#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2agw s GLU 74 N 0.00 4.28 -0.07 -0.14 2.02 -1.26 -5.07 118.70 118.46 2agw s GLU 74 Ca 0.00 1.18 0.02 0.00 0.02 0.00 0.00 54.97 56.20 2agw s GLU 74 Cb 0.00 -2.31 0.01 0.00 0.10 0.00 0.00 34.13 31.93 2agw s GLU 74 CO 0.00 0.01 -0.13 0.08 0.02 0.00 0.00 175.26 175.24 2agw s VAL 75 N -2.04 1.24 0.01 2.63 1.01 -1.26 -5.12 120.40 116.87 2agw s VAL 75 Ca 0.60 -0.54 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 2agw s VAL 75 Cb -0.12 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.09 2agw s VAL 75 CO 0.16 0.38 1.22 -0.22 0.00 0.00 0.00 175.10 176.64 2agw s LEU 76 N 0.66 4.33 0.18 3.92 2.96 -1.26 -5.04 118.68 124.42 2agw s LEU 76 Ca -0.15 1.95 0.09 0.00 -0.22 0.00 0.00 54.13 55.80 2agw s LEU 76 Cb -0.16 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 2agw s LEU 76 CO 0.04 -0.54 -0.19 0.42 -1.32 0.00 0.00 176.35 174.76 2agw s THR 77 N 1.66 1.96 0.00 3.68 -4.23 -1.26 -5.16 115.64 112.29 2agw s THR 77 Ca 0.58 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2agw s THR 77 Cb -0.28 -1.94 0.00 0.00 1.34 0.00 0.00 72.50 71.62 2agw s THR 77 CO 0.26 -0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 2agw n GLY 78 N 0.18 3.64 1.80 3.99 0.00 -1.26 -4.90 105.19 108.63 2agw n GLY 78 Ca -0.12 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.71 2agw n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2agw n GLY 79 N 5.00 0.52 3.88 -0.02 0.00 -1.26 -5.03 105.19 108.28 2agw n GLY 79 Ca 0.00 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 2agw n GLY 79 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2agw s HIS 80 N -2.00 3.48 0.31 1.61 4.02 -1.26 -5.05 115.29 116.40 2agw s HIS 80 Ca 0.00 0.94 0.02 0.00 1.02 0.00 0.00 55.06 57.04 2agw s HIS 80 Cb 0.00 -2.36 -0.03 0.00 -1.02 0.00 0.00 32.58 29.16 2agw s HIS 80 CO 0.00 -0.07 0.49 -1.12 1.02 0.00 0.00 174.74 175.06 2agw s SER 81 N -3.26 6.30 0.29 1.40 0.01 -1.26 -4.69 113.70 112.49 2agw s SER 81 Ca 0.49 0.33 -0.29 0.00 1.31 0.00 0.00 55.95 57.79 2agw s SER 81 Cb -0.10 -1.97 -0.13 0.00 0.21 0.00 0.00 66.02 64.02 2agw s SER 81 CO 0.32 -0.23 1.24 0.52 0.41 0.00 0.00 173.24 175.51 2agw n VAL 82 N -1.67 1.66 1.20 3.43 0.31 0.36 -4.88 118.33 118.74 2agw n VAL 82 Ca -0.06 -0.41 0.14 0.00 -0.01 0.00 0.00 64.34 63.99 2agw n VAL 82 Cb 0.56 -1.34 0.51 0.00 -0.91 0.00 0.00 33.84 32.66 2agw n VAL 82 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2agw n SER 83 N 1.32 0.40 -4.40 4.52 3.41 -1.26 -4.81 113.62 112.80 2agw n SER 83 Ca 0.08 -0.25 -0.28 0.00 -0.26 0.00 0.00 58.87 58.16 2agw n SER 83 Cb 0.33 -0.08 -0.12 0.00 -0.26 0.00 0.00 64.21 64.07 2agw n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2agw s ALA 84 N -2.73 2.42 0.69 7.33 0.00 -1.26 -5.12 121.76 123.08 2agw s ALA 84 Ca 0.21 -1.53 -0.16 0.00 0.00 0.00 0.00 51.96 50.47 2agw s ALA 84 Cb 0.19 -0.35 0.02 0.00 0.00 0.00 0.00 23.12 22.98 2agw s ALA 84 CO 0.55 0.48 1.19 -1.25 0.00 0.00 0.00 175.76 176.73 2agw s PRO 85 N -2.32 2.42 0.29 0.00 0.04 -1.26 -4.88 135.00 129.29 2agw s PRO 85 Ca 0.17 1.72 0.04 0.00 0.04 0.00 0.00 61.00 62.96 2agw s PRO 85 Cb -0.09 -1.87 0.70 0.00 0.04 0.00 0.00 34.50 33.28 2agw s PRO 85 CO 0.08 -1.61 1.73 1.96 0.04 0.00 0.00 177.00 179.20 2agw h GLN 86 N 0.01 0.52 0.00 4.56 4.20 -1.98 -0.66 115.11 121.77 2agw h GLN 86 Ca -0.48 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.20 2agw h GLN 86 Cb 1.29 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.95 2agw h GLN 86 CO 0.52 0.35 0.00 -0.85 -0.67 0.00 0.00 178.83 178.17 2agw n GLU 87 N -4.94 0.10 0.00 1.46 0.28 -1.26 -1.21 120.64 115.07 2agw n GLU 87 Ca 0.22 0.50 0.12 0.00 -0.16 0.00 0.00 57.16 57.83 2agw n GLU 87 Cb 0.60 -1.76 0.18 0.00 1.43 0.00 0.00 31.44 31.89 2agw n GLU 87 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2agw n ASN 88 N -1.95 1.00 -4.85 -1.84 4.13 -0.25 -4.96 115.26 106.53 2agw n ASN 88 Ca 0.00 -0.79 -0.37 0.00 1.68 0.00 0.00 54.58 55.10 2agw n ASN 88 Cb 0.09 0.40 -0.06 0.00 -1.54 0.00 0.00 39.78 38.67 2agw n ASN 88 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2agw s ARG 89 N -2.76 3.80 0.20 3.52 0.52 -0.35 -1.04 118.95 122.83 2agw s ARG 89 Ca 0.16 0.27 0.07 0.00 -0.52 0.00 0.00 55.73 55.70 2agw s ARG 89 Cb 0.18 -3.19 -0.05 0.00 0.52 0.00 0.00 34.95 32.42 2agw s ARG 89 CO 0.66 0.69 -0.11 0.96 0.02 0.00 0.00 175.30 177.52 2agw s ILE 90 N -1.11 1.54 -0.19 1.52 -4.36 0.30 -1.14 121.20 117.76 2agw s ILE 90 Ca 0.23 -2.15 0.00 0.00 -0.26 0.00 0.00 60.65 58.47 2agw s ILE 90 Cb -0.15 -2.07 0.04 0.00 1.25 0.00 0.00 42.46 41.53 2agw s ILE 90 CO 0.12 -0.58 -0.08 -0.31 0.24 0.00 0.00 174.94 174.33 2agw s TYR 91 N -3.09 2.17 -0.33 1.37 1.51 0.85 -1.35 117.35 118.47 2agw s TYR 91 Ca 0.22 -1.42 -0.08 0.00 -1.01 0.00 0.00 57.07 54.78 2agw s TYR 91 Cb 0.01 -1.53 0.02 0.00 -0.11 0.00 0.00 41.96 40.35 2agw s TYR 91 CO 0.06 -0.70 0.14 0.08 -1.11 0.00 0.00 175.55 174.02 2agw s VAL 92 N 1.48 4.23 -0.54 0.71 1.01 0.29 -1.42 120.40 126.16 2agw s VAL 92 Ca -0.01 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 2agw s VAL 92 Cb -0.16 -3.28 0.04 0.00 0.00 0.00 0.00 36.38 32.98 2agw s VAL 92 CO -0.08 -0.07 0.97 -0.32 0.00 0.00 0.00 175.10 175.60 2agw s MET 93 N 1.52 3.38 -0.45 2.72 1.75 -0.46 -0.85 119.30 126.91 2agw s MET 93 Ca 0.02 -0.13 -0.18 0.00 -1.25 0.00 0.00 55.69 54.15 2agw s MET 93 Cb -0.18 -4.03 0.04 0.00 2.84 0.00 0.00 34.83 33.49 2agw s MET 93 CO 0.04 -1.48 0.50 0.34 -0.65 0.00 0.00 175.02 173.78 2agw s ASP 94 N 2.78 6.21 0.41 1.11 -1.08 0.27 -4.11 116.67 122.26 2agw s ASP 94 Ca 0.33 -0.78 0.15 0.00 -0.52 0.00 0.00 52.55 51.73 2agw s ASP 94 Cb -0.11 -2.24 0.87 0.00 -1.46 0.00 0.00 42.92 39.98 2agw s ASP 94 CO 0.21 -0.68 1.90 0.77 0.52 0.00 0.00 175.17 177.89 2agw h SER 95 N 8.81 0.00 -6.43 -0.34 4.64 -1.48 -1.55 113.55 117.20 2agw h SER 95 Ca -0.27 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.57 2agw h SER 95 Cb 1.11 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.23 2agw h SER 95 CO 0.86 0.29 -0.94 0.52 -0.87 0.00 0.00 176.83 176.68 2agw n VAL 96 N -4.12 -4.56 -0.19 0.95 0.31 -1.24 -4.13 118.33 105.34 2agw n VAL 96 Ca -0.02 -0.78 0.08 0.00 -0.01 0.00 0.00 64.34 63.61 2agw n VAL 96 Cb 0.34 -3.52 0.37 0.00 -0.91 0.00 0.00 33.84 30.12 2agw n VAL 96 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 2agw h PHE 97 N -2.01 0.74 0.00 3.52 3.57 -1.91 0.42 116.94 121.27 2agw h PHE 97 Ca -0.67 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 60.85 2agw h PHE 97 Cb 1.37 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.87 2agw h PHE 97 CO 0.38 0.37 -0.01 0.52 -2.23 0.00 0.00 178.31 177.34 2agw h MET 98 N 0.71 0.00 -1.84 1.11 2.86 -1.99 -3.19 114.93 112.59 2agw h MET 98 Ca 0.34 0.00 -0.50 0.00 -2.06 0.00 0.00 59.70 57.48 2agw h MET 98 Cb 0.38 0.00 -0.37 0.00 0.06 0.00 0.00 31.60 31.67 2agw h MET 98 CO -0.12 0.01 -1.10 0.72 1.06 0.00 0.00 176.91 177.48 2agw n HIS 99 N -3.83 -0.35 0.30 -0.22 8.25 0.13 -5.01 115.22 114.48 2agw n HIS 99 Ca -0.03 -3.54 0.17 0.00 -0.26 0.00 0.00 57.72 54.05 2agw n HIS 99 Cb 0.09 -0.23 0.79 0.00 1.12 0.00 0.00 29.99 31.76 2agw n HIS 99 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2agw h LEU 100 N 3.54 0.00 0.00 2.41 5.85 -1.10 0.33 115.31 126.33 2agw h LEU 100 Ca 0.07 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2agw h LEU 100 Cb 0.93 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.96 2agw h LEU 100 CO 0.46 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 178.91 2agw n THR 101 N -2.74 0.53 -2.18 1.05 -2.24 -1.26 -1.96 114.28 105.48 2agw n THR 101 Ca -0.01 0.13 -0.20 0.00 -2.27 0.00 0.00 64.05 61.71 2agw n THR 101 Cb 0.16 -0.81 0.02 0.00 -2.10 0.00 0.00 70.33 67.61 2agw n THR 101 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2agw n GLU 102 N -1.37 3.29 -0.95 -0.78 2.13 0.10 -3.67 120.64 119.39 2agw n GLU 102 Ca 0.07 -4.07 -0.33 0.00 0.66 0.00 0.00 57.16 53.50 2agw n GLU 102 Cb 0.18 -2.16 0.14 0.00 0.27 0.00 0.00 31.44 29.87 2agw n GLU 102 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2agw s SER 103 N -3.63 3.30 0.12 4.31 1.04 -0.71 -4.85 113.70 113.27 2agw s SER 103 Ca 0.47 2.32 -0.25 0.00 0.48 0.00 0.00 55.95 58.97 2agw s SER 103 Cb 0.40 -2.58 0.07 0.00 0.10 0.00 0.00 66.02 64.01 2agw s SER 103 CO 0.02 -2.86 0.74 0.00 0.98 0.00 0.00 173.24 172.13 2agw s ARG 104 N -4.31 1.17 -0.22 4.02 3.03 -0.58 -1.41 118.95 120.64 2agw s ARG 104 Ca 0.71 -0.49 -0.12 0.00 2.03 0.00 0.00 55.73 57.86 2agw s ARG 104 Cb -0.27 0.50 -0.05 0.00 -1.03 0.00 0.00 34.95 34.11 2agw s ARG 104 CO 0.53 -0.52 0.22 0.08 -1.13 0.00 0.00 175.30 174.48 2agw s VAL 105 N -3.51 5.33 -0.19 4.99 1.01 -0.16 -0.57 120.40 127.30 2agw s VAL 105 Ca 0.04 0.33 -0.09 0.00 0.00 0.00 0.00 61.98 62.27 2agw s VAL 105 Cb -0.02 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 2agw s VAL 105 CO -0.08 0.34 0.11 -1.00 0.00 0.00 0.00 175.10 174.47 2agw s HIS 106 N 0.97 3.38 -0.24 5.22 3.76 -0.03 -1.30 115.29 127.05 2agw s HIS 106 Ca 0.11 0.27 -0.09 0.00 -0.15 0.00 0.00 55.06 55.20 2agw s HIS 106 Cb -0.13 -2.11 -0.04 0.00 1.11 0.00 0.00 32.58 31.40 2agw s HIS 106 CO 0.04 0.30 0.13 0.08 -0.85 0.00 0.00 174.74 174.44 2agw s VAL 107 N 0.21 5.03 0.16 -0.90 1.01 0.13 -0.54 120.40 125.50 2agw s VAL 107 Ca 0.07 0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.21 2agw s VAL 107 Cb -0.11 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 2agw s VAL 107 CO -0.01 0.33 -0.19 -0.31 0.00 0.00 0.00 175.10 174.92 2agw s TYR 108 N 1.27 1.89 -0.36 5.22 1.51 -0.46 -0.47 117.35 125.96 2agw s TYR 108 Ca 0.06 -0.45 -0.21 0.00 -1.01 0.00 0.00 57.07 55.47 2agw s TYR 108 Cb -0.14 -0.95 0.00 0.00 -0.11 0.00 0.00 41.96 40.76 2agw s TYR 108 CO 0.06 0.34 0.65 0.34 -1.11 0.00 0.00 175.55 175.83 2agw s ASP 109 N -2.58 6.43 0.53 2.29 -1.08 -0.05 -0.54 116.67 121.67 2agw s ASP 109 Ca 0.15 0.16 0.33 0.00 -0.52 0.00 0.00 52.55 52.67 2agw s ASP 109 Cb -0.07 -2.33 1.33 0.00 -1.46 0.00 0.00 42.92 40.40 2agw s ASP 109 CO 0.07 -0.61 1.96 0.10 0.52 0.00 0.00 175.17 177.21 2agw h TYR 110 N 8.47 0.00 0.00 -5.34 -0.00 -1.42 0.38 116.97 119.06 2agw h TYR 110 Ca -0.26 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.38 2agw h TYR 110 Cb 1.11 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.83 2agw h TYR 110 CO 0.75 0.00 -0.42 1.79 -0.00 0.00 0.00 178.16 180.29 2agw h THR 111 N 0.00 0.92 0.00 -0.90 1.35 -1.93 -3.38 112.91 108.97 2agw h THR 111 Ca 0.00 -1.