#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmx s PHE 1048N 0.00 1.57 0.29 7.33 0.08 -1.26 -4.95 117.98 121.05 2kmx s PHE 1048Ca 0.00 -0.77 -0.22 0.00 0.12 0.00 0.00 56.93 56.06 2kmx s PHE 1048Cb 0.00 -0.84 -0.09 0.00 -0.57 0.00 0.00 43.02 41.51 2kmx s PHE 1048CO 0.00 0.13 0.84 0.99 -0.10 0.00 0.00 175.22 177.08 2kmx s THR 1049N -3.23 4.39 -0.05 0.64 2.01 -1.26 -5.00 115.64 113.14 2kmx s THR 1049Ca 0.24 1.53 -0.02 0.00 0.31 0.00 0.00 61.69 63.76 2kmx s THR 1049Cb 0.03 -3.90 -0.01 0.00 0.01 0.00 0.00 72.50 68.64 2kmx s THR 1049CO 0.07 0.12 -0.04 -0.03 -0.69 0.00 0.00 174.62 174.05 2kmx h MET 1050N 3.13 0.00 0.00 4.92 4.05 -2.04 -3.48 114.93 121.51 2kmx h MET 1050Ca -0.47 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 58.88 2kmx h MET 1050Cb 1.19 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.98 2kmx h MET 1050CO 0.65 0.00 -1.11 0.72 0.23 0.00 0.00 176.91 177.40 2kmx n HIS 1051N -3.20 0.00 -3.74 1.39 8.25 -1.26 -5.08 115.22 111.58 2kmx n HIS 1051Ca -0.01 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.25 2kmx n HIS 1051Cb 0.05 -0.15 -0.17 0.00 1.12 0.00 0.00 29.99 30.84 2kmx n HIS 1051CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2kmx s GLY 1052N -4.96 0.27 0.22 -1.41 0.00 -1.26 -5.11 107.32 95.07 2kmx s GLY 1052Ca -0.06 0.12 -0.30 0.00 0.00 0.00 0.00 44.72 44.48 2kmx s GLY 1052CO 0.08 1.16 0.93 -1.59 0.00 0.00 0.00 173.10 173.68 2kmx s THR 1053N 1.87 4.14 0.52 0.90 2.01 -1.26 -4.90 115.64 118.92 2kmx s THR 1053Ca 0.02 2.06 -0.20 0.00 0.31 0.00 0.00 61.69 63.88 2kmx s THR 1053Cb -0.12 -4.32 -0.07 0.00 0.01 0.00 0.00 72.50 68.00 2kmx s THR 1053CO -0.03 0.48 1.09 -2.16 -0.69 0.00 0.00 174.62 173.30 2kmx s PRO 1054N -1.02 3.57 -0.03 4.92 0.04 -1.26 -2.63 135.00 138.59 2kmx s PRO 1054Ca 0.41 1.49 0.01 0.00 0.04 0.00 0.00 61.00 62.96 2kmx s PRO 1054Cb -0.25 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.25 2kmx s PRO 1054CO 0.31 -0.65 -0.05 0.54 0.04 0.00 0.00 177.00 177.20 2kmx s VAL 1055N -1.87 0.50 -0.10 -0.36 0.11 -1.03 -4.80 120.40 112.85 2kmx s VAL 1055Ca 0.70 -0.17 -0.30 0.00 -2.93 0.00 0.00 61.98 59.29 2kmx s VAL 1055Cb -0.20 -0.49 -0.03 0.00 -1.53 0.00 0.00 36.38 34.12 2kmx s VAL 1055CO 0.23 0.19 1.40 0.54 -3.33 0.00 0.00 175.10 174.14 2kmx s VAL 1056N 0.52 3.97 -0.19 2.04 0.11 -1.26 -0.83 120.40 124.76 2kmx s VAL 1056Ca -0.07 1.21 -0.04 0.00 -2.93 0.00 0.00 61.98 60.16 2kmx s VAL 1056Cb -0.10 -3.78 -0.10 0.00 -1.53 0.00 0.00 36.38 30.87 2kmx s VAL 1056CO -0.00 -0.08 -0.20 -3.20 -3.33 0.00 0.00 175.10 168.28 2kmx n ASN 1057N 6.49 2.01 -3.90 3.54 5.15 0.11 -4.92 115.26 123.75 2kmx n ASN 1057Ca 0.15 0.06 -0.11 0.00 -0.60 0.00 0.00 54.58 54.08 2kmx n ASN 1057Cb 0.44 -0.42 -0.11 0.00 -0.53 0.00 0.00 39.78 39.17 2kmx n ASN 1057CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2kmx s GLN 1058N -2.36 0.38 0.07 1.20 0.74 -0.97 -5.03 119.66 113.70 2kmx s GLN 1058Ca -0.25 -0.40 0.06 0.00 0.05 0.00 0.00 55.36 54.82 2kmx s GLN 1058Cb 0.08 0.15 -0.03 0.00 1.10 0.00 0.00 33.01 34.32 2kmx s GLN 1058CO 0.38 -0.08 -0.16 0.14 -0.55 0.00 0.00 175.29 175.02 2kmx s VAL 1059N -1.22 1.25 0.01 1.34 -7.23 -1.26 -0.75 120.40 112.53 2kmx s VAL 1059Ca -0.13 -1.25 -0.02 0.00 -1.81 0.00 0.00 61.98 58.77 2kmx s VAL 1059Cb -0.07 -1.16 -0.01 0.00 0.56 0.00 0.00 36.38 35.70 2kmx s VAL 1059CO 0.01 -0.10 0.03 -0.75 -0.31 0.00 0.00 175.10 173.97 2kmx s LYS 1060N -1.56 0.29 -0.12 4.82 2.36 -0.43 -5.02 119.74 120.08 2kmx s LYS 1060Ca 0.01 -0.41 -0.04 0.00 -2.55 0.00 0.00 55.97 52.98 2kmx s LYS 1060Cb -0.09 0.11 -0.04 0.00 -1.05 0.00 0.00 37.83 36.76 2kmx s LYS 1060CO 0.02 -0.05 0.03 0.08 1.55 0.00 0.00 175.35 176.98 2kmx s VAL 1061N -1.10 4.58 -0.05 4.02 1.01 -1.26 -0.85 120.40 126.74 2kmx s VAL 1061Ca -0.12 -0.13 0.11 0.00 0.00 0.00 0.00 61.98 61.84 2kmx s VAL 1061Cb -0.07 -2.98 -0.17 0.00 0.00 0.00 0.00 36.38 33.16 2kmx s VAL 1061CO -0.00 0.56 0.18 -0.11 0.00 0.00 0.00 175.10 175.73 2kmx n LEU 1062N 2.56 0.00 -3.78 3.92 7.94 0.65 -4.89 117.00 123.41 2kmx n LEU 1062Ca -0.18 0.00 -0.28 0.00 -1.11 0.00 0.00 56.01 54.44 2kmx n LEU 1062Cb 0.53 0.11 -0.16 0.00 0.53 0.00 0.00 43.42 44.43 2kmx n LEU 1062CO 0.31 0.11 -0.38 -0.89 -1.11 0.00 0.00 177.39 175.43 2kmx s THR 1063N -2.62 0.71 0.21 1.96 2.01 -0.84 -4.90 115.64 112.17 2kmx s THR 1063Ca -0.05 -0.66 0.11 0.00 0.31 0.00 0.00 61.69 61.40 2kmx s THR 1063Cb 0.06 -1.16 -0.04 0.00 0.01 0.00 0.00 72.50 71.37 2kmx s THR 1063CO 0.49 -0.17 -0.19 -1.83 -0.69 0.00 0.00 174.62 172.23 2kmx s GLU 1064N 1.77 1.70 0.00 4.92 -1.05 -1.26 -4.49 118.70 120.30 2kmx s GLU 1064Ca -0.02 -1.52 0.00 0.00 -0.15 0.00 0.00 54.97 53.29 2kmx s GLU 1064Cb -0.17 -1.91 0.00 0.00 -0.44 0.00 0.00 34.13 31.61 2kmx s GLU 1064CO -0.08 0.39 0.00 0.43 0.95 0.00 0.00 175.26 176.96 2kmx n SER 1065N -0.01 -2.04 0.00 0.83 7.64 -0.50 -4.59 113.62 114.95 2kmx n SER 1065Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.78 2kmx n SER 1065Cb 0.57 -2.64 0.00 0.00 -1.01 0.00 0.00 64.21 61.13 2kmx n SER 1065CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2kmx n ASN 1066N -0.24 0.60 0.00 6.43 3.02 -1.26 -4.95 115.26 118.86 2kmx n ASN 1066Ca 0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.30 2kmx n ASN 1066Cb 0.17 0.63 0.00 0.00 -0.61 0.00 0.00 39.78 39.97 2kmx n ASN 1066CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 2kmx n ARG 1067N -0.69 0.00 -4.17 3.52 3.00 -1.26 -5.15 116.66 111.92 2kmx n ARG 1067Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.85 57.75 2kmx n ARG 1067Cb 0.00 -0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.35 2kmx n ARG 1067CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2kmx s ILE 1068N -1.89 0.19 0.10 5.15 -1.09 -1.26 -5.14 121.20 117.26 2kmx s ILE 1068Ca 0.00 -1.92 -0.03 0.00 -2.23 0.00 0.00 60.65 56.46 2kmx s ILE 1068Cb 0.00 -2.08 -0.03 0.00 -1.58 0.00 0.00 42.46 38.77 2kmx s ILE 1068CO 0.00 -0.45 0.08 -0.44 -1.23 0.00 0.00 174.94 172.90 2kmx s SER 1069N -3.07 0.30 0.21 3.58 0.01 -1.26 -1.41 113.70 112.05 2kmx s SER 1069Ca 0.25 -0.98 -0.16 0.00 1.31 0.00 0.00 55.95 56.36 2kmx s SER 1069Cb 0.07 0.29 0.21 0.00 0.21 0.00 0.00 66.02 66.80 2kmx s SER 1069CO 0.03 -0.70 1.60 -0.74 0.41 0.00 0.00 173.24 173.83 2kmx h HIS 1070N 2.90 -0.63 0.00 2.43 2.76 -1.98 