#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kmx h PHE 1048N 0.00 0.00 -3.60 1.43 0.04 -2.06 -3.45 116.94 109.29 2kmx h PHE 1048Ca 0.00 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 60.26 2kmx h PHE 1048Cb 0.00 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 2kmx h PHE 1048CO 0.00 0.25 0.17 0.99 -0.60 0.00 0.00 178.31 179.13 2kmx s THR 1049N -3.38 4.43 0.04 -1.55 2.01 -1.26 -5.09 115.64 110.84 2kmx s THR 1049Ca 0.03 1.53 -0.23 0.00 0.31 0.00 0.00 61.69 63.33 2kmx s THR 1049Cb 0.08 -3.99 0.05 0.00 0.01 0.00 0.00 72.50 68.66 2kmx s THR 1049CO 0.67 0.32 0.53 0.00 -0.69 0.00 0.00 174.62 175.44 2kmx s MET 1050N -1.67 1.03 0.00 4.92 0.23 -1.26 -5.08 119.30 117.47 2kmx s MET 1050Ca 0.41 -0.20 0.00 0.00 -1.03 0.00 0.00 55.69 54.87 2kmx s MET 1050Cb -0.19 0.47 0.00 0.00 -1.53 0.00 0.00 34.83 33.58 2kmx s MET 1050CO 0.23 -0.37 0.00 0.72 -2.03 0.00 0.00 175.02 173.58 2kmx n HIS 1051N 0.46 0.00 -4.14 3.16 8.25 -1.26 -5.11 115.22 116.58 2kmx n HIS 1051Ca -0.18 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.13 2kmx n HIS 1051Cb 0.60 0.14 -0.13 0.00 1.12 0.00 0.00 29.99 31.72 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 -4.52 0.45 0.09 -1.41 0.00 -1.26 -5.04 107.32 95.63 2kmx s GLY 1052Ca 0.00 -0.56 0.08 0.00 0.00 0.00 0.00 44.72 44.24 2kmx s GLY 1052CO 0.00 -0.57 -0.15 -0.51 0.00 0.00 0.00 173.10 171.87 2kmx s THR 1053N -0.81 3.01 0.48 0.90 -4.23 -1.26 -4.96 115.64 108.77 2kmx s THR 1053Ca -0.04 -1.33 -0.22 0.00 -1.18 0.00 0.00 61.69 58.92 2kmx s THR 1053Cb -0.07 -2.36 -0.07 0.00 1.34 0.00 0.00 72.50 71.34 2kmx s THR 1053CO 0.00 0.17 1.17 -2.16 -0.54 0.00 0.00 174.62 173.27 2kmx s PRO 1054N -1.97 3.64 -0.04 3.99 0.04 -1.26 -1.05 135.00 138.35 2kmx s PRO 1054Ca 0.18 1.79 0.03 0.00 0.04 0.00 0.00 61.00 63.03 2kmx s PRO 1054Cb -0.11 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 32.11 2kmx s PRO 1054CO 0.10 -0.65 -0.11 0.54 0.04 0.00 0.00 177.00 176.92 2kmx s VAL 1055N -1.56 0.95 -0.29 -0.36 0.11 -0.45 -4.79 120.40 114.01 2kmx s VAL 1055Ca 0.66 -0.43 -0.29 0.00 -2.93 0.00 0.00 61.98 58.99 2kmx s VAL 1055Cb -0.29 -0.85 -0.01 0.00 -1.53 0.00 0.00 36.38 33.70 2kmx s VAL 1055CO 0.34 0.29 1.49 0.54 -3.33 0.00 0.00 175.10 174.44 2kmx s VAL 1056N 0.29 3.86 -0.14 2.04 0.11 -1.26 -0.92 120.40 124.38 2kmx s VAL 1056Ca -0.06 0.94 -0.06 0.00 -2.93 0.00 0.00 61.98 59.87 2kmx s VAL 1056Cb -0.11 -3.93 -0.25 0.00 -1.53 0.00 0.00 36.38 30.56 2kmx s VAL 1056CO 0.01 -0.44 0.28 -3.20 -3.33 0.00 0.00 175.10 168.42 2kmx n ASN 1057N 8.41 2.10 -3.64 3.54 5.15 0.37 -4.93 115.26 126.26 2kmx n ASN 1057Ca 0.17 0.18 -0.14 0.00 -0.60 0.00 0.00 54.58 54.19 2kmx n ASN 1057Cb 0.46 -0.81 -0.07 0.00 -0.53 0.00 0.00 39.78 38.83 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 -2.55 0.91 0.02 1.20 0.74 -0.78 -5.00 119.66 114.20 2kmx s GLN 1058Ca -0.24 -0.15 0.06 0.00 0.05 0.00 0.00 55.36 55.09 2kmx s GLN 1058Cb 0.07 0.41 -0.02 0.00 1.10 0.00 0.00 33.01 34.57 2kmx s GLN 1058CO 0.74 -0.29 -0.19 0.14 -0.55 0.00 0.00 175.29 175.14 2kmx s VAL 1059N -1.85 1.52 0.00 1.34 -7.23 -1.26 -0.92 120.40 112.00 2kmx s VAL 1059Ca -0.09 -0.99 -0.05 0.00 -1.81 0.00 0.00 61.98 59.04 2kmx s VAL 1059Cb -0.02 -1.30 -0.00 0.00 0.56 0.00 0.00 36.38 35.62 2kmx s VAL 1059CO 0.02 0.29 0.09 -0.75 -0.31 0.00 0.00 175.10 174.45 2kmx s LYS 1060N -0.82 0.42 0.01 4.82 2.20 -0.29 -5.02 119.74 121.06 2kmx s LYS 1060Ca 0.07 -0.42 -0.09 0.00 -0.36 0.00 0.00 55.97 55.17 2kmx s LYS 1060Cb -0.08 0.17 -0.05 0.00 -1.51 0.00 0.00 37.83 36.36 2kmx s LYS 1060CO 0.01 -0.09 0.31 0.08 -0.36 0.00 0.00 175.35 175.29 2kmx s VAL 1061N -1.32 5.23 -0.17 4.02 1.01 -1.26 -0.85 120.40 127.05 2kmx s VAL 1061Ca -0.14 0.34 -0.05 0.00 0.00 0.00 0.00 61.98 62.13 2kmx s VAL 1061Cb -0.08 -3.59 -0.09 0.00 0.00 0.00 0.00 36.38 32.62 2kmx s VAL 1061CO 0.01 0.40 -0.20 -0.11 0.00 0.00 0.00 175.10 175.20 2kmx n LEU 1062N 1.24 1.91 -4.21 3.92 7.94 0.34 -4.90 117.00 123.24 2kmx n LEU 1062Ca -0.12 0.10 -0.33 0.00 -1.11 0.00 0.00 56.01 54.56 2kmx n LEU 1062Cb 0.53 -0.54 -0.16 0.00 0.53 0.00 0.00 43.42 43.78 2kmx n LEU 1062CO 0.40 0.52 -0.53 -0.89 -1.11 0.00 0.00 177.39 175.78 2kmx s THR 1063N -2.32 2.23 -0.14 1.96 2.01 -0.85 -5.01 115.64 113.51 2kmx s THR 1063Ca -0.24 -0.93 -0.13 0.00 0.31 0.00 0.00 61.69 60.71 2kmx s THR 1063Cb 0.08 -1.89 0.04 0.00 0.01 0.00 0.00 72.50 70.73 2kmx s THR 1063CO 0.34 0.54 0.38 -0.70 -0.69 0.00 0.00 174.62 174.49 2kmx s GLU 1064N 0.69 0.43 0.00 4.92 2.12 -1.26 -4.69 118.70 120.91 2kmx s GLU 1064Ca -0.09 0.55 0.00 0.00 0.36 0.00 0.00 54.97 55.79 2kmx s GLU 1064Cb -0.16 0.18 0.00 0.00 0.26 0.00 0.00 34.13 34.41 2kmx s GLU 1064CO 0.01 -0.07 0.00 0.43 -0.54 0.00 0.00 175.26 175.10 2kmx n SER 1065N 3.04 0.00 -0.50 -1.70 7.64 -0.38 -4.68 113.62 117.03 2kmx n SER 1065Ca -0.14 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.86 2kmx n SER 1065Cb 0.57 -0.84 0.21 0.00 -1.01 0.00 0.00 64.21 63.14 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 0.00 1.82 0.00 6.43 3.02 -1.26 -4.78 115.26 120.50 2kmx n ASN 1066Ca 0.00 -1.41 0.00 0.00 -0.03 0.00 0.00 54.58 53.14 2kmx n ASN 1066Cb 0.00 0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 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 0.07 0.00 -4.18 3.52 3.00 -1.26 -5.16 116.66 112.65 2kmx n ARG 1067Ca 0.12 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.85 2kmx n ARG 1067Cb 0.44 -0.03 -0.10 0.00 0.00 0.00 0.00 32.46 32.77 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 -1.45 0.85 0.10 5.15 -1.09 -1.26 -5.12 121.20 118.39 2kmx s ILE 1068Ca 0.00 -1.79 0.07 0.00 -2.23 0.00 0.00 60.65 56.70 2kmx s ILE 1068Cb 0.00 -1.52 -0.04 0.00 -1.58 0.00 0.00 42.46 39.32 2kmx s ILE 1068CO 0.00 -0.71 -0.11 -0.44 -1.23 0.00 0.00 174.94 172.45 2kmx s SER 1069N -2.75 4.31 0.17 3.58 0.01 -1.26 -1.25 113.70 116.51 2kmx s SER 1069Ca 0.09 -0.41 -0.14 0.00 1.31 0.00 0.00 55.95 56.79 2kmx s SER 1069Cb 0.01 -0.79 0.12 0.00 0.21 0.00 0.00 66.02 65.58 2kmx s SER 1069CO -0.02 0.18 1.75 1.12 0.41 0.00 0.00 173.24 176.68 2kmx h HIS 1070N 3.65 0.28 0.00 2.43 2.07 -2.00 -0.21 