#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 2.13 0.41 0.66 0.08 -1.26 -5.13 117.98 114.87 2kmx s PHE 1048Ca 0.00 -0.89 0.00 0.00 0.12 0.00 0.00 56.93 56.16 2kmx s PHE 1048Cb 0.00 -1.45 0.00 0.00 -0.57 0.00 0.00 43.02 41.00 2kmx s PHE 1048CO 0.00 0.14 0.00 2.41 -0.10 0.00 0.00 175.22 177.67 2kmx n THR 1049N -0.82 -2.07 0.00 0.64 -1.04 -1.26 -5.08 114.28 104.65 2kmx n THR 1049Ca -0.04 1.03 0.00 0.00 -2.04 0.00 0.00 64.05 63.00 2kmx n THR 1049Cb 0.67 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.47 2kmx n THR 1049CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 2kmx n MET 1050N -2.26 0.00 0.00 -2.82 1.56 -1.26 -5.02 117.12 107.32 2kmx n MET 1050Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 2kmx n MET 1050Cb 0.33 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.70 2kmx n MET 1050CO 0.00 0.00 0.00 0.72 -0.73 0.00 0.00 175.97 175.96 2kmx n HIS 1051N -1.06 0.00 -4.46 1.12 8.25 -1.26 -5.10 115.22 112.71 2kmx n HIS 1051Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.23 2kmx n HIS 1051Cb 0.00 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 30.95 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 -1.06 0.69 0.09 -1.41 0.00 -1.26 -5.04 107.32 99.32 2kmx s GLY 1052Ca 0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 44.72 44.40 2kmx s GLY 1052CO 0.00 0.21 0.27 -0.51 0.00 0.00 0.00 173.10 173.07 2kmx s THR 1053N 0.73 5.31 0.16 0.90 -4.23 -1.26 -4.85 115.64 112.40 2kmx s THR 1053Ca -0.14 -0.23 -0.32 0.00 -1.18 0.00 0.00 61.69 59.83 2kmx s THR 1053Cb -0.15 -3.62 -0.10 0.00 1.34 0.00 0.00 72.50 69.96 2kmx s THR 1053CO 0.03 0.11 1.54 -2.16 -0.54 0.00 0.00 174.62 173.61 2kmx s PRO 1054N -2.53 4.23 -0.22 3.99 0.04 -1.26 -1.86 135.00 137.38 2kmx s PRO 1054Ca 0.37 2.32 -0.07 0.00 0.04 0.00 0.00 61.00 63.66 2kmx s PRO 1054Cb -0.13 -3.17 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 2kmx s PRO 1054CO 0.26 -0.58 0.06 0.08 0.04 0.00 0.00 177.00 176.86 2kmx s VAL 1055N 1.13 4.45 -0.07 -0.36 1.01 0.05 -4.91 120.40 121.71 2kmx s VAL 1055Ca 0.69 -0.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 2kmx s VAL 1055Cb -0.43 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2kmx s VAL 1055CO 0.31 0.39 1.47 0.54 0.00 0.00 0.00 175.10 177.81 2kmx s VAL 1056N 1.09 3.81 -0.12 2.92 0.11 -1.26 -1.06 120.40 125.89 2kmx s VAL 1056Ca 0.04 1.06 -0.04 0.00 -2.93 0.00 0.00 61.98 60.10 2kmx s VAL 1056Cb -0.14 -3.68 -0.06 0.00 -1.53 0.00 0.00 36.38 30.97 2kmx s VAL 1056CO 0.03 -0.06 -0.14 -3.20 -3.33 0.00 0.00 175.10 168.39 2kmx n ASN 1057N 6.41 1.38 -3.72 3.54 5.15 -0.71 -4.93 115.26 122.39 2kmx n ASN 1057Ca 0.15 0.10 -0.14 0.00 -0.60 0.00 0.00 54.58 54.09 2kmx n ASN 1057Cb 0.44 -0.32 -0.08 0.00 -0.53 0.00 0.00 39.78 39.29 2kmx n ASN 1057CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2kmx s GLN 1058N -2.22 0.72 -0.02 1.20 -0.21 -0.53 -5.01 119.66 113.60 2kmx s GLN 1058Ca -0.17 -0.06 0.06 0.00 0.02 0.00 0.00 55.36 55.21 2kmx s GLN 1058Cb 0.06 0.33 -0.01 0.00 1.00 0.00 0.00 33.01 34.38 2kmx s GLN 1058CO 0.23 -0.20 -0.19 0.14 -2.12 0.00 0.00 175.29 173.15 2kmx s VAL 1059N -1.19 1.48 0.01 1.09 -7.23 -1.26 -0.79 120.40 112.50 2kmx s VAL 1059Ca -0.12 -0.80 -0.03 0.00 -1.81 0.00 0.00 61.98 59.22 2kmx s VAL 1059Cb -0.04 -1.24 -0.01 0.00 0.56 0.00 0.00 36.38 35.65 2kmx s VAL 1059CO 0.05 0.42 0.05 -0.75 -0.31 0.00 0.00 175.10 174.56 2kmx s LYS 1060N -0.42 0.34 -0.00 4.82 2.20 -0.36 -5.03 119.74 121.30 2kmx s LYS 1060Ca 0.07 -0.43 0.01 0.00 -0.36 0.00 0.00 55.97 55.26 2kmx s LYS 1060Cb -0.07 0.13 -0.04 0.00 -1.51 0.00 0.00 37.83 36.34 2kmx s LYS 1060CO -0.01 -0.07 0.03 0.08 -0.36 0.00 0.00 175.35 175.03 2kmx s VAL 1061N -1.21 4.36 -0.06 4.02 1.01 -1.26 -0.56 120.40 126.69 2kmx s VAL 1061Ca -0.13 -0.54 0.11 0.00 0.00 0.00 0.00 61.98 61.42 2kmx s VAL 1061Cb -0.08 -2.96 -0.16 0.00 0.00 0.00 0.00 36.38 33.18 2kmx s VAL 1061CO 0.00 0.36 0.15 -0.11 0.00 0.00 0.00 175.10 175.51 2kmx n LEU 1062N 1.31 0.00 -4.95 3.92 7.94 -0.09 -4.91 117.00 120.22 2kmx n LEU 1062Ca -0.14 0.00 -0.23 0.00 -1.11 0.00 0.00 56.01 54.53 2kmx n LEU 1062Cb 0.53 0.14 -0.00 0.00 0.53 0.00 0.00 43.42 44.61 2kmx n LEU 1062CO 0.35 0.14 0.22 0.28 -1.11 0.00 0.00 177.39 177.28 2kmx s THR 1063N -2.55 4.59 -0.16 1.96 -1.32 -1.18 -5.02 115.64 111.96 2kmx s THR 1063Ca -0.05 -0.48 -0.04 0.00 -1.21 0.00 0.00 61.69 59.91 2kmx s THR 1063Cb 0.06 -3.68 0.08 0.00 -1.51 0.00 0.00 72.50 67.44 2kmx s THR 1063CO 0.48 -0.46 0.25 -0.70 -2.21 0.00 0.00 174.62 171.99 2kmx s GLU 1064N -4.42 0.17 -1.25 7.08 2.12 -1.26 -4.97 118.70 116.17 2kmx s GLU 1064Ca 0.44 0.55 -0.06 0.00 0.36 0.00 0.00 54.97 56.26 2kmx s GLU 1064Cb -0.10 -0.46 0.04 0.00 0.26 0.00 0.00 34.13 33.87 2kmx s GLU 1064CO 0.37 -0.43 0.35 0.43 -0.54 0.00 0.00 175.26 175.44 2kmx n SER 1065N 5.34 -4.12 0.00 -1.70 7.64 -1.26 -4.83 113.62 114.69 2kmx n SER 1065Ca -0.06 -0.19 0.00 0.00 1.01 0.00 0.00 58.87 59.63 2kmx n SER 1065Cb 0.50 -3.42 0.00 0.00 -1.01 0.00 0.00 64.21 60.27 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 -2.17 3.20 -3.34 6.43 5.03 -1.26 -5.05 115.26 118.10 2kmx n ASN 1066Ca -0.07 0.00 0.01 0.00 0.87 0.00 0.00 54.58 55.39 2kmx n ASN 1066Cb 0.57 0.30 -0.03 0.00 -1.02 0.00 0.00 39.78 39.60 2kmx n ASN 1066CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 2kmx s ARG 1067N -1.65 0.54 0.32 3.52 6.06 -1.26 -5.13 118.95 121.35 2kmx s ARG 1067Ca 0.00 1.11 0.00 0.00 -2.50 0.00 0.00 55.73 54.34 2kmx s ARG 1067Cb 0.00 0.56 0.00 0.00 0.06 0.00 0.00 34.95 35.57 2kmx s ARG 1067CO 0.00 -0.48 0.00 -0.89 -2.50 0.00 0.00 175.30 171.43 2kmx n ILE 1068N 5.43 -4.38 -2.80 4.11 2.08 -1.26 -4.89 119.36 117.64 2kmx n ILE 1068Ca -0.05 1.88 -0.33 0.00 0.56 0.00 0.00 62.75 64.82 2kmx n ILE 1068Cb 0.50 -2.68 -0.06 0.00 -0.75 0.00 0.00 39.64 36.65 2kmx n ILE 1068CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 2kmx s SER 1069N -2.25 6.82 0.21 4.38 0.01 -1.26 -4.65 113.70 116.96 2kmx s SER 1069Ca 0.00 1.55 -0.10 0.00 1.31 0.00 0.00 55.95 58.72 2kmx s SER 1069Cb 0.00 -2.49 0.28 0.00 0.21 0.00 0.00 66.02 64.02 2kmx s SER 1069CO 0.00 -0.37 1.73 0.45 0.41 0.00 0.00 173.24 175.45 2kmx h HIS 1070N 1.75 