0.03 115.15 120.67 2kmx h HIS 1070Ca -0.34 0.07 -0.14 0.00 -2.20 0.00 0.00 60.37 57.75 2kmx h HIS 1070Cb 1.18 0.37 -0.02 0.00 1.55 0.00 0.00 27.41 30.50 2kmx h HIS 1070CO 0.46 -0.34 -0.68 1.25 -1.30 0.00 0.00 177.93 177.32 2kmx h HIS 1071N -0.07 0.00 -0.29 5.26 -0.00 -1.99 -2.09 115.15 115.97 2kmx h HIS 1071Ca 0.29 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 60.52 2kmx h HIS 1071Cb 0.53 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.94 2kmx h HIS 1071CO -0.60 0.68 -0.35 0.87 -0.00 0.00 0.00 177.93 178.53 2kmx h LYS 1072N 0.00 0.75 0.17 5.26 1.57 -1.75 -2.46 116.57 120.10 2kmx h LYS 1072Ca -0.01 -0.42 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2kmx h LYS 1072Cb 1.29 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.61 2kmx h LYS 1072CO 0.09 1.04 -0.16 0.82 -0.57 0.00 0.00 179.45 180.67 2kmx h ILE 1073N 0.50 0.64 -0.18 1.86 2.04 -0.89 -1.60 117.51 119.87 2kmx h ILE 1073Ca 0.04 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.84 2kmx h ILE 1073Cb 0.93 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 2kmx h ILE 1073CO 0.08 0.00 -0.15 0.17 0.00 0.00 0.00 178.15 178.26 2kmx h LEU 1074N -0.36 0.28 0.08 1.44 8.10 -1.45 -2.36 115.31 121.05 2kmx h LEU 1074Ca 0.00 -0.07 -0.00 0.00 0.11 0.00 0.00 57.88 57.92 2kmx h LEU 1074Cb 0.34 -0.08 0.00 0.00 -0.44 0.00 0.00 40.66 40.48 2kmx h LEU 1074CO -0.04 0.46 -0.04 0.00 -4.11 0.00 0.00 178.44 174.71 2kmx h ALA 1075N 1.57 -0.11 -0.03 0.17 0.00 -1.19 -1.45 119.26 118.22 2kmx h ALA 1075Ca 0.05 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 2kmx h ALA 1075Cb 0.43 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2kmx h ALA 1075CO 0.03 -0.41 -0.51 -0.84 0.00 0.00 0.00 179.25 177.51 2kmx h ILE 1076N -0.42 1.36 -0.04 0.00 3.07 -1.17 -0.78 117.51 119.54 2kmx h ILE 1076Ca -0.01 -1.77 -0.02 0.00 1.55 0.00 0.00 64.86 64.61 2kmx h ILE 1076Cb 0.36 1.92 -0.00 0.00 -0.27 0.00 0.00 36.82 38.83 2kmx h ILE 1076CO 0.02 0.51 -0.06 0.58 -1.05 0.00 0.00 178.15 178.15 2kmx h VAL 1077N 0.07 1.42 -0.24 0.16 2.07 -1.49 -2.73 116.25 115.51 2kmx h VAL 1077Ca -0.00 -1.34 -0.10 0.00 0.82 0.00 0.00 66.70 66.08 2kmx h VAL 1077Cb 0.94 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.93 2kmx h VAL 1077CO 0.07 0.36 -0.29 1.23 0.02 0.00 0.00 177.57 178.97 2kmx h GLY 1078N -0.41 0.52 1.56 2.17 0.00 -1.16 -3.10 103.07 102.65 2kmx h GLY 1078Ca 0.00 -0.44 -0.20 0.00 0.00 0.00 0.00 47.33 46.69 2kmx h GLY 1078CO 0.01 0.40 -0.82 -0.91 0.00 0.00 0.00 176.54 175.23 2kmx h THR 1079N 0.42 1.39 -0.49 4.70 1.35 -1.25 -3.23 112.91 115.79 2kmx h THR 1079Ca 0.06 -2.27 0.08 0.00 -0.55 0.00 0.00 66.41 63.73 2kmx h THR 1079Cb 0.72 2.24 -0.03 0.00 -1.73 0.00 0.00 68.15 69.35 2kmx h THR 1079CO 0.05 0.68 0.34 0.00 -0.25 0.00 0.00 175.52 176.34 2kmx h ALA 1080N 0.85 2.06 0.00 6.62 0.00 -1.40 -1.24 119.26 126.14 2kmx h ALA 1080Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2kmx h ALA 1080Cb 1.42 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2kmx h ALA 1080CO 0.14 -0.17 0.00 0.39 0.00 0.00 0.00 179.25 179.62 2kmx n GLU 1081N -4.46 0.03 0.13 0.00 -0.58 -1.22 -4.51 120.64 110.02 2kmx n GLU 1081Ca 0.07 0.05 -0.14 0.00 -0.42 0.00 0.00 57.16 56.73 2kmx n GLU 1081Cb 0.34 -1.53 -0.08 0.00 -0.57 0.00 0.00 31.44 29.60 2kmx n GLU 1081CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2kmx h SER 1082N 0.00 -0.22 -0.00 1.62 0.87 -1.30 -2.39 113.55 112.12 2kmx h SER 1082Ca 0.00 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2kmx h SER 1082Cb 0.50 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 2kmx h SER 1082CO 0.00 -0.10 0.00 0.59 -0.53 0.00 0.00 176.83 176.79 2kmx n ASN 1083N -5.18 0.11 -4.18 6.23 3.02 -1.26 -4.93 115.26 109.08 2kmx n ASN 1083Ca -0.09 -1.15 -0.30 0.00 -0.03 0.00 0.00 54.58 53.01 2kmx n ASN 1083Cb 0.15 -0.00 0.18 0.00 -0.61 0.00 0.00 39.78 39.50 2kmx n ASN 1083CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2kmx s SER 1084N -1.88 3.13 0.00 6.41 0.15 -0.90 -5.04 113.70 115.57 2kmx s SER 1084Ca 0.42 0.33 0.00 0.00 0.70 0.00 0.00 55.95 57.39 2kmx s SER 1084Cb 0.19 -0.41 0.00 0.00 -1.71 0.00 0.00 66.02 64.09 2kmx s SER 1084CO 0.32 -2.73 0.55 -1.84 1.20 0.00 0.00 173.24 170.74 2kmx n GLU 1085N -3.78 -0.00 -2.13 5.44 0.28 -1.26 -4.98 120.64 114.21 2kmx n GLU 1085Ca 0.15 -0.66 -0.31 0.00 -0.16 0.00 0.00 57.16 56.18 2kmx n GLU 1085Cb 0.60 -0.93 -0.00 0.00 1.43 0.00 0.00 31.44 32.54 2kmx n GLU 1085CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 2kmx s HIS 1086N -0.21 3.57 0.03 -1.84 3.76 -1.26 -1.94 115.29 117.40 2kmx s HIS 1086Ca 0.00 1.28 0.04 0.00 -0.15 0.00 0.00 55.06 56.23 2kmx s HIS 1086Cb 0.00 -2.68 -0.24 0.00 1.11 0.00 0.00 32.58 30.76 2kmx s HIS 1086CO 0.00 -0.54 0.96 -1.00 -0.85 0.00 0.00 174.74 173.31 2kmx h PRO 1087N 0.13 0.10 0.00 8.40 0.13 -1.94 -3.38 132.00 135.44 2kmx h PRO 1087Ca -0.45 -0.18 -0.19 0.00 -0.87 0.00 0.00 66.00 64.31 2kmx h PRO 1087Cb 1.19 0.07 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 2kmx h PRO 1087CO 0.62 0.92 -1.50 -0.11 -0.23 0.00 0.00 178.00 177.70 2kmx n LEU 1088N -3.32 1.92 0.25 1.56 0.00 -1.26 -4.54 117.00 111.61 2kmx n LEU 1088Ca -0.11 0.38 0.08 0.00 0.00 0.00 0.00 56.01 56.37 2kmx n LEU 1088Cb 1.01 -0.81 0.62 0.00 0.00 0.00 0.00 43.42 44.24 2kmx n LEU 1088CO 0.48 0.06 0.98 1.23 0.00 0.00 0.00 177.39 180.13 2kmx h GLY 1089N -1.00 0.00 2.00 -3.96 0.00 -1.99 -2.26 103.07 95.86 2kmx h GLY 1089Ca -0.28 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.04 2kmx h GLY 1089CO -0.17 0.00 -0.02 -0.91 0.00 0.00 0.00 176.54 175.44 2kmx h THR 1090N 0.00 0.29 -0.10 4.70 1.35 -1.80 0.07 112.91 117.42 2kmx h THR 1090Ca -0.00 -0.10 -0.06 0.00 -0.55 0.00 0.00 66.41 65.70 2kmx h THR 1090Cb 0.21 1.08 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 2kmx h THR 1090CO 0.01 0.02 -0.21 0.00 -0.25 0.00 0.00 175.52 175.09 2kmx h ALA 1091N 1.98 1.46 -0.09 6.62 0.00 -1.65 -2.57 119.26 125.01 2kmx h ALA 1091Ca -0.00 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.49 2kmx h ALA 1091Cb 0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2kmx h ALA 1091CO 0.00 0.38 -0.67 0.82 0.00 0.00 0.00 179.25 179.78 2kmx h ILE 1092N 0.16 1.37 -0.56 0.00 2.04 -1.15 -2.79 117.51 116.58 2kmx h ILE 1092Ca 0.03 -2.06 0.10 0.00 1.00 0.00 0.00 