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.17 2agw h THR 111 Cb 0.50 2.03 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 2agw h THR 111 CO 0.00 0.41 0.00 -0.46 -0.25 0.00 0.00 175.52 175.22 2agw n ASN 112 N -3.50 0.00 0.00 5.36 0.23 -1.18 -5.03 115.26 111.14 2agw n ASN 112 Ca 0.00 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.05 2agw n ASN 112 Cb 0.55 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.25 2agw n ASN 112 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2agw n GLY 113 N 0.00 0.48 3.73 4.83 0.00 0.12 -5.00 105.19 109.35 2agw n GLY 113 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2agw n GLY 113 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2agw s LYS 114 N -0.47 4.48 -0.06 1.61 2.20 -1.22 -4.77 119.74 121.52 2agw s LYS 114 Ca 0.00 1.87 -0.30 0.00 -0.36 0.00 0.00 55.97 57.18 2agw s LYS 114 Cb 0.00 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 33.03 2agw s LYS 114 CO 0.00 -0.11 1.33 0.12 -0.36 0.00 0.00 175.35 176.33 2agw s PHE 115 N 0.08 2.88 -0.11 4.03 5.36 -1.26 -0.87 117.98 128.09 2agw s PHE 115 Ca 0.54 0.93 0.16 0.00 -0.96 0.00 0.00 56.93 57.59 2agw s PHE 115 Cb -0.32 -3.58 -0.23 0.00 -0.34 0.00 0.00 43.02 38.55 2agw s PHE 115 CO 0.36 -2.06 0.18 1.28 -1.46 0.00 0.00 175.22 173.52 2agw n LEU 116 N 5.74 0.00 0.00 6.12 4.77 0.38 -4.96 117.00 129.06 2agw n LEU 116 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2agw n LEU 116 Cb 0.45 0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 2agw n LEU 116 CO 0.57 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 2agw n GLY 117 N 1.80 -1.77 3.45 -0.72 0.00 -1.18 -4.76 105.19 102.00 2agw n GLY 117 Ca -0.18 -1.24 -0.11 0.00 0.00 0.00 0.00 46.02 44.49 2agw n GLY 117 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2agw s MET 118 N -1.95 1.28 -0.13 1.61 0.23 -1.26 -0.69 119.30 118.38 2agw s MET 118 Ca 0.00 -0.67 -0.00 0.00 -1.03 0.00 0.00 55.69 53.99 2agw s MET 118 Cb 0.00 0.54 0.03 0.00 -1.53 0.00 0.00 34.83 33.87 2agw s MET 118 CO 0.00 -0.55 -0.08 0.08 -2.03 0.00 0.00 175.02 172.44 2agw s VAL 119 N -3.81 1.15 0.27 5.16 1.01 -0.42 -4.98 120.40 118.79 2agw s VAL 119 Ca 0.04 -0.45 -0.29 0.00 0.00 0.00 0.00 61.98 61.28 2agw s VAL 119 Cb -0.01 -1.19 -0.09 0.00 0.00 0.00 0.00 36.38 35.09 2agw s VAL 119 CO -0.09 0.32 1.21 -2.16 0.00 0.00 0.00 175.10 174.38 2agw s PRO 120 N 1.65 4.49 -0.05 2.72 0.04 -1.26 -0.99 135.00 141.59 2agw s PRO 120 Ca 0.04 1.98 0.13 0.00 0.04 0.00 0.00 61.00 63.19 2agw s PRO 120 Cb -0.13 -3.16 0.25 0.00 0.04 0.00 0.00 34.50 31.50 2agw s PRO 120 CO -0.09 -0.02 1.11 0.25 0.04 0.00 0.00 177.00 178.29 2agw n THR 121 N 1.48 0.66 -1.54 1.26 -2.24 -0.50 -4.92 114.28 108.47 2agw n THR 121 Ca 0.01 -1.20 0.00 0.00 -2.27 0.00 0.00 64.05 60.59 2agw n THR 121 Cb 0.44 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 2agw n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2agw n ALA 122 N -0.25 0.00 -2.63 6.98 0.00 -1.20 -3.25 120.51 120.15 2agw n ALA 122 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.09 2agw n ALA 122 Cb 0.83 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.26 2agw n ALA 122 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2agw s PHE 123 N 0.00 3.14 -1.15 0.00 5.36 -1.23 -1.74 117.98 122.35 2agw s PHE 123 Ca 0.00 1.10 -0.23 0.00 -0.96 0.00 0.00 56.93 56.84 2agw s PHE 123 Cb 0.00 -3.66 0.00 0.00 -0.34 0.00 0.00 43.02 39.02 2agw s PHE 123 CO 0.00 -0.77 0.77 -1.71 -1.46 0.00 0.00 175.22 172.06 2agw n ASN 124 N 6.82 -5.08 -4.76 6.13 5.15 -0.83 -3.70 115.26 119.00 2agw n ASN 124 Ca 0.11 -1.07 -0.36 0.00 -0.60 0.00 0.00 54.58 52.66 2agw n ASN 124 Cb 0.47 -3.08 0.02 0.00 -0.53 0.00 0.00 39.78 36.67 2agw n ASN 124 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2agw s GLY 125 N -3.48 2.73 0.26 8.20 0.00 -1.20 -4.77 107.32 109.06 2agw s GLY 125 Ca 0.48 0.98 0.11 0.00 0.00 0.00 0.00 44.72 46.29 2agw s GLY 125 CO 0.88 1.38 -0.14 0.30 0.00 0.00 0.00 173.10 175.51 2agw s HIS 126 N -1.61 2.43 -0.02 1.90 3.76 -0.16 -4.94 115.29 116.65 2agw s HIS 126 Ca 0.75 -0.30 -0.13 0.00 -0.15 0.00 0.00 55.06 55.23 2agw s HIS 126 Cb -0.29 -1.08 0.02 0.00 1.11 0.00 0.00 32.58 32.33 2agw s HIS 126 CO 0.33 0.65 0.28 0.54 -0.85 0.00 0.00 174.74 175.69 2agw s VAL 127 N -2.30 0.06 0.12 -0.90 0.11 -1.26 -1.23 120.40 115.00 2agw s VAL 127 Ca 0.29 -0.48 -0.19 0.00 -2.93 0.00 0.00 61.98 58.68 2agw s VAL 127 Cb -0.06 -0.57 0.04 0.00 -1.53 0.00 0.00 36.38 34.26 2agw s VAL 127 CO 0.16 -0.26 0.46 0.00 -3.33 0.00 0.00 175.10 172.13 2agw s GLN 128 N -1.23 1.10 -0.07 1.54 -2.07 -0.37 -5.01 119.66 113.54 2agw s GLN 128 Ca -0.13 -0.57 -0.03 0.00 -1.82 0.00 0.00 55.36 52.81 2agw s GLN 128 Cb -0.05 0.49 -0.04 0.00 -1.09 0.00 0.00 33.01 32.32 2agw s GLN 128 CO 0.04 -0.43 0.09 0.08 -1.32 0.00 0.00 175.29 173.74 2agw s VAL 129 N -3.50 4.97 0.59 3.63 1.01 -1.26 -0.73 120.40 125.10 2agw s VAL 129 Ca 0.01 -0.12 -0.20 0.00 0.00 0.00 0.00 61.98 61.67 2agw s VAL 129 Cb 0.01 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 2agw s VAL 129 CO -0.10 0.51 1.24 -1.54 0.00 0.00 0.00 175.10 175.21 2agw n SER 130 N 1.70 1.98 0.01 3.32 3.41 0.00 -4.88 113.62 119.18 2agw n SER 130 Ca -0.17 0.88 0.06 0.00 -0.26 0.00 0.00 58.87 59.39 2agw n SER 130 Cb 0.54 -1.52 0.47 0.00 -0.26 0.00 0.00 64.21 63.44 2agw n SER 130 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2agw h ASN 131 N 0.88 0.39 0.00 4.04 2.35 -1.90 0.32 115.58 121.65 2agw h ASN 131 Ca -0.50 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.24 2agw h ASN 131 Cb 1.33 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.61 2agw h ASN 131 CO 0.54 0.27 0.00 -0.90 -1.65 0.00 0.00 177.43 175.69 2agw n ASP 132 N -4.48 0.00 0.00 5.81 5.68 -1.26 -4.21 116.55 118.08 2agw n ASP 132 Ca 0.04 -0.99 0.00 0.00 -0.50 0.00 0.00 54.79 53.34 2agw n ASP 132 Cb 0.14 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 2agw n ASP 132 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2agw n GLY 133 N 0.99 0.71 0.10 6.12 0.00 0.10 -4.81 105.19 108.40 2agw n GLY 133 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2agw n GLY 133 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2agw h LYS 134 N 2.02 0.00 -4.79 1.61 1.57 -1.91 -3.46 116.57 111.60 2agw h LYS 134 Ca 0.00 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.50 2agw h LYS 134 Cb 0.05 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.19 2agw h LYS 134 CO 0.00 0.31 -0.72 0.15 -0.57 0.00 0.00 179.45 178.62 2agw s LYS 135 N -2.93 0.81 -0.12 3.15 -0.14 -1.26 -1.69 119.74 117.56 2agw s LYS 135 Ca -0.02 -1.19 -0.01 0.00 -1.36 0.00 0.00 55.97 53.39 2agw s LYS 135 Cb 0.09 -0.38 -0.02 0.00 -1.68 0.00 0.00 37.83 35.83 2agw s LYS 135 CO 0.80 0.04 -0.07 0.42 -0.76 0.00 0.00 175.35 175.78 2agw s ILE 136 N -2.80 3.61 -0.16 2.17 1.01 0.13 -0.82 121.20 124.35 2agw s ILE 136 Ca 0.06 -0.47 -0.04 0.00 0.00 0.00 0.00 60.65 60.20 2agw s ILE 136 Cb -0.00 -2.54 -0.03 0.00 0.01 0.00 0.00 42.46 39.90 2agw s ILE 136 CO -0.02 0.53 -0.03 -0.31 0.00 0.00 0.00 174.94 175.11 2agw s TYR 137 N 0.00 3.04 0.22 3.97 4.12 0.09 -0.68 117.35 128.11 2agw s TYR 137 Ca -0.01 -0.27 0.12 0.00 0.02 0.00 0.00 57.07 56.93 2agw s TYR 137 Cb -0.14 -1.96 -0.05 0.00 -1.52 0.00 0.00 41.96 38.29 2agw s TYR 137 CO 0.03 -0.02 -0.22 0.95 0.02 0.00 0.00 175.55 176.31 2agw s THR 138 N 0.34 2.39 -0.04 -0.71 -4.23 -0.22 -1.24 115.64 111.93 2agw s THR 138 Ca -0.04 -2.17 0.03 0.00 -1.18 0.00 0.00 61.69 58.33 2agw s THR 138 Cb -0.14 -2.19 0.01 0.00 1.34 0.00 0.00 72.50 71.52 2agw s THR 138 CO 0.03 -0.23 -0.12 -0.32 -0.54 0.00 0.00 174.62 173.44 2agw s MET 139 N -2.99 1.39 0.35 3.99 1.75 -0.36 -0.60 119.30 122.84 2agw s MET 139 Ca 0.24 -0.40 -0.16 0.00 -1.25 0.00 0.00 55.69 54.12 2agw s MET 139 Cb -0.07 -1.22 0.04 0.00 2.84 0.00 0.00 34.83 36.42 2agw s MET 139 CO 0.12 0.10 0.74 -0.08 -0.65 0.00 0.00 175.02 175.25 2agw s THR 140 N 0.36 0.00 -0.06 10.11 -1.32 -0.50 -0.99 115.64 123.24 2agw s THR 140 Ca -0.08 -1.06 0.04 0.00 -1.21 0.00 0.00 61.69 59.39 2agw s THR 140 Cb -0.12 -2.60 -0.00 0.00 -1.51 0.00 0.00 72.50 68.27 2agw s THR 140 CO 0.02 0.00 -0.19 -0.89 -2.21 0.00 0.00 174.62 171.35 2agw s THR 141 N -2.86 1.59 0.22 5.08 2.01 -1.24 -1.41 115.64 119.03 2agw s THR 141 Ca 0.16 -0.79 0.10 0.00 0.31 0.00 0.00 61.69 61.47 2agw s THR 141 Cb -0.05 -1.37 -0.04 0.00 0.01 0.00 0.00 72.50 71.04 2agw s THR 141 CO 0.11 0.45 -0.15 -0.31 -0.69 0.00 0.00 174.62 174.03 2agw s TYR 142 N 0.12 2.46 0.09 4.92 1.51 -0.10 -3.53 117.35 122.82 2agw s TYR 142 Ca -0.07 -0.29 0.04 0.00 -1.01 0.00 0.00 57.07 55.74 2agw s TYR 142 Cb -0.13 -1.16 -0.03 0.00 -0.11 0.00 0.00 41.96 