114.28 107.63 1nd5 n THR 1257Ca 0.03 -0.20 -0.20 0.00 -2.27 0.00 0.00 64.05 61.41 1nd5 n THR 1257Cb 0.37 -0.36 -0.13 0.00 -2.10 0.00 0.00 70.33 68.11 1nd5 n THR 1257CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1nd5 h THR 1258N 0.00 1.08 -0.54 4.28 2.02 -1.63 -2.63 112.91 115.48 1nd5 h THR 1258Ca 0.00 -2.29 -0.00 0.00 0.77 0.00 0.00 66.41 64.89 1nd5 h THR 1258Cb 0.67 2.59 -0.03 0.00 -1.74 0.00 0.00 68.15 69.64 1nd5 h THR 1258CO 0.00 0.52 0.33 0.58 0.37 0.00 0.00 175.52 177.32 1nd5 h VAL 1259N -0.72 1.16 -0.03 3.16 2.07 -1.45 -0.60 116.25 119.84 1nd5 h VAL 1259Ca -0.28 -0.37 -0.20 0.00 0.82 0.00 0.00 66.70 66.66 1nd5 h VAL 1259Cb 1.44 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1nd5 h VAL 1259CO -0.07 0.17 -0.85 0.77 0.02 0.00 0.00 177.57 177.60 1nd5 h SER 1260N 0.73 0.45 -0.53 0.57 4.64 -1.58 -1.10 113.55 116.74 1nd5 h SER 1260Ca 0.20 -0.34 -0.10 0.00 -0.47 0.00 0.00 61.79 61.08 1nd5 h SER 1260Cb -0.01 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 1nd5 h SER 1260CO -0.04 1.12 -0.03 1.23 -0.87 0.00 0.00 176.83 178.24 1nd5 h GLY 1261N 1.38 1.07 0.92 -0.77 0.00 -1.28 0.28 103.07 104.67 1nd5 h GLY 1261Ca -0.05 -0.79 -0.07 0.00 0.00 0.00 0.00 47.33 46.42 1nd5 h GLY 1261CO 0.14 0.73 -0.06 -2.00 0.00 0.00 0.00 176.54 175.35 1nd5 h LEU 1262N 0.90 0.64 -0.55 3.11 5.85 -1.06 -1.36 115.31 122.84 1nd5 h LEU 1262Ca 0.16 -0.35 -0.15 0.00 0.84 0.00 0.00 57.88 58.38 1nd5 h LEU 1262Cb 0.57 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1nd5 h LEU 1262CO 0.03 0.83 -0.41 1.56 -0.34 0.00 0.00 178.44 180.12 1nd5 h GLN 1263N 0.43 0.71 -0.56 1.25 4.20 -0.92 -1.75 115.11 118.47 1nd5 h GLN 1263Ca 0.09 -0.38 -0.04 0.00 0.06 0.00 0.00 58.65 58.38 1nd5 h GLN 1263Cb 0.54 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 1nd5 h GLN 1263CO 0.03 0.99 0.18 0.52 -0.67 0.00 0.00 178.83 179.88 1nd5 h MET 1264N 0.58 0.87 -0.51 1.46 2.86 -0.39 0.68 114.93 120.48 1nd5 h MET 1264Ca 0.05 -0.19 -0.09 0.00 -2.06 0.00 0.00 59.70 57.41 1nd5 h MET 1264Cb 0.95 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.47 1nd5 h MET 1264CO 0.09 0.78 -0.05 0.00 1.06 0.00 0.00 176.91 178.79 1nd5 h ALA 1265N 1.04 0.95 0.00 6.32 0.00 -1.18 -1.46 119.26 124.93 1nd5 h ALA 1265Ca 0.18 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1nd5 h ALA 1265Cb 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1nd5 h ALA 1265CO -0.01 0.63 0.00 1.28 0.00 0.00 0.00 179.25 181.15 1nd5 n LEU 1266N -4.18 0.12 -1.69 0.00 4.77 -0.67 -4.91 117.00 110.45 1nd5 n LEU 1266Ca 0.02 0.51 -0.10 0.00 -0.03 0.00 0.00 56.01 56.42 1nd5 n LEU 1266Cb 0.35 -0.48 0.03 0.00 -2.33 0.00 0.00 43.42 40.99 1nd5 n LEU 1266CO 0.43 -0.04 0.09 -0.67 -1.33 0.00 0.00 177.39 175.87 1nd5 n ASP 1267N -1.61 -3.71 0.00 -1.43 2.03 0.15 -4.64 116.55 107.34 