0.30 0.00 2.43 3.86 -1.95 0.14 115.15 121.68 2kmx h HIS 1070Ca -0.48 0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 58.61 2kmx h HIS 1070Cb 1.18 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 29.58 2kmx h HIS 1070CO 0.62 0.04 -0.71 1.25 0.86 0.00 0.00 177.93 179.99 2kmx h HIS 1071N 0.33 0.00 -0.36 2.45 -0.00 -2.00 -2.92 115.15 112.65 2kmx h HIS 1071Ca 0.31 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.57 2kmx h HIS 1071Cb 0.41 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.81 2kmx h HIS 1071CO -0.20 0.71 -0.21 0.87 -0.00 0.00 0.00 177.93 179.09 2kmx h LYS 1072N 0.00 0.70 0.16 5.26 1.57 -1.48 -1.74 116.57 121.03 2kmx h LYS 1072Ca -0.01 -0.27 0.01 0.00 -1.87 0.00 0.00 60.65 58.52 2kmx h LYS 1072Cb 1.29 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.54 2kmx h LYS 1072CO 0.09 0.85 -0.22 0.82 -0.57 0.00 0.00 179.45 180.43 2kmx h ILE 1073N 0.61 0.51 -0.27 1.86 2.04 -0.74 -0.98 117.51 120.54 2kmx h ILE 1073Ca 0.09 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.89 2kmx h ILE 1073Cb 0.70 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 2kmx h ILE 1073CO 0.05 0.00 -0.08 0.17 0.00 0.00 0.00 178.15 178.29 2kmx h LEU 1074N -0.44 0.40 -0.23 1.44 8.10 -1.41 -2.67 115.31 120.51 2kmx h LEU 1074Ca 0.02 -0.09 -0.04 0.00 0.11 0.00 0.00 57.88 57.88 2kmx h LEU 1074Cb 0.44 -0.11 -0.01 0.00 -0.44 0.00 0.00 40.66 40.54 2kmx h LEU 1074CO -0.09 0.53 -0.02 0.00 -4.11 0.00 0.00 178.44 174.75 2kmx h ALA 1075N 1.52 0.31 -0.25 0.17 0.00 -1.04 -1.80 119.26 118.18 2kmx h ALA 1075Ca 0.08 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 2kmx h ALA 1075Cb 0.39 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2kmx h ALA 1075CO 0.02 0.05 -0.35 -0.84 0.00 0.00 0.00 179.25 178.14 2kmx h ILE 1076N 0.17 1.29 -0.12 0.00 3.07 -1.05 -1.83 117.51 119.03 2kmx h ILE 1076Ca 0.06 -1.46 -0.06 0.00 1.55 0.00 0.00 64.86 64.95 2kmx h ILE 1076Cb 0.44 1.48 -0.00 0.00 -0.27 0.00 0.00 36.82 38.46 2kmx h ILE 1076CO 0.01 0.46 -0.16 0.58 -1.05 0.00 0.00 178.15 178.00 2kmx h VAL 1077N 0.45 1.37 -0.38 0.16 2.07 -1.50 -2.10 116.25 116.32 2kmx h VAL 1077Ca 0.05 -1.37 -0.09 0.00 0.82 0.00 0.00 66.70 66.10 2kmx h VAL 1077Cb 0.82 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 2kmx h VAL 1077CO 0.07 0.40 -0.15 1.23 0.02 0.00 0.00 177.57 179.14 2kmx h GLY 1078N -0.10 0.76 1.65 2.17 0.00 -1.32 -3.07 103.07 103.15 2kmx h GLY 1078Ca 0.01 -0.58 -0.18 0.00 0.00 0.00 0.00 47.33 46.58 2kmx h GLY 1078CO 0.04 0.53 -0.76 -0.91 0.00 0.00 0.00 176.54 175.44 2kmx h THR 1079N 0.63 1.40 -0.66 4.70 1.35 -1.39 -3.28 112.91 115.67 2kmx h THR 1079Ca 0.10 -2.23 -0.05 0.00 -0.55 0.00 0.00 66.41 63.68 2kmx h THR 1079Cb 0.61 2.19 -0.03 0.00 -1.73 0.00 0.00 68.15 69.19 2kmx h THR 1079CO 0.04 0.66 0.22 0.00 -0.25 0.00 0.00 175.52 176.19 2kmx h ALA 1080N 0.96 1.14 0.00 6.62 0.00 -1.28 -2.17 119.26 124.53 2kmx h ALA 1080Ca -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2kmx h ALA 1080Cb 1.34 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2kmx h ALA 1080CO 0.13 0.60 0.00 0.39 0.00 0.00 0.00 179.25 180.36 2kmx n GLU 1081N -4.28 0.08 0.30 0.00 -0.58 -1.18 -3.63 120.64 111.35 2kmx n GLU 1081Ca 0.05 0.26 0.20 0.00 -0.42 0.00 0.00 57.16 57.25 2kmx n GLU 1081Cb 0.21 -1.63 1.02 0.00 -0.57 0.00 0.00 31.44 30.46 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 0.00 -0.03 1.62 0.87 -1.44 -2.20 113.55 112.37 2kmx h SER 1082Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2kmx h SER 1082Cb 0.36 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 2kmx h SER 1082CO 0.00 0.00 0.00 0.59 -0.53 0.00 0.00 176.83 176.89 2kmx n ASN 1083N -2.96 2.28 -4.97 6.23 4.13 -1.24 -5.06 115.26 113.67 2kmx n ASN 1083Ca -0.02 -1.64 -0.19 0.00 1.68 0.00 0.00 54.58 54.42 2kmx n ASN 1083Cb 0.12 -0.01 -0.00 0.00 -1.54 0.00 0.00 39.78 38.35 2kmx n ASN 1083CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2kmx s SER 1084N -1.25 5.70 -0.48 6.41 0.01 -0.83 -5.06 113.70 118.19 2kmx s SER 1084Ca 0.18 -0.36 0.06 0.00 1.31 0.00 0.00 55.95 57.15 2kmx s SER 1084Cb 0.13 -0.93 0.39 0.00 0.21 0.00 0.00 66.02 65.82 2kmx s SER 1084CO 0.19 -0.57 1.01 -0.62 0.41 0.00 0.00 173.24 173.66 2kmx n GLU 1085N -1.68 3.02 -4.34 12.44 1.02 -1.26 -5.04 120.64 124.79 2kmx n GLU 1085Ca 0.03 -4.49 -0.22 0.00 -0.02 0.00 0.00 57.16 52.46 2kmx n GLU 1085Cb 0.59 -2.13 -0.11 0.00 -0.02 0.00 0.00 31.44 29.76 2kmx n GLU 1085CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2kmx s HIS 1086N -3.41 1.89 -0.58 -0.32 3.76 -1.26 -5.08 115.29 110.29 2kmx s HIS 1086Ca 0.46 -0.45 0.24 0.00 -0.15 0.00 0.00 55.06 55.17 2kmx s HIS 1086Cb 0.35 -0.94 0.53 0.00 1.11 0.00 0.00 32.58 33.63 2kmx s HIS 1086CO -0.15 0.35 1.63 -1.00 -0.85 0.00 0.00 174.74 174.72 2kmx h PRO 1087N 3.25 0.00 0.00 8.40 0.13 -2.02 -3.38 132.00 138.38 2kmx h PRO 1087Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2kmx h PRO 1087Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2kmx h PRO 1087CO 0.50 0.00 -0.83 -0.11 -0.23 0.00 0.00 178.00 177.34 2kmx n LEU 1088N -2.61 0.09 0.27 1.56 0.00 -1.26 -4.72 117.00 110.33 2kmx n LEU 1088Ca 0.04 0.02 0.10 0.00 0.00 0.00 0.00 56.01 56.17 2kmx n LEU 1088Cb 0.48 -0.02 0.71 0.00 0.00 0.00 0.00 43.42 44.58 2kmx n LEU 1088CO 0.33 -0.11 1.07 1.23 0.00 0.00 0.00 177.39 179.91 2kmx h GLY 1089N 0.00 0.00 2.00 -3.96 0.00 -2.00 -1.58 103.07 97.54 2kmx h GLY 1089Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2kmx h GLY 1089CO 0.00 0.00 -0.05 -0.91 0.00 0.00 0.00 176.54 175.58 2kmx h THR 1090N 0.00 0.31 0.00 4.70 1.35 -1.85 0.28 112.91 117.70 2kmx h THR 1090Ca -0.00 -0.31 -0.07 0.00 -0.55 0.00 0.00 66.41 65.49 2kmx h THR 1090Cb 0.03 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.67 2kmx h THR 1090CO 0.00 0.05 -0.31 0.00 -0.25 0.00 0.00 175.52 175.01 2kmx h ALA 1091N 1.95 1.40 -0.15 6.62 0.00 -1.57 -1.96 119.26 125.55 2kmx h ALA 1091Ca -0.00 -0.29 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 2kmx h ALA 1091Cb 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2kmx h ALA 1091CO 0.01 0.39 -0.59 0.82 0.00 0.00 0.00 179.25 179.88 2kmx h ILE 1092N 0.00 1.33 -0.31 0.00 2.04 -1.07 -0.75 