64.86 63.93 2kmx h ILE 1092Cb 0.47 2.04 -0.07 0.00 -0.74 0.00 0.00 36.82 38.51 2kmx h ILE 1092CO 0.03 0.62 0.15 0.74 0.00 0.00 0.00 178.15 179.69 2kmx h THR 1093N 0.27 0.71 -0.26 -0.27 2.02 -1.24 -0.94 112.91 113.20 2kmx h THR 1093Ca -0.02 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.06 2kmx h THR 1093Cb 1.23 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 2kmx h THR 1093CO 0.11 0.05 0.17 0.50 0.37 0.00 0.00 175.52 176.73 2kmx h LYS 1094N 0.30 0.35 -0.53 6.66 3.64 -1.43 0.14 116.57 125.70 2kmx h LYS 1094Ca 0.29 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.71 2kmx h LYS 1094Cb 0.39 -0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 32.07 2kmx h LYS 1094CO -0.34 0.26 0.20 -0.92 -2.27 0.00 0.00 179.45 176.37 2kmx h TYR 1095N 0.34 0.35 0.20 1.91 5.03 -1.20 -0.35 116.97 123.26 2kmx h TYR 1095Ca 0.10 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.42 2kmx h TYR 1095Cb -0.01 -0.08 0.00 0.00 1.55 0.00 0.00 36.73 38.19 2kmx h TYR 1095CO -0.05 0.12 -0.10 0.00 -1.32 0.00 0.00 178.16 176.81 2kmx h LYS 1097N -0.60 0.67 -0.07 0.00 3.11 -0.47 0.95 116.57 120.17 2kmx h LYS 1097Ca -0.03 -0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 57.76 2kmx h LYS 1097Cb 0.44 -0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 31.51 2kmx h LYS 1097CO 0.05 0.44 -0.02 0.37 -2.81 0.00 0.00 179.45 177.48 2kmx h GLN 1098N 0.69 0.14 -0.73 1.90 4.15 -1.14 -3.02 115.11 117.11 2kmx h GLN 1098Ca 0.22 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.57 2kmx h GLN 1098Cb 0.04 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.69 2kmx h GLN 1098CO -0.06 0.48 0.40 1.49 -1.93 0.00 0.00 178.83 179.21 2kmx h GLU 1099N -0.22 1.00 0.00 1.69 4.57 -0.69 -2.72 114.58 118.21 2kmx h GLU 1099Ca 0.02 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 2kmx h GLU 1099Cb 0.43 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 2kmx h GLU 1099CO 0.01 0.74 0.00 -0.07 -1.18 0.00 0.00 179.01 178.50 2kmx h LEU 1100N 1.01 0.00 2.68 1.64 3.38 -0.94 -3.48 115.31 119.60 2kmx h LEU 1100Ca 0.26 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.88 2kmx h LEU 1100Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2kmx h LEU 1100CO -0.04 0.00 -0.46 -0.67 0.09 0.00 0.00 178.44 177.36 2kmx n ASP 1101N -2.61 -5.10 -4.78 -0.43 2.03 -1.03 -5.02 116.55 99.60 2kmx n ASP 1101Ca 0.03 0.04 -0.22 0.00 0.52 0.00 0.00 54.79 55.16 2kmx n ASP 1101Cb 0.36 -4.27 -0.05 0.00 -0.72 0.00 0.00 41.12 36.44 2kmx n ASP 1101CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2kmx s THR 1102N -2.88 4.19 -1.08 5.18 -1.32 -1.20 -5.03 115.64 113.50 2kmx s THR 1102Ca 0.02 -1.53 0.22 0.00 -1.21 0.00 0.00 61.69 59.19 2kmx s THR 1102Cb -0.01 -3.25 -0.15 0.00 -1.51 0.00 0.00 72.50 67.57 2kmx s THR 1102CO 0.03 -0.35 1.04 1.21 -2.21 0.00 0.00 174.62 174.34 2kmx n GLU 1103N -1.09 0.09 -3.77 7.08 2.13 -1.26 -4.72 120.64 119.11 2kmx n GLU 1103Ca -0.07 -0.07 -0.14 0.00 0.66 0.00 0.00 57.16 57.53 2kmx n GLU 1103Cb 0.58 -1.50 -0.15 0.00 0.27 0.00 0.00 31.44 30.64 2kmx n GLU 1103CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 2kmx s THR 1104N -2.96 -0.05 0.11 6.31 -1.32 -1.26 -5.16 115.64 111.32 2kmx s THR 1104Ca 0.10 0.18 -0.25 0.00 -1.21 0.00 0.00 61.69 60.51 2kmx s THR 1104Cb 0.17 -0.16 0.08 0.00 -1.51 0.00 0.00 72.50 71.07 2kmx s THR 1104CO 0.81 0.07 0.75 -1.48 -2.21 0.00 0.00 174.62 172.56 2kmx s LEU 1105N 1.03 -0.42 -0.55 9.08 2.34 -1.26 -5.06 118.68 123.83 2kmx s LEU 1105Ca -0.08 -0.11 -0.12 0.00 0.06 0.00 0.00 54.13 53.88 2kmx s LEU 1105Cb -0.11 2.36 0.02 0.00 -0.56 0.00 0.00 46.19 47.90 2kmx s LEU 1105CO -0.04 -0.88 0.64 0.61 -1.06 0.00 0.00 176.35 175.62 2kmx n GLY 1106N -0.35 -1.19 0.05 -3.48 0.00 -1.26 -4.80 105.19 94.16 2kmx n GLY 1106Ca -0.12 0.98 -0.13 0.00 0.00 0.00 0.00 46.02 46.76 2kmx n GLY 1106CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2kmx h THR 1107N 1.43 1.31 -3.89 2.61 2.02 -1.87 -3.40 112.91 111.12 2kmx h THR 1107Ca -0.07 -0.95 -0.29 0.00 0.77 0.00 0.00 66.41 65.87 2kmx h THR 1107Cb 1.05 1.96 -0.27 0.00 -1.74 0.00 0.00 68.15 69.15 2kmx h THR 1107CO 0.24 0.25 -0.74 0.00 0.37 0.00 0.00 175.52 175.63 2kmx s ILE 1109N -0.40 1.18 -0.69 0.00 -0.00 -1.26 -1.88 121.20 118.15 2kmx s ILE 1109Ca -0.01 -1.18 0.05 0.00 -0.00 0.00 0.00 60.65 59.51 2kmx s ILE 1109Cb -0.04 -1.10 0.17 0.00 -0.00 0.00 0.00 42.46 41.50 2kmx s ILE 1109CO -0.00 -0.09 0.48 -0.62 -0.00 0.00 0.00 174.94 174.71 2kmx s ASP 1110N -1.44 4.80 -0.00 4.36 2.15 -0.39 -4.91 116.67 121.24 2kmx s ASP 1110Ca 0.01 -3.79 -0.18 0.00 0.43 0.00 0.00 52.55 49.02 2kmx s ASP 1110Cb -0.09 -1.64 -0.06 0.00 -0.30 0.00 0.00 42.92 40.83 2kmx s ASP 1110CO 0.02 -0.10 0.50 0.72 -0.17 0.00 0.00 175.17 176.14 2kmx s PHE 1111N -1.36 3.70 -0.33 -5.34 -0.71 -1.26 -2.77 117.98 109.90 2kmx s PHE 1111Ca 0.24 1.09 0.03 0.00 -1.04 0.00 0.00 56.93 57.25 2kmx s PHE 1111Cb -0.06 -2.46 0.09 0.00 -1.21 0.00 0.00 43.02 39.38 2kmx s PHE 1111CO -0.15 0.48 0.04 -0.65 -1.34 0.00 0.00 175.22 173.60 2kmx s GLN 1112N -0.59 1.69 -0.07 1.99 1.11 0.57 -4.99 119.66 119.36 2kmx s GLN 1112Ca 0.27 -1.77 -0.06 0.00 0.01 0.00 0.00 55.36 53.81 2kmx s GLN 1112Cb -0.17 -3.20 -0.04 0.00 -1.01 0.00 0.00 33.01 28.58 2kmx s GLN 1112CO 0.15 -0.89 0.17 0.14 0.01 0.00 0.00 175.29 174.87 2kmx s VAL 1113N 0.97 5.46 -0.38 1.09 -7.23 -1.26 -1.30 120.40 117.75 2kmx s VAL 1113Ca 0.07 0.11 0.00 0.00 -1.81 0.00 0.00 61.98 60.36 2kmx s VAL 1113Cb -0.20 -3.46 0.13 0.00 0.56 0.00 0.00 36.38 33.41 2kmx s VAL 1113CO -0.07 0.51 0.19 -0.69 -0.31 0.00 0.00 175.10 174.74 2kmx s VAL 1114N -1.14 0.84 0.61 1.32 1.01 -0.57 -5.01 120.40 117.47 2kmx s VAL 1114Ca 0.20 -1.95 -0.19 0.00 0.00 0.00 0.00 61.98 60.05 2kmx s VAL 1114Cb -0.12 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 2kmx s VAL 1114CO 0.09 -0.86 1.10 -2.65 0.00 0.00 0.00 175.10 172.78 2kmx n PRO 1115N 4.09 1.03 -1.21 2.72 -0.02 -1.26 -1.75 135.00 138.59 2kmx n PRO 1115Ca 0.06 0.40 -0.07 0.00 -2.02 0.00 0.00 63.50 61.87 2kmx n PRO 1115Cb 0.37 -2.31 -0.03 0.00 -0.02 0.00 0.00 33.50 31.51 2kmx n PRO 1115CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kmx n GLY 1116N 1.13 0.85 1.86 -1.23 0.00 -1.26 -4.75 105.19 101.79 2kmx n GLY 1116Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2kmx