1nd5 n ASP 1267Ca 0.07 -0.20 0.00 0.00 0.52 0.00 0.00 54.79 55.17 1nd5 n ASP 1267Cb 0.34 -2.31 0.00 0.00 -0.72 0.00 0.00 41.12 38.43 1nd5 n ASP 1267CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1nd5 n VAL 1268N -3.54 0.37 -2.02 5.18 0.24 0.19 -4.57 118.33 114.17 1nd5 n VAL 1268Ca -0.00 -0.37 -0.42 0.00 -2.04 0.00 0.00 64.34 61.51 1nd5 n VAL 1268Cb 0.53 0.84 -0.03 0.00 -1.47 0.00 0.00 33.84 33.71 1nd5 n VAL 1268CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1nd5 s TYR 1269N -0.37 3.07 -0.88 6.34 5.04 -1.10 -4.89 117.35 124.57 1nd5 s TYR 1269Ca 0.00 0.93 0.08 0.00 -2.44 0.00 0.00 57.07 55.64 1nd5 s TYR 1269Cb 0.00 -3.82 0.39 0.00 0.35 0.00 0.00 41.96 38.89 1nd5 s TYR 1269CO 0.00 -2.77 1.15 0.27 -1.34 0.00 0.00 175.55 172.86 1nd5 n ASN 1270N 2.93 3.11 0.00 4.32 6.94 -1.26 -4.89 115.26 126.41 1nd5 n ASN 1270Ca 0.09 -2.38 0.00 0.00 -0.02 0.00 0.00 54.58 52.27 1nd5 n ASN 1270Cb 0.40 -0.53 0.00 0.00 -2.36 0.00 0.00 39.78 37.29 1nd5 n ASN 1270CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1nd5 n GLY 1271N 0.46 0.71 3.84 4.83 0.00 -1.26 -4.95 105.19 108.82 1nd5 n GLY 1271Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1nd5 n GLY 1271CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nd5 s LEU 1272N 0.00 4.23 -0.01 0.99 1.43 -1.26 -4.86 118.68 119.20 1nd5 s LEU 1272Ca 0.00 1.21 -0.30 0.00 -1.03 0.00 0.00 54.13 54.01 1nd5 s LEU 1272Cb 0.00 -3.67 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 1nd5 s LEU 1272CO 0.00 -0.04 1.73 -0.76 0.23 0.00 0.00 176.35 177.51 1nd5 s LEU 1273N -2.42 4.36 -0.02 1.79 1.43 -1.26 -4.90 118.68 117.66 1nd5 s LEU 1273Ca 0.46 2.39 -0.36 0.00 -1.03 0.00 0.00 54.13 55.58 1nd5 s LEU 1273Cb -0.13 -3.54 -0.15 0.00 0.03 0.00 0.00 46.19 42.40 1nd5 s LEU 1273CO 0.19 -0.95 1.61 -2.65 0.23 0.00 0.00 176.35 174.79 1nd5 n PRO 1274N 6.91 1.62 -1.32 1.29 -0.02 -1.26 -4.94 135.00 137.28 1nd5 n PRO 1274Ca 0.18 0.59 -0.30 0.00 -2.02 0.00 0.00 63.50 61.94 1nd5 n PRO 1274Cb 0.42 -2.32 0.11 0.00 -0.02 0.00 0.00 33.50 31.70 1nd5 n PRO 1274CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1nd5 s PRO 1275N 2.06 1.70 0.39 0.52 0.02 -1.26 -4.92 135.00 133.51 1nd5 s PRO 1275Ca 0.88 0.84 -0.27 0.00 0.02 0.00 0.00 61.00 62.47 1nd5 s PRO 1275Cb -0.86 -1.86 -0.11 0.00 0.02 0.00 0.00 34.50 31.70 1nd5 s PRO 1275CO 0.50 -1.94 1.39 0.66 -0.33 0.00 0.00 177.00 177.28 1nd5 n TYR 1276N -3.68 2.60 -1.36 6.54 0.53 -1.26 -1.68 117.16 118.85 1nd5 n TYR 1276Ca 0.07 0.48 -0.14 0.00 -1.02 0.00 0.00 57.90 57.30 1nd5 n TYR 1276Cb 0.55 -2.46 -0.06 0.00 -1.03 0.00 0.00 39.34 36.34 1nd5 n TYR 1276CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1nd5 n ALA 1277N 0.17 -0.21 -1.76 -0.72 0.00 0.22 -4.92 120.51 113.29 1nd5 n ALA 1277Ca 0.04 0.22 -0.38 0.00 0.00 0.00 0.00 53.44 