117.51 118.76 2kmx h ILE 1092Ca -0.00 -1.87 0.04 0.00 1.00 0.00 0.00 64.86 64.02 2kmx h ILE 1092Cb 0.58 1.85 -0.04 0.00 -0.74 0.00 0.00 36.82 38.48 2kmx h ILE 1092CO 0.04 0.57 0.10 0.74 0.00 0.00 0.00 178.15 179.60 2kmx h THR 1093N 0.38 0.90 -0.16 -0.27 2.02 -1.22 0.52 112.91 115.08 2kmx h THR 1093Ca -0.00 -0.08 0.04 0.00 0.77 0.00 0.00 66.41 67.15 2kmx h THR 1093Cb 1.13 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 68.15 2kmx h THR 1093CO 0.11 0.04 -0.12 0.50 0.37 0.00 0.00 175.52 176.41 2kmx h LYS 1094N 0.22 -0.13 -0.59 6.66 3.64 -1.20 0.40 116.57 125.57 2kmx h LYS 1094Ca 0.14 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.55 2kmx h LYS 1094Cb 0.12 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 2kmx h LYS 1094CO -0.16 -0.09 0.37 -0.92 -2.27 0.00 0.00 179.45 176.39 2kmx h TYR 1095N -0.13 0.69 -0.02 1.91 3.20 -0.91 -1.20 116.97 120.51 2kmx h TYR 1095Ca 0.10 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 2kmx h TYR 1095Cb 0.28 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 2kmx h TYR 1095CO -0.26 0.40 0.00 0.00 -1.64 0.00 0.00 178.16 176.66 2kmx h LYS 1097N -0.26 0.37 -0.29 0.00 3.11 -0.76 0.14 116.57 118.89 2kmx h LYS 1097Ca 0.01 -0.06 -0.16 0.00 -2.81 0.00 0.00 60.65 57.62 2kmx h LYS 1097Cb 0.30 -0.06 -0.00 0.00 -1.00 0.00 0.00 32.23 31.47 2kmx h LYS 1097CO 0.00 0.39 -0.44 0.37 -2.81 0.00 0.00 179.45 176.96 2kmx h GLN 1098N 0.36 0.81 -0.38 1.90 4.15 -1.18 -2.75 115.11 118.03 2kmx h GLN 1098Ca 0.08 -0.48 -0.15 0.00 0.77 0.00 0.00 58.65 58.87 2kmx h GLN 1098Cb 0.23 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.96 2kmx h GLN 1098CO 0.00 1.12 -0.35 1.49 -1.93 0.00 0.00 178.83 179.16 2kmx h GLU 1099N 0.57 0.91 0.00 1.69 4.57 -0.10 -3.14 114.58 119.08 2kmx h GLU 1099Ca 0.03 -0.47 -0.00 0.00 -1.18 0.00 0.00 59.36 57.73 2kmx h GLU 1099Cb 1.04 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.64 2kmx h GLU 1099CO 0.10 1.12 -0.01 -0.07 -1.18 0.00 0.00 179.01 178.97 2kmx h LEU 1100N 0.72 0.00 -1.15 1.64 3.38 -0.86 -3.48 115.31 115.56 2kmx h LEU 1100Ca 0.06 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.58 2kmx h LEU 1100Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2kmx h LEU 1100CO 0.09 0.01 -0.77 -0.67 0.09 0.00 0.00 178.44 177.20 2kmx n ASP 1101N -3.11 -4.15 -4.44 -0.43 2.03 -1.04 -5.01 116.55 100.40 2kmx n ASP 1101Ca 0.02 -0.76 -0.22 0.00 0.52 0.00 0.00 54.79 54.35 2kmx n ASP 1101Cb 0.38 -4.05 -0.10 0.00 -0.72 0.00 0.00 41.12 36.63 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 -3.38 1.58 -0.89 5.18 -1.32 -1.22 -5.08 115.64 110.50 2kmx s THR 1102Ca 0.51 -2.09 0.21 0.00 -1.21 0.00 0.00 61.69 59.10 2kmx s THR 1102Cb -0.25 -2.54 -0.24 0.00 -1.51 0.00 0.00 72.50 67.96 2kmx s THR 1102CO 0.82 -0.23 0.85 1.21 -2.21 0.00 0.00 174.62 175.06 2kmx n GLU 1103N -0.62 0.08 -3.75 7.08 2.13 -1.26 -4.82 120.64 119.48 2kmx n GLU 1103Ca -0.05 -0.02 -0.12 0.00 0.66 0.00 0.00 57.16 57.63 2kmx n GLU 1103Cb 0.64 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.73 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 -3.06 -0.02 -0.05 6.31 -1.32 -1.26 -5.17 115.64 111.07 2kmx s THR 1104Ca 0.06 0.06 -0.28 0.00 -1.21 0.00 0.00 61.69 60.33 2kmx s THR 1104Cb 0.16 -0.43 0.06 0.00 -1.51 0.00 0.00 72.50 70.78 2kmx s THR 1104CO 0.87 0.03 0.62 -1.48 -2.21 0.00 0.00 174.62 172.45 2kmx s LEU 1105N 0.72 -0.41 0.30 9.08 2.34 -1.26 -5.12 118.68 124.33 2kmx s LEU 1105Ca -0.05 0.65 0.00 0.00 0.06 0.00 0.00 54.13 54.79 2kmx s LEU 1105Cb -0.06 2.32 0.00 0.00 -0.56 0.00 0.00 46.19 47.89 2kmx s LEU 1105CO -0.05 -0.56 0.00 0.61 -1.06 0.00 0.00 176.35 175.29 2kmx n GLY 1106N 1.06 -3.78 0.00 -3.48 0.00 -1.26 -4.85 105.19 92.88 2kmx n GLY 1106Ca -0.19 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 44.87 2kmx n GLY 1106CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2kmx n THR 1107N -1.28 0.00 -4.17 2.61 -1.04 -1.26 -5.01 114.28 104.13 2kmx n THR 1107Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.84 2kmx n THR 1107Cb 0.07 -0.70 -0.15 0.00 -1.82 0.00 0.00 70.33 67.74 2kmx n THR 1107CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2kmx s ILE 1109N 0.20 0.10 -0.19 0.00 1.09 -1.25 -1.79 121.20 119.36 2kmx s ILE 1109Ca -0.02 -0.84 -0.04 0.00 -1.10 0.00 0.00 60.65 58.65 2kmx s ILE 1109Cb -0.06 -0.30 0.06 0.00 -1.06 0.00 0.00 42.46 41.11 2kmx s ILE 1109CO -0.00 -0.46 0.07 -0.62 -0.10 0.00 0.00 174.94 173.82 2kmx s ASP 1110N -1.41 2.76 -0.12 3.58 2.15 -0.57 -4.91 116.67 118.14 2kmx s ASP 1110Ca -0.15 -0.80 -0.11 0.00 0.43 0.00 0.00 52.55 51.92 2kmx s ASP 1110Cb -0.09 -0.45 -0.05 0.00 -0.30 0.00 0.00 42.92 42.04 2kmx s ASP 1110CO -0.00 -0.34 0.24 0.72 -0.17 0.00 0.00 175.17 175.62 2kmx s PHE 1111N 1.98 3.55 -0.35 -5.34 -0.71 -1.26 -1.66 117.98 114.19 2kmx s PHE 1111Ca 0.01 0.61 -0.11 0.00 -1.04 0.00 0.00 56.93 56.41 2kmx s PHE 1111Cb -0.17 -2.18 0.01 0.00 -1.21 0.00 0.00 43.02 39.47 2kmx s PHE 1111CO -0.11 0.48 0.20 -0.65 -1.34 0.00 0.00 175.22 173.80 2kmx s GLN 1112N -0.31 3.14 -0.02 1.99 1.11 0.67 -4.99 119.66 121.25 2kmx s GLN 1112Ca 0.16 -0.87 0.04 0.00 0.01 0.00 0.00 55.36 54.70 2kmx s GLN 1112Cb -0.13 -3.70 -0.03 0.00 -1.01 0.00 0.00 33.01 28.13 2kmx s GLN 1112CO 0.05 -0.55 -0.10 0.14 0.01 0.00 0.00 175.29 174.83 2kmx s VAL 1113N 1.62 3.37 -0.02 1.09 -7.23 -1.26 -1.54 120.40 116.43 2kmx s VAL 1113Ca 0.04 -0.78 0.00 0.00 -1.81 0.00 0.00 61.98 59.43 2kmx s VAL 1113Cb -0.18 -2.41 0.03 0.00 0.56 0.00 0.00 36.38 34.38 2kmx s VAL 1113CO 0.07 0.47 0.02 -0.69 -0.31 0.00 0.00 175.10 174.67 2kmx s VAL 1114N -0.89 -0.03 0.14 1.32 1.01 -1.23 -4.74 120.40 115.99 2kmx s VAL 1114Ca 0.14 0.18 -0.31 0.00 0.00 0.00 0.00 61.98 61.99 2kmx s VAL 1114Cb -0.11 -0.09 -0.08 0.00 0.00 0.00 0.00 36.38 36.10 2kmx s VAL 1114CO 0.04 0.08 1.40 -2.16 0.00 0.00 0.00 175.10 174.47 2kmx s PRO 1115N 0.94 4.31 0.00 2.72 0.04 -1.26 -3.64 135.00 138.11 2kmx s PRO 1115Ca -0.08 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2kmx s PRO 1115Cb -0.11 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.20 2kmx s PRO 1115CO -0.03 -0.43 0.00 0.41 0.04 0.00 0.00 177.00 176.99 2kmx n GLY 1116N 3.30 0.63 0.05 0.56 0.00 -1.26 -4.76 105.19 103.71 2kmx n GLY 1116Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 0.40 -0.93 3.23 0.00 0.00 -1.26 -4.27 105.19 102.36 2kmx n GLY 1118Ca 0.00 -1.66 -0.13 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.82 0.51 0.12 -0.61 -4.36 -0.27 -3.50 121.20 111.26 2kmx s ILE 1119Ca 0.00 -1.97 0.07 0.00 -0.26 0.00 0.00 60.65 58.49 2kmx s ILE 1119Cb 0.00 -2.18 -0.04 0.00 1.25 0.00 0.00 42.46 41.49 2kmx s ILE 1119CO 0.00 -0.40 -0.17 -0.55 0.24 0.00 0.00 174.94 174.06 2kmx s SER 1120N -3.16 2.28 0.21 4.36 0.15 -0.59 -1.48 113.70 115.47 2kmx s SER 1120Ca 0.26 -0.75 -0.05 0.00 0.70 0.00 0.00 55.95 56.11 2kmx s SER 1120Cb 0.07 -0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.24 2kmx s SER 1120CO 0.05 -0.04 0.25 0.00 1.20 0.00 0.00 173.24 174.70 2kmx s LYS 1122N -4.10 3.06 -0.03 0.00 -0.14 -0.66 -1.26 119.74 116.60 2kmx s LYS 1122Ca 0.32 -0.80 0.04 0.00 -1.36 0.00 0.00 55.97 54.18 2kmx s LYS 1122Cb 0.04 -2.65 -0.01 0.00 -1.68 0.00 0.00 37.83 33.53 2kmx s LYS 1122CO 0.10 -0.21 -0.16 0.54 -0.76 0.00 0.00 175.35 174.86 2kmx s VAL 1123N 1.32 1.32 0.13 3.17 0.11 -0.11 -1.52 120.40 124.83 2kmx s VAL 1123Ca 0.05 -0.67 0.11 0.00 -2.93 0.00 0.00 61.98 58.54 2kmx s VAL 1123Cb -0.13 -1.13 -0.04 0.00 -1.53 0.00 0.00 36.38 33.55 2kmx s VAL 1123CO -0.11 0.38 -0.26 0.28 -3.33 0.00 0.00 175.10 172.06 2kmx s THR 1124N -0.07 2.30 -0.14 5.04 -1.32 -0.74 -0.94 115.64 119.77 2kmx s THR 1124Ca -0.01 -1.75 0.05 0.00 -1.21 0.00 0.00 61.69 58.78 2kmx s THR 1124Cb -0.10 -2.02 0.17 0.00 -1.51 0.00 0.00 72.50 69.04 2kmx s THR 1124CO 0.01 0.09 0.98 -3.20 -2.21 0.00 0.00 174.62 170.28 2kmx n ASN 1125N 0.89 -0.82 0.00 8.08 2.85 -1.26 -3.45 115.26 121.54 2kmx n ASN 1125Ca -0.18 -1.59 0.00 0.00 -0.11 0.00 0.00 54.58 52.70 2kmx n ASN 1125Cb 0.53 0.35 0.00 0.00 1.24 0.00 0.00 39.78 41.90 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 -0.64 0.00 0.00 -1.44 -5.35 -1.26 -5.03 119.36 105.64 2kmx n ILE 1126Ca -0.13 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.35 2kmx n ILE 1126Cb 0.67 -0.33 0.00 0.00 -1.74 0.00 0.00 39.64 38.24 2kmx n ILE 1126CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2kmx n GLU 1127N -1.66 3.67 0.00 6.28 1.02 -1.22 -4.85 120.64 123.88 2kmx n GLU 1127Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 2kmx n GLU 1127Cb 0.00 -0.28 0.03 0.00 -0.02 0.00 0.00 31.44 31.17 2kmx n GLU 1127CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kmx n GLY 1128N 0.56 -0.39 0.00 0.62 0.00 -0.60 -2.70 105.19 102.68 2kmx n GLY 1128Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.34 0.00 0.05 0.99 -0.00 -1.26 -1.70 117.00 113.74 2kmx n LEU 1129Ca 0.01 0.39 -0.12 0.00 -0.00 0.00 0.00 56.01 56.29 2kmx n LEU 1129Cb 0.01 -0.39 -0.08 0.00 -0.00 0.00 0.00 43.42 42.96 2kmx n LEU 1129CO 0.01 -0.39 0.47 0.25 -0.00 0.00 0.00 177.39 177.73 2kmx h LEU 1130N 0.00 -0.17 -7.21 1.47 6.46 -1.88 -3.48 115.31 110.50 2kmx h LEU 1130Ca 0.00 -0.37 -0.10 0.00 -0.12 0.00 0.00 57.88 57.29 2kmx h LEU 1130Cb 0.09 0.04 -0.24 0.00 -0.73 0.00 0.00 40.66 39.82 2kmx h LEU 1130CO 0.00 0.36 -0.20 -2.28 -0.62 0.00 0.00 178.44 175.70 2kmx s HIS 1131N -3.74 -0.62 0.00 1.25 5.04 -0.69 -5.07 115.29 111.46 2kmx s HIS 1131Ca -0.14 1.38 0.00 0.00 -1.54 0.00 0.00 55.06 54.76 2kmx s HIS 1131Cb 0.01 0.27 0.00 0.00 0.04 0.00 0.00 32.58 32.90 2kmx s HIS 1131CO 0.53 -0.32 0.00 1.63 -2.34 0.00 0.00 174.74 174.24 2kmx n LYS 1132N 3.63 0.00 -2.35 2.88 5.02 -1.26 -4.83 118.16 121.25 2kmx n LYS 1132Ca -0.19 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 55.99 2kmx n LYS 1132Cb 0.56 -0.43 -0.01 0.00 -0.02 0.00 0.00 35.03 35.13 2kmx n LYS 1132CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2kmx n ASN 1133N -1.64 -3.71 -2.72 4.39 5.15 -1.26 -4.88 115.26 110.59 2kmx n ASN 1133Ca 0.00 0.22 -0.31 0.00 -0.60 0.00 0.00 54.58 53.89 2kmx n ASN 1133Cb 0.00 -3.19 -0.03 0.00 -0.53 0.00 0.00 39.78 36.03 2kmx n ASN 1133CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2kmx n ASN 1134N -1.67 6.86 -4.68 1.20 2.85 -1.26 -4.92 115.26 113.64 2kmx n ASN 1134Ca -0.14 -3.31 -0.24 0.00 -0.11 0.00 0.00 54.58 50.78 2kmx n ASN 1134Cb 0.59 -1.22 0.10 0.00 1.24 0.00 0.00 39.78 40.49 2kmx n ASN 1134CO 0.00 0.00 0.00 0.26 -2.11 0.00 0.00 177.26 175.41 2kmx s TRP 1135N -2.10 1.84 0.00 1.20 0.52 -1.26 -5.06 118.94 114.07 2kmx s TRP 1135Ca 0.57 -0.14 0.00 0.00 0.02 0.00 0.00 56.10 56.55 2kmx s TRP 1135Cb 0.36 -3.08 0.00 0.00 -1.15 0.00 0.00 33.47 29.60 2kmx s TRP 1135CO -0.24 -1.67 0.52 0.27 0.02 0.00 0.00 176.95 175.85 2kmx n ASN 1136N -2.87 0.00 -2.96 2.95 0.23 -1.26 -4.97 115.26 106.38 2kmx n ASN 1136Ca 0.14 0.52 -0.04 0.00 -0.53 0.00 0.00 54.58 54.67 2kmx n ASN 1136Cb 0.60 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 2kmx n ASN 1136CO 0.00 0.00 0.00 -0.38 -0.93 0.00 0.00 177.26 175.95 2kmx n ILE 1137N -1.16 -7.66 0.30 1.53 5.41 -1.26 -4.70 119.36 111.82 2kmx n ILE 1137Ca 0.00 1.14 0.19 0.00 1.00 0.00 0.00 62.75 65.08 2kmx n ILE 1137Cb 0.00 -5.26 0.89 0.00 -0.71 0.00 0.00 39.64 34.56 2kmx n ILE 1137CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2kmx h GLU 1138N 3.10 0.00 0.00 0.38 4.39 -1.98 -0.95 114.58 119.52 2kmx h GLU 1138Ca -0.04 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 2kmx h GLU 1138Cb 0.56 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2kmx h GLU 1138CO 0.08 0.02 -0.01 -0.44 -1.16 0.00 0.00 179.01 177.50 2kmx h ASP 1139N 0.00 0.00 0.04 1.42 5.19 -1.96 -2.85 116.42 118.26 2kmx h ASP 1139Ca -0.00 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 56.07 2kmx h ASP 1139Cb 0.30 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.77 2kmx h ASP 1139CO 0.00 0.01 -1.91 -3.20 -3.12 0.00 0.00 179.24 171.02 2kmx n ASN 1140N -3.18 1.99 0.14 6.45 5.15 -0.39 -4.43 115.26 120.98 2kmx n ASN 1140Ca -0.02 0.25 -0.00 0.00 -0.60 0.00 0.00 54.58 54.21 2kmx n ASN 1140Cb 0.12 -0.83 0.17 0.00 -0.53 0.00 0.00 39.78 38.71 2kmx n ASN 1140CO 0.00 0.00 0.00 0.78 1.40 0.00 0.00 177.26 179.44 2kmx h ASN 1141N -0.49 0.00 0.00 1.20 2.35 -1.28 -3.39 115.58 113.97 2kmx h ASN 1141Ca -0.47 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.25 2kmx h ASN 