115.15 121.37 2kmx h HIS 1070Ca -0.49 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 2kmx h HIS 1070Cb 1.17 -0.06 0.00 0.00 2.57 0.00 0.00 27.41 31.09 2kmx h HIS 1070CO 0.60 0.10 0.00 1.25 -3.07 0.00 0.00 177.93 176.81 2kmx h HIS 1071N 0.33 0.00 0.00 6.12 -0.00 -2.00 -2.60 115.15 117.00 2kmx h HIS 1071Ca 0.21 0.00 -0.29 0.00 -0.00 0.00 0.00 60.37 60.29 2kmx h HIS 1071Cb 0.20 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 27.56 2kmx h HIS 1071CO -0.15 0.00 -1.65 0.87 -0.00 0.00 0.00 177.93 177.00 2kmx h LYS 1072N 0.00 0.00 0.14 5.26 1.57 -1.68 -2.87 116.57 119.00 2kmx h LYS 1072Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2kmx h LYS 1072Cb 0.46 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 2kmx h LYS 1072CO 0.00 0.54 -0.12 0.82 -0.57 0.00 0.00 179.45 180.12 2kmx h ILE 1073N 0.00 0.72 -0.28 1.86 2.04 -0.71 -1.42 117.51 119.72 2kmx h ILE 1073Ca -0.26 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.53 2kmx h ILE 1073Cb 1.99 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.78 2kmx h ILE 1073CO 0.08 0.00 -0.11 0.17 0.00 0.00 0.00 178.15 178.30 2kmx h LEU 1074N -0.28 0.45 0.28 1.44 8.10 -1.61 -2.20 115.31 121.48 2kmx h LEU 1074Ca -0.00 -0.11 -0.01 0.00 0.11 0.00 0.00 57.88 57.87 2kmx h LEU 1074Cb 0.26 -0.12 -0.00 0.00 -0.44 0.00 0.00 40.66 40.36 2kmx h LEU 1074CO -0.02 0.60 -0.15 0.00 -4.11 0.00 0.00 178.44 174.75 2kmx h ALA 1075N 1.46 -0.39 -0.05 0.17 0.00 -1.27 -0.67 119.26 118.50 2kmx h ALA 1075Ca 0.08 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2kmx h ALA 1075Cb 0.46 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2kmx h ALA 1075CO 0.03 -0.72 -0.40 -0.84 0.00 0.00 0.00 179.25 177.31 2kmx h ILE 1076N -0.40 1.30 -0.17 0.00 3.07 -1.06 -0.60 117.51 119.65 2kmx h ILE 1076Ca -0.03 -1.43 -0.08 0.00 1.55 0.00 0.00 64.86 64.86 2kmx h ILE 1076Cb 0.32 1.71 -0.00 0.00 -0.27 0.00 0.00 36.82 38.58 2kmx h ILE 1076CO 0.05 0.42 -0.21 0.58 -1.05 0.00 0.00 178.15 177.93 2kmx h VAL 1077N 0.09 1.35 -0.81 0.16 2.07 -1.39 -2.11 116.25 115.60 2kmx h VAL 1077Ca 0.01 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.10 2kmx h VAL 1077Cb 0.75 1.88 -0.04 0.00 -1.52 0.00 0.00 31.29 32.36 2kmx h VAL 1077CO 0.06 0.42 0.46 1.23 0.02 0.00 0.00 177.57 179.76 2kmx h GLY 1078N 0.08 1.20 1.38 2.17 0.00 -0.84 -2.45 103.07 104.60 2kmx h GLY 1078Ca 0.02 -0.53 -0.19 0.00 0.00 0.00 0.00 47.33 46.62 2kmx h GLY 1078CO 0.05 0.51 -0.70 -0.91 0.00 0.00 0.00 176.54 175.50 2kmx h THR 1079N 1.12 1.32 -0.23 4.70 1.35 -1.18 -3.03 112.91 116.97 2kmx h THR 1079Ca 0.29 -1.98 -0.01 0.00 -0.55 0.00 0.00 66.41 64.16 2kmx h THR 1079Cb 0.01 1.95 -0.01 0.00 -1.73 0.00 0.00 68.15 68.37 2kmx h THR 1079CO -0.05 0.61 0.09 0.00 -0.25 0.00 0.00 175.52 175.92 2kmx h ALA 1080N 0.79 0.30 0.00 6.62 0.00 -1.22 -2.66 119.26 123.08 2kmx h ALA 1080Ca -0.03 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2kmx h ALA 1080Cb 1.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2kmx h ALA 1080CO 0.13 -0.10 0.00 0.93 0.00 0.00 0.00 179.25 180.21 2kmx h GLU 1081N 0.21 0.00 0.00 0.00 4.39 -1.54 -3.22 114.58 114.42 2kmx h GLU 1081Ca 0.08 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 2kmx h GLU 1081Cb 0.19 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2kmx h GLU 1081CO -0.01 0.00 -0.05 1.03 -1.16 0.00 0.00 179.01 178.83 2kmx h SER 1082N 0.00 0.00 0.38 1.42 0.87 -1.34 -0.95 113.55 113.93 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 0.43 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 2kmx h SER 1082CO 0.00 0.05 -0.93 0.59 -0.53 0.00 0.00 176.83 176.01 2kmx n ASN 1083N -3.58 0.64 -4.81 6.23 4.13 -1.22 -5.03 115.26 111.63 2kmx n ASN 1083Ca -0.02 -0.33 -0.31 0.00 1.68 0.00 0.00 54.58 55.60 2kmx n ASN 1083Cb 0.16 0.73 0.06 0.00 -1.54 0.00 0.00 39.78 39.19 2kmx n ASN 1083CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2kmx s SER 1084N -3.63 5.15 -0.05 6.41 0.15 -0.36 -4.54 113.70 116.83 2kmx s SER 1084Ca 0.06 1.65 0.14 0.00 0.70 0.00 0.00 55.95 58.50 2kmx s SER 1084Cb 0.15 -2.48 0.44 0.00 -1.71 0.00 0.00 66.02 62.42 2kmx s SER 1084CO 0.79 -1.60 1.37 -1.84 1.20 0.00 0.00 173.24 173.17 2kmx n GLU 1085N -3.23 2.99 -2.25 5.44 0.28 -1.26 -5.04 120.64 117.57 2kmx n GLU 1085Ca 0.08 -2.38 -0.29 0.00 -0.16 0.00 0.00 57.16 54.41 2kmx n GLU 1085Cb 0.53 -1.49 0.01 0.00 1.43 0.00 0.00 31.44 31.92 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 -1.44 3.59 -0.04 -1.84 3.76 -1.26 -5.05 115.29 113.01 2kmx s HIS 1086Ca 0.33 1.05 0.02 0.00 -0.15 0.00 0.00 55.06 56.31 2kmx s HIS 1086Cb 0.20 -2.52 -0.25 0.00 1.11 0.00 0.00 32.58 31.12 2kmx s HIS 1086CO 0.18 -0.50 0.67 -1.00 -0.85 0.00 0.00 174.74 173.24 2kmx h PRO 1087N -0.06 0.16 0.00 8.40 0.13 -2.01 -3.39 132.00 135.23 2kmx h PRO 1087Ca -0.45 -0.27 -0.27 0.00 -0.87 0.00 0.00 66.00 64.14 2kmx h PRO 1087Cb 1.20 0.10 -0.04 0.00 0.13 0.00 0.00 31.00 32.39 2kmx h PRO 1087CO 0.62 0.92 -1.59 -0.11 -0.23 0.00 0.00 178.00 177.61 2kmx n LEU 1088N -3.31 1.89 0.20 1.56 0.00 -1.26 -4.21 117.00 111.87 2kmx n LEU 1088Ca -0.20 0.41 0.05 0.00 0.00 0.00 0.00 56.01 56.27 2kmx n LEU 1088Cb 1.04 -0.90 0.49 0.00 0.00 0.00 0.00 43.42 44.06 2kmx n LEU 1088CO 0.46 0.26 0.92 1.23 0.00 0.00 0.00 177.39 180.26 2kmx h GLY 1089N -1.00 0.06 2.00 -3.96 0.00 -1.99 -2.07 103.07 96.11 2kmx h GLY 1089Ca -0.41 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2kmx h GLY 1089CO -0.25 0.03 0.00 -0.91 0.00 0.00 0.00 176.54 175.41 2kmx h THR 1090N 0.05 0.00 -0.13 4.70 1.35 -1.76 -0.03 112.91 117.09 2kmx h THR 1090Ca 0.01 -0.23 -0.07 0.00 -0.55 0.00 0.00 66.41 65.57 2kmx h THR 1090Cb 0.30 1.15 -0.01 0.00 -1.73 0.00 0.00 68.15 67.86 2kmx h THR 1090CO 0.02 0.00 -0.21 0.00 -0.25 0.00 0.00 175.52 175.08 2kmx h ALA 1091N 2.03 1.40 -0.21 6.62 0.00 -1.54 -2.63 119.26 124.93 2kmx h ALA 1091Ca 0.00 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 2kmx h ALA 1091Cb 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2kmx h ALA 1091CO 0.00 0.42 -0.57 0.82 0.00 0.00 0.00 179.25 179.92 2kmx h ILE 1092N 0.21 1.30 -0.50 0.00 2.04 -1.13 -2.59 117.51 116.83 2kmx