53.32 1nd5 n ALA 1277Cb 0.39 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1nd5 n ALA 1277CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nd5 s SER 1278N -2.20 5.99 -0.10 0.00 1.04 -0.67 -4.72 113.70 113.04 1nd5 s SER 1278Ca 0.00 2.53 -0.01 0.00 0.48 0.00 0.00 55.95 58.95 1nd5 s SER 1278Cb 0.00 -2.62 0.03 0.00 0.10 0.00 0.00 66.02 63.53 1nd5 s SER 1278CO 0.00 -1.06 -0.02 0.00 0.98 0.00 0.00 173.24 173.14 1nd5 s HIS 1280N 1.86 3.25 -0.07 0.00 5.04 -0.60 -0.52 115.29 124.26 1nd5 s HIS 1280Ca 0.04 0.66 0.05 0.00 -1.54 0.00 0.00 55.06 54.27 1nd5 s HIS 1280Cb -0.13 -2.85 -0.01 0.00 0.04 0.00 0.00 32.58 29.63 1nd5 s HIS 1280CO -0.07 -0.36 -0.22 -0.48 -2.34 0.00 0.00 174.74 171.27 1nd5 s LEU 1281N 2.47 2.23 -0.14 8.88 2.34 0.17 -0.61 118.68 134.02 1nd5 s LEU 1281Ca 0.24 -0.46 0.01 0.00 0.06 0.00 0.00 54.13 53.98 1nd5 s LEU 1281Cb -0.15 -1.43 -0.00 0.00 -0.56 0.00 0.00 46.19 44.04 1nd5 s LEU 1281CO 0.10 0.23 -0.17 -0.89 -1.06 0.00 0.00 176.35 174.56 1nd5 s THR 1282N -0.09 2.57 -0.07 5.48 2.01 -0.03 -0.77 115.64 124.74 1nd5 s THR 1282Ca -0.05 -0.81 0.05 0.00 0.31 0.00 0.00 61.69 61.18 1nd5 s THR 1282Cb -0.14 -2.06 -0.00 0.00 0.01 0.00 0.00 72.50 70.30 1nd5 s THR 1282CO 0.04 0.53 -0.22 -1.61 -0.69 0.00 0.00 174.62 172.67 1nd5 s GLU 1283N 0.65 2.56 -0.37 4.92 2.02 0.48 -0.25 118.70 128.71 1nd5 s GLU 1283Ca -0.09 -0.80 -0.13 0.00 0.02 0.00 0.00 54.97 53.97 1nd5 s GLU 1283Cb -0.16 -2.05 0.00 0.00 0.10 0.00 0.00 34.13 32.02 1nd5 s GLU 1283CO 0.02 0.24 0.25 -1.17 0.02 0.00 0.00 175.26 174.63 1nd5 s LEU 1284N 0.16 4.72 0.07 1.80 2.96 -0.15 -0.69 118.68 127.55 1nd5 s LEU 1284Ca -0.11 -0.67 0.03 0.00 -0.22 0.00 0.00 54.13 53.16 1nd5 s LEU 1284Cb -0.15 -2.12 -0.04 0.00 0.50 0.00 0.00 46.19 44.38 1nd5 s LEU 1284CO 0.06 -0.33 0.06 -0.31 -1.32 0.00 0.00 176.35 174.51 1nd5 s TYR 1285N 1.68 3.16 -0.03 5.38 1.51 0.20 -1.26 117.35 127.98 1nd5 s TYR 1285Ca 0.05 0.07 0.07 0.00 -1.01 0.00 0.00 57.07 56.25 1nd5 s TYR 1285Cb -0.18 -1.61 -0.02 0.00 -0.11 0.00 0.00 41.96 40.04 1nd5 s TYR 1285CO 0.09 0.51 -0.24 0.12 -1.11 0.00 0.00 175.55 174.93 1nd5 s PHE 1286N -1.36 2.40 0.00 2.71 5.36 0.12 0.17 117.98 127.39 1nd5 s PHE 1286Ca 0.28 -0.48 0.00 0.00 -0.96 0.00 0.00 56.93 55.77 1nd5 s PHE 1286Cb -0.12 -1.54 0.00 0.00 -0.34 0.00 0.00 43.02 41.02 1nd5 s PHE 1286CO 0.21 -0.06 0.00 -1.91 -1.46 0.00 0.00 175.22 171.99 1nd5 n GLU 1287N 2.57 0.00 -1.21 10.12 2.13 -0.26 0.23 120.64 134.22 1nd5 n GLU 1287Ca -0.17 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.30 1nd5 n GLU 1287Cb 0.51 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.20 1nd5 n GLU 1287CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1nd5 n LYS 1288N 0.00 2.83 -0.84 5.31 5.02 -1.26 -4.33 118.16 124.89 1nd5 n LYS 1288Ca 0.00 -2.02 