1141Cb 1.69 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 40.00 2kmx h ASN 1141CO -0.13 0.60 -0.39 0.00 -1.65 0.00 0.00 177.43 175.87 2kmx n ILE 1142N -3.66 0.00 0.11 2.81 3.06 -1.10 -4.92 119.36 115.66 2kmx n ILE 1142Ca -0.01 -0.13 -0.22 0.00 -2.50 0.00 0.00 62.75 59.90 2kmx n ILE 1142Cb 0.64 0.40 -0.13 0.00 0.54 0.00 0.00 39.64 41.09 2kmx n ILE 1142CO 0.00 0.00 0.00 0.50 -2.50 0.00 0.00 176.55 174.55 2kmx h LYS 1143N 0.13 0.54 -6.66 9.51 3.64 -1.75 -3.48 116.57 118.50 2kmx h LYS 1143Ca -0.08 -0.79 -0.54 0.00 -1.27 0.00 0.00 60.65 57.97 2kmx h LYS 1143Cb 1.34 0.27 -0.17 0.00 -0.41 0.00 0.00 32.23 33.27 2kmx h LYS 1143CO -0.01 1.36 -0.83 0.09 -2.27 0.00 0.00 179.45 177.79 2kmx n ASN 1144N -3.73 -3.11 -3.95 4.20 3.02 -1.26 -4.95 115.26 105.48 2kmx n ASN 1144Ca -0.13 -0.98 -0.11 0.00 -0.03 0.00 0.00 54.58 53.32 2kmx n ASN 1144Cb 1.02 -2.95 -0.07 0.00 -0.61 0.00 0.00 39.78 37.17 2kmx n ASN 1144CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kmx s ALA 1145N -3.38 0.42 -0.06 5.41 0.00 -1.24 -4.80 121.76 118.10 2kmx s ALA 1145Ca 0.63 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 51.33 2kmx s ALA 1145Cb -0.34 1.20 0.02 0.00 0.00 0.00 0.00 23.12 24.00 2kmx s ALA 1145CO 0.91 -0.75 -0.04 0.45 0.00 0.00 0.00 175.76 176.33 2kmx s SER 1146N -3.10 1.23 0.17 0.00 0.15 -1.26 -1.06 113.70 109.82 2kmx s SER 1146Ca 0.30 -0.13 0.11 0.00 0.70 0.00 0.00 55.95 56.92 2kmx s SER 1146Cb 0.02 -0.49 -0.04 0.00 -1.71 0.00 0.00 66.02 63.80 2kmx s SER 1146CO 0.12 -0.09 -0.24 -0.76 1.20 0.00 0.00 173.24 173.47 2kmx s LEU 1147N 1.25 2.40 -1.47 3.45 2.01 -1.26 -4.82 118.68 120.24 2kmx s LEU 1147Ca -0.06 -0.83 -0.05 0.00 0.01 0.00 0.00 54.13 53.21 2kmx s LEU 1147Cb -0.14 -1.10 0.04 0.00 0.01 0.00 0.00 46.19 45.00 2kmx s LEU 1147CO -0.02 0.10 0.53 0.52 1.01 0.00 0.00 176.35 178.49 2kmx n VAL 1148N 0.48 -2.63 -2.33 -1.59 0.31 -1.26 -4.88 118.33 106.42 2kmx n VAL 1148Ca -0.14 -0.37 -0.41 0.00 -0.01 0.00 0.00 64.34 63.40 2kmx n VAL 1148Cb 0.55 -2.50 -0.03 0.00 -0.91 0.00 0.00 33.84 30.95 2kmx n VAL 1148CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2kmx s GLN 1149N -6.62 4.44 -0.19 5.55 1.11 -1.26 -4.95 119.66 117.73 2kmx s GLN 1149Ca 0.19 1.90 0.10 0.00 0.01 0.00 0.00 55.36 57.56 2kmx s GLN 1149Cb -0.10 -3.26 -0.22 0.00 -1.01 0.00 0.00 33.01 28.42 2kmx s GLN 1149CO 0.89 -0.20 0.07 -0.89 0.01 0.00 0.00 175.29 175.18 2kmx n ILE 1150N 3.02 1.48 -3.87 1.08 2.08 -1.26 -5.03 119.36 116.87 2kmx n ILE 1150Ca 0.07 -0.74 -0.28 0.00 0.56 0.00 0.00 62.75 62.36 2kmx n ILE 1150Cb 0.44 -0.95 0.00 0.00 -0.75 0.00 0.00 39.64 38.39 2kmx n ILE 1150CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2kmx n ASP 1151N -3.01 -1.95 0.26 4.38 8.00 -1.26 -4.90 116.55 118.08 2kmx n ASP 1151Ca -0.35 -1.01 0.17 0.00 0.71 0.00 0.00 54.79 54.30 2kmx n ASP 1151Cb 1.08 -3.14 0.62 0.00 -0.02 0.00 0.00 41.12 39.66 2kmx n ASP 1151CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kmx h ALA 1152N 0.87 1.00 -2.57 2.24 0.00 -2.03 -3.50 119.26 115.27 2kmx h ALA 1152Ca -0.64 0.00 0.27 0.00 0.00 0.00 0.00 54.91 54.53 2kmx h ALA 1152Cb 1.37 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 19.03 2kmx h ALA 1152CO 0.57 0.00 -0.85 -1.13 0.00 0.00 0.00 179.25 177.84 2kmx n SER 1153N -3.05 -6.05 -2.84 0.00 3.41 -1.26 -4.95 113.62 98.88 2kmx n SER 1153Ca 0.01 0.97 -0.21 0.00 -0.26 0.00 0.00 58.87 59.38 2kmx n SER 1153Cb 0.33 -3.62 0.01 0.00 -0.26 0.00 0.00 64.21 60.68 2kmx n SER 1153CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2kmx n ASN 1154N -3.78 -5.52 -0.01 4.04 5.15 -1.26 -4.87 115.26 109.01 2kmx n ASN 1154Ca -0.06 -0.17 -0.01 0.00 -0.60 0.00 0.00 54.58 53.74 2kmx n ASN 1154Cb 0.51 -4.52 -0.01 0.00 -0.53 0.00 0.00 39.78 35.22 2kmx n ASN 1154CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2kmx n GLU 1155N -3.59 0.19 -1.39 1.20 2.13 -1.26 -5.17 120.64 112.76 2kmx n GLU 1155Ca -0.14 0.01 0.17 0.00 0.66 0.00 0.00 57.16 57.86 2kmx n GLU 1155Cb 0.63 -1.04 -0.07 0.00 0.27 0.00 0.00 31.44 31.23 2kmx n GLU 1155CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2kmx n GLN 1156N -2.53 -3.08 -1.17 5.31 3.00 -1.26 -5.05 117.38 112.60 2kmx n GLN 1156Ca -0.03 2.37 0.15 0.00 -0.01 0.00 0.00 57.00 59.49 2kmx n GLN 1156Cb 0.53 -3.64 -0.05 0.00 0.00 0.00 0.00 30.24 27.08 2kmx n GLN 1156CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2kmx n SER 1157N -4.25 -7.01 -1.55 1.08 2.88 -1.26 -4.96 113.62 98.54 2kmx n SER 1157Ca -0.06 0.67 -0.16 0.00 -1.33 0.00 0.00 58.87 57.99 2kmx n SER 1157Cb 0.65 -3.68 -0.04 0.00 -0.75 0.00 0.00 64.21 60.39 2kmx n SER 1157CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2kmx n SER 1158N -3.82 -4.92 0.21 -3.46 3.41 -1.26 -4.94 113.62 98.85 2kmx n SER 1158Ca -0.01 0.20 0.14 0.00 -0.26 0.00 0.00 58.87 58.93 2kmx n SER 1158Cb 0.54 -3.94 0.40 0.00 -0.26 0.00 0.00 64.21 60.96 2kmx n SER 1158CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2kmx h THR 1159N 0.00 0.00 0.24 6.66 1.35 -1.99 -3.09 112.91 116.08 2kmx h THR 1159Ca -0.36 -0.68 -0.01 0.00 -0.55 0.00 0.00 66.41 64.80 2kmx h THR 1159Cb 1.17 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 2kmx h THR 1159CO 0.47 0.00 -0.11 0.77 -0.25 0.00 0.00 175.52 176.40 2kmx h SER 1160N 0.00 -0.27 -3.56 5.36 4.64 -1.92 -3.46 113.55 114.33 2kmx h SER 1160Ca 0.00 -0.24 -0.13 0.00 -0.47 0.00 0.00 61.79 60.95 2kmx h SER 1160Cb 0.74 0.07 -0.26 0.00 -0.31 0.00 0.00 62.40 62.64 2kmx h SER 1160CO 0.00 0.14 -0.29 -0.55 -0.87 0.00 0.00 176.83 175.26 2kmx s SER 1161N -5.23 -0.45 -0.21 4.97 0.15 -1.23 -3.67 113.70 108.04 2kmx s SER 1161Ca -0.14 0.82 0.15 0.00 0.70 0.00 0.00 55.95 57.48 2kmx s SER 1161Cb 0.02 0.77 0.69 0.00 -1.71 0.00 0.00 66.02 65.79 2kmx s SER 1161CO 0.54 -0.16 1.61 -1.20 1.20 0.00 0.00 173.24 175.23 2kmx n SER 1162N 3.55 4.92 -4.36 5.45 7.64 -0.22 -4.69 113.62 125.91 2kmx n SER 1162Ca -0.18 -2.94 -0.25 0.00 1.01 0.00 0.00 58.87 56.51 2kmx n SER 1162Cb 0.56 -0.62 -0.12 0.00 -1.01 0.00 0.00 64.21 63.02 2kmx n SER 1162CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2kmx s MET 1163N -2.74 1.35 0.00 1.43 -1.94 -1.26 -4.64 119.30 111.50 2kmx s MET 1163Ca 0.49 -1.40 0.00 0.00 -1.71 0.00 0.00 55.69 53.07 2kmx s MET 1163Cb 0.38 -1.60 0.00 0.00 2.01 0.00 0.00 34.83 35.62 2kmx s MET 1163CO 0.13 0.35 0.00 -0.89 -0.01 0.00 0.00 175.02 174.60 2kmx n ILE 1164N 0.50 0.00 0.26 2.53 2.08 -1.26 -4.72 119.36 118.75 2kmx n ILE 1164Ca -0.15 0.00 0.12 0.00 0.56 0.00 0.00 62.75 63.28 2kmx n ILE 1164Cb 0.55 0.00 0.75 0.00 -0.75 0.00 0.00 39.64 40.19 2kmx n ILE 1164CO 0.00 0.00 0.00 0.16 0.56 0.00 0.00 176.55 177.27 2kmx h ILE 1165N 0.00 0.80 0.00 1.39 -0.00 -1.91 -2.94 117.51 114.85 2kmx h ILE 1165Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.86 2kmx h ILE 1165Cb 0.00 0.98 0.00 0.00 -0.00 0.00 0.00 36.82 37.80 2kmx h ILE 1165CO 0.00 0.00 -1.38 -0.90 -0.00 0.00 0.00 178.15 175.87 2kmx n ASP 1166N -4.26 0.49 0.00 2.16 5.75 -1.26 -4.33 116.55 115.10 2kmx n ASP 1166Ca -0.02 0.10 0.11 0.00 -0.01 0.00 0.00 54.79 54.96 2kmx n ASP 1166Cb 0.13 1.09 0.56 0.00 -1.03 0.00 0.00 41.12 41.87 2kmx n ASP 1166CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2kmx n ALA 1167N -2.14 2.15 0.17 2.12 0.00 -1.11 -3.26 120.51 118.45 2kmx n ALA 1167Ca -0.01 -0.11 0.06 0.00 0.00 0.00 0.00 53.44 53.38 2kmx n ALA 1167Cb 0.53 -1.36 0.11 0.00 0.00 0.00 0.00 19.45 18.73 2kmx n ALA 1167CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kmx n GLN 1168N -1.28 1.72 0.08 0.00 10.64 -1.26 -4.59 117.38 122.70 2kmx n GLN 1168Ca 0.11 -1.64 -0.19 0.00 -1.83 0.00 0.00 57.00 53.45 2kmx n GLN 1168Cb 0.18 -1.26 -0.15 0.00 -0.86 0.00 0.00 30.24 28.15 2kmx n GLN 1168CO 0.00 0.00 0.00 0.82 -1.83 0.00 0.00 177.06 176.05 2kmx h ILE 1169N 2.30 1.19 0.00 -0.39 2.04 -1.81 -3.38 117.51 117.46 2kmx h ILE 1169Ca 0.00 -2.78 0.00 0.00 1.00 0.00 0.00 64.86 63.08 2kmx h ILE 1169Cb 0.62 2.83 0.00 0.00 -0.74 0.00 0.00 36.82 39.54 2kmx h ILE 1169CO 0.00 0.84 0.00 -1.54 0.00 0.00 0.00 178.15 177.45 2kmx n SER 1170N -3.53 0.61 -0.00 1.72 3.41 -1.26 -0.99 113.62 113.58 2kmx n SER 1170Ca -0.17 0.72 0.08 0.00 -0.26 0.00 0.00 58.87 59.24 2kmx n SER 1170Cb 1.06 -0.82 -0.10 0.00 -0.26 0.00 0.00 64.21 64.09 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 -2.25 0.81 -0.26 4.04 3.02 -1.26 -4.90 115.26 114.46 2kmx n ASN 1171Ca 0.00 -0.80 0.05 0.00 -0.03 0.00 0.00 54.58 53.81 2kmx n ASN 1171Cb 0.12 1.08 0.16 0.00 -0.61 0.00 0.00 39.78 40.52 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 2.23 0.80 0.00 5.41 0.00 -1.23 0.42 119.26 126.89 2kmx h ALA 1172Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2kmx h ALA 1172Cb 0.42 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2kmx h ALA 1172CO 0.00 -0.42 0.00 -0.07 0.00 0.00 0.00 179.25 178.76 2kmx h LEU 1173N 0.11 0.00 0.00 0.00 -0.00 -1.91 -1.99 115.31 111.53 2kmx h LEU 1173Ca 0.41 0.00 -0.41 0.00 -0.00 0.00 0.00 57.88 57.88 2kmx h LEU 1173Cb 0.73 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 41.32 2kmx h LEU 1173CO -0.66 0.00 -2.49 0.59 -0.00 0.00 0.00 178.44 175.88 2kmx n ASN 1174N -2.71 1.98 -2.62 -0.43 4.13 -0.65 -4.61 115.26 110.33 2kmx n ASN 1174Ca -0.00 0.01 -0.26 0.00 1.68 0.00 0.00 54.58 56.00 2kmx n ASN 1174Cb 0.19 -0.54 -0.08 0.00 -1.54 0.00 0.00 39.78 37.81 2kmx n ASN 1174CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2kmx n ALA 1175N -3.55 6.63 -1.62 5.41 0.00 0.05 -4.72 120.51 122.72 2kmx n ALA 1175Ca -0.48 -2.93 -0.39 0.00 0.00 0.00 0.00 53.44 49.63 2kmx n ALA 1175Cb 0.96 -2.45 0.03 0.00 0.00 0.00 0.00 19.45 17.99 2kmx n ALA 1175CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2kmx n GLN 1176N 1.82 1.14 -3.95 0.00 6.02 -0.78 -3.82 117.38 117.81 2kmx n GLN 1176Ca 0.53 0.42 -0.10 0.00 -0.01 0.00 0.00 57.00 57.84 2kmx n GLN 1176Cb 0.57 -2.14 -0.02 0.00 1.02 0.00 0.00 30.24 29.67 2kmx n GLN 1176CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2kmx s GLN 1177N -2.44 1.88 -0.06 -1.09 -1.52 -1.26 -1.56 119.66 113.61 2kmx s GLN 1177Ca 0.70 -1.42 0.02 0.00 -1.95 0.00 0.00 55.36 52.71 2kmx s GLN 1177Cb -0.47 0.52 0.02 0.00 -0.22 0.00 0.00 33.01 32.86 2kmx s GLN 1177CO 0.52 -0.82 -0.09 0.71 -0.25 0.00 0.00 175.29 175.35 2kmx s TYR 1178N -3.26 1.17 -0.19 0.91 2.02 -0.12 -4.96 117.35 112.92 2kmx s TYR 1178Ca 0.21 -0.40 -0.21 0.00 -0.37 0.00 0.00 57.07 56.30 2kmx s TYR 1178Cb -0.03 -0.90 -0.02 0.00 -0.40 0.00 0.00 41.96 40.61 2kmx s TYR 1178CO 0.13 -0.24 0.66 0.21 -1.57 0.00 0.00 175.55 174.74 2kmx s LYS 1179N 0.75 4.23 0.11 -0.62 2.20 -1.26 -0.93 119.74 124.21 2kmx s LYS 1179Ca -0.13 0.68 0.04 0.00 -0.36 0.00 0.00 55.97 56.20 2kmx s LYS 1179Cb -0.15 -3.58 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 2kmx s LYS 1179CO 0.02 -0.25 -0.12 0.14 -0.36 0.00 0.00 175.35 174.79 2kmx s VAL 1180N 1.94 1.08 0.01 4.02 -7.23 -0.39 -0.66 120.40 119.17 2kmx s VAL 1180Ca 0.30 -1.66 -0.17 0.00 -1.81 0.00 0.00 61.98 58.65 2kmx s VAL 1180Cb -0.16 -1.41 0.03 0.00 0.56 0.00 0.00 36.38 35.40 2kmx s VAL 1180CO 0.11 -0.50 0.37 -1.48 -0.31 0.00 0.00 175.10 173.28 2kmx s LEU 1181N -2.43 0.61 0.02 1.32 2.34 -0.24 -1.03 118.68 119.28 2kmx s LEU 1181Ca 0.06 0.07 -0.20 0.00 0.06 0.00 0.00 54.13 54.13 2kmx s LEU 1181Cb -0.04 1.51 0.04 0.00 -0.56 0.00 0.00 46.19 47.15 2kmx s LEU 1181CO 0.01 -0.55 0.44 -0.51 -1.06 0.00 0.00 176.35 174.69 2kmx s ILE 1182N -1.82 0.04 0.00 1.48 2.07 -0.55 -0.77 121.20 121.65 2kmx s ILE 1182Ca -0.10 -0.36 0.00 0.00 -1.41 0.00 0.00 60.65 58.78 2kmx s ILE 1182Cb -0.03 -0.89 0.00 0.00 0.13 0.00 0.00 42.46 41.67 2kmx s ILE 1182CO 0.02 -0.20 0.00 0.61 -1.91 0.00 0.00 174.94 173.46 2kmx n GLY 1183N 0.71 2.38 7.00 1.50 0.00 -0.97 -1.12 105.19 114.69 2kmx n GLY 1183Ca -0.19 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.01 2kmx n GLY 1183CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2kmx n ASN 1184N 0.00 -2.43 0.00 1.61 2.85 -1.26 -4.12 115.26 111.90 2kmx n ASN 1184Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2kmx n ASN 1184Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2kmx n ASN 1184CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 2kmx n ARG 1185N -0.21 2.70 -0.04 1.20 0.00 -1.26 -3.53 116.66 115.51 2kmx n ARG 1185Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.85 57.73 2kmx n ARG 1185Cb 0.00 -0.88 -0.06 0.00 -0.00 0.00 0.00 32.46 31.52 