n GLY 1116CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kmx n GLY 1118N 0.36 -0.98 3.17 0.00 0.00 -0.72 -0.76 105.19 106.25 2kmx n GLY 1118Ca 0.00 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.88 2kmx n GLY 1118CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2kmx s ILE 1119N -2.00 0.59 0.08 -0.61 -4.36 -0.88 -1.50 121.20 112.51 2kmx s ILE 1119Ca 0.00 -1.92 0.07 0.00 -0.26 0.00 0.00 60.65 58.54 2kmx s ILE 1119Cb 0.00 -1.73 -0.03 0.00 1.25 0.00 0.00 42.46 41.95 2kmx s ILE 1119CO 0.00 -0.83 -0.18 -0.55 0.24 0.00 0.00 174.94 173.62 2kmx s SER 1120N -3.04 2.15 0.30 4.36 0.15 -0.42 -2.12 113.70 115.08 2kmx s SER 1120Ca 0.13 -0.62 -0.15 0.00 0.70 0.00 0.00 55.95 56.02 2kmx s SER 1120Cb 0.06 -0.11 0.02 0.00 -1.71 0.00 0.00 66.02 64.27 2kmx s SER 1120CO -0.04 0.02 0.63 0.00 1.20 0.00 0.00 173.24 175.05 2kmx s LYS 1122N -3.44 3.06 0.05 0.00 -0.14 -1.11 -1.13 119.74 117.02 2kmx s LYS 1122Ca 0.18 -0.82 0.02 0.00 -1.36 0.00 0.00 55.97 53.99 2kmx s LYS 1122Cb -0.03 -2.52 -0.04 0.00 -1.68 0.00 0.00 37.83 33.56 2kmx s LYS 1122CO 0.11 -0.06 0.06 0.08 -0.76 0.00 0.00 175.35 174.77 2kmx s VAL 1123N 0.95 4.44 0.08 3.17 1.01 -0.31 -1.26 120.40 128.49 2kmx s VAL 1123Ca -0.03 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 61.13 2kmx s VAL 1123Cb -0.15 -3.09 0.01 0.00 0.00 0.00 0.00 36.38 33.15 2kmx s VAL 1123CO -0.04 0.21 0.25 0.28 0.00 0.00 0.00 175.10 175.79 2kmx s THR 1124N -1.29 0.12 -0.32 3.92 -1.32 -0.79 -2.27 115.64 113.69 2kmx s THR 1124Ca 0.26 -0.95 0.03 0.00 -1.21 0.00 0.00 61.69 59.82 2kmx s THR 1124Cb -0.12 -1.19 0.23 0.00 -1.51 0.00 0.00 72.50 69.91 2kmx s THR 1124CO 0.18 -0.52 1.29 -3.20 -2.21 0.00 0.00 174.62 170.15 2kmx n ASN 1125N 0.09 -1.14 0.00 8.08 2.85 -1.26 -3.22 115.26 120.67 2kmx n ASN 1125Ca -0.16 -1.71 0.00 0.00 -0.11 0.00 0.00 54.58 52.60 2kmx n ASN 1125Cb 0.62 1.07 0.00 0.00 1.24 0.00 0.00 39.78 42.71 2kmx n ASN 1125CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 2kmx n ILE 1126N 0.13 0.00 -2.04 -1.44 -5.35 -1.26 -4.90 119.36 104.49 2kmx n ILE 1126Ca -0.14 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 2kmx n ILE 1126Cb 0.72 0.00 -0.00 0.00 -1.74 0.00 0.00 39.64 38.62 2kmx n ILE 1126CO 0.00 0.00 0.00 -1.84 -1.76 0.00 0.00 176.55 172.95 2kmx n GLU 1127N -0.69 0.00 0.00 6.28 0.00 -1.26 -4.98 120.64 119.99 2kmx n GLU 1127Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 57.16 56.31 2kmx n GLU 1127Cb 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 31.44 31.13 2kmx n GLU 1127CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2kmx n GLY 1128N 0.04 -0.30 0.00 -1.84 0.00 -1.26 -1.72 105.19 100.11 2kmx n GLY 1128Ca -0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 2kmx n GLY 1128CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2kmx n LEU 1129N -1.30 0.00 -0.02 0.99 -0.00 -1.26 -3.17 117.00 112.24 2kmx n LEU 1129Ca 0.00 0.38 -0.18 0.00 -0.00 0.00 0.00 56.01 56.20 2kmx n LEU 1129Cb 0.19 -0.38 -0.14 0.00 -0.00 0.00 0.00 43.42 43.10 2kmx n LEU 1129CO 0.00 -0.22 -0.83 -0.11 -0.00 0.00 0.00 177.39 176.23 2kmx n LEU 1130N -1.38 2.27 -4.57 1.47 7.94 -0.70 -5.05 117.00 116.98 2kmx n LEU 1130Ca 0.05 0.20 -0.46 0.00 -1.11 0.00 0.00 56.01 54.69 2kmx n LEU 1130Cb 0.12 -0.81 -0.02 0.00 0.53 0.00 0.00 43.42 43.24 2kmx n LEU 1130CO 0.11 0.77 0.54 1.57 -1.11 0.00 0.00 177.39 179.26 2kmx n HIS 1131N -3.35 1.08 -3.84 1.96 -0.00 -1.19 -5.06 115.22 104.83 2kmx n HIS 1131Ca -0.31 0.73 -0.11 0.00 0.46 0.00 0.00 57.72 58.49 2kmx n HIS 1131Cb 1.05 -2.22 -0.09 0.00 -0.12 0.00 0.00 29.99 28.60 2kmx n HIS 1131CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 2kmx s LYS 1132N -1.25 0.60 -0.06 1.57 -0.14 -1.26 -5.07 119.74 114.13 2kmx s LYS 1132Ca 0.62 -0.42 -0.22 0.00 -1.36 0.00 0.00 55.97 54.59 2kmx s LYS 1132Cb -0.76 0.25 -0.30 0.00 -1.68 0.00 0.00 37.83 35.34 2kmx s LYS 1132CO 0.58 -0.16 0.84 -0.97 -0.76 0.00 0.00 175.35 174.88 2kmx h ASN 1133N 3.91 0.41 -3.95 2.83 -1.24 -1.97 -3.48 115.58 112.09 2kmx h ASN 1133Ca -0.31 -0.94 -0.13 0.00 0.71 0.00 0.00 56.30 55.62 2kmx h ASN 1133Cb 1.19 -0.13 -0.24 0.00 0.73 0.00 0.00 38.32 39.86 2kmx h ASN 1133CO 0.43 1.38 -0.28 0.21 -1.29 0.00 0.00 177.43 177.87 2kmx s ASN 1134N -6.91 -0.37 -0.26 1.15 2.47 -1.26 -4.92 114.94 104.84 2kmx s ASN 1134Ca -0.15 0.69 -0.03 0.00 0.42 0.00 0.00 52.86 53.80 2kmx s ASN 1134Cb 0.01 0.72 -0.16 0.00 -1.45 0.00 0.00 41.25 40.36 2kmx s ASN 1134CO 0.81 -0.15 -0.23 0.79 -3.72 0.00 0.00 177.10 174.59 2kmx n TRP 1135N 2.76 0.06 -0.31 0.43 7.02 -1.26 -4.90 117.44 121.24 2kmx n TRP 1135Ca -0.14 0.02 0.00 0.00 -1.02 0.00 0.00 57.50 56.36 2kmx n TRP 1135Cb 0.57 -1.01 0.00 0.00 -2.42 0.00 0.00 31.31 28.46 2kmx n TRP 1135CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2kmx n ASN 1136N -3.54 0.00 -4.54 -0.99 3.02 -1.26 -5.11 115.26 102.84 2kmx n ASN 1136Ca -0.48 -0.11 -0.42 0.00 -0.03 0.00 0.00 54.58 53.54 2kmx n ASN 1136Cb 0.96 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 40.06 2kmx n ASN 1136CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2kmx s ILE 1137N 0.00 4.92 0.01 2.41 1.01 -1.26 -4.92 121.20 123.36 2kmx s ILE 1137Ca 0.00 0.25 0.11 0.00 0.00 0.00 0.00 60.65 61.01 2kmx s ILE 1137Cb 0.00 -4.09 -0.18 0.00 0.01 0.00 0.00 42.46 38.20 2kmx s ILE 1137CO 0.00 -0.40 1.02 -0.33 0.00 0.00 0.00 174.94 175.22 2kmx h GLU 1138N 8.64 0.00 0.00 2.79 5.08 -2.03 -3.37 114.58 125.69 2kmx h GLU 1138Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2kmx h GLU 1138Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2kmx h GLU 1138CO 0.84 0.69 0.00 -0.25 -1.00 0.00 0.00 179.01 179.28 2kmx n ASP 1139N -3.18 0.40 0.00 1.42 8.00 -1.26 -1.73 116.55 120.20 2kmx n ASP 1139Ca -0.07 0.67 0.10 0.00 0.71 0.00 0.00 54.79 56.20 2kmx n ASP 1139Cb 0.95 -0.73 0.46 0.00 -0.02 0.00 0.00 41.12 41.78 2kmx n ASP 1139CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2kmx n ASN 1140N -2.02 0.00 -2.70 -2.24 2.85 -1.26 -4.61 115.26 105.29 2kmx n ASN 1140Ca -0.00 0.43 -0.19 0.00 -0.11 0.00 0.00 54.58 54.71 2kmx n ASN 1140Cb 0.06 -0.47 -0.07 0.00 1.24 0.00 0.00 39.78 40.54 2kmx n ASN 1140CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 2kmx n ASN 1141N -1.47 5.13 -3.99 1.20 5.15 -0.71 -4.12 115.26 116.46 2kmx n ASN 1141Ca 0.06 -2.32 -0.08 0.00 -0.60 0.00 0.00 54.58 51.64 2kmx n ASN 1141Cb 0.23 -1.15 -0.08 0.00 -0.53 0.00 0.00 39.78 38.25 2kmx n ASN 1141CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2kmx s ILE 1142N 2.27 0.16 0.41 -1.44 -4.36 -1.26 -5.13 121.20 111.84 2kmx s ILE 1142Ca 0.50 -1.51 -0.24 0.00 -0.26 0.00 0.00 60.65 59.14 2kmx s ILE 1142Cb 0.18 -1.55 -0.09 0.00 1.25 0.00 0.00 42.46 42.25 2kmx s ILE 1142CO -0.02 -0.71 1.05 -0.54 0.24 0.00 0.00 174.94 174.97 2kmx s LYS 1143N -3.92 4.13 0.00 0.37 1.02 -1.26 -3.90 119.74 116.18 2kmx s LYS 1143Ca 0.10 1.51 0.16 0.00 0.02 0.00 0.00 55.97 57.76 2kmx s LYS 1143Cb 0.06 -2.51 0.78 0.00 -0.52 0.00 0.00 37.83 35.64 2kmx s LYS 1143CO -0.08 -0.17 1.52 0.27 -0.92 0.00 0.00 175.35 175.97 2kmx n ASN 1144N -0.14 0.62 -4.66 2.83 6.94 -1.26 -4.70 115.26 114.88 2kmx n ASN 1144Ca 0.05 -1.63 -0.30 0.00 -0.02 0.00 0.00 54.58 52.68 2kmx n ASN 1144Cb 0.50 -0.05 -0.09 0.00 -2.36 0.00 0.00 39.78 37.78 2kmx n ASN 1144CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2kmx s ALA 1145N -1.90 3.66 -0.39 -2.53 0.00 -1.26 -4.86 121.76 114.47 2kmx s ALA 1145Ca 0.25 -1.15 0.10 0.00 0.00 0.00 0.00 51.96 51.16 2kmx s ALA 1145Cb 0.12 0.14 0.32 0.00 0.00 0.00 0.00 23.12 23.71 2kmx s ALA 1145CO 0.19 -0.08 0.75 0.45 0.00 0.00 0.00 175.76 177.06 2kmx n SER 1146N -1.14 0.12 -3.83 0.00 2.88 -1.26 -5.13 113.62 105.25 2kmx n SER 1146Ca -0.13 -3.05 -0.12 0.00 -1.33 0.00 0.00 58.87 54.24 2kmx n SER 1146Cb 0.67 -0.18 -0.10 0.00 -0.75 0.00 0.00 64.21 63.84 2kmx n SER 1146CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 2kmx s LEU 1147N -2.09 1.35 -0.08 2.46 2.34 -1.26 -5.17 118.68 116.23 2kmx s LEU 1147Ca 0.36 -0.01 0.02 0.00 0.06 0.00 0.00 54.13 54.57 2kmx s LEU 1147Cb 0.30 0.79 -0.02 0.00 -0.56 0.00 0.00 46.19 46.70 2kmx s LEU 1147CO -0.09 -0.31 -0.14 -0.69 -1.06 0.00 0.00 176.35 174.06 2kmx s VAL 1148N -1.02 3.02 -1.35 1.48 1.01 -1.26 -4.73 120.40 117.56 2kmx s VAL 1148Ca -0.11 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.09 2kmx s VAL 1148Cb -0.06 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.12 2kmx s VAL 1148CO 0.02 0.57 0.92 1.67 0.00 0.00 0.00 175.10 178.27 2kmx n GLN 1149N 2.79 -6.46 -4.04 2.72 7.27 -1.26 -5.02 117.38 113.38 2kmx n GLN 1149Ca -0.18 0.81 -0.33 0.00 0.07 0.00 0.00 57.00 57.37 2kmx n GLN 1149Cb 0.52 -5.66 -0.15 0.00 2.41 0.00 0.00 30.24 27.36 2kmx n GLN 1149CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2kmx s ILE 1150N -3.24 2.43 0.57 1.69 -1.09 -1.26 -5.12 121.20 115.18 2kmx s ILE 1150Ca 0.45 -1.12 -0.20 0.00 -2.23 0.00 0.00 60.65 57.56 2kmx s ILE 1150Cb -0.20 -2.20 -0.04 0.00 -1.58 0.00 0.00 42.46 38.44 2kmx s ILE 1150CO 0.56 0.28 1.25 -1.81 -1.23 0.00 0.00 174.94 173.99 2kmx s ASP 1151N 1.26 5.22 0.00 3.58 1.01 -1.26 -4.91 116.67 121.58 2kmx s ASP 1151Ca -0.00 2.51 0.00 0.00 0.71 0.00 0.00 52.55 55.77 2kmx s ASP 1151Cb -0.16 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.16 2kmx s ASP 1151CO -0.08 -1.58 0.53 0.00 0.21 0.00 0.00 175.17 174.26 2kmx n ALA 1152N -1.37 2.15 0.01 5.23 0.00 -1.26 -4.50 120.51 120.77 2kmx n ALA 1152Ca 0.12 0.00 0.23 0.00 0.00 0.00 0.00 53.44 53.79 2kmx n ALA 1152Cb 0.48 -1.00 0.72 0.00 0.00 0.00 0.00 19.45 19.65 2kmx n ALA 1152CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2kmx h SER 1153N 0.40 0.00 -0.20 0.00 0.02 -2.06 -2.64 113.55 109.07 2kmx h SER 1153Ca 0.00 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.74 2kmx h SER 1153Cb 0.53 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 62.69 2kmx h SER 1153CO 0.00 0.00 -1.04 -3.20 -1.14 0.00 0.00 176.83 171.45 2kmx n ASN 1154N -3.79 1.16 -4.37 3.07 5.15 -1.26 -5.04 115.26 110.19 2kmx n ASN 1154Ca 0.11 -2.01 -0.39 0.00 -0.60 0.00 0.00 54.58 51.69 2kmx n ASN 1154Cb 0.76 -0.35 -0.12 0.00 -0.53 0.00 0.00 39.78 39.55 2kmx n ASN 1154CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2kmx s GLU 1155N -1.79 3.03 0.25 1.20 2.12 -1.00 -4.56 118.70 117.95 2kmx s GLU 1155Ca 0.29 -0.92 0.08 0.00 0.36 0.00 0.00 54.97 54.78 2kmx s GLU 1155Cb 0.35 -3.54 -0.05 0.00 0.26 0.00 0.00 34.13 31.15 2kmx s GLU 1155CO -0.10 -0.54 -0.11 -0.65 -0.54 0.00 0.00 175.26 173.32 2kmx s GLN 1156N 1.54 1.49 1.97 4.30 -0.21 -1.26 -5.03 119.66 122.46 2kmx s GLN 1156Ca 0.02 -1.71 0.00 0.00 0.02 0.00 0.00 55.36 53.69 2kmx s GLN 1156Cb -0.18 -1.22 0.00 0.00 1.00 0.00 0.00 33.01 32.61 2kmx s GLN 1156CO 0.05 0.13 0.00 0.45 -2.12 0.00 0.00 175.29 173.80 2kmx n SER 1157N -0.51 -1.92 -4.21 5.90 2.88 -1.26 -4.81 113.62 109.68 2kmx n SER 1157Ca -0.06 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.15 2kmx n SER 1157Cb 0.62 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.92 2kmx n SER 1157CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2kmx s SER 1158N -4.00 3.27 0.08 -3.46 1.04 -1.26 -5.12 113.70 104.25 2kmx s SER 1158Ca 0.00 -0.55 -0.21 0.00 0.48 0.00 0.00 55.95 55.67 2kmx s SER 1158Cb 0.00 -1.47 0.05 0.00 0.10 0.00 0.00 66.02 64.70 2kmx s SER 1158CO 0.00 0.11 0.50 0.28 0.98 0.00 0.00 173.24 175.11 2kmx s THR 1159N 0.66 0.03 0.27 2.02 -1.32 -1.26 -4.95 115.64 111.10 2kmx s THR 1159Ca -0.10 -0.28 0.02 0.00 -1.21 0.00 0.00 61.69 60.12 2kmx s THR 1159Cb -0.16 -1.02 -0.04 0.00 -1.51 0.00 0.00 72.50 69.77 2kmx s THR 1159CO 0.02 -0.16 0.16 -0.94 -2.21 0.00 0.00 174.62 171.50 2kmx s SER 1160N -2.27 1.14 0.46 8.08 1.04 -1.26 -4.56 113.70 116.33 2kmx s SER 1160Ca -0.03 -1.53 -0.25 0.00 0.48 0.00 0.00 55.95 54.63 2kmx s SER 1160Cb -0.00 0.39 -0.08 0.00 0.10 0.00 0.00 66.02 66.43 2kmx s SER 1160CO -0.06 -0.89 1.41 -0.94 0.98 0.00 0.00 173.24 173.75 2kmx s SER 1161N -3.31 5.83 0.00 7.02 1.04 -1.25 -4.67 113.70 118.35 2kmx s SER 1161Ca 0.38 2.88 0.21 0.00 0.48 0.00 0.00 55.95 59.90 2kmx s SER 1161Cb 0.05 -2.65 1.06 0.00 0.10 0.00 0.00 66.02 64.59 2kmx s SER 1161CO 0.17 -1.20 1.68 -1.20 0.98 0.00 0.00 173.24 173.67 2kmx n SER 1162N -0.28 0.00 -0.05 7.02 7.64 -1.26 -3.89 113.62 122.80 2kmx n SER 1162Ca 0.06 0.01 0.25 0.00 1.01 0.00 0.00 58.87 60.19 2kmx n SER 1162Cb 0.42 -0.30 0.68 0.00 -1.01 0.00 0.00 64.21 64.00 2kmx n SER 1162CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kmx h MET 1163N 0.00 0.00 0.00 1.43 -0.00 -2.00 -1.08 114.93 113.28 2kmx h MET 1163Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.69 2kmx h MET 1163Cb 0.21 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.81 2kmx h MET 1163CO 0.00 0.00 -0.04 -0.84 -0.00 0.00 0.00 176.91 176.03 2kmx h ILE 1164N 0.00 0.08 0.18 -0.10 3.07 -1.97 -3.06 117.51 115.71 2kmx h ILE 1164Ca 0.32 -1.01 -0.31 0.00 1.55 0.00 0.00 64.86 65.42 2kmx h ILE 1164Cb 1.70 1.94 0.02 0.00 -0.27 0.00 0.00 36.82 40.20 2kmx h ILE 1164CO -0.00 0.04 -1.42 0.16 -1.05 0.00 0.00 178.15 175.88 2kmx h ILE 1165N 0.00 1.32 0.00 0.16 -0.00 -1.50 -3.25 117.51 114.24 2kmx h ILE 1165Ca -0.00 -2.85 -0.04 0.00 -0.00 0.00 0.00 64.86 61.97 2kmx h ILE 1165Cb 0.94 2.94 -0.01 0.00 -0.00 0.00 0.00 36.82 40.69 2kmx h ILE 1165CO 0.01 0.85 -0.21 0.44 -0.00 0.00 0.00 178.15 179.23 2kmx h ASP 1166N 0.10 0.00 0.81 2.16 3.32 -1.67 -2.64 116.42 118.50 2kmx h ASP 1166Ca -0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.84 2kmx h ASP 1166Cb 2.