0.00 0.00 -2.02 0.00 0.00 58.31 54.27 1nd5 n LYS 1288Cb 0.00 -2.81 0.00 0.00 -0.02 0.00 0.00 35.03 32.20 1nd5 n LYS 1288CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nd5 n GLY 1289N 3.84 0.56 3.32 0.72 0.00 -1.26 -4.98 105.19 107.39 1nd5 n GLY 1289Ca 0.61 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.46 1nd5 n GLY 1289CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nd5 s GLU 1290N -0.45 1.28 -0.09 1.61 2.02 -1.26 -5.15 118.70 116.65 1nd5 s GLU 1290Ca 0.00 -1.62 -0.02 0.00 0.02 0.00 0.00 54.97 53.35 1nd5 s GLU 1290Cb 0.00 -0.67 -0.03 0.00 0.10 0.00 0.00 34.13 33.53 1nd5 s GLU 1290CO 0.00 -0.03 -0.00 0.71 0.02 0.00 0.00 175.26 175.96 1nd5 s TYR 1291N -3.35 3.15 0.09 1.61 1.51 -1.26 -1.11 117.35 118.00 1nd5 s TYR 1291Ca 0.25 0.16 0.06 0.00 -1.01 0.00 0.00 57.07 56.52 1nd5 s TYR 1291Cb 0.04 -1.81 -0.03 0.00 -0.11 0.00 0.00 41.96 40.05 1nd5 s TYR 1291CO 0.07 0.42 -0.14 -0.06 -1.11 0.00 0.00 175.55 174.73 1nd5 s PHE 1292N -0.76 1.32 -0.15 2.71 0.40 0.13 -0.71 117.98 120.91 1nd5 s PHE 1292Ca 0.12 -0.50 -0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1nd5 s PHE 1292Cb -0.12 -0.72 -0.01 0.00 0.51 0.00 0.00 43.02 42.68 1nd5 s PHE 1292CO 0.02 0.10 -0.12 0.08 0.70 0.00 0.00 175.22 176.00 1nd5 s VAL 1293N -1.66 3.08 -0.09 -0.44 1.01 0.50 0.60 120.40 123.41 1nd5 s VAL 1293Ca 0.03 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.41 1nd5 s VAL 1293Cb -0.08 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.99 1nd5 s VAL 1293CO 0.03 0.51 -0.21 -1.61 0.00 0.00 0.00 175.10 173.81 1nd5 s GLU 1294N 0.59 2.64 -0.04 2.72 2.02 0.13 -0.74 118.70 126.02 1nd5 s GLU 1294Ca -0.07 -0.76 0.05 0.00 0.02 0.00 0.00 54.97 54.21 1nd5 s GLU 1294Cb -0.15 -2.05 -0.02 0.00 0.10 0.00 0.00 34.13 32.00 1nd5 s GLU 1294CO 0.03 0.16 -0.18 -1.64 0.02 0.00 0.00 175.26 173.65 1nd5 s MET 1295N 0.36 2.40 0.06 1.61 -1.94 -1.26 -0.39 119.30 120.15 1nd5 s MET 1295Ca -0.16 -0.77 0.01 0.00 -1.71 0.00 0.00 55.69 53.06 1nd5 s MET 1295Cb -0.17 -2.27 -0.03 0.00 2.01 0.00 0.00 34.83 34.37 1nd5 s MET 1295CO 0.07 0.59 -0.06 0.71 -0.01 0.00 0.00 175.02 176.32 1nd5 s TYR 1296N -0.65 0.64 -0.28 -0.03 1.51 0.05 -0.90 117.35 117.69 1nd5 s TYR 1296Ca 0.10 -0.73 0.01 0.00 -1.01 0.00 0.00 57.07 55.45 1nd5 s TYR 1296Cb -0.11 -0.40 0.08 0.00 -0.11 0.00 0.00 41.96 41.43 1nd5 s TYR 1296CO 0.00 -0.17 0.00 -0.47 -1.11 0.00 0.00 175.55 173.80 1nd5 s TYR 1297N -2.49 2.60 -0.66 2.71 5.04 0.38 -0.66 117.35 124.26 1nd5 s TYR 1297Ca -0.02 -2.06 -0.18 0.00 -2.44 0.00 0.00 57.07 52.37 1nd5 s TYR 1297Cb -0.02 -1.94 0.12 0.00 0.35 0.00 0.00 41.96 40.47 1nd5 s TYR 1297CO -0.03 -0.84 0.77 0.50 -1.34 0.00 0.00 175.55 174.61 1nd5 s ARG 1298N 1.32 3.18 -0.24 4.97 3.52 0.32 -0.97 118.95 131.05 1nd5 s ARG 1298Ca 0.01 -1.52 0.11 0.00 -0.13 