2kmx n ARG 1185CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2kmx h GLU 1186N 0.00 0.21 0.00 2.89 5.08 -1.87 -2.10 114.58 118.79 2kmx h GLU 1186Ca 0.00 -0.06 -0.24 0.00 -1.00 0.00 0.00 59.36 58.06 2kmx h GLU 1186Cb 0.60 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.84 2kmx h GLU 1186CO 0.00 0.43 -0.98 2.35 -1.00 0.00 0.00 179.01 179.80 2kmx h TRP 1187N -0.04 0.78 -0.89 4.33 7.01 -1.87 -2.12 115.95 123.15 2kmx h TRP 1187Ca 0.04 -0.42 0.13 0.00 2.11 0.00 0.00 58.89 60.74 2kmx h TRP 1187Cb 0.33 -0.09 -0.07 0.00 -2.10 0.00 0.00 29.16 27.23 2kmx h TRP 1187CO 0.03 1.25 0.57 0.52 -2.79 0.00 0.00 178.44 178.02 2kmx h MET 1188N 0.29 0.73 0.26 2.65 2.86 -1.78 0.47 114.93 120.42 2kmx h MET 1188Ca -0.10 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 2kmx h MET 1188Cb 1.63 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 33.12 2kmx h MET 1188CO 0.18 0.48 -0.12 0.82 1.06 0.00 0.00 176.91 179.33 2kmx h ILE 1189N 0.75 0.00 0.00 -1.22 2.04 -1.39 -3.35 117.51 114.35 2kmx h ILE 1189Ca 0.44 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 66.23 2kmx h ILE 1189Cb 0.61 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2kmx h ILE 1189CO -0.20 0.00 0.17 -1.14 0.00 0.00 0.00 178.15 176.98 2kmx n ARG 1190N -3.13 0.00 0.00 2.37 0.00 -0.55 -2.14 116.66 113.21 2kmx n ARG 1190Ca -0.04 0.33 0.00 0.00 -0.00 0.00 0.00 57.85 58.13 2kmx n ARG 1190Cb 0.14 -1.67 0.00 0.00 0.00 0.00 0.00 32.46 30.93 2kmx n ARG 1190CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2kmx n ASN 1191N -1.33 1.01 -0.99 6.15 5.15 0.05 -4.85 115.26 120.45 2kmx n ASN 1191Ca 0.00 -1.69 -0.13 0.00 -0.60 0.00 0.00 54.58 52.16 2kmx n ASN 1191Cb 0.17 -0.42 -0.06 0.00 -0.53 0.00 0.00 39.78 38.94 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 0.13 1.31 3.84 8.20 0.00 -0.91 -4.93 105.19 112.83 2kmx n GLY 1192Ca 0.00 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 2kmx n GLY 1192CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kmx s LEU 1193N -2.95 2.79 -0.15 0.99 1.43 -1.17 -5.06 118.68 114.55 2kmx s LEU 1193Ca 0.00 1.27 -0.19 0.00 -1.03 0.00 0.00 54.13 54.19 2kmx s LEU 1193Cb 0.00 -4.00 -0.04 0.00 0.03 0.00 0.00 46.19 42.19 2kmx s LEU 1193CO 0.00 -1.64 0.50 -0.69 0.23 0.00 0.00 176.35 174.75 2kmx s VAL 1194N -3.22 5.15 -0.03 -1.59 1.01 -1.26 -4.96 120.40 115.49 2kmx s VAL 1194Ca 0.59 0.98 0.06 0.00 0.00 0.00 0.00 61.98 63.61 2kmx s VAL 1194Cb -0.13 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 2kmx s VAL 1194CO 0.53 0.26 -0.21 -0.51 0.00 0.00 0.00 175.10 175.17 2kmx s ILE 1195N 1.04 2.45 0.21 2.22 2.07 -1.26 -4.96 121.20 122.98 2kmx s ILE 1195Ca 0.26 -0.96 0.10 0.00 -1.41 0.00 0.00 60.65 58.64 2kmx s ILE 1195Cb -0.15 -1.90 -0.04 0.00 0.13 0.00 0.00 42.46 40.50 2kmx s ILE 1195CO 0.10 0.58 -0.15 0.20 -1.91 0.00 0.00 174.94 173.77 2kmx s ASN 1196N -0.66 3.93 0.28 4.50 0.01 -1.26 -5.06 114.94 116.69 2kmx s ASN 1196Ca 0.11 -0.74 -0.01 0.00 -0.71 0.00 0.00 52.86 51.50 2kmx s ASN 1196Cb -0.10 -0.53 0.40 0.00 0.41 0.00 0.00 41.25 41.43 2kmx s ASN 1196CO -0.00 0.09 1.83 0.78 -1.51 0.00 0.00 177.10 178.29 2kmx h ASN 1197N 2.80 0.77 0.07 -1.22 2.35 -2.01 -1.89 115.58 116.45 2kmx h ASN 1197Ca -0.45 -0.13 -0.20 0.00 -0.55 0.00 0.00 56.30 54.96 2kmx h ASN 1197Cb 1.22 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.39 2kmx h ASN 1197CO 0.54 0.75 -0.76 0.44 -1.65 0.00 0.00 177.43 176.75 2kmx h ASP 1198N 0.80 0.70 0.14 5.81 3.32 -1.99 -0.04 116.42 125.16 2kmx h ASP 1198Ca 0.18 -0.46 -0.16 0.00 0.02 0.00 0.00 57.03 56.61 2kmx h ASP 1198Cb 0.28 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2kmx h ASP 1198CO -0.00 1.23 -0.59 1.62 -1.72 0.00 0.00 179.24 179.78 2kmx h VAL 1199N 0.40 1.34 -0.51 -1.35 3.04 -1.99 -2.94 116.25 114.24 2kmx h VAL 1199Ca -0.04 -1.89 -0.03 0.00 -1.01 0.00 0.00 66.70 63.73 2kmx h VAL 1199Cb 1.36 1.88 -0.02 0.00 -2.01 0.00 0.00 31.29 32.50 2kmx h VAL 1199CO 0.14 0.58 0.20 -1.13 -1.01 0.00 0.00 177.57 176.35 2kmx h ASN 1200N 0.35 0.71 -0.07 3.17 -1.24 -1.11 0.41 115.58 117.79 2kmx h ASN 1200Ca -0.00 -0.17 -0.06 0.00 0.71 0.00 0.00 56.30 56.78 2kmx h ASN 1200Cb 1.13 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 39.98 2kmx h ASN 1200CO 0.11 0.69 -0.10 -0.78 -1.29 0.00 0.00 177.43 176.05 2kmx h ASP 1201N 0.69 0.35 0.14 1.15 3.58 -1.04 -0.37 116.42 120.92 2kmx h ASP 1201Ca 0.17 -0.08 -0.21 0.00 0.42 0.00 0.00 57.03 57.33 2kmx h ASP 1201Cb 0.21 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2kmx h ASP 1201CO -0.01 0.50 -0.80 0.15 -2.88 0.00 0.00 179.24 176.19 2kmx h PHE 1202N 0.35 0.74 0.21 0.28 3.57 -1.35 -2.98 116.94 117.76 2kmx h PHE 1202Ca 0.07 -0.34 -0.01 0.00 3.53 0.00 0.00 57.97 61.22 2kmx h PHE 1202Cb 0.40 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2kmx h PHE 1202CO 0.01 1.14 -0.10 1.98 -2.23 0.00 0.00 178.31 179.11 2kmx h MET 1203N 0.35 -0.27 0.00 1.11 4.05 -0.42 -3.14 114.93 116.61 2kmx h MET 1203Ca -0.05 0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.34 2kmx h MET 1203Cb 1.41 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 32.26 2kmx h MET 1203CO 0.15 -0.02 -0.23 0.00 0.23 0.00 0.00 176.91 177.04 2kmx h THR 1204N -0.50 1.07 0.27 -0.77 1.03 -1.22 -3.02 112.91 109.77 2kmx h THR 1204Ca -0.03 -0.83 -0.00 0.00 -0.01 0.00 0.00 66.41 65.54 2kmx h THR 1204Cb 0.38 1.46 -0.02 0.00 -1.07 0.00 0.00 68.15 68.90 2kmx h THR 1204CO 0.05 0.23 -0.24 -0.08 -0.01 0.00 0.00 175.52 175.47 2kmx h GLU 1205N 0.00 -0.51 0.00 0.00 4.57 -1.47 0.19 114.58 117.36 2kmx h GLU 1205Ca -0.00 0.04 -0.12 0.00 -1.18 0.00 0.00 59.36 58.10 2kmx h GLU 1205Cb 0.44 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.13 2kmx h GLU 1205CO 0.03 -0.34 -0.55 0.45 -1.18 0.00 0.00 179.01 177.42 2kmx h HIS 1206N -0.53 0.00 -0.68 0.92 3.86 -1.62 -2.41 115.15 114.69 2kmx h HIS 1206Ca -0.01 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.12 2kmx h HIS 1206Cb 0.48 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.93 2kmx h HIS 1206CO -0.15 0.55 0.11 1.49 0.86 0.00 0.00 177.93 180.79 2kmx h GLU 1207N 0.00 1.12 0.00 2.45 4.22 -1.35 -0.77 114.58 120.26 2kmx h GLU 1207Ca -0.01 -0.30 -0.05 0.00 0.08 0.00 0.00 59.36 