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.62 2kmx h ASP 1166CO 0.22 0.21 0.00 0.00 -1.72 0.00 0.00 179.24 177.95 2kmx n ALA 1167N -2.21 1.79 0.37 3.45 0.00 -1.16 -3.70 120.51 119.06 2kmx n ALA 1167Ca 0.00 0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.52 2kmx n ALA 1167Cb 0.43 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2kmx n ALA 1167CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2kmx n GLN 1168N -2.05 2.00 -0.12 0.00 6.02 -1.00 -4.52 117.38 117.71 2kmx n GLN 1168Ca 0.03 -0.59 0.16 0.00 -0.01 0.00 0.00 57.00 56.59 2kmx n GLN 1168Cb 0.25 -1.04 0.55 0.00 1.02 0.00 0.00 30.24 31.02 2kmx n GLN 1168CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2kmx h ILE 1169N 1.01 0.79 0.00 5.09 2.04 -1.62 -2.07 117.51 122.74 2kmx h ILE 1169Ca 0.00 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.75 2kmx h ILE 1169Cb 0.29 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 2kmx h ILE 1169CO 0.00 0.06 0.00 -1.54 0.00 0.00 0.00 178.15 176.67 2kmx n SER 1170N -4.45 0.00 -0.26 1.72 3.41 -1.26 -2.58 113.62 110.19 2kmx n SER 1170Ca 0.13 0.21 0.12 0.00 -0.26 0.00 0.00 58.87 59.08 2kmx n SER 1170Cb 0.54 -0.34 0.28 0.00 -0.26 0.00 0.00 64.21 64.43 2kmx n SER 1170CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2kmx n ASN 1171N -1.34 1.15 0.13 4.04 3.02 -0.78 -4.63 115.26 116.85 2kmx n ASN 1171Ca 0.05 -0.95 0.06 0.00 -0.03 0.00 0.00 54.58 53.71 2kmx n ASN 1171Cb 0.11 0.23 0.52 0.00 -0.61 0.00 0.00 39.78 40.03 2kmx n ASN 1171CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kmx h ALA 1172N 3.64 1.82 -0.91 5.41 0.00 -1.69 -1.70 119.26 125.83 2kmx h ALA 1172Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2kmx h ALA 1172Cb 0.55 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 2kmx h ALA 1172CO 0.00 0.16 0.60 1.25 0.00 0.00 0.00 179.25 181.25 2kmx h LEU 1173N 0.27 0.94 0.02 0.00 6.46 -1.86 -2.88 115.31 118.26 2kmx h LEU 1173Ca 0.07 0.00 -0.24 0.00 -0.12 0.00 0.00 57.88 57.59 2kmx h LEU 1173Cb 0.01 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 39.71 2kmx h LEU 1173CO -0.01 0.62 -1.24 0.78 -0.62 0.00 0.00 178.44 177.97 2kmx h ASN 1174N 1.08 0.06 -3.36 1.25 2.35 -1.69 -3.46 115.58 111.80 2kmx h ASN 1174Ca 0.38 -0.08 -0.57 0.00 -0.55 0.00 0.00 56.30 55.49 2kmx h ASN 1174Cb 0.13 -0.02 -0.06 0.00 0.05 0.00 0.00 38.32 38.42 2kmx h ASN 1174CO -0.13 1.06 0.14 0.00 -1.65 0.00 0.00 177.43 176.85 2kmx s ALA 1175N -2.67 3.40 -0.04 -0.83 0.00 -0.77 -4.95 121.76 115.91 2kmx s ALA 1175Ca -0.02 0.05 -0.13 0.00 0.00 0.00 0.00 51.96 51.86 2kmx s ALA 1175Cb 0.09 -3.00 -0.31 0.00 0.00 0.00 0.00 23.12 19.89 2kmx s ALA 1175CO 0.83 -0.27 0.73 1.96 0.00 0.00 0.00 175.76 179.00 2kmx h GLN 1176N 6.98 0.41 0.00 0.00 4.20 -1.90 -3.46 115.11 121.33 2kmx h GLN 1176Ca -0.37 -0.69 0.00 0.00 0.06 0.00 0.00 58.65 57.64 2kmx h GLN 1176Cb 1.18 0.26 0.00 0.00 0.30 0.00 0.00 27.48 29.21 2kmx h GLN 1176CO 0.77 1.33 0.00 1.04 -0.67 0.00 0.00 178.83 181.30 2kmx n GLN 1177N -3.68 0.00 -2.61 1.46 6.02 -1.26 -4.87 117.38 112.43 2kmx n GLN 1177Ca -0.23 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.33 2kmx n GLN 1177Cb 1.05 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 32.29 2kmx n GLN 1177CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2kmx s TYR 1178N 0.00 2.86 -0.27 1.08 2.02 -0.96 -4.84 117.35 117.23 2kmx s TYR 1178Ca 0.00 0.76 -0.29 0.00 -0.37 0.00 0.00 57.07 57.17 2kmx s TYR 1178Cb 0.00 -4.33 0.01 0.00 -0.40 0.00 0.00 41.96 37.24 2kmx s TYR 1178CO 0.00 -1.21 1.10 0.21 -1.57 0.00 0.00 175.55 174.08 2kmx s LYS 1179N 4.33 4.13 -0.00 -0.62 2.20 -1.26 -1.16 119.74 127.37 2kmx s LYS 1179Ca 0.47 1.23 0.01 0.00 -0.36 0.00 0.00 55.97 57.33 2kmx s LYS 1179Cb -0.08 -3.72 -0.00 0.00 -1.51 0.00 0.00 37.83 32.52 2kmx s LYS 1179CO 0.30 -0.81 -0.04 0.14 -0.36 0.00 0.00 175.35 174.57 2kmx s VAL 1180N 3.55 0.35 0.02 4.02 -7.23 -0.29 -0.72 120.40 120.10 2kmx s VAL 1180Ca 0.47 -0.18 -0.00 0.00 -1.81 0.00 0.00 61.98 60.45 2kmx s VAL 1180Cb -0.14 -0.30 -0.02 0.00 0.56 0.00 0.00 36.38 36.48 2kmx s VAL 1180CO 0.13 0.10 -0.03 -1.48 -0.31 0.00 0.00 175.10 173.51 2kmx s LEU 1181N -0.08 2.23 -0.09 1.32 2.34 -0.02 -0.56 118.68 123.80 2kmx s LEU 1181Ca 0.01 -0.49 -0.10 0.00 0.06 0.00 0.00 54.13 53.61 2kmx s LEU 1181Cb -0.02 0.11 0.03 0.00 -0.56 0.00 0.00 46.19 45.75 2kmx s LEU 1181CO -0.00 -0.30 0.28 -0.51 -1.06 0.00 0.00 176.35 174.75 2kmx s ILE 1182N -1.46 0.01 -3.66 1.48 2.07 -0.90 -1.25 121.20 117.49 2kmx s ILE 1182Ca -0.16 -0.08 0.00 0.00 -1.41 0.00 0.00 60.65 59.00 2kmx s ILE 1182Cb -0.10 -0.42 0.00 0.00 0.13 0.00 0.00 42.46 42.07 2kmx s ILE 1182CO -0.01 -0.04 0.00 0.61 -1.91 0.00 0.00 174.94 173.59 2kmx n GLY 1183N 2.71 0.21 3.76 1.50 0.00 -0.71 -2.08 105.19 110.57 2kmx n GLY 1183Ca -0.14 -1.19 -0.32 0.00 0.00 0.00 0.00 46.02 44.37 2kmx n GLY 1183CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2kmx s ASN 1184N -4.00 4.63 0.56 1.61 0.01 0.06 -1.54 114.94 116.26 2kmx s ASN 1184Ca 0.00 1.93 0.28 0.00 -0.71 0.00 0.00 52.86 54.36 2kmx s ASN 1184Cb 0.00 -2.54 1.47 0.00 0.41 0.00 0.00 41.25 40.59 2kmx s ASN 1184CO 0.00 -1.95 1.96 -0.09 -1.51 0.00 0.00 177.10 175.50 2kmx h ARG 1185N -0.70 0.00 -0.89 -0.60 2.43 -1.94 -3.03 114.38 109.65 2kmx h ARG 1185Ca -0.45 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2kmx h ARG 1185Cb 1.24 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.75 