0.00 0.00 55.73 54.20 1nd5 s ARG 1298Cb -0.19 -4.37 0.44 0.00 -1.56 0.00 0.00 34.95 29.28 1nd5 s ARG 1298CO -0.11 -1.54 1.20 0.27 -0.81 0.00 0.00 175.30 174.31 1nd5 n ASN 1299N 6.07 3.01 0.00 -2.12 6.94 -1.26 0.08 115.26 127.98 1nd5 n ASN 1299Ca -0.02 -3.68 0.00 0.00 -0.02 0.00 0.00 54.58 50.86 1nd5 n ASN 1299Cb 0.44 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1nd5 n ASN 1299CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 1nd5 n GLU 1300N -0.85 0.00 0.23 -3.83 0.28 -1.26 -4.83 120.64 110.37 1nd5 n GLU 1300Ca 0.28 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.36 1nd5 n GLU 1300Cb 0.83 0.00 0.54 0.00 1.43 0.00 0.00 31.44 34.24 1nd5 n GLU 1300CO 0.00 0.00 0.00 1.79 -0.16 0.00 0.00 177.13 178.76 1nd5 h THR 1301N 0.00 0.90 0.00 3.84 1.35 -1.99 -3.03 112.91 113.99 1nd5 h THR 1301Ca 0.00 -0.83 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 1nd5 h THR 1301Cb 0.00 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1nd5 h THR 1301CO 0.00 0.22 0.00 0.00 -0.25 0.00 0.00 175.52 175.49 1nd5 n GLN 1302N -3.91 0.03 -4.09 4.72 6.02 -1.26 -4.76 117.38 114.12 1nd5 n GLN 1302Ca -0.02 0.50 -0.12 0.00 -0.01 0.00 0.00 57.00 57.35 1nd5 n GLN 1302Cb 0.31 -1.58 -0.06 0.00 1.02 0.00 0.00 30.24 29.92 1nd5 n GLN 1302CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1nd5 s HIS 1303N -3.09 0.89 0.38 1.08 3.76 -1.14 -5.16 115.29 112.00 1nd5 s HIS 1303Ca 0.00 -1.14 -0.18 0.00 -0.15 0.00 0.00 55.06 53.59 1nd5 s HIS 1303Cb 0.02 -0.14 -0.10 0.00 1.11 0.00 0.00 32.58 33.47 1nd5 s HIS 1303CO 0.06 -0.96 0.86 -1.83 -0.85 0.00 0.00 174.74 172.02 1nd5 s GLU 1304N -3.66 4.14 0.20 1.40 -1.05 -1.26 -4.85 118.70 113.61 1nd5 s GLU 1304Ca 0.30 0.93 -0.30 0.00 -0.15 0.00 0.00 54.97 55.76 1nd5 s GLU 1304Cb 0.01 -2.30 -0.16 0.00 -0.44 0.00 0.00 34.13 31.24 1nd5 s GLU 1304CO 0.15 0.05 0.76 -2.30 0.95 0.00 0.00 175.26 174.87 1nd5 n PRO 1305N -0.51 0.43 -2.52 -4.83 -0.02 -1.26 -4.88 135.00 121.41 1nd5 n PRO 1305Ca 0.05 0.15 -0.42 0.00 -2.02 0.00 0.00 63.50 61.27 1nd5 n PRO 1305Cb 0.54 -1.34 -0.03 0.00 -0.02 0.00 0.00 33.50 32.65 1nd5 n PRO 1305CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1nd5 s TYR 1306N -0.82 3.48 -0.23 6.00 1.51 -0.14 -4.73 117.35 122.41 1nd5 s TYR 1306Ca 0.67 1.42 -0.29 0.00 -1.01 0.00 0.00 57.07 57.85 1nd5 s TYR 1306Cb -0.90 -3.33 -0.02 0.00 -0.11 0.00 0.00 41.96 37.60 1nd5 s TYR 1306CO 0.57 -0.88 1.57 -2.14 -1.11 0.00 0.00 175.55 173.56 1nd5 s PRO 1307N 1.20 3.80 -0.20 -1.71 0.02 -1.26 -0.47 135.00 136.39 1nd5 s PRO 1307Ca 0.56 1.59 -0.14 0.00 0.02 0.00 0.00 61.00 63.03 1nd5 s PRO 1307Cb -0.26 -4.01 -0.04 0.00 0.02 0.00 0.00 34.50 30.20 1nd5 s PRO 1307CO 0.28 -1.28 0.33 -0.51 -0.33 0.00 0.00 177.00 175.49 1nd5 s LEU 1308N 5.11 4.17 -0.06 -5.54 1.43 -0.08 -4.95 118.68 118.76 