40.53 2agw s TYR 142 CO 0.04 0.58 -0.12 -1.01 -1.11 0.00 0.00 175.55 173.92 2agw s HIS 143 N -1.99 1.14 0.39 2.71 3.76 -1.26 -0.61 115.29 119.42 2agw s HIS 143 Ca 0.26 -0.56 0.12 0.00 -0.15 0.00 0.00 55.06 54.72 2agw s HIS 143 Cb -0.07 -0.62 0.92 0.00 1.11 0.00 0.00 32.58 33.91 2agw s HIS 143 CO 0.14 0.04 1.89 0.93 -0.85 0.00 0.00 174.74 176.89 2agw h GLU 144 N 3.85 0.56 -0.15 1.40 5.08 -1.39 -1.84 114.58 122.08 2agw h GLU 144 Ca -0.39 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 57.78 2agw h GLU 144 Cb 1.19 -0.13 -0.22 0.00 0.50 0.00 0.00 28.75 30.10 2agw h GLU 144 CO 0.48 0.37 -0.77 0.54 -1.00 0.00 0.00 179.01 178.63 2agw n ARG 145 N -4.53 1.43 0.00 2.33 5.12 -0.25 -5.01 116.66 115.76 2agw n ARG 145 Ca 0.16 -3.07 0.00 0.00 -1.93 0.00 0.00 57.85 53.01 2agw n ARG 145 Cb 0.50 -1.24 0.00 0.00 -1.16 0.00 0.00 32.46 30.57 2agw n ARG 145 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2agw n ILE 146 N -0.53 0.00 0.79 0.55 5.41 -0.70 -3.34 119.36 121.55 2agw n ILE 146 Ca 0.18 0.00 0.12 0.00 1.00 0.00 0.00 62.75 64.05 2agw n ILE 146 Cb 0.88 0.00 0.13 0.00 -0.71 0.00 0.00 39.64 39.94 2agw n ILE 146 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2agw n THR 147 N 0.00 0.15 -3.97 1.39 -2.24 -1.26 -4.50 114.28 103.86 2agw n THR 147 Ca 0.00 -0.57 -0.09 0.00 -2.27 0.00 0.00 64.05 61.12 2agw n THR 147 Cb 0.00 1.35 -0.05 0.00 -2.10 0.00 0.00 70.33 69.53 2agw n THR 147 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2agw s ARG 148 N -1.83 1.60 0.00 -0.78 1.70 -1.21 -5.16 118.95 113.27 2agw s ARG 148 Ca 0.31 -1.19 0.00 0.00 -0.47 0.00 0.00 55.73 54.38 2agw s ARG 148 Cb 0.21 0.50 0.00 0.00 -0.57 0.00 0.00 34.95 35.09 2agw s ARG 148 CO 0.30 -0.68 0.00 0.41 -1.08 0.00 0.00 175.30 174.25 2agw n GLY 149 N -0.40 -0.34 3.76 3.88 0.00 -1.26 -1.09 105.19 109.75 2agw n GLY 149 Ca -0.02 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.75 2agw n GLY 149 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2agw s LYS 150 N -1.16 4.32 0.13 1.61 2.20 -1.26 -4.44 119.74 121.14 2agw s LYS 150 Ca 0.00 2.25 -0.28 0.00 -0.36 0.00 0.00 55.97 57.58 2agw s LYS 150 Cb 0.00 -3.08 -0.07 0.00 -1.51 0.00 0.00 37.83 33.18 2agw s LYS 150 CO 0.00 -0.25 0.87 0.50 -0.36 0.00 0.00 175.35 176.10 2agw s ARG 151 N -1.50 4.66 -0.19 4.03 3.52 -1.26 -1.61 118.95 126.59 2agw s ARG 151 Ca 0.51 1.30 -0.02 0.00 -0.13 0.00 0.00 55.73 57.40 2agw s ARG 151 Cb -0.40 -3.33 0.05 0.00 -1.56 0.00 0.00 34.95 29.71 2agw s ARG 151 CO 0.51 0.38 -0.00 -1.12 -0.81 0.00 0.00 175.30 174.26 2agw s SER 152 N -0.52 2.98 -0.05 -2.12 0.01 0.22 -4.97 113.70 109.24 2agw s SER 152 Ca 0.41 -0.80 -0.17 0.00 1.31 0.00 0.00 55.95 56.70 2agw s SER 152 Cb -0.23 -0.76 -0.05 0.00 0.21 0.00 0.00 66.02 65.19 2agw s SER 152 CO 0.28 -0.26 0.45 -1.81 0.41 0.00 0.00 173.24 172.31 2agw s ASP 153 N 1.73 6.77 0.03 2.44 1.11 -1.26 -0.92 116.67 126.58 2agw s ASP 153 Ca -0.01 0.92 -0.05 0.00 0.18 0.00 0.00 52.55 53.58 2agw s ASP 153 Cb -0.17 -2.28 -0.01 0.00 1.07 0.00 0.00 42.92 41.53 2agw s ASP 153 CO -0.07 0.17 0.09 0.68 1.18 0.00 0.00 175.17 177.21 2agw s VAL 154 N -0.27 0.13 -0.13 -1.27 -7.23 -0.50 -1.45 120.40 109.67 2agw s VAL 154 Ca 0.25 -1.06 -0.06 0.00 -1.81 0.00 0.00 61.98 59.29 2agw s VAL 154 Cb -0.16 -0.83 -0.04 0.00 0.56 0.00 0.00 36.38 35.91 2agw s VAL 154 CO 0.12 -0.59 0.10 -0.69 -0.31 0.00 0.00 175.10 173.74 2agw s VAL 155 N -2.46 5.18 -0.00 1.32 1.01 -0.55 -1.41 120.40 123.48 2agw s VAL 155 Ca -0.06 0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.06 2agw s VAL 155 Cb -0.02 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 2agw s VAL 155 CO -0.04 0.57 -0.15 -1.61 0.00 0.00 0.00 175.10 173.88 2agw s GLU 156 N -0.64 2.34 -0.21 2.72 2.02 0.24 -0.32 118.70 124.85 2agw s GLU 156 Ca 0.12 -0.81 -0.06 0.00 0.02 0.00 0.00 54.97 54.24 2agw s GLU 156 Cb -0.12 -2.32 -0.03 0.00 0.10 0.00 0.00 34.13 31.77 2agw s GLU 156 CO 0.02 0.59 0.01 0.08 0.02 0.00 0.00 175.26 175.98 2agw s VAL 157 N -0.85 4.06 0.06 2.63 1.01 0.14 -1.05 120.40 126.39 2agw s VAL 157 Ca 0.14 -0.27 0.09 0.00 0.00 0.00 0.00 61.98 61.93 2agw s VAL 157 Cb -0.11 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 2agw s VAL 157 CO 0.04 0.42 -0.25 0.26 0.00 0.00 0.00 175.10 175.56 2agw s TRP 158 N 1.07 2.37 0.13 5.22 0.52 0.14 -0.47 118.94 127.92 2agw s TRP 158 Ca 0.03 -0.37 -0.31 0.00 0.02 0.00 0.00 56.10 55.47 2agw s TRP 158 Cb -0.14 -1.38 -0.08 0.00 -1.15 0.00 0.00 33.47 30.72 2agw s TRP 158 CO 0.02 0.19 1.28 0.34 0.02 0.00 0.00 176.95 178.80 2agw s ASP 159 N -1.44 6.96 0.28 2.95 -1.08 0.04 -0.69 116.67 123.70 2agw s ASP 159 Ca 0.13 2.24 0.09 0.00 -0.52 0.00 0.00 52.55 54.49 2agw s ASP 159 Cb -0.10 -2.59 0.40 0.00 -1.46 0.00 0.00 42.92 39.17 2agw s ASP 159 CO 0.03 -0.52 1.65 0.00 0.52 0.00 0.00 175.17 176.85 2agw h ALA 160 N 6.18 1.03 0.06 3.66 0.00 -1.62 -0.10 119.26 128.47 2agw h ALA 160 Ca -0.43 -0.51 -0.33 0.00 0.00 0.00 0.00 54.91 53.65 2agw h ALA 160 Cb 1.21 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 2agw h ALA 160 CO 0.81 0.69 -1.85 -0.25 0.00 0.00 0.00 179.25 178.65 2agw n ASP 161 N -3.89 1.46 0.03 0.00 8.00 -1.26 -4.10 116.55 116.79 2agw n ASP 161 Ca -0.02 0.32 0.12 0.00 0.71 0.00 0.00 54.79 55.92 2agw n ASP 161 Cb 0.57 -0.44 0.12 0.00 -0.02 0.00 0.00 41.12 41.35 2agw n ASP 161 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2agw n LYS 162 N -3.25 0.19 -3.88 -1.24 4.76 -1.24 -0.48 118.16 113.02 2agw n LYS 162 Ca -0.24 0.02 -0.27 0.00 -2.87 0.00 0.00 58.31 54.96 2agw n LYS 162 Cb 1.05 -1.59 0.01 0.00 -1.84 0.00 0.00 35.03 32.67 2agw n LYS 162 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2agw n LEU 163 N -1.84 -2.58 -4.44 -0.35 4.77 -0.05 -4.89 117.00 107.61 2agw n LEU 163 Ca 0.03 -0.87 -0.29 0.00 -0.03 0.00 0.00 56.01 54.85 2agw n LEU 163 Cb 0.40 -2.47 -0.12 0.00 -2.33 0.00 0.00 43.42 38.90 2agw n LEU 163 CO 0.38 0.42 -0.52 0.42 -1.33 0.00 0.00 177.39 176.75 2agw s THR 164 N -3.59 2.60 0.18 -5.08 -4.23 -1.23 -4.93 115.64 99.36 2agw s THR 164 Ca 0.28 -1.58 -0.30 0.00 -1.18 0.00 0.00 61.69 58.92 2agw s THR 164 Cb -0.14 -2.16 -0.08 0.00 1.34 0.00 0.00 72.50 71.45 2agw s THR 164 CO 0.85 0.12 1.16 0.12 -0.54 0.00 0.00 174.62 176.33 2agw s PHE 165 N -1.09 3.49 -0.05 3.99 5.36 -1.26 -0.78 117.98 127.65 2agw s PHE 165 Ca 0.16 1.50 -0.01 0.00 -0.96 0.00 0.00 56.93 57.62 2agw s PHE 165 Cb -0.10 -3.37 -0.03 0.00 -0.34 0.00 0.00 43.02 39.18 2agw s PHE 165 CO 0.08 -0.95 -0.05 0.39 -1.46 0.00 0.00 175.22 173.22 2agw n GLU 166 N 2.43 0.11 -3.73 10.12 1.02 0.38 -4.89 120.64 126.08 2agw n GLU 166 Ca 0.04 0.04 -0.13 0.00 -0.02 0.00 0.00 57.16 57.08 2agw n GLU 166 Cb 0.45 -0.91 -0.10 0.00 -0.02 0.00 0.00 31.44 30.87 2agw n GLU 166 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2agw s LYS 167 N -2.09 0.54 -0.12 3.49 2.20 -0.99 -4.99 119.74 117.77 2agw s LYS 167 Ca -0.07 0.39 -0.03 0.00 -0.36 0.00 0.00 55.97 55.90 2agw s LYS 167 Cb 0.02 0.26 -0.03 0.00 -1.51 0.00 0.00 37.83 36.56 2agw s LYS 167 CO 0.10 -0.09 0.01 -2.00 -0.36 0.00 0.00 175.35 173.00 2agw s GLU 168 N -0.17 3.33 -0.18 4.03 2.12 -1.26 -0.69 118.70 125.88 2agw s GLU 168 Ca -0.03 -0.41 0.00 0.00 0.36 0.00 0.00 54.97 54.89 2agw s GLU 168 Cb -0.03 -2.91 0.01 0.00 0.26 0.00 0.00 34.13 31.46 2agw s GLU 168 CO 0.02 0.53 -0.17 0.42 -0.54 0.00 0.00 175.26 175.51 2agw s ILE 169 N -0.39 2.35 0.18 -3.70 1.01 0.57 -5.00 121.20 116.21 2agw s ILE 169 Ca 0.08 -0.85 -0.30 0.00 0.00 0.00 0.00 60.65 59.58 2agw s ILE 169 Cb -0.12 -2.00 -0.08 0.00 0.01 0.00 0.00 42.46 40.27 2agw s ILE 169 CO 0.02 0.52 1.10 -0.44 0.00 0.00 0.00 174.94 176.14 2agw s SER 170 N 1.22 7.26 0.23 3.58 0.01 -1.26 -1.48 113.70 123.25 2agw s SER 170 Ca 0.03 2.09 0.10 0.00 1.31 0.00 0.00 55.95 59.48 2agw s SER 170 Cb -0.14 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 2agw s SER 170 CO -0.09 -0.22 -0.09 -0.76 0.41 0.00 0.00 173.24 172.49 2agw s LEU 171 N -0.39 2.94 0.63 2.44 1.43 -0.53 -4.29 118.68 120.92 2agw s LEU 171 Ca 0.49 -0.70 -0.18 0.00 -1.03 0.00 0.00 54.13 52.71 2agw s LEU 171 Cb -0.29 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.37 2agw s LEU 171 CO 0.35 0.06 1.21 -2.16 0.23 0.00 0.00 176.35 176.04 2agw s PRO 172 N -3.23 2.73 -1.32 1.29 0.04 -1.26 -4.37 135.00 128.88 2agw s PRO 172 Ca 0.28 1.80 -0.09 0.00 0.04 0.00 0.00 61.00 63.03 2agw s PRO 172 Cb -0.07 -1.90 -0.09 0.00 0.04 0.00 0.00 34.50 32.47 2agw s PRO 172 CO 0.16 -1.39 2.79 -0.35 0.04 0.00 0.00 177.00 178.25 2agw n PRO 173 N -1.95 3.15 -0.35 0.56 -0.04 -1.26 -3.72 135.00 131.39 2agw n PRO 173 Ca 0.14 -1.91 0.00 0.00 -0.04 0.00 0.00 63.50 61.69 2agw n PRO 173 Cb 0.50 -2.64 0.00 0.00 -0.04 0.00 0.00 33.50 31.32 2agw n PRO 173 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2agw n LYS 174 N 3.64 0.00 -1.84 0.54 2.85 -1.26 -5.02 118.16 117.08 2agw n LYS 174 Ca 0.67 -0.55 -0.38 0.00 -1.05 0.00 0.00 58.31 57.00 2agw n LYS 174 Cb 0.26 -0.33 0.04 0.00 -0.65 0.00 0.00 35.03 34.35 2agw n LYS 174 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 2agw s ARG 175 N 0.00 3.16 0.19 -1.58 1.04 -1.24 -0.70 118.95 119.81 2agw s ARG 175 Ca 0.00 2.16 -0.32 0.00 -1.04 0.00 0.00 55.73 56.53 2agw s ARG 175 Cb 0.00 -2.23 -0.12 0.00 -2.04 0.00 0.00 34.95 30.56 2agw s ARG 175 CO 0.00 -1.15 1.75 1.55 -0.04 0.00 0.00 175.30 177.40 2agw n VAL 176 N -1.05 0.09 -3.75 4.99 3.14 -0.37 -4.61 118.33 116.76 2agw n VAL 176 Ca 0.10 -0.02 -0.37 0.00 -2.96 0.00 0.00 64.34 61.10 2agw n VAL 176 Cb 0.46 -2.00 -0.12 0.00 -1.06 0.00 0.00 33.84 31.11 2agw n VAL 176 