h ILE 1092Ca 0.04 -1.78 0.09 0.00 1.00 0.00 0.00 64.86 64.21 2kmx h ILE 1092Cb 0.50 1.85 -0.08 0.00 -0.74 0.00 0.00 36.82 38.36 2kmx h ILE 1092CO 0.03 0.57 0.05 0.74 0.00 0.00 0.00 178.15 179.54 2kmx h THR 1093N 0.48 0.66 -0.02 -0.27 2.02 -1.30 0.97 112.91 115.45 2kmx h THR 1093Ca -0.01 -0.06 0.01 0.00 0.77 0.00 0.00 66.41 67.12 2kmx h THR 1093Cb 1.19 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 2kmx h THR 1093CO 0.12 0.03 -0.03 0.50 0.37 0.00 0.00 175.52 176.52 2kmx h LYS 1094N 0.17 -0.04 -0.96 6.66 3.64 -1.47 0.13 116.57 124.71 2kmx h LYS 1094Ca 0.25 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.68 2kmx h LYS 1094Cb 0.36 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.13 2kmx h LYS 1094CO -0.37 -0.02 0.62 -0.92 -2.27 0.00 0.00 179.45 176.49 2kmx h TYR 1095N -0.04 1.17 -0.13 1.91 3.20 -1.04 -1.62 116.97 120.42 2kmx h TYR 1095Ca 0.02 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.77 2kmx h TYR 1095Cb 0.06 -0.39 0.01 0.00 1.54 0.00 0.00 36.73 37.95 2kmx h TYR 1095CO -0.11 0.65 -0.49 0.00 -1.64 0.00 0.00 178.16 176.58 2kmx h LYS 1097N 0.19 0.88 -0.19 0.00 3.11 -0.53 0.88 116.57 120.91 2kmx h LYS 1097Ca -0.02 -0.08 -0.02 0.00 -2.81 0.00 0.00 60.65 57.72 2kmx h LYS 1097Cb 1.12 -0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 32.16 2kmx h LYS 1097CO 0.10 0.63 0.06 0.37 -2.81 0.00 0.00 179.45 177.80 2kmx h GLN 1098N 0.89 0.30 -0.46 1.90 4.15 -1.32 -2.94 115.11 117.63 2kmx h GLN 1098Ca 0.23 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.56 2kmx h GLN 1098Cb -0.01 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.62 2kmx h GLN 1098CO -0.04 0.42 0.21 1.49 -1.93 0.00 0.00 178.83 178.98 2kmx h GLU 1099N 0.13 0.67 0.00 1.69 4.57 -0.15 -2.95 114.58 118.55 2kmx h GLU 1099Ca 0.06 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2kmx h GLU 1099Cb 0.24 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 2kmx h GLU 1099CO -0.00 0.58 0.00 -0.07 -1.18 0.00 0.00 179.01 178.34 2kmx h LEU 1100N 0.60 0.00 1.73 1.64 3.38 -0.95 -3.47 115.31 118.24 2kmx h LEU 1100Ca 0.16 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.87 2kmx h LEU 1100Cb 0.14 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2kmx h LEU 1100CO -0.02 0.00 -0.36 -0.67 0.09 0.00 0.00 178.44 177.48 2kmx n ASP 1101N -2.89 -3.36 -0.00 -0.43 2.03 -1.11 -4.87 116.55 105.92 2kmx n ASP 1101Ca 0.01 0.02 0.10 0.00 0.52 0.00 0.00 54.79 55.45 2kmx n ASP 1101Cb 0.32 -2.86 -0.13 0.00 -0.72 0.00 0.00 41.12 37.74 2kmx n ASP 1101CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2kmx n THR 1102N -3.45 0.00 0.00 5.18 5.66 -1.26 -5.01 114.28 115.41 2kmx n THR 1102Ca -0.07 -0.12 0.00 0.00 -3.05 0.00 0.00 64.05 60.81 2kmx n THR 1102Cb 0.57 0.76 0.00 0.00 -1.55 0.00 0.00 70.33 70.10 2kmx n THR 1102CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 2kmx n GLU 1103N -1.68 0.00 -3.69 1.09 2.13 -1.26 -4.90 120.64 112.33 2kmx n GLU 1103Ca 0.02 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.72 2kmx n GLU 1103Cb 0.39 -2.65 -0.09 0.00 0.27 0.00 0.00 31.44 29.36 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 -0.35 -0.00 0.03 6.31 -1.32 -1.26 -5.16 115.64 113.89 2kmx s THR 1104Ca 0.00 0.01 -0.23 0.00 -1.21 0.00 0.00 61.69 60.26 2kmx s THR 1104Cb 0.00 -0.72 0.05 0.00 -1.51 0.00 0.00 72.50 70.32 2kmx s THR 1104CO 0.00 0.00 0.53 -1.48 -2.21 0.00 0.00 174.62 171.47 2kmx s LEU 1105N 0.50 -0.13 0.00 9.08 2.34 -1.26 -5.14 118.68 124.07 2kmx s LEU 1105Ca -0.02 0.26 0.00 0.00 0.06 0.00 0.00 54.13 54.43 2kmx s LEU 1105Cb -0.04 2.15 0.00 0.00 -0.56 0.00 0.00 46.19 47.74 2kmx s LEU 1105CO -0.02 -0.69 0.00 0.61 -1.06 0.00 0.00 176.35 175.19 2kmx n GLY 1106N 0.53 1.59 1.30 -3.48 0.00 -1.26 -4.86 105.19 99.01 2kmx n GLY 1106Ca -0.19 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.35 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 2.05 0.17 -3.97 2.61 -1.04 -1.26 -5.01 114.28 107.83 2kmx n THR 1107Ca 0.00 0.06 -0.12 0.00 -2.04 0.00 0.00 64.05 61.94 2kmx n THR 1107Cb 0.00 -0.81 -0.13 0.00 -1.82 0.00 0.00 70.33 67.56 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 -0.38 -0.00 -0.12 0.00 -1.09 -1.25 -3.62 121.20 114.73 2kmx s ILE 1109Ca -0.03 0.01 0.16 0.00 -2.23 0.00 0.00 60.65 58.56 2kmx s ILE 1109Cb -0.03 -0.20 -0.22 0.00 -1.58 0.00 0.00 42.46 40.42 2kmx s ILE 1109CO -0.00 0.00 0.46 -0.67 -1.23 0.00 0.00 174.94 173.51 2kmx n ASP 1110N 3.07 0.47 -2.59 3.58 2.03 -1.03 -4.80 116.55 117.28 2kmx n ASP 1110Ca -0.13 0.21 -0.04 0.00 0.52 0.00 0.00 54.79 55.35 2kmx n ASP 1110Cb 0.59 0.57 -0.03 0.00 -0.72 0.00 0.00 41.12 41.52 2kmx n ASP 1110CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2kmx n PHE 1111N -2.83 -4.24 -4.08 -0.67 7.35 -1.26 -4.94 117.46 106.80 2kmx n PHE 1111Ca -0.20 2.32 -0.33 0.00 -0.76 0.00 0.00 57.45 58.48 2kmx n PHE 1111Cb 1.00 -3.89 -0.15 0.00 0.35 0.00 0.00 39.48 36.79 2kmx n PHE 1111CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2kmx s GLN 1112N -0.94 2.59 -0.12 -4.13 1.11 0.20 -5.01 119.66 113.36 2kmx s GLN 1112Ca -0.20 -1.11 0.00 0.00 0.01 0.00 0.00 55.36 54.06 2kmx s GLN 1112Cb 0.01 -2.77 -0.02 0.00 -1.01 0.00 0.00 33.01 29.23 2kmx s GLN 1112CO 0.77 -0.41 -0.12 0.08 0.01 0.00 0.00 175.29 175.62 2kmx s VAL 1113N 1.20 3.12 -0.10 1.09 1.01 -1.26 -1.92 120.40 123.54 2kmx s VAL 1113Ca -0.03 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 2kmx s VAL 1113Cb -0.17 -2.30 0.03 0.00 0.00 0.00 0.00 36.38 33.94 2kmx s VAL 1113CO -0.08 0.53 -0.01 -0.69 0.00 0.00 0.00 175.10 174.85 2kmx s VAL 1114N 0.20 0.56 0.26 2.92 1.01 -1.24 -5.09 120.40 119.01 2kmx s VAL 1114Ca -0.08 -0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.54 2kmx s VAL 1114Cb -0.15 -0.72 -0.14 0.00 0.00 0.00 0.00 36.38 35.37 2kmx s VAL 1114CO 0.05 0.23 1.29 -2.65 0.00 0.00 0.00 175.10 174.02 2kmx n PRO 1115N 5.08 1.84 0.00 2.72 -0.02 -1.26 -2.71 135.00 140.65 2kmx n PRO 1115Ca -0.09 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2kmx n PRO 1115Cb 0.50 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 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 1.70 0.78 0.00 -1.23 0.00 -1.26 -4.74 105.19 100.43 2kmx n GLY 1116Ca 0.10 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.21 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 0.19 -0.67 2.99 0.00 0.00 -1.24 -4.32 105.19 102.13 2kmx n GLY 1118Ca 0.09 -2.18 -0.11 0.00 0.00 0.00 0.00 46.02 43.81 2kmx n GLY 1118CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2kmx s ILE 1119N 0.00 0.03 0.10 -0.61 -1.16 -0.38 -3.70 121.20 115.48 2kmx s ILE 1119Ca 0.00 -0.27 0.06 0.00 -0.51 0.00 0.00 60.65 59.93 2kmx s ILE 1119Cb 0.00 -0.20 -0.03 0.00 0.61 0.00 0.00 42.46 42.84 2kmx s ILE 1119CO 0.00 -0.15 -0.15 -0.55 -2.81 0.00 0.00 174.94 171.28 2kmx s SER 1120N -0.46 1.95 0.25 4.50 0.15 -0.81 -1.83 113.70 117.46 2kmx s SER 1120Ca -0.05 -0.70 -0.21 0.00 0.70 0.00 0.00 55.95 55.68 2kmx s SER 1120Cb -0.03 -0.07 0.05 0.00 -1.71 0.00 0.00 66.02 64.25 2kmx s SER 1120CO 0.00 -0.08 0.84 0.00 1.20 0.00 0.00 173.24 175.20 2kmx s LYS 1122N -3.24 2.86 0.07 0.00 -0.14 -1.26 -0.96 119.74 117.06 2kmx s LYS 1122Ca 0.13 -0.69 0.06 0.00 -1.36 0.00 0.00 55.97 54.11 2kmx s LYS 1122Cb -0.04 -2.48 -0.03 0.00 -1.68 0.00 0.00 37.83 33.60 2kmx s LYS 1122CO 0.06 0.46 -0.16 0.14 -0.76 0.00 0.00 175.35 175.09 2kmx s VAL 1123N -0.29 1.30 0.03 3.17 -7.23 -0.21 -2.46 120.40 114.71 2kmx s VAL 1123Ca 0.02 -1.26 0.03 0.00 -1.81 0.00 0.00 61.98 58.97 2kmx s VAL 1123Cb -0.13 -1.20 -0.02 0.00 0.56 0.00 0.00 36.38 35.59 2kmx s VAL 1123CO 0.03 -0.07 -0.09 0.28 -0.31 0.00 0.00 175.10 174.93 2kmx s THR 1124N -1.07 0.69 -0.32 5.32 -1.32 -1.24 -1.27 115.64 116.43 2kmx s THR 1124Ca 0.02 -0.81 0.09 0.00 -1.21 0.00 0.00 61.69 59.78 2kmx s THR 1124Cb -0.09 -0.66 0.31 0.00 -1.51 0.00 0.00 72.50 70.55 2kmx s THR 1124CO 0.02 -0.12 1.30 -3.20 -2.21 0.00 0.00 174.62 170.42 2kmx n ASN 1125N 2.03 -1.40 0.00 8.08 4.05 -1.26 -3.56 115.26 123.19 2kmx n ASN 1125Ca -0.18 -2.09 0.00 0.00 0.45 0.00 0.00 54.58 52.76 2kmx n ASN 1125Cb 0.56 0.76 0.00 0.00 1.23 0.00 0.00 39.78 42.32 2kmx n ASN 1125CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 2kmx n ILE 1126N -0.93 0.00 -0.99 -1.44 -5.35 -1.26 -4.93 119.36 104.46 2kmx n ILE 1126Ca -0.12 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 2kmx n ILE 1126Cb 0.80 -0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.54 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 -0.88 0.00 0.09 6.28 1.02 -1.26 -4.95 120.64 120.94 2kmx n GLU 1127Ca 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.19 2kmx n GLU 1127Cb 0.09 -0.46 0.29 0.00 -0.02 0.00 0.00 31.44 31.34 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 0.00 -0.62 0.00 0.62 0.00 -1.26 -2.23 105.19 101.70 2kmx n GLY 1128Ca 0.00 0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.85 0.00 -0.97 0.99 -0.00 -1.26 -3.82 117.00 110.09 2kmx n LEU 1129Ca -0.01 0.21 0.00 0.00 -0.00 0.00 0.00 56.01 56.22 2kmx n LEU 1129Cb 0.12 -0.21 0.00 0.00 -0.00 0.00 0.00 43.42 43.33 2kmx n LEU 1129CO 0.05 -0.09 0.30 0.18 -0.00 0.00 0.00 177.39 177.83 2kmx n LEU 1130N -1.21 1.81 -4.57 1.47 4.77 -0.95 -4.93 117.00 113.38 2kmx n LEU 1130Ca 0.09 -0.90 -0.46 0.00 -0.03 0.00 0.00 56.01 54.71 2kmx n LEU 1130Cb 0.12 -0.32 -0.03 0.00 -2.33 0.00 0.00 43.42 40.87 2kmx n LEU 1130CO 0.12 0.30 0.60 1.57 -1.33 0.00 0.00 177.39 178.66 2kmx n HIS 1131N 0.65 1.18 -2.19 -1.77 -0.00 -1.25 -4.94 115.22 106.90 2kmx n HIS 1131Ca 0.00 0.71 -0.42 0.00 0.46 0.00 0.00 57.72 58.47 2kmx n HIS 1131Cb 0.30 -2.25 -0.03 0.00 -0.12 0.00 0.00 29.99 27.90 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 -1.02 4.29 0.11 1.57 -0.14 -1.26 -4.95 119.74 118.34 2kmx s LYS 1132Ca 0.65 2.03 -0.23 0.00 -1.36 0.00 0.00 55.97 57.06 2kmx s LYS 1132Cb -0.78 -3.47 -0.08 0.00 -1.68 0.00 0.00 37.83 31.83 2kmx s LYS 1132CO 0.56 -0.54 1.70 -0.97 -0.76 0.00 0.00 175.35 175.35 2kmx h ASN 1133N 7.53 -0.26 -3.88 2.83 -1.24 -2.01 -3.45 115.58 115.10 2kmx h ASN 1133Ca -0.40 0.05 -0.02 0.00 0.71 0.00 0.00 56.30 56.64 2kmx h ASN 1133Cb 1.19 0.12 -0.22 0.00 0.73 0.00 0.00 38.32 40.14 2kmx h ASN 1133CO 0.89 -0.12 0.20 0.21 -1.29 0.00 0.00 177.43 177.32 2kmx s ASN 1134N -5.10 -0.68 0.99 1.15 2.47 -1.26 -5.17 114.94 107.35 2kmx s ASN 1134Ca -0.14 1.29 0.00 0.00 0.42 0.00 0.00 52.86 54.43 2kmx s ASN 1134Cb 0.08 1.30 0.00 0.00 -1.45 0.00 0.00 41.25 41.18 2kmx s ASN 1134CO 0.67 -0.25 0.00 0.79 -3.72 0.00 0.00 177.10 174.59 2kmx n TRP 1135N 2.50 -1.23 -1.52 0.43 5.03 -1.26 -4.95 117.44 116.44 2kmx n TRP 1135Ca -0.14 0.00 -0.15 0.00 3.03 0.00 0.00 57.50 60.24 2kmx n TRP 1135Cb 0.55 0.22 -0.06 0.00 -1.03 0.00 0.00 31.31 31.00 2kmx n TRP 1135CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 2kmx n ASN 1136N -2.96 -4.74 -0.02 -0.99 3.02 -1.26 -4.89 115.26 103.42 2kmx n ASN 1136Ca 0.00 0.32 0.02 0.00 -0.03 0.00 0.00 54.58 54.89 2kmx n ASN 1136Cb 0.00 -3.57 -0.08 0.00 -0.61 0.00 0.00 39.78 35.52 2kmx n ASN 1136CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2kmx n ILE 1137N -2.73 0.25 0.00 2.41 5.41 -1.26 -4.88 119.36 118.56 2kmx n ILE 1137Ca -0.15 -0.31 0.00 0.00 1.00 0.00 0.00 62.75 63.29 2kmx n ILE 1137Cb 0.50 -0.11 0.00 0.00 -0.71 0.00 0.00 39.64 39.32 2kmx n ILE 1137CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 2kmx n GLU 1138N -2.06 0.00 -0.25 0.38 2.13 -1.26 -4.38 120.64 115.20 2kmx n GLU 1138Ca -0.07 0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.81 2kmx n GLU 1138Cb 0.48 -1.50 0.19 0.00 0.27 0.00 0.00 31.44 30.88 2kmx n GLU 1138CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2kmx n ASP 1139N 0.16 3.21 -0.43 4.31 8.00 -1.26 -4.90 116.55 125.64 2kmx n ASP 1139Ca 0.00 -2.15 0.40 0.00 0.71 0.00 0.00 54.79 53.75 2kmx n ASP 1139Cb 0.00 -0.31 0.71 0.00 -0.02 0.00 0.00 41.12 41.51 2kmx n ASP 1139CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 2kmx h ASN 1140N 2.26 0.00 0.00 -2.24 -0.00 -1.96 -2.88 115.58 110.75 2kmx h ASN 1140Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 56.30 55.99 2kmx h ASN 1140Cb 0.87 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 39.19 2kmx h ASN 1140CO 0.04 0.00 1.70 -3.20 -0.00 0.00 0.00 177.43 175.96 2kmx n ASN 1141N -3.83 4.75 -4.59 