2kmx h ARG 1185CO 0.52 0.00 0.55 0.93 -1.51 0.00 0.00 179.97 180.45 2kmx h GLU 1186N 0.00 1.20 0.00 0.20 5.08 -1.96 -2.57 114.58 116.52 2kmx h GLU 1186Ca 0.25 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.48 2kmx h GLU 1186Cb 1.13 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 2kmx h GLU 1186CO -0.00 0.83 -0.76 2.35 -1.00 0.00 0.00 179.01 180.42 2kmx h TRP 1187N 1.22 0.00 -0.41 4.33 2.91 -1.93 -2.37 115.95 119.70 2kmx h TRP 1187Ca 0.32 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.32 2kmx h TRP 1187Cb -0.07 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 28.56 2kmx h TRP 1187CO 0.00 0.12 0.17 0.52 -1.03 0.00 0.00 178.44 178.22 2kmx h MET 1188N 0.00 0.58 0.08 2.65 2.86 -1.55 -0.21 114.93 119.33 2kmx h MET 1188Ca -0.02 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2kmx h MET 1188Cb 1.11 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.66 2kmx h MET 1188CO 0.01 0.48 -0.04 0.82 1.06 0.00 0.00 176.91 179.24 2kmx h ILE 1189N 0.58 0.00 -0.23 -1.22 2.04 -1.49 -3.26 117.51 113.92 2kmx h ILE 1189Ca 0.14 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 66.02 2kmx h ILE 1189Cb 0.11 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 2kmx h ILE 1189CO -0.02 0.00 0.31 -0.09 0.00 0.00 0.00 178.15 178.35 2kmx h ARG 1190N -0.16 0.00 -0.15 2.37 1.12 -1.26 -1.08 114.38 115.22 2kmx h ARG 1190Ca -0.01 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.86 2kmx h ARG 1190Cb 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.04 2kmx h ARG 1190CO 0.02 0.00 0.00 -1.71 -3.11 0.00 0.00 179.97 175.17 2kmx n ASN 1191N -3.58 0.15 -0.12 -3.80 5.15 -0.11 -4.86 115.26 108.09 2kmx n ASN 1191Ca 0.03 -1.61 -0.02 0.00 -0.60 0.00 0.00 54.58 52.39 2kmx n ASN 1191Cb 0.44 -0.08 -0.01 0.00 -0.53 0.00 0.00 39.78 39.60 2kmx n ASN 1191CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2kmx n GLY 1192N 0.26 0.53 3.22 8.20 0.00 -0.41 -4.89 105.19 112.10 2kmx n GLY 1192Ca 0.00 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.29 2kmx n GLY 1192CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kmx n LEU 1193N -0.19 0.00 -4.18 0.99 4.77 -1.22 -5.09 117.00 112.09 2kmx n LEU 1193Ca -0.02 -1.55 -0.29 0.00 -0.03 0.00 0.00 56.01 54.13 2kmx n LEU 1193Cb 0.09 -0.66 -0.16 0.00 -2.33 0.00 0.00 43.42 40.36 2kmx n LEU 1193CO 0.02 -1.05 -0.53 -0.69 -1.33 0.00 0.00 177.39 173.81 2kmx s VAL 1194N -2.87 1.70 -0.10 4.08 1.01 -1.26 -4.76 120.40 118.20 2kmx s VAL 1194Ca 0.58 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 2kmx s VAL 1194Cb -0.03 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 2kmx s VAL 1194CO 0.39 0.48 0.03 -0.51 0.00 0.00 0.00 175.10 175.49 2kmx s ILE 1195N 0.07 4.53 0.29 2.22 2.07 -1.26 -4.93 121.20 124.19 2kmx s ILE 1195Ca -0.07 -0.16 0.03 0.00 -1.41 0.00 0.00 60.65 59.04 2kmx s ILE 1195Cb -0.14 -2.93 -0.03 0.00 0.13 0.00 0.00 42.46 39.49 2kmx s ILE 1195CO 0.04 0.60 0.44 0.54 -1.91 0.00 0.00 174.94 174.65 2kmx s ASN 1196N -0.80 6.29 0.44 4.50 2.20 -1.26 -5.04 114.94 121.28 2kmx s ASN 1196Ca 0.12 0.22 0.25 0.00 -0.94 0.00 0.00 52.86 52.51 2kmx s ASN 1196Cb -0.12 -1.91 0.63 0.00 -2.00 0.00 0.00 41.25 37.85 2kmx s ASN 1196CO 0.02 -0.18 1.71 0.78 -2.94 0.00 0.00 177.10 176.49 2kmx h ASN 1197N 0.98 0.00 0.26 3.54 2.35 -2.00 -2.78 115.58 117.93 2kmx h ASN 1197Ca -0.51 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.05 2kmx h ASN 1197Cb 1.23 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.59 2kmx h ASN 1197CO 0.61 0.10 -0.77 0.44 -1.65 0.00 0.00 177.43 176.16 2kmx h ASP 1198N 0.00 0.50 0.40 5.81 3.32 -1.99 -0.04 116.42 124.43 2kmx h ASP 1198Ca -0.00 -0.34 -0.19 0.00 0.02 0.00 0.00 57.03 56.52 2kmx h ASP 1198Cb 0.90 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 2kmx h ASP 1198CO 0.01 1.10 -0.78 1.62 -1.72 0.00 0.00 179.24 179.47 2kmx h VAL 1199N 0.27 1.42 -0.72 -1.35 3.04 -1.99 -2.73 116.25 114.19 2kmx h VAL 1199Ca -0.04 -2.31 0.00 0.00 -1.01 0.00 0.00 66.70 63.34 2kmx h VAL 1199Cb 1.36 2.25 -0.04 0.00 -2.01 0.00 0.00 31.29 32.85 2kmx h VAL 1199CO 0.13 0.68 0.46 -1.13 -1.01 0.00 0.00 177.57 176.71 2kmx h ASN 1200N 0.19 0.84 -0.24 3.17 -1.24 -1.21 -0.23 115.58 116.86 2kmx h ASN 1200Ca -0.04 -0.03 -0.03 0.00 0.71 0.00 0.00 56.30 56.92 2kmx h ASN 1200Cb 1.37 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 40.20 2kmx h ASN 1200CO 0.13 0.62 0.05 -0.78 -1.29 0.00 0.00 177.43 176.16 2kmx h ASP 1201N 0.98 0.37 -0.92 1.15 1.82 -0.98 -2.55 116.42 116.30 2kmx h ASP 1201Ca 0.26 -0.24 0.05 0.00 -0.39 0.00 0.00 57.03 56.71 2kmx h ASP 1201Cb -0.09 -0.10 -0.06 0.00 0.68 0.00 0.00 39.33 39.76 2kmx h ASP 1201CO -0.05 0.52 0.59 0.15 -1.61 0.00 0.00 179.24 178.83 2kmx h PHE 1202N 0.21 1.09 0.58 0.28 3.04 -1.14 -2.07 116.94 118.94 2kmx h PHE 1202Ca 0.08 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 62.03 2kmx h PHE 1202Cb 0.29 -0.36 0.01 0.00 2.56 0.00 0.00 35.95 38.45 2kmx h PHE 1202CO 0.01 0.59 -0.28 1.98 -2.02 0.00 0.00 178.31 178.60 2kmx h MET 1203N 1.10 -0.76 -0.05 1.11 4.05 -0.91 -2.75 114.93 116.73 2kmx h MET 1203Ca 0.38 0.05 -0.08 0.00 -0.28 0.00 0.00 59.70 59.77 2kmx h MET 1203Cb 0.09 0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 2kmx h MET 1203CO -0.15 -0.45 -0.34 0.00 0.23 0.00 0.00 176.91 176.20 2kmx h THR 1204N -0.99 1.26 -0.49 -0.77 1.03 -1.48 -1.69 112.91 109.79 2kmx h THR 1204Ca -0.08 -1.25 0.02 0.00 -0.01 0.00 0.00 66.41 65.09 2kmx h THR 1204Cb 0.66 1.61 -0.03 0.00 -1.07 0.00 0.00 68.15 69.32 2kmx h THR 1204CO 0.13 0.36 0.29 -0.08 -0.01 0.00 0.00 175.52 176.22 2kmx h GLU 1205N 0.08 0.56 -0.20 0.00 4.57 -1.34 0.20 114.58 118.45 2kmx h GLU 1205Ca 0.01 -0.03 -0.15 0.00 -1.18 0.00 0.00 59.36 58.01 2kmx h GLU 1205Cb 0.65 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 2kmx h GLU 1205CO 0.05 0.37 -0.49 0.45 -1.18 0.00 0.00 179.01 178.21 2kmx h HIS 1206N 0.58 0.65 -0.60 0.92 3.86 -1.24 -1.97 115.15 117.36 2kmx h HIS 1206Ca 0.20 -0.21 -0.03 0.00 -1.16 0.00 0.00 60.37 59.16 2kmx h HIS 1206Cb 0.02 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.33 2kmx h HIS 1206CO -0.07 0.92 0.26 0.93 0.86 0.00 0.00 177.93 180.83 2kmx h GLU 1207N 0.42 0.85 -0.02 2.45 5.08 -0.83 -2.69 114.58 119.85 2kmx h GLU 1207Ca 0.02 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.14 