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2agw s GLN 177 N 1.53 3.13 0.00 1.45 -0.21 -1.26 -5.02 119.66 119.27 2agw s GLN 177 Ca 0.77 -0.83 0.00 0.00 0.02 0.00 0.00 55.36 55.31 2agw s GLN 177 Cb -0.51 -3.39 0.00 0.00 1.00 0.00 0.00 33.01 30.11 2agw s GLN 177 CO 0.34 -0.44 0.00 0.41 -2.12 0.00 0.00 175.29 173.48 2agw n GLY 178 N 4.88 0.38 3.74 3.09 0.00 -1.26 -5.14 105.19 110.88 2agw n GLY 178 Ca -0.14 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.62 2agw n GLY 178 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2agw s LEU 179 N 0.00 3.10 -1.51 0.99 0.05 -1.26 -4.86 118.68 115.19 2agw s LEU 179 Ca 0.00 2.00 -0.11 0.00 0.05 0.00 0.00 54.13 56.07 2agw s LEU 179 Cb 0.00 -4.55 -0.00 0.00 -2.05 0.00 0.00 46.19 39.59 2agw s LEU 179 CO 0.00 -2.22 2.54 0.59 -0.55 0.00 0.00 176.35 176.71 2agw n ASN 180 N -3.36 6.45 -4.77 1.48 3.02 -1.26 -4.95 115.26 111.87 2agw n ASN 180 Ca 0.10 -2.77 -0.39 0.00 -0.03 0.00 0.00 54.58 51.50 2agw n ASN 180 Cb 0.52 -1.58 -0.02 0.00 -0.61 0.00 0.00 39.78 38.10 2agw n ASN 180 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2agw s TYR 181 N 2.18 3.02 0.28 3.10 1.51 -1.26 -4.52 117.35 121.66 2agw s TYR 181 Ca 0.57 1.50 -0.01 0.00 -1.01 0.00 0.00 57.07 58.13 2agw s TYR 181 Cb 0.16 -3.51 0.47 0.00 -0.11 0.00 0.00 41.96 38.97 2agw s TYR 181 CO -0.07 -1.57 1.88 -0.44 -1.11 0.00 0.00 175.55 174.24 2agw h ASP 182 N 2.83 0.98 0.00 2.29 3.32 -1.93 -2.77 116.42 121.15 2agw h ASP 182 Ca -0.49 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2agw h ASP 182 Cb 1.24 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.59 2agw h ASP 182 CO 0.63 0.61 0.00 0.61 -1.72 0.00 0.00 179.24 179.37 2agw n GLY 183 N -1.37 -0.68 0.08 2.75 0.00 -1.26 -2.64 105.19 102.07 2agw n GLY 183 Ca 0.16 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.20 2agw n GLY 183 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2agw h LEU 184 N 0.00 0.00 -6.30 0.99 3.38 -1.79 0.26 115.31 111.85 2agw h LEU 184 Ca 0.00 -0.17 -0.19 0.00 0.09 0.00 0.00 57.88 57.61 2agw h LEU 184 Cb 0.00 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 40.47 2agw h LEU 184 CO 0.00 0.08 -0.54 0.12 0.09 0.00 0.00 178.44 178.19 2agw s PHE 185 N -3.22 -1.00 0.08 1.13 5.36 -1.08 -1.65 117.98 117.59 2agw s PHE 185 Ca 0.04 0.26 0.01 0.00 -0.96 0.00 0.00 56.93 56.28 2agw s PHE 185 Cb 0.12 -0.15 -0.00 0.00 -0.34 0.00 0.00 43.02 42.65 2agw s PHE 185 CO 0.75 -0.99 0.03 0.54 -1.46 0.00 0.00 175.22 174.08 2agw n ARG 186 N 5.27 0.75 -3.81 10.12 5.12 0.10 -4.84 116.66 129.37 2agw n ARG 186 Ca 0.02 -0.67 -0.10 0.00 -1.93 0.00 0.00 57.85 55.17 2agw n ARG 186 Cb 0.49 0.39 -0.07 0.00 -1.16 0.00 0.00 32.46 32.12 2agw n ARG 186 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 2agw s GLN 187 N -2.30 0.85 0.78 5.56 -2.07 -1.26 -0.85 119.66 120.38 2agw s GLN 187 Ca 0.05 -0.83 -0.11 0.00 -1.82 0.00 0.00 55.36 52.65 2agw s GLN 187 Cb 0.00 0.36 0.07 0.00 -1.09 0.00 0.00 33.01 32.34 2agw s GLN 187 CO 0.03 -0.28 1.11 0.95 -1.32 0.00 0.00 175.29 175.78 2agw s THR 188 N -3.53 2.99 0.30 3.63 -4.23 -0.12 -4.81 115.64 109.87 2agw s THR 188 Ca 0.02 0.35 0.02 0.00 -1.18 0.00 0.00 61.69 60.90 2agw s THR 188 Cb 0.03 -2.75 0.29 0.00 1.34 0.00 0.00 72.50 71.41 2agw s THR 188 CO -0.09 -0.40 1.86 0.74 -0.54 0.00 0.00 174.62 176.19 2agw h THR 189 N -1.09 0.95 0.00 3.99 2.02 -1.70 -0.55 112.91 116.53 2agw h THR 189 Ca -0.44 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 66.41 2agw h THR 189 Cb 1.24 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2agw h THR 189 CO 0.50 0.18 0.00 -0.90 0.37 0.00 0.00 175.52 175.66 2agw n ASP 190 N -4.57 0.00 0.00 4.18 5.68 -0.53 -4.89 116.55 116.42 2agw n ASP 190 Ca 0.17 -0.35 0.00 0.00 -0.50 0.00 0.00 54.79 54.11 2agw n ASP 190 Cb 0.33 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 2agw n ASP 190 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2agw n GLY 191 N 0.66 0.57 0.14 6.12 0.00 -0.22 -4.88 105.19 107.58 2agw n GLY 191 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2agw n GLY 191 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2agw h LYS 192 N 1.57 0.00 -4.50 1.61 1.57 -1.90 -3.46 116.57 111.46 2agw h LYS 192 Ca 0.00 0.00 -0.42 0.00 -1.87 0.00 0.00 60.65 58.36 2agw h LYS 192 Cb 0.11 0.00 -0.31 0.00 0.08 0.00 0.00 32.23 32.11 2agw h LYS 192 CO 0.00 0.00 -0.78 -0.06 -0.57 0.00 0.00 179.45 178.04 2agw s PHE 193 N -3.26 0.89 -0.01 -1.35 0.40 -1.26 -2.18 117.98 111.21 2agw s PHE 193 Ca 0.04 -0.22 -0.17 0.00 -0.60 0.00 0.00 56.93 55.98 2agw s PHE 193 Cb 0.09 -0.64 -0.06 0.00 0.51 0.00 0.00 43.02 42.92 2agw s PHE 193 CO 0.73 -0.10 0.48 0.42 0.70 0.00 0.00 175.22 177.45 2agw s ILE 194 N 0.24 4.98 -0.16 0.64 1.01 0.18 -0.94 121.20 127.15 2agw s ILE 194 Ca -0.04 1.00 0.00 0.00 0.00 0.00 0.00 60.65 61.62 2agw s ILE 194 Cb -0.09 -3.81 0.04 0.00 0.01 0.00 0.00 42.46 38.61 2agw s ILE 194 CO 0.00 0.50 -0.09 -0.69 0.00 0.00 0.00 174.94 174.67 2agw s VAL 195 N -0.61 1.32 0.10 2.92 1.01 -0.03 -0.79 120.40 124.32 2agw s VAL 195 Ca 0.26 -0.67 0.05 0.00 0.00 0.00 0.00 61.98 61.63 2agw s VAL 195 Cb -0.17 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 2agw s VAL 195 CO 0.14 0.24 -0.13 -1.48 0.00 0.00 0.00 175.10 173.87 2agw s LEU 196 N 1.56 2.37 -0.05 3.92 0.05 -0.32 -0.72 118.68 125.49 2agw s LEU 196 Ca 0.02 -0.76 -0.20 0.00 0.05 0.00 0.00 54.13 53.24 2agw s LEU 196 Cb -0.15 -0.50 -0.05 0.00 -2.05 0.00 0.00 46.19 43.45 2agw s LEU 196 CO -0.08 -0.15 0.55 -1.58 -0.55 0.00 0.00 176.35 174.54 2agw s GLN 197 N -2.46 4.31 0.16 1.48 2.00 -0.66 -0.59 119.66 123.90 2agw s GLN 197 Ca 0.06 0.62 0.06 0.00 -2.00 0.00 0.00 55.36 54.09 2agw s GLN 197 Cb -0.06 -3.38 -0.04 0.00 0.80 0.00 0.00 33.01 30.33 2agw s GLN 197 CO 0.02 0.28 0.06 -0.80 -0.50 0.00 0.00 175.29 174.35 2agw s ASN 198 N 0.16 5.13 -0.19 6.67 0.01 0.05 -1.24 114.94 125.54 2agw s ASN 198 Ca 0.29 -0.25 -0.09 0.00 -0.71 0.00 0.00 52.86 52.11 2agw s ASN 198 Cb -0.17 -1.23 0.07 0.00 0.41 0.00 0.00 41.25 40.34 2agw s ASN 198 CO 0.14 0.09 0.43 0.00 -1.51 0.00 0.00 177.10 176.26 2agw s ALA 199 N -1.68 -1.14 -0.25 0.60 0.00 0.12 -3.04 121.76 116.37 2agw s ALA 199 Ca 0.29 1.57 0.03 0.00 0.00 0.00 0.00 51.96 53.85 2agw s ALA 199 Cb -0.10 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.88 2agw s ALA 199 CO 0.21 -0.48 0.29 -1.13 0.00 0.00 0.00 175.76 174.64 2agw n SER 200 N 4.75 0.51 -0.32 0.00 3.41 -1.26 -4.69 113.62 116.02 2agw n SER 200 Ca -0.17 -0.76 0.13 0.00 -0.26 0.00 0.00 58.87 57.81 2agw n SER 200 Cb 0.53 0.69 0.29 0.00 -0.26 0.00 0.00 64.21 65.46 2agw n SER 200 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2agw n PRO 201 N -0.67 0.97 -1.70 4.33 -0.04 -1.26 -5.10 135.00 131.52 2agw n PRO 201 Ca 0.01 -0.64 -0.43 0.00 -0.04 0.00 0.00 63.50 62.41 2agw n PRO 201 Cb 0.06 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.03 2agw n PRO 201 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2agw n ALA 202 N -0.46 1.37 -2.79 0.55 0.00 -1.26 -4.95 120.51 112.96 2agw n ALA 202 Ca 0.12 0.36 -0.34 0.00 0.00 0.00 0.00 53.44 53.58 2agw n ALA 202 Cb 0.38 -2.27 -0.05 0.00 0.00 0.00 0.00 19.45 17.51 2agw n ALA 202 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2agw s THR 203 N -1.04 5.33 0.21 0.00 -4.23 -1.26 -4.09 115.64 110.56 2agw s THR 203 Ca 0.56 0.08 -0.17 0.00 -1.18 0.00 0.00 61.69 60.97 2agw s THR 203 Cb -0.57 -3.56 0.02 0.00 1.34 0.00 0.00 72.50 69.73 2agw s THR 203 CO 0.62 0.33 0.54 -0.94 -0.54 0.00 0.00 174.62 174.63 2agw s SER 204 N -1.81 -0.23 -0.15 3.99 1.04 -1.17 -3.38 113.70 111.99 2agw s SER 204 Ca 0.28 -0.58 -0.04 0.00 0.48 0.00 0.00 55.95 56.10 2agw s SER 204 Cb -0.13 0.60 -0.03 0.00 0.10 0.00 0.00 66.02 66.56 2agw s SER 204 CO 0.17 -1.10 -0.03 -0.63 0.98 0.00 0.00 173.24 172.63 2agw s ILE 205 N -3.91 3.95 -0.03 -1.02 1.01 -1.14 -0.77 121.20 119.29 2agw s ILE 205 Ca 0.12 -0.34 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 2agw s ILE 205 Cb -0.01 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 2agw s ILE 205 CO 0.00 0.50 0.10 -0.83 0.00 0.00 0.00 174.94 174.71 2agw s GLY 206 N 0.27 2.05 -0.14 6.18 0.00 0.24 0.16 107.32 116.08 2agw s GLY 206 Ca -0.03 -0.81 0.02 0.00 0.00 0.00 0.00 44.72 43.91 2agw s GLY 206 CO 0.03 -0.65 -0.21 -0.42 0.00 0.00 0.00 173.10 171.85 2agw s ILE 207 N -1.15 1.98 -0.17 0.90 -1.09 -0.45 -1.17 121.20 120.04 2agw s ILE 207 Ca 0.21 -0.93 -0.03 0.00 -2.23 0.00 0.00 60.65 57.67 2agw s ILE 207 Cb -0.12 -1.76 -0.02 0.00 -1.58 0.00 0.00 42.46 38.98 2agw s ILE 207 CO 0.12 0.53 -0.05 -0.69 -1.23 0.00 0.00 174.94 173.62 2agw s VAL 208 N 0.86 3.63 -0.42 2.92 1.01 0.03 -0.58 120.40 127.85 2agw s VAL 208 Ca -0.06 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.23 2agw s VAL 208 Cb -0.15 -2.60 0.02 0.00 0.00 0.00 0.00 36.38 33.65 2agw s VAL 208 CO -0.02 0.47 0.85 -0.62 0.00 0.00 0.00 175.10 175.78 2agw s ASP 209 N 0.70 6.52 0.08 3.32 -1.08 0.18 -0.65 116.67 125.75 2agw s ASP 209 Ca -0.03 0.20 -0.21 0.00 -0.52 0.00 0.00 52.55 52.00 2agw s ASP 209 Cb -0.15 -2.42 -0.10 0.00 -1.46 0.00 0.00 42.92 38.79 2agw s ASP 209 CO 0.02 -0.89 1.61 0.58 0.52 0.00 0.00 175.17 177.01 2agw h VAL 210 N 5.92 1.17 -0.33 1.11 2.07 -1.74 0.54 116.25 124.99 2agw h VAL 210 Ca -0.24 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 66.78 2agw h VAL 210 Cb 1.08 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 2agw h VAL 210 CO 0.97 0.16 0.19 0.00 0.02 0.00 0.00 177.57 178.91 2agw h ALA 211 N 0.89 0.41 0.00 1.67 0.00 -1.93 -2.55 119.26 117.75 2agw h ALA 211 Ca 0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2agw