1.15 5.15 -1.26 -4.93 115.26 111.71 2kmx n ASN 1141Ca 0.32 -2.27 -0.42 0.00 -0.60 0.00 0.00 54.58 51.60 2kmx n ASN 1141Cb 1.59 -1.08 -0.03 0.00 -0.53 0.00 0.00 39.78 39.73 2kmx n ASN 1141CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2kmx s ILE 1142N 2.60 3.72 -0.51 -1.44 1.01 -1.09 -4.90 121.20 120.59 2kmx s ILE 1142Ca 0.44 0.67 0.07 0.00 0.00 0.00 0.00 60.65 61.83 2kmx s ILE 1142Cb 0.15 -4.13 0.25 0.00 0.01 0.00 0.00 42.46 38.74 2kmx s ILE 1142CO -0.02 -0.83 0.63 0.29 0.00 0.00 0.00 174.94 175.00 2kmx n LYS 1143N 8.46 1.56 0.05 2.79 5.02 -1.26 -4.71 118.16 130.06 2kmx n LYS 1143Ca 0.17 -3.89 0.12 0.00 -2.02 0.00 0.00 58.31 52.69 2kmx n LYS 1143Cb 0.49 -1.70 0.27 0.00 -0.02 0.00 0.00 35.03 34.07 2kmx n LYS 1143CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2kmx n ASN 1144N 1.14 0.60 -4.74 4.39 3.02 -1.26 -4.97 115.26 113.43 2kmx n ASN 1144Ca 0.25 0.15 -0.41 0.00 -0.03 0.00 0.00 54.58 54.53 2kmx n ASN 1144Cb 0.48 -0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.60 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 -3.10 3.69 0.19 5.41 0.00 -1.26 -4.91 121.76 121.78 2kmx s ALA 1145Ca 0.09 1.43 0.11 0.00 0.00 0.00 0.00 51.96 53.58 2kmx s ALA 1145Cb 0.15 -3.60 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 2kmx s ALA 1145CO 0.68 -0.84 -0.22 -1.54 0.00 0.00 0.00 175.76 173.83 2kmx s SER 1146N 0.48 3.23 -0.09 0.00 1.04 -1.26 -4.93 113.70 112.17 2kmx s SER 1146Ca 0.62 -0.87 -0.01 0.00 0.48 0.00 0.00 55.95 56.17 2kmx s SER 1146Cb -0.44 -0.23 0.01 0.00 0.10 0.00 0.00 66.02 65.46 2kmx s SER 1146CO 0.44 0.08 2.29 0.18 0.98 0.00 0.00 173.24 177.21 2kmx n LEU 1147N 0.26 5.63 -4.70 2.42 7.99 -1.26 -4.81 117.00 122.52 2kmx n LEU 1147Ca -0.13 -2.80 -0.42 0.00 -0.01 0.00 0.00 56.01 52.65 2kmx n LEU 1147Cb 0.56 -1.16 -0.03 0.00 -0.11 0.00 0.00 43.42 42.68 2kmx n LEU 1147CO 0.29 1.20 0.87 -0.69 -1.51 0.00 0.00 177.39 177.55 2kmx s VAL 1148N -0.45 4.27 0.53 4.08 1.01 -1.26 -4.79 120.40 123.79 2kmx s VAL 1148Ca 0.20 1.61 0.00 0.00 0.00 0.00 0.00 61.98 63.79 2kmx s VAL 1148Cb 0.12 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.46 2kmx s VAL 1148CO -0.01 0.08 0.00 0.00 0.00 0.00 0.00 175.10 175.17 2kmx n GLN 1149N 4.38 -4.04 -1.53 2.72 6.02 -1.26 -5.08 117.38 118.58 2kmx n GLN 1149Ca 0.09 3.09 0.00 0.00 -0.01 0.00 0.00 57.00 60.17 2kmx n GLN 1149Cb 0.47 -3.77 0.00 0.00 1.02 0.00 0.00 30.24 27.96 2kmx n GLN 1149CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2kmx n ILE 1150N -1.98 -4.45 -0.00 5.09 2.08 -1.26 -5.01 119.36 113.83 2kmx n ILE 1150Ca 0.00 2.05 0.00 0.00 0.56 0.00 0.00 62.75 65.36 2kmx n ILE 1150Cb 0.29 -2.94 -0.00 0.00 -0.75 0.00 0.00 39.64 36.23 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 -1.41 4.88 0.00 4.38 9.92 -1.26 -4.74 116.55 128.31 2kmx n ASP 1151Ca 0.00 0.00 0.03 0.00 -0.53 0.00 0.00 54.79 54.29 2kmx n ASP 1151Cb 0.14 1.00 0.18 0.00 -0.64 0.00 0.00 41.12 41.80 2kmx n ASP 1151CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2kmx n ALA 1152N -1.54 2.08 0.53 2.24 0.00 -1.26 -1.19 120.51 121.37 2kmx n ALA 1152Ca -0.00 -0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.46 2kmx n ALA 1152Cb 0.03 -1.10 0.04 0.00 0.00 0.00 0.00 19.45 18.43 2kmx n ALA 1152CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2kmx n SER 1153N -0.67 1.85 -4.30 0.00 3.41 -1.26 -5.06 113.62 107.59 2kmx n SER 1153Ca 0.04 -1.43 -0.35 0.00 -0.26 0.00 0.00 58.87 56.88 2kmx n SER 1153Cb 0.02 0.13 -0.06 0.00 -0.26 0.00 0.00 64.21 64.04 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 0.45 -1.06 -0.34 4.04 5.15 -0.33 -1.03 115.26 122.13 2kmx n ASN 1154Ca 0.07 -1.16 -0.04 0.00 -0.60 0.00 0.00 54.58 52.84 2kmx n ASN 1154Cb 0.30 -2.11 -0.02 0.00 -0.53 0.00 0.00 39.78 37.42 2kmx n ASN 1154CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2kmx n GLU 1155N -4.35 -1.32 -0.03 1.20 1.02 -1.26 -4.90 120.64 110.99 2kmx n GLU 1155Ca -0.10 0.56 0.11 0.00 -0.02 0.00 0.00 57.16 57.70 2kmx n GLU 1155Cb 0.58 -4.65 0.11 0.00 -0.02 0.00 0.00 31.44 27.46 2kmx n GLU 1155CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2kmx n GLN 1156N -0.84 2.09 0.00 3.49 6.02 -0.20 -4.54 117.38 123.41 2kmx n GLN 1156Ca -0.04 -1.87 0.00 0.00 -0.01 0.00 0.00 57.00 55.07 2kmx n GLN 1156Cb 0.40 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 30.23 2kmx n GLN 1156CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2kmx n SER 1157N 1.25 0.33 -4.76 1.08 2.88 -1.25 -5.12 113.62 108.02 2kmx n SER 1157Ca 0.14 -1.15 -0.41 0.00 -1.33 0.00 0.00 58.87 56.12 2kmx n SER 1157Cb 0.55 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.99 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 -0.15 6.81 0.10 -3.46 1.04 -1.26 -5.04 113.70 111.74 2kmx s SER 1158Ca 0.00 2.61 -0.26 0.00 0.48 0.00 0.00 55.95 58.78 2kmx s SER 1158Cb 0.00 -2.64 0.08 0.00 0.10 0.00 0.00 66.02 63.56 2kmx s SER 1158CO 0.00 -0.53 0.84 0.28 0.98 0.00 0.00 173.24 174.80 2kmx s THR 1159N -0.74 0.00 0.29 2.02 -1.32 -1.26 -5.02 115.64 109.61 2kmx s THR 1159Ca 0.52 -0.29 -0.18 0.00 -1.21 0.00 0.00 61.69 60.53 2kmx s THR 1159Cb -0.39 -1.39 0.02 0.00 -1.51 0.00 0.00 72.50 69.23 2kmx s THR 1159CO 0.48 0.00 0.66 -0.94 -2.21 0.00 0.00 174.62 172.61 2kmx s SER 1160N -2.71 -0.14 0.63 8.08 1.04 -1.26 -4.73 113.70 114.61 2kmx s SER 1160Ca 0.07 -0.79 0.36 0.00 0.48 0.00 0.00 55.95 56.07 2kmx s SER 1160Cb -0.02 0.71 2.05 0.00 0.10 0.00 0.00 66.02 68.86 2kmx s SER 1160CO -0.05 -1.34 2.25 0.77 0.98 0.00 0.00 173.24 175.85 2kmx h SER 1161N 2.07 0.00 0.09 7.02 4.64 -1.97 -2.57 113.55 122.83 2kmx h SER 1161Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2kmx h SER 1161Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2kmx h SER 1161CO 0.29 0.00 -0.01 -1.20 -0.87 0.00 0.00 176.83 175.04 2kmx n SER 1162N -3.42 0.20 -4.78 4.97 7.64 -1.26 -4.72 113.62 112.25 2kmx n SER 1162Ca -0.02 -0.92 -0.37 0.00 1.01 0.00 0.00 58.87 58.57 2kmx n SER 1162Cb 0.15 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.27 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 -2.10 4.08 0.00 1.43 1.00 -0.97 -3.46 119.30 119.28 2kmx