1nd5 s LEU 1308Ca 0.69 0.44 0.01 0.00 -1.03 0.00 0.00 54.13 54.24 1nd5 s LEU 1308Cb -0.24 -2.40 -0.03 0.00 0.03 0.00 0.00 46.19 43.55 1nd5 s LEU 1308CO 0.28 -0.00 -0.05 -0.32 0.23 0.00 0.00 176.35 176.49 1nd5 s MET 1309N 1.02 2.77 0.03 1.70 -2.45 -1.26 -4.09 119.30 117.02 1nd5 s MET 1309Ca 0.16 -0.54 -0.24 0.00 -1.25 0.00 0.00 55.69 53.82 1nd5 s MET 1309Cb -0.14 -2.62 -0.05 0.00 1.25 0.00 0.00 34.83 33.27 1nd5 s MET 1309CO 0.06 0.66 0.71 -1.17 1.05 0.00 0.00 175.02 176.34 1nd5 s LEU 1310N -0.91 4.44 -0.04 4.11 2.96 -1.26 -4.81 118.68 123.17 1nd5 s LEU 1310Ca 0.13 1.35 -0.30 0.00 -0.22 0.00 0.00 54.13 55.10 1nd5 s LEU 1310Cb -0.11 -3.13 -0.06 0.00 0.50 0.00 0.00 46.19 43.39 1nd5 s LEU 1310CO 0.02 0.04 1.64 -2.16 -1.32 0.00 0.00 176.35 174.58 1nd5 s PRO 1311N -0.08 4.19 0.00 0.98 0.04 -1.26 -1.78 135.00 137.09 1nd5 s PRO 1311Ca 0.36 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.60 1nd5 s PRO 1311Cb -0.20 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.42 1nd5 s PRO 1311CO 0.21 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 176.84 1nd5 n GLY 1312N 4.09 0.96 3.29 0.56 0.00 -1.26 -5.05 105.19 107.79 1nd5 n GLY 1312Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1nd5 n GLY 1312CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nd5 s SER 1314N -1.89 2.24 0.50 0.00 1.04 -1.26 -4.22 113.70 110.10 1nd5 s SER 1314Ca -0.07 0.86 0.15 0.00 0.48 0.00 0.00 55.95 57.37 1nd5 s SER 1314Cb -0.01 -1.31 1.19 0.00 0.10 0.00 0.00 66.02 65.98 1nd5 s SER 1314CO -0.01 -3.33 2.12 -0.65 0.98 0.00 0.00 173.24 172.34 1nd5 h PRO 1315N -2.04 0.12 -3.55 4.02 0.11 -1.92 -3.18 132.00 125.56 1nd5 h PRO 1315Ca -0.50 -0.01 -0.70 0.00 0.11 0.00 0.00 66.00 64.91 1nd5 h PRO 1315Cb 1.31 -0.03 -0.35 0.00 0.11 0.00 0.00 31.00 32.04 1nd5 h PRO 1315CO 0.49 0.08 -0.34 0.45 -0.21 0.00 0.00 178.00 178.47 1nd5 s SER 1316N -6.93 5.29 -0.12 -2.05 0.15 -1.26 -4.26 113.70 104.52 1nd5 s SER 1316Ca -0.06 -2.92 -0.23 0.00 0.70 0.00 0.00 55.95 53.45 1nd5 s SER 1316Cb 0.17 -1.86 -0.03 0.00 -1.71 0.00 0.00 66.02 62.59 1nd5 s SER 1316CO 0.69 -0.36 0.70 0.00 1.20 0.00 0.00 173.24 175.47 1nd5 s PRO 1318N 1.32 4.28 0.28 0.00 0.04 -1.26 0.19 135.00 139.84 1nd5 s PRO 1318Ca 0.35 2.22 0.04 0.00 0.04 0.00 0.00 61.00 63.65 1nd5 s PRO 1318Cb -0.17 -3.18 0.74 0.00 0.04 0.00 0.00 34.50 31.93 1nd5 s PRO 1318CO 0.15 -0.48 1.39 -0.11 0.04 0.00 0.00 177.00 177.98 1nd5 n LEU 1319N 3.57 -0.05 -0.21 -3.56 7.94 0.11 0.11 117.00 124.91 1nd5 n LEU 1319Ca 0.11 1.50 -0.06 0.00 -1.11 0.00 0.00 56.01 56.45 1nd5 n LEU 1319Cb 0.40 -0.57 0.03 0.00 0.53 0.00 0.00 43.42 43.82 1nd5 n LEU 1319CO 0.60 -1.54 1.09 -0.33 -1.11 0.00 0.00 177.39 176.10 1nd5 h GLU 1320N 0.00 0.80 -0.21 1.96 4.39 -1.90 0.29 114.58 119.91 1nd5 h GLU 1320Ca 0.56 