h ALA 211 Cb 0.19 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2agw h ALA 211 CO -0.00 -0.16 -0.10 0.87 0.00 0.00 0.00 179.25 179.86 2agw h LYS 212 N 0.40 0.00 -3.04 0.00 1.57 -1.94 -3.48 116.57 110.09 2agw h LYS 212 Ca 0.13 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.67 2agw h LYS 212 Cb -0.01 0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.35 2agw h LYS 212 CO -0.06 0.10 -0.36 0.41 -0.57 0.00 0.00 179.45 178.97 2agw n GLY 213 N 0.83 0.00 3.04 3.86 0.00 0.15 -5.03 105.19 108.05 2agw n GLY 213 Ca 0.03 -0.22 -0.15 0.00 0.00 0.00 0.00 46.02 45.67 2agw n GLY 213 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2agw s ASP 214 N -2.91 0.88 -0.29 1.61 1.01 -1.05 -4.68 116.67 111.24 2agw s ASP 214 Ca 0.21 -0.37 -0.29 0.00 0.71 0.00 0.00 52.55 52.81 2agw s ASP 214 Cb -0.09 -0.02 0.01 0.00 1.01 0.00 0.00 42.92 43.82 2agw s ASP 214 CO 0.27 -0.08 1.15 -0.47 0.21 0.00 0.00 175.17 176.24 2agw s TYR 215 N -0.86 3.03 -0.17 4.23 5.04 -1.26 -0.65 117.35 126.71 2agw s TYR 215 Ca -0.04 1.13 0.05 0.00 -2.44 0.00 0.00 57.07 55.77 2agw s TYR 215 Cb -0.07 -3.67 -0.06 0.00 0.35 0.00 0.00 41.96 38.51 2agw s TYR 215 CO 0.00 -1.06 0.18 1.33 -1.34 0.00 0.00 175.55 174.67 2agw n VAL 216 N 5.83 0.00 -3.63 3.14 0.24 0.25 -4.97 118.33 119.20 2agw n VAL 216 Ca 0.13 -0.31 -0.15 0.00 -2.04 0.00 0.00 64.34 61.97 2agw n VAL 216 Cb 0.47 0.84 -0.07 0.00 -1.47 0.00 0.00 33.84 33.60 2agw n VAL 216 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2agw s GLU 217 N -1.70 0.82 -0.23 7.34 2.56 -1.20 -4.78 118.70 121.52 2agw s GLU 217 Ca 0.01 0.66 -0.00 0.00 0.00 0.00 0.00 54.97 55.64 2agw s GLU 217 Cb 0.04 0.40 0.06 0.00 2.00 0.00 0.00 34.13 36.62 2agw s GLU 217 CO 0.21 -0.16 -0.03 0.34 -0.56 0.00 0.00 175.26 175.06 2agw s ASP 218 N -0.16 3.65 -1.10 -1.70 -1.08 -1.26 -1.34 116.67 113.69 2agw s ASP 218 Ca -0.04 -1.11 -0.17 0.00 -0.52 0.00 0.00 52.55 50.71 2agw s ASP 218 Cb -0.03 -1.05 0.12 0.00 -1.46 0.00 0.00 42.92 40.50 2agw s ASP 218 CO 0.03 -0.25 1.38 -0.69 0.52 0.00 0.00 175.17 176.16 2agw s VAL 219 N 1.49 4.62 -0.36 1.11 1.01 0.12 -4.81 120.40 123.59 2agw s VAL 219 Ca -0.05 -1.89 0.26 0.00 0.00 0.00 0.00 61.98 60.30 2agw s VAL 219 Cb -0.18 -4.94 0.29 0.00 0.00 0.00 0.00 36.38 31.55 2agw s VAL 219 CO -0.07 -1.70 1.78 0.71 0.00 0.00 0.00 175.10 175.83 2agw h THR 220 N 5.52 0.00 0.00 3.92 1.35 -1.90 -2.78 112.91 119.02 2agw h THR 220 Ca 0.27 -0.32 -0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2agw h THR 220 Cb 0.94 1.14 -0.00 0.00 -1.73 0.00 0.00 68.15 68.50 2agw h THR 220 CO 1.26 0.00 -0.00 0.00 -0.25 0.00 0.00 175.52 176.53 2agw h ALA 221 N 2.22 1.24 -0.20 6.62 0.00 -1.93 -1.44 119.26 125.77 2agw h ALA 221 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2agw h ALA 221 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2agw h ALA 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2agw n ALA 222 N -2.19 2.49 -1.66 0.00 0.00 -1.06 -4.92 120.51 113.17 2agw n ALA 222 Ca -0.03 -0.36 -0.45 0.00 0.00 0.00 0.00 53.44 52.61 2agw n ALA 222 Cb 0.08 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.52 2agw n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2agw n ALA 223 N 0.09 0.94 -0.97 0.00 0.00 -0.55 -1.03 120.51 118.99 2agw n ALA 223 Ca 0.07 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2agw n ALA 223 Cb 0.19 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.39 2agw n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2agw n GLY 224 N 1.92 0.80 3.81 0.00 0.00 -1.26 -4.95 105.19 105.50 2agw n GLY 224 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 2agw n GLY 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2agw s TRP 226 N -2.63 -0.76 0.00 0.00 -0.11 0.21 -4.87 118.94 110.79 2agw s TRP 226 Ca 0.39 1.59 0.00 0.00 1.22 0.00 0.00 56.10 59.30 2agw s TRP 226 Cb 0.01 0.39 0.00 0.00 -1.50 0.00 0.00 33.47 32.37 2agw s TRP 226 CO 0.22 -0.40 0.00 -1.13 -4.62 0.00 0.00 176.95 171.02 2agw n SER 227 N 4.21 0.00 -4.13 5.86 3.41 -1.26 -2.85 113.62 118.87 2agw n SER 227 Ca -0.22 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.07 2agw n SER 227 Cb 0.57 0.03 -0.16 0.00 -0.26 0.00 0.00 64.21 64.39 2agw n SER 227 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2agw s VAL 228 N -3.03 1.98 -0.36 -3.33 1.01 0.91 -4.14 120.40 113.44 2agw s VAL 228 Ca 0.00 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.08 2agw s VAL 228 Cb 0.00 -1.78 0.10 0.00 0.00 0.00 0.00 36.38 34.70 2agw s VAL 228 CO 0.00 0.53 0.09 -0.63 0.00 0.00 0.00 175.10 175.09 2agw s ILE 229 N 1.11 2.69 0.44 2.22 1.09 0.68 -4.47 121.20 124.96 2agw s ILE 229 Ca -0.00 -2.14 -0.25 0.00 -1.10 0.00 0.00 60.65 57.16 2agw s ILE 229 Cb -0.14 -2.88 -0.08 0.00 -1.06 0.00 0.00 42.46 38.30 2agw s ILE 229 CO -0.08 -0.57 1.28 -2.84 -0.10 0.00 0.00 174.94 172.63 2agw s PRO 230 N 1.02 3.80 -0.45 2.79 0.02 -1.26 -0.78 135.00 140.14 2agw s PRO 230 Ca 0.08 2.08 -0.23 0.00 0.02 0.00 0.00 61.00 62.95 2agw s PRO 230 Cb -0.20 -2.60 0.03 0.00 0.02 0.00 0.00 34.50 31.74 2agw s PRO 230 CO -0.06 -0.61 0.78 -0.65 -0.33 0.00 0.00 177.00 176.13 2agw s GLN 231 N -2.44 3.41 0.00 5.54 -0.21 -0.51 -4.89 119.66 120.56 2agw s GLN 231 Ca 0.61 -0.10 0.12 0.00 0.02 0.00 0.00 55.36 56.00 2agw s GLN 231 Cb -0.36 -3.94 0.54 0.00 1.00 0.00 0.00 33.01 30.25 2agw s GLN 231 CO 0.46 -1.11 1.37 -2.30 -2.12 0.00 0.00 175.29 171.59 2agw n PRO 232 N 6.70 0.04 -0.10 2.91 -0.02 -1.25 -2.56 135.00 140.72 2agw n PRO 232 Ca 0.02 0.26 0.12 0.00 -2.02 0.00 0.00 63.50 61.89 2agw n PRO 232 Cb 0.48 -1.50 0.23 0.00 -0.02 0.00 0.00 33.50 32.69 2agw n PRO 232 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2agw n ASN 233 N -1.45 2.89 -4.05 2.55 6.94 -1.05 -4.92 115.26 116.17 2agw n ASN 233 Ca 0.04 -1.91 -0.13 0.00 -0.02 0.00 0.00 54.58 52.56 2agw n ASN 233 Cb 0.13 -0.13 -0.11 0.00 -2.36 0.00 0.00 39.78 37.31 2agw n ASN 233 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2agw s ARG 234 N -1.74 0.50 0.28 -3.83 0.52 -1.06 -5.08 118.95 108.54 2agw s ARG 234 Ca 0.34 -0.72 0.06 0.00 -0.52 0.00 0.00 55.73 54.89 2agw s ARG 234 Cb 0.21 -0.25 0.42 0.00 0.52 0.00 0.00 34.95 35.85 2agw s ARG 234 CO 0.31 0.04 1.68 -1.00 0.02 0.00 0.00 175.30 176.34 2agw h PRO 235 N 4.57 0.23 -0.47 3.54 0.13 -1.91 -3.38 132.00 134.71 2agw h PRO 235 Ca -0.35 -0.12 -0.26 0.00 -0.87 0.00 0.00 66.00 64.40 2agw h PRO 235 Cb 1.20 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.02 2agw h PRO 235 CO 0.41 0.64 -0.86 0.54 -0.23 0.00 0.00 178.00 178.50 2agw n ARG 236 N -4.00 1.38 -4.64 0.86 1.74 -1.26 -1.45 116.66 109.29 2agw n ARG 236 Ca -0.02 -2.73 -0.27 0.00 -0.77 0.00 0.00 57.85 54.07 2agw n ARG 236 Cb 0.50 -0.86 -0.14 0.00 -1.02 0.00 0.00 32.46 30.95 2agw n ARG 236 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2agw s SER 237 N -2.65 2.68 0.17 0.55 0.01 -1.26 -0.59 113.70 112.61 2agw s SER 237 Ca 0.23 -0.57 -0.15 0.00 1.31 0.00 0.00 55.95 56.77 2agw s SER 237 Cb 0.40 -0.22 0.02 0.00 0.21 0.00 0.00 66.02 66.44 2agw s SER 237 CO -0.04 0.17 0.44 0.72 0.41 0.00 0.00 173.24 174.95 2agw s PHE 238 N -0.86 -0.03 0.23 2.43 -0.12 -0.47 -1.43 117.98 117.72 2agw s PHE 238 Ca 0.09 -0.31 0.10 0.00 -0.05 0.00 0.00 56.93 56.75 2agw s PHE 238 Cb -0.09 0.27 -0.05 0.00 -0.63 0.00 0.00 43.02 42.52 2agw s PHE 238 CO 0.02 -0.82 -0.18 -1.64 -0.05 0.00 0.00 175.22 172.55 2agw s MET 239 N -3.88 1.47 0.03 1.99 -1.94 0.04 -0.64 119.30 116.38 2agw s MET 239 Ca 0.09 -1.63 -0.00 0.00 -1.71 0.00 0.00 55.69 52.44 2agw s MET 239 Cb 0.01 -1.46 -0.03 0.00 2.01 0.00 0.00 34.83 35.36 2agw s MET 239 CO -0.05 0.27 -0.03 -0.08 -0.01 0.00 0.00 175.02 175.12 2agw s THR 240 N -2.56 0.15 -0.18 2.05 -1.32 0.08 -0.23 115.64 113.63 2agw s THR 240 Ca 0.24 -1.19 -0.16 0.00 -1.21 0.00 0.00 61.69 59.37 2agw s THR 240 Cb -0.04 -0.66 -0.04 0.00 -1.51 0.00 0.00 72.50 70.26 2agw s THR 240 CO 0.10 -0.65 0.41 -0.63 -2.21 0.00 0.00 174.62 171.64 2agw s ILE 241 N -2.22 5.20 0.31 5.08 1.01 -1.13 -1.20 121.20 128.25 2agw s ILE 241 Ca -0.09 0.76 0.08 0.00 0.00 0.00 0.00 60.65 61.40 2agw s ILE 241 Cb -0.04 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 2agw s ILE 241 CO -0.04 0.28 0.13 0.00 0.00 0.00 0.00 174.94 175.32 2agw n GLY 243 N -1.12 -0.95 0.17 0.00 0.00 -0.69 -1.41 105.19 101.18 2agw n GLY 243 Ca -0.04 0.03 0.15 0.00 0.00 0.00 0.00 46.02 46.16 2agw n GLY 243 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2agw n ASP 244 N -1.81 0.53 0.00 1.61 5.75 -1.26 -4.89 116.55 116.47 2agw n ASP 244 Ca 0.02 -1.15 0.00 0.00 -0.01 0.00 0.00 54.79 53.65 2agw n ASP 244 Cb 0.13 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 2agw n ASP 244 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2agw n GLY 245 N 1.07 0.50 2.79 6.12 0.00 -0.50 -4.80 105.19 110.37 2agw n GLY 245 Ca 0.22 -0.