s MET 1163Ca 0.43 1.58 0.00 0.00 0.00 0.00 0.00 55.69 57.70 2kmx s MET 1163Cb 0.22 -2.53 0.00 0.00 0.00 0.00 0.00 34.83 32.52 2kmx s MET 1163CO 0.38 -0.23 0.00 -0.89 0.00 0.00 0.00 175.02 174.29 2kmx n ILE 1164N -0.14 0.00 0.09 2.53 5.41 -1.26 -4.85 119.36 121.14 2kmx n ILE 1164Ca 0.05 0.00 0.15 0.00 1.00 0.00 0.00 62.75 63.95 2kmx n ILE 1164Cb 0.49 0.00 0.65 0.00 -0.71 0.00 0.00 39.64 40.07 2kmx n ILE 1164CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 176.55 176.71 2kmx h ILE 1165N 0.00 0.85 0.00 1.39 -0.00 -1.84 -1.05 117.51 116.86 2kmx h ILE 1165Ca 0.00 -0.01 -0.07 0.00 -0.00 0.00 0.00 64.86 64.77 2kmx h ILE 1165Cb 0.00 0.80 -0.01 0.00 -0.00 0.00 0.00 36.82 37.61 2kmx h ILE 1165CO 0.00 0.01 -0.35 0.44 -0.00 0.00 0.00 178.15 178.25 2kmx h ASP 1166N 0.04 0.00 -0.09 2.16 3.32 -1.88 0.08 116.42 120.05 2kmx h ASP 1166Ca 0.16 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.15 2kmx h ASP 1166Cb 0.59 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 2kmx h ASP 1166CO -0.01 0.35 -0.12 0.00 -1.72 0.00 0.00 179.24 177.74 2kmx h ALA 1167N 1.65 1.33 0.13 3.45 0.00 -1.50 -2.34 119.26 121.98 2kmx h ALA 1167Ca -0.00 -0.25 -0.25 0.00 0.00 0.00 0.00 54.91 54.41 2kmx h ALA 1167Cb 0.69 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.37 2kmx h ALA 1167CO 0.05 0.45 -1.22 1.96 0.00 0.00 0.00 179.25 180.49 2kmx h GLN 1168N 0.39 0.28 -0.46 0.00 4.20 -1.15 -3.00 115.11 115.36 2kmx h GLN 1168Ca 0.07 -0.48 -0.12 0.00 0.06 0.00 0.00 58.65 58.18 2kmx h GLN 1168Cb 0.45 0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 2kmx h GLN 1168CO 0.03 1.23 -0.20 0.82 -0.67 0.00 0.00 178.83 180.04 2kmx h ILE 1169N -0.30 1.27 0.00 2.54 2.04 -1.17 -3.10 117.51 118.80 2kmx h ILE 1169Ca -0.25 -1.36 -0.05 0.00 1.00 0.00 0.00 64.86 64.20 2kmx h ILE 1169Cb 1.75 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 2kmx h ILE 1169CO 0.10 0.46 -0.25 0.28 0.00 0.00 0.00 178.15 178.74 2kmx h SER 1170N 0.79 0.00 0.40 1.72 0.02 -1.49 -1.25 113.55 113.75 2kmx h SER 1170Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2kmx h SER 1170Cb 0.77 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.31 2kmx h SER 1170CO 0.06 0.25 -0.13 -0.46 -1.14 0.00 0.00 176.83 175.42 2kmx n ASN 1171N -4.12 0.46 0.29 3.07 0.23 -1.13 -4.21 115.26 109.85 2kmx n ASN 1171Ca -0.02 -0.51 0.19 0.00 -0.53 0.00 0.00 54.58 53.71 2kmx n ASN 1171Cb 0.31 -0.08 0.97 0.00 -2.08 0.00 0.00 39.78 38.90 2kmx n ASN 1171CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2kmx h ALA 1172N 3.55 1.00 -0.67 -2.53 0.00 -1.14 0.11 119.26 119.57 2kmx h ALA 1172Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.04 2kmx h ALA 1172Cb 0.38 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2kmx h ALA 1172CO 0.00 0.00 0.45 1.25 0.00 0.00 0.00 179.25 180.95 2kmx h LEU 1173N 0.00 0.32 0.02 0.00 7.12 -1.75 -2.53 115.31 118.49 2kmx h LEU 1173Ca 0.00 0.01 -0.35 0.00 0.13 0.00 0.00 57.88 57.67 2kmx h LEU 1173Cb 0.15 -0.05 -0.06 0.00 -0.53 0.00 0.00 40.66 40.18 2kmx h LEU 1173CO 0.00 0.18 -2.16 0.59 -0.13 0.00 0.00 178.44 176.92 2kmx n ASN 1174N -4.46 0.98 -4.24 1.25 4.13 0.18 -4.91 115.26 108.19 2kmx n ASN 1174Ca 0.12 0.12 -0.40 0.00 1.68 0.00 0.00 54.58 56.10 2kmx n ASN 1174Cb 0.49 0.13 -0.10 0.00 -1.54 0.00 0.00 39.78 38.76 2kmx n ASN 1174CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2kmx s ALA 1175N -2.54 3.30 0.35 5.41 0.00 -0.07 -5.00 121.76 123.21 2kmx s ALA 1175Ca -0.16 -2.27 -0.25 0.00 0.00 0.00 0.00 51.96 49.29 2kmx s ALA 1175Cb 0.07 -2.66 -0.14 0.00 0.00 0.00 0.00 23.12 20.40 2kmx s ALA 1175CO 0.77 -1.72 0.67 1.04 0.00 0.00 0.00 175.76 176.53 2kmx n GLN 1176N 4.88 0.70 -4.30 0.00 6.02 -1.25 -4.28 117.38 119.15 2kmx n GLN 1176Ca -0.09 0.25 -0.16 0.00 -0.01 0.00 0.00 57.00 56.99 2kmx n GLN 1176Cb 0.42 -1.53 -0.10 0.00 1.02 0.00 0.00 30.24 30.05 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 -1.49 1.21 -0.05 -1.09 -0.21 -1.26 -4.47 119.66 112.29 2kmx s GLN 1177Ca 0.62 -1.55 0.04 0.00 0.02 0.00 0.00 55.36 54.50 2kmx s GLN 1177Cb -0.68 -0.78 -0.00 0.00 1.00 0.00 0.00 33.01 32.56 2kmx s GLN 1177CO 0.58 0.07 -0.17 0.71 -2.12 0.00 0.00 175.29 174.37 2kmx s TYR 1178N -3.24 1.68 -0.49 0.91 1.51 -0.40 -4.97 117.35 112.36 2kmx s TYR 1178Ca 0.21 -0.50 -0.19 0.00 -1.01 0.00 0.00 57.07 55.58 2kmx s TYR 1178Cb 0.02 -1.14 0.06 0.00 -0.11 0.00 0.00 41.96 40.79 2kmx s TYR 1178CO 0.04 -0.18 0.58 0.21 -1.11 0.00 0.00 175.55 175.09 2kmx s LYS 1179N 0.12 3.11 0.01 -0.62 2.20 -1.26 -1.05 119.74 122.25 2kmx s LYS 1179Ca -0.05 -0.92 0.07 0.00 -0.36 0.00 0.00 55.97 54.70 2kmx s LYS 1179Cb -0.12 -4.09 -0.02 0.00 -1.51 0.00 0.00 37.83 32.09 2kmx s LYS 1179CO 0.03 -1.17 -0.21 0.14 -0.36 0.00 0.00 175.35 173.78 2kmx s VAL 1180N 2.48 1.67 0.02 4.02 -7.23 -0.13 -0.35 120.40 120.88 2kmx s VAL 1180Ca 0.14 -1.05 -0.08 0.00 -1.81 0.00 0.00 61.98 59.18 2kmx s VAL 1180Cb -0.20 -1.42 0.00 0.00 0.56 0.00 0.00 36.38 35.33 2kmx s VAL 1180CO 0.12 0.35 0.16 -1.48 -0.31 0.00 0.00 175.10 173.93 2kmx s LEU 1181N -0.82 1.48 0.05 1.32 2.34 -0.34 -1.07 118.68 121.64 2kmx s LEU 1181Ca 0.08 -0.27 -0.09 0.00 0.06 0.00 0.00 54.13 53.91 2kmx s LEU 1181Cb -0.08 0.79 0.00 0.00 -0.56 0.00 0.00 46.19 46.33 2kmx s LEU 1181CO 0.00 -0.44 0.19 -0.51 -1.06 0.00 0.00 176.35 174.53 2kmx s ILE 1182N -1.85 0.12 0.00 1.48 2.07 -0.76 -1.00 121.20 121.26 2kmx s ILE 1182Ca -0.11 -0.95 0.00 0.00 -1.41 0.00 0.00 60.65 58.18 2kmx s ILE 1182Cb -0.05 -0.97 0.00 0.00 0.13 0.00 0.00 42.46 41.58 2kmx s ILE 1182CO -0.00 -0.52 0.00 0.61 -1.91 0.00 0.00 174.94 173.11 2kmx n GLY 1183N 0.60 2.32 7.00 1.50 0.00 -0.81 -1.24 105.19 114.55 2kmx n GLY 1183Ca -0.18 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 43.86 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 -0.78 0.00 1.61 2.85 -1.26 -4.42 115.26 113.26 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 -1.14 -2.11 0.00 0.00 177.26 174.01 2kmx n ARG 1185N 0.00 1.05 0.08 1.20 0.63 -1.26 -3.32 116.66 115.04 2kmx n ARG 1185Ca 0.00 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.83 2kmx n ARG 1185Cb 0.00 -0.75 -0.06 0.00 