2kmx h GLU 1207Cb 1.02 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 2kmx h GLU 1207CO 0.09 0.68 -0.55 0.00 -1.00 0.00 0.00 179.01 178.24 2kmx h ARG 1208N 0.85 0.04 0.00 2.33 3.08 -0.51 -2.08 114.38 118.09 2kmx h ARG 1208Ca 0.21 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2kmx h ARG 1208Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2kmx h ARG 1208CO -0.02 0.58 0.00 1.63 -1.07 0.00 0.00 179.97 181.09 2kmx n LYS 1209N -3.90 0.33 -0.73 0.04 5.02 -0.75 -4.92 118.16 113.25 2kmx n LYS 1209Ca -0.01 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 2kmx n LYS 1209Cb 0.56 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 2kmx n LYS 1209CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2kmx n GLY 1210N 0.28 0.79 3.98 0.72 0.00 -0.78 -5.05 105.19 105.13 2kmx n GLY 1210Ca 0.10 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 2kmx n GLY 1210CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kmx s ARG 1211N -0.27 3.13 0.09 1.61 1.81 -1.14 -5.02 118.95 119.17 2kmx s ARG 1211Ca 0.00 -0.85 -0.31 0.00 -1.72 0.00 0.00 55.73 52.85 2kmx s ARG 1211Cb 0.00 -2.76 -0.06 0.00 -0.45 0.00 0.00 34.95 31.68 2kmx s ARG 1211CO 0.00 0.00 1.24 0.99 -0.68 0.00 0.00 175.30 176.86 2kmx s THR 1212N -2.26 3.80 -0.15 0.02 2.01 -1.26 -4.08 115.64 113.73 2kmx s THR 1212Ca 0.45 1.32 0.02 0.00 0.31 0.00 0.00 61.69 63.79 2kmx s THR 1212Cb -0.10 -3.85 0.01 0.00 0.01 0.00 0.00 72.50 68.58 2kmx s THR 1212CO 0.33 0.12 -0.19 0.00 -0.69 0.00 0.00 174.62 174.18 2kmx s ALA 1213N 0.93 2.14 0.03 7.40 0.00 -1.26 -1.58 121.76 129.41 2kmx s ALA 1213Ca 0.59 -1.05 -0.01 0.00 0.00 0.00 0.00 51.96 51.49 2kmx s ALA 1213Cb -0.32 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.75 2kmx s ALA 1213CO 0.30 -0.17 -0.02 0.14 0.00 0.00 0.00 175.76 176.02 2kmx s VAL 1214N 1.05 0.15 0.29 0.00 -7.23 -0.88 -4.86 120.40 108.93 2kmx s VAL 1214Ca -0.02 -1.24 0.06 0.00 -1.81 0.00 0.00 61.98 58.96 2kmx s VAL 1214Cb -0.14 -0.76 -0.02 0.00 0.56 0.00 0.00 36.38 36.02 2kmx s VAL 1214CO -0.06 -0.68 0.43 -0.76 -0.31 0.00 0.00 175.10 173.71 2kmx s LEU 1215N -2.03 4.13 -0.06 1.32 1.02 -0.59 -1.01 118.68 121.47 2kmx s LEU 1215Ca -0.07 -0.04 0.02 0.00 0.02 0.00 0.00 54.13 54.06 2kmx s LEU 1215Cb -0.03 -2.83 0.02 0.00 0.02 0.00 0.00 46.19 43.37 2kmx s LEU 1215CO -0.04 -0.27 -0.08 -0.69 0.02 0.00 0.00 176.35 175.29 2kmx s VAL 1216N -2.10 0.81 0.07 -1.59 1.01 0.18 -1.75 120.40 117.05 2kmx s VAL 1216Ca 0.40 -0.28 0.06 0.00 0.00 0.00 0.00 61.98 62.16 2kmx s VAL 1216Cb -0.09 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 2kmx s VAL 1216CO 0.30 0.29 -0.17 0.00 0.00 0.00 0.00 175.10 175.52 2kmx s ALA 1217N 0.84 1.48 -0.12 5.51 0.00 -0.38 -1.81 121.76 127.28 2kmx s ALA 1217Ca -0.12 -1.06 -0.07 0.00 0.00 0.00 0.00 51.96 50.71 2kmx s ALA 1217Cb -0.15 -0.20 0.05 0.00 0.00 0.00 0.00 23.12 22.82 2kmx s ALA 1217CO 0.01 0.28 0.30 0.14 0.00 0.00 0.00 175.76 176.49 2kmx s VAL 1218N -1.07 -0.03 -1.48 0.00 -7.23 0.19 -0.84 120.40 109.93 2kmx s VAL 1218Ca 0.03 0.12 -0.07 0.00 -1.81 0.00 0.00 61.98 60.25 2kmx s VAL 1218Cb -0.09 -0.45 0.01 0.00 0.56 0.00 0.00 36.38 36.40 2kmx s VAL 1218CO 0.03 0.05 0.15 -0.67 -0.31 0.00 0.00 175.10 174.35 2kmx n ASP 1219N 4.15 -0.09 -2.72 4.85 2.03 0.11 -1.43 116.55 123.46 2kmx n ASP 1219Ca -0.24 -1.27 -0.21 0.00 0.52 0.00 0.00 54.79 53.59 2kmx n ASP 1219Cb 0.54 -1.69 0.02 0.00 -0.72 0.00 0.00 41.12 39.27 2kmx n ASP 1219CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2kmx n ASP 1220N -2.75 -5.97 -3.98 1.67 8.00 -1.26 -5.02 116.55 107.23 2kmx n ASP 1220Ca -0.29 -0.18 -0.18 0.00 0.71 0.00 0.00 54.79 54.84 2kmx n ASP 1220Cb 0.67 -4.86 -0.15 0.00 -0.02 0.00 0.00 41.12 36.76 2kmx n ASP 1220CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2kmx s GLU 1221N -5.43 0.71 -0.27 -1.24 2.56 -0.51 -4.87 118.70 109.65 2kmx s GLU 1221Ca 0.19 -0.24 -0.29 0.00 0.00 0.00 0.00 54.97 54.63 2kmx s GLU 1221Cb -0.08 -0.69 -0.00 0.00 2.00 0.00 0.00 34.13 35.36 2kmx s GLU 1221CO 0.23 0.11 1.33 -1.17 -0.56 0.00 0.00 175.26 175.20 2kmx s LEU 1222N 0.10 3.94 -0.16 2.70 0.20 -1.26 -0.64 118.68 123.55 2kmx s LEU 1222Ca -0.01 1.34 0.14 0.00 0.69 0.00 0.00 54.13 56.29 2kmx s LEU 1222Cb -0.06 -3.54 -0.20 0.00 -0.43 0.00 0.00 46.19 41.96 2kmx s LEU 1222CO -0.00 -1.04 0.05 0.00 -0.29 0.00 0.00 176.35 175.07 2kmx n GLY 1224N 2.01 0.60 3.08 0.00 0.00 -1.07 -0.25 105.19 109.56 2kmx n GLY 1224Ca -0.27 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.84 2kmx n GLY 1224CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2kmx s LEU 1225N 0.00 1.93 -0.05 0.99 2.34 -0.03 -0.64 118.68 123.21 2kmx s LEU 1225Ca 0.00 -0.53 0.04 0.00 0.06 0.00 0.00 54.13 53.70 2kmx s LEU 1225Cb 0.00 0.46 0.00 0.00 -0.56 0.00 0.00 46.19 46.09 2kmx s LEU 1225CO 0.00 -0.46 -0.17 -0.63 -1.06 0.00 0.00 176.35 174.04 2kmx s ILE 1226N -2.34 1.42 -0.13 1.48 -1.09 -0.18 -1.31 121.20 119.05 2kmx s ILE 1226Ca -0.07 -0.69 -0.03 0.00 -2.23 0.00 0.00 60.65 57.63 2kmx s ILE 1226Cb -0.03 -1.23 -0.03 0.00 -1.58 0.00 0.00 42.46 39.59 2kmx s ILE 1226CO -0.04 0.41 -0.02 0.00 -1.23 0.00 0.00 174.94 174.06 2kmx s ALA 1227N 0.20 3.11 0.45 9.38 0.00 0.07 -2.07 121.76 132.89 2kmx s ALA 1227Ca -0.07 -0.82 0.08 0.00 0.00 0.00 0.00 51.96 51.15 2kmx s ALA 1227Cb -0.13 -1.52 0.01 0.00 0.00 0.00 0.00 23.12 21.48 2kmx s ALA 1227CO 0.03 0.36 0.54 0.42 0.00 0.00 0.00 175.76 177.11 2kmx s ILE 1228N -0.13 2.70 0.00 0.00 -1.09 -0.62 -0.71 121.20 121.36 2kmx s ILE 1228Ca 0.03 -1.13 0.00 0.00 -2.23 0.00 0.00 60.65 57.33 2kmx s ILE 1228Cb -0.13 -2.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.92 2kmx s ILE 1228CO 0.02 0.00 0.00 0.00 -1.23 0.00 0.00 174.94 173.73 2kmx n ALA 1229N -1.82 0.00 -2.40 9.38 0.00 -0.01 -4.50 120.51 121.16 2kmx n ALA 1229Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.20 2kmx n ALA 1229Cb 0.60 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.91 2kmx n ALA 1229CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2kmx s ASP 1230N -0.31 3.51 0.00 0.00 2.15 -1.26 -2.45 116.67 118.31 2kmx s ASP 1230Ca 0.00 -0.43 0.14 0.00 0.43 0.00 0.00 52.55 52.69 2kmx s ASP 1230Cb 0.00 -0.51 0.11 0.00 -0.30 0.00 0.00 42.92 42.22 2kmx s ASP 1230CO 0.00 0.29 0.94 0.35 -0.17 0.00 0.00 175.17 176.58