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 2agw n GLY 245 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2agw n GLY 246 N -2.97 2.90 3.36 -0.02 0.00 -1.25 -0.24 105.19 106.96 2agw n GLY 246 Ca 0.00 -2.27 -0.32 0.00 0.00 0.00 0.00 46.02 43.43 2agw n GLY 246 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2agw s LEU 247 N 0.00 2.48 -0.24 0.99 1.43 -1.26 -1.00 118.68 121.08 2agw s LEU 247 Ca 0.21 -0.36 -0.11 0.00 -1.03 0.00 0.00 54.13 52.84 2agw s LEU 247 Cb -0.02 -1.51 -0.05 0.00 0.03 0.00 0.00 46.19 44.65 2agw s LEU 247 CO 0.13 0.24 0.18 -0.22 0.23 0.00 0.00 176.35 176.92 2agw s LEU 248 N -0.13 4.12 -0.18 1.79 2.96 -0.34 -1.06 118.68 125.83 2agw s LEU 248 Ca -0.03 0.15 -0.08 0.00 -0.22 0.00 0.00 54.13 53.95 2agw s LEU 248 Cb -0.14 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.37 2agw s LEU 248 CO 0.04 0.05 0.07 -0.89 -1.32 0.00 0.00 176.35 174.30 2agw s THR 249 N 1.09 4.91 -0.12 3.68 2.01 0.32 -0.74 115.64 126.79 2agw s THR 249 Ca 0.09 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.12 2agw s THR 249 Cb -0.14 -3.22 -0.00 0.00 0.01 0.00 0.00 72.50 69.16 2agw s THR 249 CO 0.05 0.46 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.61 2agw s ILE 250 N 0.35 2.39 -0.27 1.82 -1.09 0.19 -1.38 121.20 123.20 2agw s ILE 250 Ca 0.04 -0.89 -0.04 0.00 -2.23 0.00 0.00 60.65 57.52 2agw s ILE 250 Cb -0.12 -1.96 0.02 0.00 -1.58 0.00 0.00 42.46 38.82 2agw s ILE 250 CO -0.00 0.54 0.01 0.20 -1.23 0.00 0.00 174.94 174.46 2agw s ASN 251 N 0.48 4.75 0.19 3.58 0.01 -0.16 -1.37 114.94 122.42 2agw s ASN 251 Ca -0.13 -0.78 -0.21 0.00 -0.71 0.00 0.00 52.86 51.03 2agw s ASN 251 Cb -0.17 -1.78 -0.08 0.00 0.41 0.00 0.00 41.25 39.63 2agw s ASN 251 CO 0.05 -0.16 0.72 -0.76 -1.51 0.00 0.00 177.10 175.44 2agw s LEU 252 N 1.42 4.44 1.11 0.60 1.43 0.24 -0.11 118.68 127.81 2agw s LEU 252 Ca 0.01 1.46 -0.18 0.00 -1.03 0.00 0.00 54.13 54.39 2agw s LEU 252 Cb -0.17 -3.41 0.26 0.00 0.03 0.00 0.00 46.19 42.90 2agw s LEU 252 CO -0.01 0.12 1.23 -0.83 0.23 0.00 0.00 176.35 177.09 2agw s GLY 253 N -1.44 1.70 0.00 -3.19 0.00 0.71 -4.68 107.32 100.42 2agw s GLY 253 Ca 0.39 -1.16 0.17 0.00 0.00 0.00 0.00 44.72 44.12 2agw s GLY 253 CO 0.22 -0.29 1.52 1.18 0.00 0.00 0.00 173.10 175.73 2agw n GLU 254 N -4.35 0.08 0.00 2.90 1.02 -1.26 -1.06 120.64 117.98 2agw n GLU 254 Ca 0.15 0.19 0.13 0.00 -0.02 0.00 0.00 57.16 57.61 2agw n GLU 254 Cb 0.59 -1.50 0.34 0.00 -0.02 0.00 0.00 31.44 30.86 2agw n GLU 254 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2agw n ASP 255 N -1.43 1.92 0.00 1.62 5.68 -1.26 -4.96 116.55 118.11 2agw n ASP 255 Ca 0.05 -1.57 0.00 0.00 -0.50 0.00 0.00 54.79 52.78 2agw n ASP 255 Cb 0.17 0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 2agw n ASP 255 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2agw n GLY 256 N 1.27 1.05 3.88 6.12 0.00 -0.22 -4.98 105.19 112.30 2agw n GLY 256 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2agw n GLY 256 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2agw s LYS 257 N -0.12 3.79 0.06 1.61 1.02 -1.26 -4.61 119.74 120.22 2agw s LYS 257 Ca 0.00 0.42 -0.30 0.00 0.02 0.00 0.00 55.97 56.11 2agw s LYS 257 Cb 0.00 -2.44 -0.09 0.00 -0.52 0.00 0.00 37.83 34.78 2agw s LYS 257 CO 0.00 0.03 1.91 0.08 -0.92 0.00 0.00 175.35 176.45 2agw s VAL 258 N -2.27 2.91 -0.09 3.17 1.01 -1.26 -0.21 120.40 123.67 2agw s VAL 258 Ca 0.50 0.07 0.11 0.00 0.00 0.00 0.00 61.98 62.67 2agw s VAL 258 Cb -0.10 -3.05 -0.24 0.00 0.00 0.00 0.00 36.38 32.99 2agw s VAL 258 CO 0.29 -0.00 0.50 0.00 0.00 0.00 0.00 175.10 175.88 2agw n ALA 259 N 6.97 1.43 -3.66 5.51 0.00 0.84 -4.74 120.51 126.87 2agw n ALA 259 Ca 0.19 -0.87 -0.05 0.00 0.00 0.00 0.00 53.44 52.71 2agw n ALA 259 Cb 0.40 -0.69 -0.02 0.00 0.00 0.00 0.00 19.45 19.15 2agw n ALA 259 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2agw s SER 260 N -6.08 -0.23 0.16 0.00 1.04 -1.00 -4.98 113.70 102.59 2agw s SER 260 Ca -0.08 -0.26 -0.12 0.00 0.48 0.00 0.00 55.95 55.97 2agw s SER 260 Cb 0.07 0.44 0.01 0.00 0.10 0.00 0.00 66.02 66.64 2agw s SER 260 CO 0.81 -0.78 0.35 0.00 0.98 0.00 0.00 173.24 174.60 2agw s GLN 261 N -3.19 1.15 0.05 4.02 -2.07 -1.26 -0.98 119.66 117.37 2agw s GLN 261 Ca 0.10 -1.00 -0.20 0.00 -1.82 0.00 0.00 55.36 52.43 2agw s GLN 261 Cb -0.01 0.42 0.04 0.00 -1.09 0.00 0.00 33.01 32.38 2agw s GLN 261 CO -0.02 -0.44 0.47 -1.54 -1.32 0.00 0.00 175.29 172.44 2agw s SER 262 N -2.91 -0.37 -0.09 12.60 1.04 -0.48 -4.99 113.70 118.50 2agw s SER 262 Ca 0.11 0.09 0.03 0.00 0.48 0.00 0.00 55.95 56.66 2agw s SER 262 Cb 0.02 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.60 2agw s SER 262 CO -0.04 -0.70 -0.20 -0.13 0.98 0.00 0.00 173.24 173.15 2agw s ARG 263 N -2.50 2.96 0.86 4.02 1.81 -1.26 -0.52 118.95 124.32 2agw s ARG 263 Ca -0.05 -0.80 -0.12 0.00 -1.72 0.00 0.00 55.73 53.04 2agw s ARG 263 Cb -0.01 -2.38 0.11 0.00 -0.45 0.00 0.00 34.95 32.22 2agw s ARG 263 CO -0.02 0.30 1.14 -1.54 -0.68 0.00 0.00 175.30 174.50 2agw s SER 264 N 0.08 3.99 0.97 0.23 1.04 -0.22 -4.97 113.70 114.81 2agw s SER 264 Ca -0.09 0.95 -0.12 0.00 0.48 0.00 0.00 55.95 57.17 2agw s SER 264 Cb -0.15 -1.52 0.17 0.00 0.10 0.00 0.00 66.02 64.62 2agw s SER 264 CO 0.06 -2.25 1.08 -0.54 0.98 0.00 0.00 173.24 172.57 2agw s LYS 265 N -5.36 0.61 0.17 4.02 1.02 -1.26 -4.58 119.74 114.35 2agw s LYS 265 Ca 0.63 0.88 -0.32 0.00 0.02 0.00 0.00 55.97 57.18 2agw s LYS 265 Cb -0.13 -1.73 -0.12 0.00 -0.52 0.00 0.00 37.83 35.32 2agw s LYS 265 CO 0.52 -2.70 1.72 0.94 -0.92 0.00 0.00 175.35 174.91 2agw n GLN 266 N -4.21 2.60 -0.09 1.68 7.27 -1.26 -4.51 117.38 118.85 2agw n GLN 266 Ca 0.06 0.94 -0.23 0.00 0.07 0.00 0.00 57.00 57.84 2agw n GLN 266 Cb 0.55 -2.78 -0.12 0.00 2.41 0.00 0.00 30.24 30.30 2agw n GLN 266 CO 0.00 0.00 0.00 -0.12 0.07 0.00 0.00 177.06 177.01 2agw n MET 267 N 4.27 0.63 -4.14 3.69 0.00 0.67 -4.93 117.12 117.31 2agw n MET 267 Ca 0.17 0.35 -0.12 0.00 -0.00 0.00 0.00 57.70 58.10 2agw n MET 267 Cb 0.34 -1.63 -0.11 0.00 0.00 0.00 0.00 33.22 31.82 2agw n MET 267 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 175.97 175.38 2agw s PHE 268 N -2.47 0.87 -0.32 1.12 -0.12 -0.91 -4.79 117.98 111.35 2agw s PHE 268 Ca -0.31 -0.73 -0.28 0.00 -0.05 0.00 0.00 56.93 55.56 2agw s PHE 268 Cb 0.09 -0.50 0.02 0.00 -0.63 0.00 0.00 43.02 42.00 2agw s PHE 268 CO 0.61 -0.09 1.04 0.45 -0.05 0.00 0.00 175.22 177.18 2agw s SER 269 N -2.46 6.91 0.22 1.98 0.15 -1.26 -4.39 113.70 114.85 2agw s SER 269 Ca 0.04 1.01 -0.09 0.00 0.70 0.00 0.00 55.95 57.62 2agw s SER 269 Cb -0.01 -2.53 0.20 0.00 -1.71 0.00 0.00 66.02 61.97 2agw s SER 269 CO -0.02 -0.85 1.89 0.58 1.20 0.00 0.00 173.24 176.04 2agw h VAL 270 N 5.71 1.19 0.07 4.45 2.07 -1.89 0.06 116.25 127.92 2agw h VAL 270 Ca -0.21 -0.38 -0.28 0.00 0.82 0.00 0.00 66.70 66.65 2agw h VAL 270 Cb 1.06 -0.01 0.02 0.00 -1.52 0.00 0.00 31.29 30.85 2agw h VAL 270 CO 1.02 0.20 -1.17 0.11 0.02 0.00 0.00 177.57 177.75 2agw h LYS 271 N 1.11 0.63 0.00 1.57 1.79 -1.96 -3.33 116.57 116.37 2agw h LYS 271 Ca 0.31 -0.78 -0.13 0.00 -2.18 0.00 0.00 60.65 57.87 2agw h LYS 271 Cb -0.10 0.24 -0.02 0.00 -1.58 0.00 0.00 32.23 30.77 2agw h LYS 271 CO -0.08 1.34 -1.94 -0.25 -1.08 0.00 0.00 179.45 177.45 2agw n ASP 272 N -3.80 0.20 -2.92 0.86 8.00 -1.16 -4.69 116.55 113.04 2agw n ASP 272 Ca -0.12 0.09 -0.13 0.00 0.71 0.00 0.00 54.79 55.33 2agw n ASP 272 Cb 0.95 1.29 0.03 0.00 -0.02 0.00 0.00 41.12 43.37 2agw n ASP 272 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2agw n ASP 273 N -2.54 -1.26 -4.77 -2.24 2.03 -0.00 -5.01 116.55 102.76 2agw n ASP 273 Ca -0.13 -3.30 -0.41 0.00 0.52 0.00 0.00 54.79 51.47 2agw n ASP 273 Cb 0.78 0.87 0.00 0.00 -0.72 0.00 0.00 41.12 42.06 2agw n ASP 273 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2agw s PRO 274 N -0.57 4.02 0.19 -0.67 0.04 -1.21 -4.48 135.00 132.32 2agw s PRO 274 Ca 0.31 2.48 -0.07 0.00 0.04 0.00 0.00 61.00 63.75 2agw s PRO 274 Cb 0.28 -2.89 -0.06 0.00 0.04 0.00 0.00 34.50 31.87 2agw s PRO 274 CO -0.11 -0.57 0.47 0.96 0.04 0.00 0.00 177.00 177.80 2agw s ILE 275 N -1.15 5.04 0.35 0.56 -4.36 -1.26 -0.91 121.20 119.47 2agw s ILE 275 Ca 0.55 0.25 -0.28 0.00 -0.26 0.00 0.00 60.65 60.91 2agw s ILE 275 Cb -0.45 -3.63 -0.10 0.00 1.25 0.00 0.00 42.46 39.54 2agw s ILE 275 CO 0.60 -0.04 1.25 -0.36 0.24 0.00 0.00 174.94 176.63 2agw s PHE 276 N -1.76 3.08 0.15 1.37 0.40 -0.21 -4.90 117.98 116.11 2agw s PHE 276 Ca 0.44 1.48 0.28 0.00 -0.60 0.00 0.00 56.93 58.53 2agw s PHE 276 Cb -0.12 -3.57 1.14 0.00 0.51 0.00 0.00 43.02 40.98 2agw s PHE 276 CO 0.23 -1.62 1.91 -0.84 0.70 0.00 0.00 175.22 175.60 2agw h ILE 277 N 2.82 0.34 -2.59 0.64 3.07 -1.91 -3.42 117.51 116.47 2agw h ILE 277 Ca -0.49 -0.84 -0.55 0.00 1.55 0.00 0.00 64.86 64.54 2agw h ILE 277 Cb 1.23 1.63 -0.01 0.00 -0.27 0.00 0.00 36.82 39.40 2agw h ILE 277 CO 0.65 0.13 1.12 0.00 -1.05 0.00 0.00 178.15 178.99 2agw s ALA 278 N -3.71 3.55 0.36 0.16 0.00 -1.26 -4.99 121.76 115.88 2agw s ALA 278 Ca 0.00 0.92 -0.16 0.00 0.00 0.00 0.00 51.96 52.72 2agw s ALA 278 Cb 0.10 -3.78 -0.09 0.00 0.00 0.00 0.00 23.12 19.35 2agw s ALA 278 CO 0.60 -1.51 0.79 -1.25 0.00 0.00 0.00 175.76 174.39 2agw s PRO 279 N 4.21 4.04 -0.58 0.00 0.04 -1.26 -4.66 135.00 136.79 2agw s PRO 279 Ca 0.75 0.77 -0.16 0.00 0.04 0.00 0.00 61.00 62.40 2agw s PRO 279 Cb -0.33 -2.36 0.14 0.00 0.04 0.00 0.00 34.50 31.98 2agw s PRO 279 CO 0.31 0.09 0.57 0.00 0.04 0.00 0.00 177.00 178.00 2agw s ALA 280 N -2.07 3.66 -0.25 8.56 0.00 0.42 -4.65 121.76 127.43 2agw s ALA 280 Ca 0.56 -2.58 -0.10 0.00 0.00 0.00 0.00 51.96 49.84 2agw s ALA 280 Cb -0.10 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 2agw s ALA 280 CO 0.17 -2.11 0.14 -1.17 0.00 0.00 0.00 175.76 172.80 2agw s LEU 281 N 1.62 3.92 0.00 0.00 2.96 -1.26 -1.01 118.68 124.91 2agw s LEU 281 Ca 0.06 0.00 0.08 0.00 -0.22 0.00 0.00 54.13 54.05 2agw s LEU 281 Cb -0.27 -2.06 0.08 0.00 0.50 0.00 0.00 46.19 44.44 2agw s LEU 281 CO 0.02 0.01 0.66 -0.67 -1.32 0.00 0.00 176.35 175.05 2agw n ASP 282 N 4.62 2.21 0.08 3.68 -0.08 0.83 -4.76 116.55 123.13 2agw n ASP 282 Ca -0.15 -2.57 0.00 0.00 -1.51 0.00 0.00 54.79 50.56 2agw n ASP 282 Cb 0.52 -0.30 0.31 0.00 2.34 0.00 0.00 41.12 43.99 2agw n ASP 282 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 