59.08 2kmx h GLU 1207Cb 0.98 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 2kmx h GLU 1207CO 0.07 1.03 -0.24 0.00 -2.18 0.00 0.00 179.01 177.69 2kmx h ARG 1208N 1.05 0.00 0.00 1.92 3.08 -0.53 -1.71 114.38 118.19 2kmx h ARG 1208Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2kmx h ARG 1208Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2kmx h ARG 1208CO 0.01 0.24 0.00 1.63 -1.07 0.00 0.00 179.97 180.79 2kmx n LYS 1209N -3.61 0.93 -1.21 0.04 5.02 -0.92 -4.90 118.16 113.51 2kmx n LYS 1209Ca -0.01 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.21 2kmx n LYS 1209Cb 0.38 -1.26 -0.03 0.00 -0.02 0.00 0.00 35.03 34.10 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 0.65 0.92 1.91 0.72 0.00 -0.64 -5.02 105.19 103.73 2kmx n GLY 1210Ca 0.11 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 2kmx n GLY 1210CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kmx n ARG 1211N -2.53 0.86 -4.08 1.61 5.12 -0.32 -5.01 116.66 112.31 2kmx n ARG 1211Ca -0.07 -1.57 -0.35 0.00 -1.93 0.00 0.00 57.85 53.93 2kmx n ARG 1211Cb 0.27 -0.06 -0.12 0.00 -1.16 0.00 0.00 32.46 31.39 2kmx n ARG 1211CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2kmx s THR 1212N -0.88 4.01 -0.05 0.55 2.01 -0.76 -4.10 115.64 116.42 2kmx s THR 1212Ca 0.27 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 61.98 2kmx s THR 1212Cb -0.02 -2.81 0.02 0.00 0.01 0.00 0.00 72.50 69.70 2kmx s THR 1212CO 0.17 0.43 -0.03 0.00 -0.69 0.00 0.00 174.62 174.51 2kmx s ALA 1213N 0.94 0.61 0.05 7.40 0.00 -1.26 -0.60 121.76 128.91 2kmx s ALA 1213Ca 0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 51.96 51.92 2kmx s ALA 1213Cb -0.14 -0.48 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 2kmx s ALA 1213CO 0.02 -0.13 0.00 0.14 0.00 0.00 0.00 175.76 175.79 2kmx s VAL 1214N 1.18 0.19 0.31 0.00 -7.23 -0.56 -4.79 120.40 109.50 2kmx s VAL 1214Ca -0.07 -1.56 0.07 0.00 -1.81 0.00 0.00 61.98 58.60 2kmx s VAL 1214Cb -0.14 -1.27 -0.02 0.00 0.56 0.00 0.00 36.38 35.51 2kmx s VAL 1214CO -0.02 -0.86 0.36 -0.76 -0.31 0.00 0.00 175.10 173.51 2kmx s LEU 1215N -2.64 3.86 -0.01 1.32 1.02 -1.23 -0.95 118.68 120.05 2kmx s LEU 1215Ca 0.02 -0.27 0.00 0.00 0.02 0.00 0.00 54.13 53.90 2kmx s LEU 1215Cb 0.04 -2.52 0.02 0.00 0.02 0.00 0.00 46.19 43.75 2kmx s LEU 1215CO -0.08 -0.31 0.01 0.54 0.02 0.00 0.00 176.35 176.53 2kmx s VAL 1216N -2.19 0.04 0.10 -1.59 0.11 -0.33 -2.29 120.40 114.26 2kmx s VAL 1216Ca 0.41 0.09 0.05 0.00 -2.93 0.00 0.00 61.98 59.59 2kmx s VAL 1216Cb -0.08 -0.11 -0.03 0.00 -1.53 0.00 0.00 36.38 34.63 2kmx s VAL 1216CO 0.28 0.07 -0.13 0.00 -3.33 0.00 0.00 175.10 172.00 2kmx s ALA 1217N 0.61 1.26 -0.10 1.54 0.00 0.05 -2.25 121.76 122.88 2kmx s ALA 1217Ca -0.05 -1.17 -0.05 0.00 0.00 0.00 0.00 51.96 50.69 2kmx s ALA 1217Cb -0.08 -0.05 0.04 0.00 0.00 0.00 0.00 23.12 23.04 2kmx s ALA 1217CO -0.02 0.07 0.24 0.14 0.00 0.00 0.00 175.76 176.19 2kmx s VAL 1218N -1.98 -0.04 -1.65 0.00 -7.23 0.59 -1.07 120.40 109.01 2kmx s VAL 1218Ca 0.04 0.13 -0.09 0.00 -1.81 0.00 0.00 61.98 60.26 2kmx s VAL 1218Cb -0.06 -0.36 0.09 0.00 0.56 0.00 0.00 36.38 36.60 2kmx s VAL 1218CO 0.02 0.05 0.28 -0.90 -0.31 0.00 0.00 175.10 174.25 2kmx n ASP 1219N 4.09 -0.34 -2.43 4.85 5.75 0.17 -0.53 116.55 128.11 2kmx n ASP 1219Ca -0.24 -1.22 -0.20 0.00 -0.01 0.00 0.00 54.79 53.11 2kmx n ASP 1219Cb 0.53 -1.82 0.00 0.00 -1.03 0.00 0.00 41.12 38.81 2kmx n ASP 1219CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2kmx n ASP 1220N -2.75 -5.77 -4.25 -1.12 8.00 -1.26 -5.04 116.55 104.36 2kmx n ASP 1220Ca -0.16 -0.08 -0.15 0.00 0.71 0.00 0.00 54.79 55.11 2kmx n ASP 1220Cb 0.61 -4.74 -0.10 0.00 -0.02 0.00 0.00 41.12 36.86 2kmx n ASP 1220CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2kmx s GLU 1221N -5.16 1.06 0.37 -1.24 0.41 0.31 -4.84 118.70 109.61 2kmx s GLU 1221Ca 0.07 -1.41 -0.24 0.00 -0.41 0.00 0.00 54.97 52.98 2kmx s GLU 1221Cb -0.03 -0.69 -0.10 0.00 -1.78 0.00 0.00 34.13 31.53 2kmx s GLU 1221CO 0.09 0.10 0.97 -0.51 -0.49 0.00 0.00 175.26 175.41 2kmx s LEU 1222N -3.02 4.17 -0.02 1.80 1.43 -1.26 -0.30 118.68 121.48 2kmx s LEU 1222Ca 0.15 1.83 -0.00 0.00 -1.03 0.00 0.00 54.13 55.08 2kmx s LEU 1222Cb 0.01 -4.22 -0.01 0.00 0.03 0.00 0.00 46.19 42.00 2kmx s LEU 1222CO 0.01 -0.25 -0.02 0.00 0.23 0.00 0.00 176.35 176.33 2kmx n GLY 1224N 3.32 1.52 3.08 0.00 0.00 -1.14 -0.92 105.19 111.06 2kmx n GLY 1224Ca -0.03 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.16 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 0.27 -1.18 118.68 122.98 2kmx s LEU 1225Ca 0.00 -0.51 0.05 0.00 0.06 0.00 0.00 54.13 53.73 2kmx s LEU 1225Cb 0.00 0.45 -0.01 0.00 -0.56 0.00 0.00 46.19 46.08 2kmx s LEU 1225CO 0.00 -0.44 -0.19 -0.63 -1.06 0.00 0.00 176.35 174.03 2kmx s ILE 1226N -2.22 1.60 -0.08 1.48 -1.09 -0.13 -1.22 121.20 119.55 2kmx s ILE 1226Ca -0.08 -0.81 0.05 0.00 -2.23 0.00 0.00 60.65 57.57 2kmx s ILE 1226Cb -0.04 -1.37 -0.00 0.00 -1.58 0.00 0.00 42.46 39.47 2kmx s ILE 1226CO -0.03 0.46 -0.23 0.00 -1.23 0.00 0.00 174.94 173.91 2kmx s ALA 1227N -0.03 2.04 0.09 9.38 0.00 0.02 -1.50 121.76 131.76 2kmx s ALA 1227Ca -0.03 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 51.02 2kmx s ALA 1227Cb -0.12 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 2kmx s ALA 1227CO 0.02 0.32 -0.07 0.42 0.00 0.00 0.00 175.76 176.46 2kmx s ILE 1228N 0.17 0.64 0.00 0.00 1.01 0.24 -1.45 121.20 121.81 2kmx s ILE 1228Ca -0.12 -1.76 0.00 0.00 0.00 0.00 0.00 60.65 58.77 2kmx s ILE 1228Cb -0.16 -1.47 0.00 0.00 0.01 0.00 0.00 42.46 40.85 2kmx s ILE 1228CO 0.06 -0.78 0.00 0.00 0.00 0.00 0.00 174.94 174.22 2kmx n ALA 1229N 0.26 0.00 -2.88 9.38 0.00 -0.22 -1.83 120.51 125.22 2kmx n ALA 1229Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.00 2kmx n ALA 1229Cb 0.60 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.88 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 -0.90 2.84 0.00 0.00 -1.08 -1.26 -0.77 116.67 115.50 2kmx s ASP 1230Ca 0.00 -0.48 0.21 0.00 -0.52 0.00 0.00 52.55 51.76 2kmx s ASP 1230Cb 0.00 -0.89 0.17 0.00 -1.46 0.00 0.00 42.92 40.74 2kmx s ASP 1230CO 0.00 0.20 1.16 1.07 0.52 0.00 0.00 175.17 178.13