0.45 0.00 0.00 32.46 32.10 2kmx n ARG 1185CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 2kmx h GLU 1186N 0.00 0.16 0.00 -0.14 4.81 -1.87 -3.10 114.58 114.43 2kmx h GLU 1186Ca 0.00 -0.21 -0.12 0.00 -0.13 0.00 0.00 59.36 58.90 2kmx h GLU 1186Cb 0.49 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2kmx h GLU 1186CO 0.00 1.02 -0.56 2.35 -0.73 0.00 0.00 179.01 181.09 2kmx h TRP 1187N 0.07 0.00 -0.58 0.92 2.91 -1.86 -1.74 115.95 115.68 2kmx h TRP 1187Ca -0.05 0.00 0.07 0.00 1.13 0.00 0.00 58.89 60.04 2kmx h TRP 1187Cb 1.67 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 30.28 2kmx h TRP 1187CO 0.03 0.56 0.38 1.98 -1.03 0.00 0.00 178.44 180.36 2kmx h MET 1188N 0.00 0.49 0.23 2.65 4.05 -1.81 0.69 114.93 121.22 2kmx h MET 1188Ca -0.01 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.37 2kmx h MET 1188Cb 1.05 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.74 2kmx h MET 1188CO 0.07 0.32 -0.11 0.82 0.23 0.00 0.00 176.91 178.25 2kmx h ILE 1189N 0.50 0.00 0.00 1.77 2.04 -1.48 -3.33 117.51 117.01 2kmx h ILE 1189Ca 0.25 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.94 2kmx h ILE 1189Cb 0.35 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 2kmx h ILE 1189CO -0.07 0.00 0.20 0.03 0.00 0.00 0.00 178.15 178.31 2kmx h ARG 1190N -0.48 0.00 0.00 2.37 3.08 -0.97 -0.00 114.38 118.38 2kmx h ARG 1190Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2kmx h ARG 1190Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2kmx h ARG 1190CO 0.05 0.00 0.00 -1.71 -1.07 0.00 0.00 179.97 177.24 2kmx n ASN 1191N -2.78 0.00 -0.50 7.04 5.15 0.20 -4.89 115.26 119.47 2kmx n ASN 1191Ca -0.02 -1.66 -0.07 0.00 -0.60 0.00 0.00 54.58 52.23 2kmx n ASN 1191Cb 0.25 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.47 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 0.34 0.88 3.92 8.20 0.00 -0.01 -4.91 105.19 113.61 2kmx n GLY 1192Ca 0.00 -0.61 -0.27 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.49 2.72 -0.24 0.99 1.43 -1.24 -5.09 118.68 115.76 2kmx s LEU 1193Ca 0.00 0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 53.53 2kmx s LEU 1193Cb 0.00 -3.01 -0.02 0.00 0.03 0.00 0.00 46.19 43.19 2kmx s LEU 1193CO 0.00 -1.82 0.02 -0.69 0.23 0.00 0.00 176.35 174.09 2kmx s VAL 1194N -3.41 3.88 -0.24 -1.59 1.01 -1.26 -4.87 120.40 113.92 2kmx s VAL 1194Ca 0.62 -0.32 -0.11 0.00 0.00 0.00 0.00 61.98 62.18 2kmx s VAL 1194Cb -0.10 -2.79 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2kmx s VAL 1194CO 0.47 0.38 0.16 -0.51 0.00 0.00 0.00 175.10 175.60 2kmx s ILE 1195N 1.54 5.36 0.31 2.22 2.07 -1.26 -5.01 121.20 126.43 2kmx s ILE 1195Ca 0.06 0.19 -0.04 0.00 -1.41 0.00 0.00 60.65 59.46 2kmx s ILE 1195Cb -0.15 -3.50 -0.05 0.00 0.13 0.00 0.00 42.46 38.89 2kmx s ILE 1195CO 0.00 0.35 0.56 0.54 -1.91 0.00 0.00 174.94 174.49 2kmx s ASN 1196N 1.02 6.40 0.48 4.50 2.20 -1.26 -4.97 114.94 123.31 2kmx s ASN 1196Ca 0.08 0.66 0.13 0.00 -0.94 0.00 0.00 52.86 52.79 2kmx s ASN 1196Cb -0.13 -2.12 1.12 0.00 -2.00 0.00 0.00 41.25 38.11 2kmx s ASN 1196CO 0.04 -0.24 2.11 0.78 -2.94 0.00 0.00 177.10 176.85 2kmx h ASN 1197N 1.38 0.16 -0.21 3.54 2.35 -1.98 -1.13 115.58 119.68 2kmx h ASN 1197Ca -0.48 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.12 2kmx h ASN 1197Cb 1.20 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.53 2kmx h ASN 1197CO 0.65 0.12 -0.42 0.44 -1.65 0.00 0.00 177.43 176.57 2kmx h ASP 1198N 0.18 0.74 0.51 5.81 5.19 -2.00 -2.39 116.42 124.46 2kmx h ASP 1198Ca 0.05 -0.55 -0.25 0.00 -0.62 0.00 0.00 57.03 55.66 2kmx h ASP 1198Cb -0.00 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.30 2kmx h ASP 1198CO -0.01 1.15 -1.11 1.62 -3.12 0.00 0.00 179.24 177.77 2kmx h VAL 1199N 0.36 1.46 -0.80 -1.35 3.04 -1.93 -3.09 116.25 113.93 2kmx h VAL 1199Ca 0.01 -2.79 -0.02 0.00 -1.01 0.00 0.00 66.70 62.89 2kmx h VAL 1199Cb 1.03 2.72 -0.04 0.00 -2.01 0.00 0.00 31.29 32.99 2kmx h VAL 1199CO 0.09 0.82 0.42 -1.13 -1.01 0.00 0.00 177.57 176.76 2kmx h ASN 1200N 0.14 1.01 -0.07 3.17 -1.24 -1.24 0.15 115.58 117.49 2kmx h ASN 1200Ca -0.11 -0.10 0.00 0.00 0.71 0.00 0.00 56.30 56.80 2kmx h ASN 1200Cb 1.80 -0.26 -0.00 0.00 0.73 0.00 0.00 38.32 40.58 2kmx h ASN 1200CO 0.19 0.83 0.05 -0.78 -1.29 0.00 0.00 177.43 176.43 2kmx h ASP 1201N 1.13 0.08 -0.87 1.15 1.82 -1.53 -2.67 116.42 115.53 2kmx h ASP 1201Ca 0.28 -0.01 0.06 0.00 -0.39 0.00 0.00 57.03 56.98 2kmx h ASP 1201Cb 0.06 -0.02 -0.06 0.00 0.68 0.00 0.00 39.33 39.99 2kmx h ASP 1201CO -0.04 0.06 0.54 0.15 -1.61 0.00 0.00 179.24 178.35 2kmx h PHE 1202N 0.10 1.01 -0.05 0.28 3.04 -1.31 -0.35 116.94 119.65 2kmx h PHE 1202Ca 0.03 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.00 2kmx h PHE 1202Cb -0.01 -0.33 -0.00 0.00 2.56 0.00 0.00 35.95 38.17 2kmx h PHE 1202CO -0.07 0.51 0.01 1.98 -2.02 0.00 0.00 178.31 178.72 2kmx h MET 1203N 0.99 0.08 -0.00 1.11 4.05 -0.87 -2.77 114.93 117.52 2kmx h MET 1203Ca 0.38 -0.02 -0.16 0.00 -0.28 0.00 0.00 59.70 59.62 2kmx h MET 1203Cb 0.17 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.94 2kmx h MET 1203CO -0.17 0.30 -0.76 0.00 0.23 0.00 0.00 176.91 176.51 2kmx h THR 1204N -0.15 1.52 0.20 -0.77 1.03 -1.38 -3.04 112.91 110.32 2kmx h THR 1204Ca 0.02 -2.54 0.00 0.00 -0.01 0.00 0.00 66.41 63.88 2kmx h THR 1204Cb 0.25 2.37 -0.01 0.00 -1.07 0.00 0.00 68.15 69.69 2kmx h THR 1204CO 0.00 0.73 -0.18 -0.08 -0.01 0.00 0.00 175.52 175.98 2kmx h GLU 1205N 0.02 -0.38 0.00 0.00 4.57 -0.97 -0.01 114.58 117.81 2kmx h GLU 1205Ca -0.01 0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 58.08 2kmx h GLU 1205Cb 1.34 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 30.00 2kmx h GLU 1205CO 0.10 -0.25 -0.52 0.45 -1.18 0.00 0.00 179.01 177.61 2kmx h HIS 1206N -0.39 0.00 -0.32 0.92 3.86 -1.61 -2.42 115.15 115.19 2kmx h HIS 1206Ca -0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 2kmx h HIS 1206Cb 0.36 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 2kmx h HIS 1206CO -0.13 0.52 0.13 1.49 0.86 0.00 0.00 177.93 180.80 2kmx h GLU 1207N 0.00 0.47 0.00 2.45 4.22 -1.38 -3.04 114.58 117.31 2kmx h GLU 1207Ca -0.01 -0.08 -0.07 0.00 0.08 0.00 0.00 59.36 59.28 2kmx h GLU 1207Cb 0.96 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 2kmx h GLU 1207CO 0.07 0.47 -0.33 0.00 -2.18 0.00 0.00 179.01 177.04 2kmx h ARG 1208N 0.37 0.00 0.00 1.92 3.08 -0.90 -1.56 114.38 117.29 2kmx h ARG 1208Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2kmx h ARG 1208Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 2kmx h ARG 1208CO -0.01 0.33 0.00 1.63 -1.07 0.00 0.00 179.97 180.85 2kmx n LYS 1209N -4.08 0.02 -0.66 0.04 5.02 -0.92 -4.89 118.16 112.70 2kmx n LYS 1209Ca -0.02 0.39 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 2kmx n LYS 1209Cb 0.38 -1.56 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 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 -0.67 1.42 3.58 0.72 0.00 -0.59 -5.09 105.19 104.56 2kmx n GLY 1210Ca 0.02 -0.30 -0.27 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.95 1.98 0.03 1.61 0.52 -1.16 -5.07 118.95 114.92 2kmx s ARG 1211Ca 0.00 -2.21 -0.18 0.00 -0.52 0.00 0.00 55.73 52.82 2kmx s ARG 1211Cb 0.00 -0.93 -0.06 0.00 0.52 0.00 0.00 34.95 34.48 2kmx s ARG 1211CO 0.00 -0.40 0.51 0.99 0.02 0.00 0.00 175.30 176.42 2kmx s THR 1212N -3.11 4.87 -0.03 0.02 2.01 0.10 -4.24 115.64 115.27 2kmx s THR 1212Ca 0.21 1.07 0.01 0.00 0.31 0.00 0.00 61.69 63.29 2kmx s THR 1212Cb 0.03 -3.83 0.02 0.00 0.01 0.00 0.00 72.50 68.73 2kmx s THR 1212CO 0.12 0.54 -0.02 0.00 -0.69 0.00 0.00 174.62 174.57 2kmx s ALA 1213N -0.95 0.40 0.13 7.40 0.00 -1.26 -0.64 121.76 126.84 2kmx s ALA 1213Ca 0.27 0.08 -0.04 0.00 0.00 0.00 0.00 51.96 52.28 2kmx s ALA 1213Cb -0.18 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 2kmx s ALA 1213CO 0.16 -0.03 0.12 0.14 0.00 0.00 0.00 175.76 176.15 2kmx s VAL 1214N 0.86 0.10 0.39 0.00 -7.23 -0.57 -4.79 120.40 109.17 2kmx s VAL 1214Ca -0.09 -1.71 0.08 0.00 -1.81 0.00 0.00 61.98 58.44 2kmx s VAL 1214Cb -0.13 -1.90 -0.07 0.00 0.56 0.00 0.00 36.38 34.84 2kmx s VAL 1214CO -0.01 -0.47 0.03 -0.76 -0.31 0.00 0.00 175.10 173.58 2kmx s LEU 1215N -3.00 2.92 -0.04 1.32 1.02 -1.21 -1.06 118.68 118.62 2kmx s LEU 1215Ca 0.20 -1.25 0.00 0.00 0.02 0.00 0.00 54.13 53.10 2kmx s LEU 1215Cb 0.06 -1.07 0.03 0.00 0.02 0.00 0.00 46.19 45.23 2kmx s LEU 1215CO -0.00 -0.41 -0.01 -0.69 0.02 0.00 0.00 176.35 175.26 2kmx s VAL 1216N -2.65 0.25 0.10 -1.59 1.01 -0.45 -1.93 120.40 115.14 2kmx s VAL 1216Ca 0.36 0.06 0.08 0.00 0.00 0.00 0.00 61.98 62.48 2kmx s VAL 1216Cb 0.07 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 2kmx s VAL 1216CO 0.19 0.17 -0.20 0.00 0.00 0.00 0.00 175.10 175.26 2kmx s ALA 1217N 1.12 1.76 -0.11 5.51 0.00 -0.17 -2.04 121.76 127.84 2kmx s ALA 1217Ca -0.08 -1.24 -0.05 0.00 0.00 0.00 0.00 51.96 50.59 2kmx s ALA 1217Cb -0.14 -0.23 0.05 0.00 0.00 0.00 0.00 23.12 22.81 2kmx s ALA 1217CO -0.02 0.34 0.24 0.14 0.00 0.00 0.00 175.76 176.46 2kmx s VAL 1218N -1.21 -0.19 -1.27 0.00 -7.23 0.46 -1.19 120.40 109.77 2kmx s VAL 1218Ca 0.06 0.21 -0.11 0.00 -1.81 0.00 0.00 61.98 60.33 2kmx s VAL 1218Cb -0.10 -0.39 0.02 0.00 0.56 0.00 0.00 36.38 36.47 2kmx s VAL 1218CO 0.04 0.09 0.21 0.47 -0.31 0.00 0.00 175.10 175.60 2kmx n ASP 1219N 4.69 -0.72 -2.35 4.85 8.00 0.53 -1.15 116.55 130.41 2kmx n ASP 1219Ca -0.17 -1.15 -0.20 0.00 0.71 0.00 0.00 54.79 53.98 2kmx n ASP 1219Cb 0.52 -1.40 -0.01 0.00 -0.02 0.00 0.00 41.12 40.20 2kmx n ASP 1219CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2kmx n ASP 1220N -2.26 -5.64 -4.30 -2.24 8.00 -1.26 -5.02 116.55 103.83 2kmx n ASP 1220Ca -0.22 0.04 -0.23 0.00 0.71 0.00 0.00 54.79 55.09 2kmx n ASP 1220Cb 0.58 -4.73 -0.12 0.00 -0.02 0.00 0.00 41.12 36.83 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 -4.95 1.17 0.35 -1.24 0.41 -0.30 -4.86 118.70 109.28 2kmx s GLU 1221Ca 0.00 -1.24 -0.25 0.00 -0.41 0.00 0.00 54.97 53.07 2kmx s GLU 1221Cb 0.00 -1.36 -0.10 0.00 -1.78 0.00 0.00 34.13 30.89 2kmx s GLU 1221CO 0.00 0.30 0.98 -0.51 -0.49 0.00 0.00 175.26 175.54 2kmx s LEU 1222N -2.15 4.25 -0.01 1.80 1.43 -1.26 -0.40 118.68 122.33 2kmx s LEU 1222Ca 0.09 1.89 0.00 0.00 -1.03 0.00 0.00 54.13 55.08 2kmx s LEU 1222Cb -0.09 -4.11 -0.00 0.00 0.03 0.00 0.00 46.19 42.02 2kmx s LEU 1222CO 0.05 -0.22 -0.01 0.00 0.23 0.00 0.00 176.35 176.41 2kmx n GLY 1224N 3.44 0.92 3.04 0.00 0.00 -1.20 -0.51 105.19 110.89 2kmx n GLY 1224Ca -0.01 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 44.95 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 2.31 -0.02 0.99 2.34 -0.03 -1.34 118.68 122.92 2kmx s LEU 1225Ca 0.07 -0.65 0.03 0.00 0.06 0.00 0.00 54.13 53.64 2kmx s LEU 1225Cb -0.01 0.01 0.00 0.00 -0.56 0.00 0.00 46.19 45.64 2kmx s LEU 1225CO 0.01 -0.33 -0.09 -0.63 -1.06 0.00 0.00 176.35 174.25 2kmx s ILE 1226N -2.05 0.78 -0.09 1.48 -1.09 -0.23 -1.14 121.20 118.86 2kmx s ILE 1226Ca -0.08 -0.36 -0.01 0.00 -2.23 0.00 0.00 60.65 57.97 2kmx s ILE 1226Cb -0.06 -0.69 -0.03 0.00 -1.58 0.00 0.00 42.46 40.11 2kmx s ILE 1226CO -0.02 0.24 -0.06 0.00 -1.23 0.00 0.00 174.94 173.87 2kmx s ALA 1227N 0.15 2.99 0.02 9.38 0.00 -0.09 -1.51 121.76 132.69 2kmx s ALA 1227Ca -0.02 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.10 2kmx s ALA 1227Cb -0.08 -1.33 -0.01 0.00 0.00 0.00 0.00 23.12 21.69 2kmx s ALA 1227CO 0.00 0.47 -0.08 0.42 0.00 0.00 0.00 175.76 176.57 2kmx s ILE 1228N -0.46 0.63 0.09 0.00 1.09 0.19 -0.48 121.20 122.26 2kmx s ILE 1228Ca 0.07 -0.62 0.00 0.00 -1.10 0.00 0.00 60.65 59.00 2kmx s ILE 1228Cb -0.12 -0.58 -0.00 0.00 -1.06 0.00 0.00 42.46 40.70 2kmx s ILE 1228CO 0.02 -0.02 0.01 0.00 -0.10 0.00 0.00 174.94 174.85 2kmx n ALA 1229N 2.35 0.09 -3.03 9.38 0.00 -0.09 -0.72 120.51 128.48 2kmx n ALA 1229Ca -0.16 -0.41 -0.27 0.00 0.00 0.00 0.00 53.44 52.59 2kmx n ALA 1229Cb 0.56 0.24 -0.16 0.00 0.00 0.00 0.00 19.45 20.09 2kmx n ALA 1229CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kmx s ASP 1230N -1.51 2.36 0.00 0.00 1.01 -1.26 -1.34 116.67 115.93 2kmx s ASP 1230Ca 0.01 -0.40 0.00 0.00 0.71 0.00 0.00 52.55 52.88 2kmx s ASP 1230Cb 0.00 -0.80 0.00 0.00 1.01 0.00 0.00 42.92 43.13 2kmx s ASP 1230CO 0.01 0.14 0.09 1.07 0.21 0.00 0.00 175.17 176.69