2agw h LYS 283 N 0.00 0.30 0.00 -0.67 3.64 -1.96 -3.33 116.57 114.55 2agw h LYS 283 Ca -0.28 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 2agw h LYS 283 Cb 1.20 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2agw h LYS 283 CO 0.41 0.50 -0.03 -0.40 -2.27 0.00 0.00 179.45 177.67 2agw n ASP 284 N -4.19 0.53 -3.61 4.20 5.75 -1.26 -2.54 116.55 115.43 2agw n ASP 284 Ca -0.01 -1.34 -0.11 0.00 -0.01 0.00 0.00 54.79 53.33 2agw n ASP 284 Cb 0.34 -0.02 -0.04 0.00 -1.03 0.00 0.00 41.12 40.37 2agw n ASP 284 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2agw s LYS 285 N -0.30 1.21 0.02 0.11 -2.85 -1.25 -0.50 119.74 116.18 2agw s LYS 285 Ca 0.01 -0.69 0.02 0.00 -1.00 0.00 0.00 55.97 54.31 2agw s LYS 285 Cb 0.01 0.51 -0.01 0.00 -2.06 0.00 0.00 37.83 36.28 2agw s LYS 285 CO 0.00 -0.50 -0.07 0.00 0.10 0.00 0.00 175.35 174.88 2agw s ALA 286 N -3.81 0.56 0.10 0.59 0.00 -0.17 -0.12 121.76 118.90 2agw s ALA 286 Ca 0.04 -0.49 0.08 0.00 0.00 0.00 0.00 51.96 51.59 2agw s ALA 286 Cb 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 2agw s ALA 286 CO -0.10 0.07 -0.16 -1.01 0.00 0.00 0.00 175.76 174.56 2agw s HIS 287 N -0.68 2.59 0.01 0.00 0.09 -0.18 -0.87 115.29 116.25 2agw s HIS 287 Ca -0.03 -0.23 0.03 0.00 -0.00 0.00 0.00 55.06 54.83 2agw s HIS 287 Cb -0.06 -1.39 -0.01 0.00 -0.00 0.00 0.00 32.58 31.12 2agw s HIS 287 CO 0.00 0.37 -0.09 -0.06 -0.00 0.00 0.00 174.74 174.97 2agw s PHE 288 N -1.12 0.77 0.16 1.40 0.40 0.25 -0.43 117.98 119.41 2agw s PHE 288 Ca 0.18 -0.22 0.04 0.00 -0.60 0.00 0.00 56.93 56.33 2agw s PHE 288 Cb -0.11 -0.48 -0.04 0.00 0.51 0.00 0.00 43.02 42.91 2agw s PHE 288 CO 0.10 -0.02 0.21 0.14 0.70 0.00 0.00 175.22 176.35 2agw s VAL 289 N -0.46 4.86 0.38 -0.44 -7.23 -1.26 -0.78 120.40 115.46 2agw s VAL 289 Ca 0.01 -0.93 0.08 0.00 -1.81 0.00 0.00 61.98 59.32 2agw s VAL 289 Cb -0.05 -3.50 -0.04 0.00 0.56 0.00 0.00 36.38 33.35 2agw s VAL 289 CO 0.00 -0.12 0.24 -0.94 -0.31 0.00 0.00 175.10 173.97 2agw s SER 290 N -3.22 4.80 0.58 4.85 1.04 0.50 -1.05 113.70 121.20 2agw s SER 290 Ca 0.33 -0.81 0.28 0.00 0.48 0.00 0.00 55.95 56.22 2agw s SER 290 Cb -0.10 -0.65 1.66 0.00 0.10 0.00 0.00 66.02 67.03 2agw s SER 290 CO 0.26 -0.47 2.14 1.88 0.98 0.00 0.00 173.24 178.02 2agw h TYR 291 N 1.32 0.00 -0.55 5.02 0.99 -1.32 -1.22 116.97 121.21 2agw h TYR 291 Ca -0.43 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.30 2agw h TYR 291 Cb 1.26 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.99 2agw h TYR 291 CO 0.58 0.00 0.00 0.66 -0.00 0.00 0.00 178.16 179.40 2agw n TYR 292 N -3.90 0.81 -0.90 4.88 4.02 -1.26 -4.56 117.16 116.25 2agw n TYR 292 Ca 0.00 -0.52 0.00 0.00 -0.01 0.00 0.00 57.90 57.37 2agw n TYR 292 Cb 0.25 -0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.53 2agw n TYR 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2agw n GLY 293 N 1.06 0.73 3.98 2.72 0.00 -0.46 -4.92 105.19 108.29 2agw n GLY 293 Ca 0.19 -0.66 -0.20 0.00 0.00 0.00 0.00 46.02 45.35 2agw n GLY 293 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2agw s ASN 294 N -2.65 5.99 -0.09 1.61 0.01 -1.26 -0.62 114.94 117.93 2agw s ASN 294 Ca 0.00 -0.01 0.03 0.00 -0.71 0.00 0.00 52.86 52.17 2agw s ASN 294 Cb 0.00 -1.41 0.01 0.00 0.41 0.00 0.00 41.25 40.25 2agw s ASN 294 CO 0.00 -0.45 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.25 2agw s VAL 295 N -2.25 1.72 0.11 1.60 1.01 0.10 -0.37 120.40 122.32 2agw s VAL 295 Ca 0.44 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.69 2agw s VAL 295 Cb -0.10 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 2agw s VAL 295 CO 0.33 0.48 -0.16 -0.31 0.00 0.00 0.00 175.10 175.44 2agw s TYR 296 N 0.48 2.59 0.06 5.22 1.51 0.04 -1.92 117.35 125.33 2agw s TYR 296 Ca -0.17 -0.23 0.04 0.00 -1.01 0.00 0.00 57.07 55.70 2agw s TYR 296 Cb -0.17 -1.37 -0.03 0.00 -0.11 0.00 0.00 41.96 40.28 2agw s TYR 296 CO 0.07 0.39 -0.13 -1.12 -1.11 0.00 0.00 175.55 173.66 2agw s SER 297 N -2.14 1.46 -0.13 2.29 0.01 -0.19 -0.59 113.70 114.41 2agw s SER 297 Ca 0.19 -0.58 -0.00 0.00 1.31 0.00 0.00 55.95 56.87 2agw s SER 297 Cb -0.11 -0.04 0.03 0.00 0.21 0.00 0.00 66.02 66.12 2agw s SER 297 CO 0.11 -0.09 -0.07 0.00 0.41 0.00 0.00 173.24 173.60 2agw s ALA 298 N -1.24 1.37 -0.28 1.44 0.00 -0.05 -1.19 121.76 121.80 2agw s ALA 298 Ca -0.03 -0.64 -0.10 0.00 0.00 0.00 0.00 51.96 51.19 2agw s ALA 298 Cb -0.10 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 22.01 2agw s ALA 298 CO 0.02 -0.55 0.15 0.34 0.00 0.00 0.00 175.76 175.72 2agw s ASP 299 N 1.69 5.66 -0.25 0.00 -1.08 0.86 -1.00 116.67 122.54 2agw s ASP 299 Ca 0.03 -0.23 0.09 0.00 -0.52 0.00 0.00 52.55 51.93 2agw s ASP 299 Cb -0.13 -2.04 0.44 0.00 -1.46 0.00 0.00 42.92 39.73 2agw s ASP 299 CO -0.08 -0.10 1.25 2.22 0.52 0.00 0.00 175.17 178.98 2agw n PHE 300 N 5.01 1.04 0.21 -5.34 1.16 0.35 -1.09 117.46 118.80 2agw n PHE 300 Ca -0.14 -1.77 0.05 0.00 -1.87 0.00 0.00 57.45 53.72 2agw n PHE 300 Cb 0.51 -0.33 0.48 0.00 -1.61 0.00 0.00 39.48 38.53 2agw n PHE 300 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 2agw h SER 301 N 1.39 0.00 -0.74 5.98 4.64 -1.84 -3.44 113.55 119.54 2agw h SER 301 Ca 0.15 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.95 2agw h SER 301 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2agw h SER 301 CO 0.31 0.26 -0.17 -0.83 -0.87 0.00 0.00 176.83 175.53 2agw s GLY 302 N -4.25 1.94 0.27 -0.77 0.00 -1.26 -5.02 107.32 98.22 2agw s GLY 302 Ca -0.03 -1.86 0.04 0.00 0.00 0.00 0.00 44.72 42.87 2agw s GLY 302 CO 0.69 -1.76 1.65 -0.55 0.00 0.00 0.00 173.10 173.12 2agw h ASP 303 N 0.37 0.35 -3.45 1.64 3.32 -1.96 -3.40 116.42 113.29 2agw h ASP 303 Ca -0.32 -0.16 -0.60 0.00 0.02 0.00 0.00 57.03 55.97 2agw h ASP 303 Cb 1.29 -0.10 -0.11 0.00 0.22 0.00 0.00 39.33 40.63 2agw h ASP 303 CO 0.46 0.75 -0.23 -1.61 -1.72 0.00 0.00 179.24 176.89 2agw s GLU 304 N -4.11 4.19 0.02 3.56 0.41 -1.26 -4.96 118.70 116.55 2agw s GLU 304 Ca -0.05 0.18 -0.30 0.00 -0.41 0.00 0.00 54.97 54.39 2agw s GLU 304 Cb 0.13 -3.51 -0.04 0.00 -1.78 0.00 0.00 34.13 28.92 2agw s GLU 304 CO 0.79 0.02 1.11 0.08 -0.49 0.00 0.00 175.26 176.76 2agw s VAL 305 N 1.14 4.40 -0.15 2.63 1.01 -1.26 -4.82 120.40 123.34 2agw s VAL 305 Ca 0.19 1.72 -0.06 0.00 0.00 0.00 0.00 61.98 63.83 2agw s VAL 305 Cb -0.14 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2agw s VAL 305 CO 0.07 0.12 0.05 -0.54 0.00 0.00 0.00 175.10 174.81 2agw s LYS 306 N 1.16 3.69 0.13 2.72 1.02 -0.25 -4.66 119.74 123.54 2agw s LYS 306 Ca 0.56 -0.34 0.10 0.00 0.02 0.00 0.00 55.97 56.31 2agw s LYS 306 Cb -0.25 -3.11 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 2agw s LYS 306 CO 0.28 0.43 -0.23 0.14 -0.92 0.00 0.00 175.35 175.05 2agw s VAL 307 N -0.07 2.54 0.28 3.17 -7.23 -1.26 -0.10 120.40 117.73 2agw s VAL 307 Ca 0.06 -1.65 -0.14 0.00 -1.81 0.00 0.00 61.98 58.45 2agw s VAL 307 Cb -0.12 -2.15 0.01 0.00 0.56 0.00 0.00 36.38 34.68 2agw s VAL 307 CO 0.01 0.09 0.57 1.51 -0.31 0.00 0.00 175.10 176.97 2agw s ASP 308 N -2.12 -0.00 0.00 4.85 -4.77 -0.33 -5.00 116.67 109.29 2agw s ASP 308 Ca 0.16 -0.95 0.00 0.00 -3.30 0.00 0.00 52.55 48.46 2agw s ASP 308 Cb -0.10 0.66 0.00 0.00 -1.09 0.00 0.00 42.92 42.39 2agw s ASP 308 CO 0.08 -1.27 0.00 0.61 0.70 0.00 0.00 175.17 175.29 2agw n GLY 309 N -0.44 2.61 3.93 2.12 0.00 -1.26 -1.03 105.19 111.13 2agw n GLY 309 Ca -0.03 -2.04 -0.26 0.00 0.00 0.00 0.00 46.02 43.69 2agw n GLY 309 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2agw s PRO 310 N -2.48 3.53 0.16 1.61 0.04 -1.26 -4.98 135.00 131.62 2agw s PRO 310 Ca 0.00 -0.29 0.10 0.00 0.04 0.00 0.00 61.00 60.85 2agw s PRO 310 Cb 0.00 -2.76 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 2agw s PRO 310 CO 0.00 0.31 -0.20 1.67 0.04 0.00 0.00 177.00 178.81 2agw s TRP 311 N -2.02 2.42 -0.03 0.56 1.48 -0.81 -4.92 118.94 115.62 2agw s TRP 311 Ca 0.40 -0.31 -0.15 0.00 -1.06 0.00 0.00 56.10 54.97 2agw s TRP 311 Cb -0.10 -1.24 -0.05 0.00 -1.16 0.00 0.00 33.47 30.92 2agw s TRP 311 CO 0.31 0.45 0.41 0.45 -4.06 0.00 0.00 176.95 174.50 2agw s SER 312 N -2.46 6.75 0.51 -2.66 0.15 -1.26 0.01 113.70 114.73 2agw s SER 312 Ca 0.20 0.90 0.34 0.00 0.70 0.00 0.00 55.95 58.08 2agw s SER 312 Cb -0.09 -2.25 1.58 0.00 -1.71 0.00 0.00 66.02 63.56 2agw s SER 312 CO 0.10 0.26 2.01 -0.07 1.20 0.00 0.00 173.24 176.74 2agw h LEU 313 N 5.20 0.00 -9.52 3.45 3.38 -1.19 -3.46 115.31 113.17 2agw h LEU 313 Ca -0.49 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 56.81 2agw h LEU 313 Cb 1.21 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.86 2agw h LEU 313 CO 0.65 0.00 -0.54 -0.76 0.09 0.00 0.00 178.44 177.88 2agw s LEU 314 N -5.67 4.06 0.00 1.67 1.43 -1.26 -4.78 118.68 114.13 2agw s LEU 314 Ca -0.00 0.32 0.08 0.00 -1.03 0.00 0.00 54.13 53.50 2agw s LEU 314 Cb 0.10 -2.03 0.08 0.00 0.03 0.00 0.00 46.19 44.37 2agw s LEU 314 CO 0.44 0.38 0.68 -0.46 0.23 0.00 0.00 176.35 177.62 2agw n ASN 315 N 1.90 1.83 -0.07 2.29 0.23 -1.26 -4.93 115.26 115.25 2agw n ASN 315 Ca -0.18 -2.33 -0.03 0.00 -0.53 0.00 0.00 54.58 51.51 2agw n ASN 315 Cb 0.54 -0.36 0.21 0.00 -2.08 0.00 0.00 39.78 38.10 2agw n ASN 315 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2agw h ASP 316 N 0.10 0.67 -0.52 0.53 3.45 -1.99 -1.54 116.42 117.11 2agw h ASP 316 Ca -0.23 -0.14 -0.07 0.00 0.43 0.00 0.00 57.03 57.01 2agw h ASP 316 Cb 1.07 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.65 2agw h ASP 316 CO 0.34 0.73 0.05 -0.33 -1.57 0.00 0.00 179.24 178.45 2agw h GLU 317 N 0.67 0.88 -0.67 3.56 5.08 -2.00 -2.06 114.58 120.04 2agw h GLU 317 Ca 0.14 -0.26 0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2agw h GLU 317 Cb 0.39 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 2agw h GLU 317 CO 0.01 0.89 0.42 -0.44 -1.00 0.00 0.00 179.01 178.89 2agw h ASP 318 N 0.76 0.69 -0.36 1.42 3.32 -1.80 -2.43 116.42 118.02 2agw h ASP 318 Ca 0.15 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 2agw h ASP 318 Cb 0.46 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 2agw h ASP 318 CO 0.02 0.48 0.02 0.11 -1.72 0.00 0.00 179.24 178.15 2agw h LYS 319 N 0.82 0.71 -0.20 3.56 1.57 -1.11 -2.35 116.57 119.56 2agw h LYS 319 Ca 0.27 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2agw h LYS 319 Cb 0.02 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2agw h LYS 319 CO -0.11 0.71 0.05 0.00 -0.57 0.00 0.00 179.45 179.53 2agw h ALA 320 N 1.35 1.71 -0.70 3.86 0.00 -0.87 -1.90 119.26 122.71 2agw h ALA 320 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2agw h ALA 320 Cb 0.