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 60.14 1nd5 h GLU 1320Cb 1.22 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.69 1nd5 h GLU 1320CO -0.81 0.57 -0.09 -0.09 -1.16 0.00 0.00 179.01 177.42 1nd5 h ARG 1321N 0.80 0.44 -0.15 2.33 9.65 0.39 -2.51 114.38 125.33 1nd5 h ARG 1321Ca 0.21 -0.19 0.05 0.00 -1.10 0.00 0.00 59.98 58.95 1nd5 h ARG 1321Cb -0.03 -0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 28.48 1nd5 h ARG 1321CO -0.04 0.71 -0.20 0.35 2.80 0.00 0.00 179.97 183.59 1nd5 h PHE 1322N 0.14 -0.53 -0.78 2.20 3.57 -0.48 -1.71 116.94 119.35 1nd5 h PHE 1322Ca 0.05 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.65 1nd5 h PHE 1322Cb 0.58 0.26 -0.06 0.00 2.79 0.00 0.00 35.95 39.51 1nd5 h PHE 1322CO 0.06 -0.28 0.45 0.00 -2.23 0.00 0.00 178.31 176.32 1nd5 h ALA 1323N 0.77 1.09 0.46 2.41 0.00 -0.91 -1.99 119.26 121.09 1nd5 h ALA 1323Ca 0.11 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1nd5 h ALA 1323Cb 0.40 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1nd5 h ALA 1323CO -0.29 0.12 -0.22 1.49 0.00 0.00 0.00 179.25 180.35 1nd5 h GLU 1324N 0.80 -0.59 -0.43 0.00 4.81 -0.96 -0.55 114.58 117.66 1nd5 h GLU 1324Ca 0.36 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.64 1nd5 h GLU 1324Cb 0.26 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 1nd5 h GLU 1324CO -0.21 -0.33 0.28 -0.07 -0.73 0.00 0.00 179.01 177.95 1nd5 h LEU 1325N -0.75 0.49 -0.21 1.64 3.38 -1.25 -2.60 115.31 116.01 1nd5 h LEU 1325Ca -0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1nd5 h LEU 1325Cb 0.54 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1nd5 h LEU 1325CO 0.10 0.36 0.00 1.62 0.09 0.00 0.00 178.44 180.61 1nd5 h VAL 1326N 0.58 0.00 -0.82 1.22 3.04 -1.40 -3.36 116.25 115.52 1nd5 h VAL 1326Ca 0.16 -0.46 0.18 0.00 -1.01 0.00 0.00 66.70 65.56 1nd5 h VAL 1326Cb -0.07 1.40 -0.11 0.00 -2.01 0.00 0.00 31.29 30.50 1nd5 h VAL 1326CO -0.04 0.00 0.33 1.23 -1.01 0.00 0.00 177.57 178.08 1nd5 h GLY 1327N 3.89 1.30 2.00 3.17 0.00 -0.68 -2.24 103.07 110.50 1nd5 h GLY 1327Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1nd5 h GLY 1327CO 0.00 -0.17 0.00 -1.55 0.00 0.00 0.00 176.54 174.82 1nd5 n PRO 1328N -5.03 0.00 -0.16 4.80 -0.04 -1.26 -1.79 135.00 131.52 1nd5 n PRO 1328Ca 0.18 0.42 0.10 0.00 -0.04 0.00 0.00 63.50 64.15 1nd5 n PRO 1328Cb 0.52 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.65 1nd5 n PRO 1328CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1nd5 n VAL 1329N -1.51 0.51 -3.63 0.52 0.24 -0.84 -4.81 118.33 108.80 1nd5 n VAL 1329Ca 0.01 -0.75 -0.39 0.00 -2.04 0.00 0.00 64.34 61.17 1nd5 n VAL 1329Cb 0.06 0.95 -0.11 0.00 -1.47 0.00 0.00 33.84 33.27 1nd5 n VAL 1329CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1nd5 s ILE 1330N -1.33 4.69 0.38 1.34 1.01 -0.74 -3.60 121.20 122.95 1nd5 s ILE 1330Ca 0.33 -0.45 -0.26 0.00 0.00 0.00 0.00 60.65 60.27 1nd5 s ILE 1330Cb 0.19 -3.42 -0.09 0.00 0.01 0.00 0.00 42.46 39.15 1nd5 s ILE 1330CO 0.27 0.02 1.18 -2.16 0.00 0.00 0.00 174.94 174.24 1nd5 s PRO 1331N 1.62 4.17 -0.05 2.79 0.04 -1.26 -4.98 135.00 137.33 1nd5 s PRO 1331Ca 0.04 1.88 0.10 0.00 0.04 0.00 0.00 61.00 63.06 1nd5 s PRO 1331Cb -0.17 -2.79 -0.24 0.00 0.04 0.00 0.00 34.50 31.35 1nd5 s PRO 1331CO 0.07 -0.23 0.62 1.04 0.04 0.00 0.00 177.00 178.54 1nd5 n GLN 1332N 0.30 0.65 -2.94 4.56 1.13 -1.26 -4.66 117.38 115.17 1nd5 n GLN 1332Ca 0.03 0.29 -0.14 0.00 -1.94 0.00 0.00 57.00 55.24 1nd5 n GLN 1332Cb 0.46 -1.78 -0.00 0.00 0.11 0.00 0.00 30.24 29.02 1nd5 n GLN 1332CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1nd5 n ASP 1333N -3.11 -1.77 -0.28 1.08 4.64 -1.26 -5.03 116.55 110.83 1nd5 n ASP 1333Ca -0.19 -3.01 -0.07 0.00 -1.38 0.00 0.00 54.79 50.13 1nd5 n ASP 1333Cb 1.05 0.85 -0.07 0.00 -1.04 0.00 0.00 41.12 41.92 1nd5 n ASP 1333CO 0.00 0.00 0.00 1.87 -0.82 0.00 0.00 177.20 178.25 1nd5 n TRP 1334N 1.74 -0.29 -0.30 -0.67 -0.00 -1.26 -0.50 117.44 116.16 1nd5 n TRP 1334Ca 0.15 0.82 0.06 0.00 -0.00 0.00 0.00 57.50 58.53 1nd5 n TRP 1334Cb 0.58 -0.54 0.15 0.00 -0.00 0.00 0.00 31.31 31.51 1nd5 n TRP 1334CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 177.69 178.46 1nd5 h SER 1335N 0.00 -0.63 0.09 5.87 0.02 -1.99 -0.85 113.55 116.07 1nd5 h SER 1335Ca 0.11 0.25 -0.22 0.00 -0.84 0.00 0.00 61.79 61.08 1nd5 h SER 1335Cb 0.27 0.48 0.01 0.00 0.14 0.00 0.00 62.40 63.29 1nd5 h SER 1335CO -0.62 -0.27 -0.86 0.74 -1.14 0.00 0.00 176.83 174.68 1nd5 h THR 1336N 0.03 1.33 0.00 -2.27 2.02 -1.22 -2.92 112.91 109.88 1nd5 h THR 1336Ca 0.44 -2.18 0.00 0.00 0.77 0.00 0.00 66.41 65.45 1nd5 h THR 1336Cb 0.76 2.19 0.00 0.00 -1.74 0.00 0.00 68.15 69.36 1nd5 h THR 1336CO -0.83 0.67 0.00 -0.62 0.37 0.00 0.00 175.52 175.11 1nd5 n GLU 1337N -3.85 0.28 0.07 6.66 1.02 -0.41 -2.02 120.64 122.39 1nd5 n GLU 1337Ca -0.07 0.11 0.11 0.00 -0.02 0.00 0.00 57.16 57.29 1nd5 n GLU 1337Cb 0.79 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.67 1nd5 n GLU 1337CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nd5 s MET 1339N -3.40 -0.26 0.00 0.00 -1.94 -0.86 0.29 119.30 113.14 1nd5 s MET 1339Ca -0.02 -0.15 0.00 0.00 -1.71 0.00 0.00 55.69 53.81 1nd5 s MET 1339Cb 0.11 -1.72 0.00 0.00 2.01 0.00 0.00 34.83 35.23 1nd5 s MET 1339CO 0.82 -3.06 0.00 -2.37 -0.01 0.00 0.00 175.02 170.40 1nd5 n THR 1340N -4.28 0.00 0.33 2.05 5.66 -1.26 -4.42 114.28 112.36 1nd5 n THR 1340Ca 0.13 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.17 1nd5 n THR 1340Cb 0.59 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.41 1nd5 n THR 1340CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09