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2agw h ALA 320 CO 0.01 0.23 0.00 1.63 0.00 0.00 0.00 179.25 181.12 2agw n LYS 321 N -4.42 2.95 -3.64 0.00 5.02 -1.00 -4.97 118.16 112.11 2agw n LYS 321 Ca 0.00 -2.69 -0.25 0.00 -2.02 0.00 0.00 58.31 53.35 2agw n LYS 321 Cb 0.15 -1.63 0.07 0.00 -0.02 0.00 0.00 35.03 33.60 2agw n LYS 321 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2agw n ASN 322 N 1.49 -6.16 -4.75 4.39 3.02 -0.71 -1.42 115.26 111.13 2agw n ASN 322 Ca 0.24 -0.57 -0.41 0.00 -0.03 0.00 0.00 54.58 53.81 2agw n ASN 322 Cb 0.67 -4.86 -0.02 0.00 -0.61 0.00 0.00 39.78 34.96 2agw n ASN 322 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2agw s TRP 323 N -3.31 3.08 0.15 3.10 0.52 -1.06 -0.13 118.94 121.29 2agw s TRP 323 Ca 0.60 1.15 -0.10 0.00 0.02 0.00 0.00 56.10 57.77 2agw s TRP 323 Cb -0.27 -3.74 -0.00 0.00 -1.15 0.00 0.00 33.47 28.31 2agw s TRP 323 CO 0.74 -2.31 0.29 0.14 0.02 0.00 0.00 176.95 175.82 2agw s VAL 324 N -0.19 0.08 0.63 4.03 -7.23 -0.62 -4.81 120.40 112.28 2agw s VAL 324 Ca 0.57 -1.26 -0.14 0.00 -1.81 0.00 0.00 61.98 59.34 2agw s VAL 324 Cb -0.40 -1.68 -0.02 0.00 0.56 0.00 0.00 36.38 34.84 2agw s VAL 324 CO 0.44 -0.36 1.06 -2.84 -0.31 0.00 0.00 175.10 173.08 2agw s PRO 325 N -3.93 3.19 -0.08 4.82 0.02 -1.26 -1.07 135.00 136.68 2agw s PRO 325 Ca 0.13 1.11 -0.30 0.00 0.02 0.00 0.00 61.00 61.96 2agw s PRO 325 Cb 0.03 -2.02 0.07 0.00 0.02 0.00 0.00 34.50 32.60 2agw s PRO 325 CO -0.03 -0.91 0.68 0.20 -0.33 0.00 0.00 177.00 176.61 2agw s GLY 326 N -3.15 -0.57 0.00 0.52 0.00 -0.77 -4.65 107.32 98.70 2agw s GLY 326 Ca 0.61 1.42 0.00 0.00 0.00 0.00 0.00 44.72 46.75 2agw s GLY 326 CO 0.43 1.07 0.00 0.61 0.00 0.00 0.00 173.10 175.21 2agw n GLY 327 N 1.17 0.83 0.00 0.20 0.00 -0.55 -4.56 105.19 102.27 2agw n GLY 327 Ca -0.18 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.07 2agw n GLY 327 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2agw n TYR 328 N 9.00 0.00 -1.89 1.61 4.02 -0.12 -4.55 117.16 125.23 2agw n TYR 328 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 2agw n TYR 328 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 2agw n TYR 328 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2agw n ASN 329 N -0.26 4.17 -0.45 7.72 3.02 -1.25 -4.68 115.26 123.53 2agw n ASN 329 Ca 0.00 -2.90 0.13 0.00 -0.03 0.00 0.00 54.58 51.77 2agw n ASN 329 Cb 0.00 -1.62 0.27 0.00 -0.61 0.00 0.00 39.78 37.82 2agw n ASN 329 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2agw n LEU 330 N 5.68 1.63 -4.31 3.41 -0.00 -1.26 -0.39 117.00 121.76 2agw n LEU 330 Ca 0.49 -0.53 -0.16 0.00 -0.00 0.00 0.00 56.01 55.81 2agw n LEU 330 Cb 0.39 -0.05 -0.10 0.00 -0.00 0.00 0.00 43.42 43.65 2agw n LEU 330 CO 0.88 0.29 -0.35 0.68 -0.00 0.00 0.00 177.39 178.89 2agw s VAL 331 N -2.33 1.05 0.17 1.47 -7.23 -1.26 -2.30 120.40 109.97 2agw s VAL 331 Ca 0.26 -2.04 -0.23 0.00 -1.81 0.00 0.00 61.98 58.16 2agw s VAL 331 Cb 0.19 -2.22 0.07 0.00 0.56 0.00 0.00 36.38 34.97 2agw s VAL 331 CO 0.47 -0.42 0.64 -0.83 -0.31 0.00 0.00 175.10 174.64 2agw s GLY 332 N -3.27 -0.54 -0.05 2.32 0.00 -0.70 -4.81 107.32 100.28 2agw s GLY 332 Ca 0.26 0.41 0.02 0.00 0.00 0.00 0.00 44.72 45.40 2agw s GLY 332 CO 0.07 0.13 -0.09 -2.27 0.00 0.00 0.00 173.10 170.94 2agw s LEU 333 N -2.76 1.59 -0.48 0.66 2.96 -1.26 -0.73 118.68 118.66 2agw s LEU 333 Ca 0.03 -0.22 -0.19 0.00 -0.22 0.00 0.00 54.13 53.52 2agw s LEU 333 Cb -0.02 -0.65 0.04 0.00 0.50 0.00 0.00 46.19 46.07 2agw s LEU 333 CO -0.10 0.02 0.61 -2.28 -1.32 0.00 0.00 176.35 173.28 2agw s HIS 334 N 0.61 3.06 0.25 5.38 5.65 0.39 -4.88 115.29 125.75 2agw s HIS 334 Ca -0.11 -0.39 -0.00 0.00 0.25 0.00 0.00 55.06 54.81 2agw s HIS 334 Cb -0.14 -3.42 0.30 0.00 -1.18 0.00 0.00 32.58 28.14 2agw s HIS 334 CO 0.02 -0.96 1.66 0.00 -0.65 0.00 0.00 174.74 174.81 2agw h ARG 335 N 8.94 0.59 -0.11 2.88 3.08 -1.90 0.02 114.38 127.88 2agw h ARG 335 Ca -0.27 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 59.49 2agw h ARG 335 Cb 1.10 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.11 2agw h ARG 335 CO 0.93 0.81 -0.17 0.00 -1.07 0.00 0.00 179.97 180.46 2agw h ALA 336 N 1.19 1.51 0.00 0.04 0.00 -1.95 -3.21 119.26 116.84 2agw h ALA 336 Ca 0.07 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2agw h ALA 336 Cb 0.74 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2agw h ALA 336 CO 0.06 0.35 -1.91 -1.13 0.00 0.00 0.00 179.25 176.62 2agw n SER 337 N -4.26 0.65 0.00 0.00 3.41 -1.12 -4.99 113.62 107.32 2agw n SER 337 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 2agw n SER 337 Cb 0.28 1.75 0.00 0.00 -0.26 0.00 0.00 64.21 65.99 2agw n SER 337 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2agw n GLY 338 N 1.48 0.60 3.71 5.00 0.00 -0.02 -4.88 105.19 111.09 2agw n GLY 338 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 2agw n GLY 338 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2agw s ARG 339 N -0.01 4.40 -0.10 1.61 0.52 -1.16 -2.64 118.95 121.55 2agw s ARG 339 Ca 0.00 1.87 -0.02 0.00 -0.52 0.00 0.00 55.73 57.06 2agw s ARG 339 Cb 0.00 -3.31 -0.03 0.00 0.52 0.00 0.00 34.95 32.13 2agw s ARG 339 CO 0.00 -0.31 -0.01 1.41 0.02 0.00 0.00 175.30 176.41 2agw s MET 340 N 1.06 3.13 -0.12 3.54 -2.45 0.23 -0.46 119.30 124.23 2agw s MET 340 Ca 0.61 -0.43 -0.01 0.00 -1.25 0.00 0.00 55.69 54.61 2agw s MET 340 Cb -0.32 -2.82 -0.02 0.00 1.25 0.00 0.00 34.83 32.92 2agw s MET 340 CO 0.30 0.60 -0.09 0.71 1.05 0.00 0.00 175.02 177.59 2agw s TYR 341 N -0.61 2.90 -0.05 4.11 1.51 0.10 -0.07 117.35 125.24 2agw s TYR 341 Ca 0.10 -0.35 -0.02 0.00 -1.01 0.00 0.00 57.07 55.79 2agw s TYR 341 Cb -0.12 -1.84 0.03 0.00 -0.11 0.00 0.00 41.96 39.93 2agw s TYR 341 CO 0.02 -0.01 0.10 0.08 -1.11 0.00 0.00 175.55 174.63 2agw s VAL 342 N 0.03 -0.04 0.06 0.71 1.01 -0.65 -1.72 120.40 119.79 2agw s VAL 342 Ca -0.02 0.16 -0.31 0.00 0.00 0.00 0.00 61.98 61.81 2agw s VAL 342 Cb -0.14 -0.17 -0.06 0.00 0.00 0.00 0.00 36.38 36.01 2agw s VAL 342 CO 0.03 0.07 1.20 -0.36 0.00 0.00 0.00 175.10 176.04 2agw s PHE 343 N 0.95 3.43 0.08 5.22 2.99 -0.97 -1.05 117.98 128.63 2agw s PHE 343 Ca -0.08 1.29 0.04 0.00 0.00 0.00 0.00 56.93 58.18 2agw s PHE 343 Cb -0.10 -3.43 -0.03 0.00 0.00 0.00 0.00 43.02 39.46 2agw s PHE 343 CO -0.04 -1.31 -0.11 -1.64 -0.00 0.00 0.00 175.22 172.12 2agw s MET 344 N 1.08 0.81 0.02 0.44 -1.94 -0.20 -1.85 119.30 117.66 2agw s MET 344 Ca 0.59 -1.05 -0.06 0.00 -1.71 0.00 0.00 55.69 53.46 2agw s MET 344 Cb -0.30 -0.61 -0.01 0.00 2.01 0.00 0.00 34.83 35.93 2agw s MET 344 CO 0.29 0.11 0.11 -3.38 -0.01 0.00 0.00 175.02 172.15 2agw s HIS 345 N -1.93 0.13 0.84 -0.03 -3.43 -0.24 -1.08 115.29 109.56 2agw s HIS 345 Ca 0.01 -0.34 -0.12 0.00 -0.80 0.00 0.00 55.06 53.81 2agw s HIS 345 Cb -0.06 -0.10 0.12 0.00 -1.43 0.00 0.00 32.58 31.11 2agw s HIS 345 CO 0.01 -0.33 1.19 -1.25 -2.00 0.00 0.00 174.74 172.36 2agw s PRO 346 N -2.04 1.50 -1.46 -0.38 0.04 -1.26 -1.59 135.00 129.80 2agw s PRO 346 Ca -0.10 -0.23 -0.08 0.00 0.04 0.00 0.00 61.00 60.63 2agw s PRO 346 Cb -0.04 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.54 2agw s PRO 346 CO -0.02 -1.83 0.84 -0.25 0.04 0.00 0.00 177.00 175.79 2agw n ASP 347 N -3.38 -5.81 -4.77 6.66 8.00 -0.50 -4.86 116.55 111.90 2agw n ASP 347 Ca 0.11 -0.45 -0.40 0.00 0.71 0.00 0.00 54.79 54.76 2agw n ASP 347 Cb 0.60 -4.64 -0.01 0.00 -0.02 0.00 0.00 41.12 37.05 2agw n ASP 347 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2agw s GLY 348 N -2.99 2.94 0.33 0.44 0.00 0.81 -5.02 107.32 103.83 2agw s GLY 348 Ca 0.46 1.25 -0.18 0.00 0.00 0.00 0.00 44.72 46.25 2agw s GLY 348 CO 0.57 1.85 0.80 -1.59 0.00 0.00 0.00 173.10 174.73 2agw s LYS 349 N -2.16 2.00 0.04 2.90 -2.85 -1.26 -4.93 119.74 113.48 2agw s LYS 349 Ca 0.55 -1.24 -0.35 0.00 -1.00 0.00 0.00 55.97 53.93 2agw s LYS 349 Cb -0.39 0.59 -0.14 0.00 -2.06 0.00 0.00 37.83 35.83 2agw s LYS 349 CO 0.50 -0.93 1.59 -1.91 0.10 0.00 0.00 175.35 174.70 2agw n GLU 350 N -0.52 1.77 -0.00 1.78 4.07 -1.26 -2.27 120.64 124.21 2agw n GLU 350 Ca -0.07 0.64 0.00 0.00 -0.06 0.00 0.00 57.16 57.68 2agw n GLU 350 Cb 0.60 -2.38 0.00 0.00 -0.06 0.00 0.00 31.44 29.59 2agw n GLU 350 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2agw n GLY 351 N 3.46 0.68 0.94 8.31 0.00 -1.26 -4.98 105.19 112.34 2agw n GLY 351 Ca 0.20 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.29 2agw n GLY 351 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2agw n THR 352 N -2.00 1.35 0.48 2.61 -2.24 -0.96 -4.66 114.28 108.86 2agw n THR 352 Ca 0.00 -1.18 0.10 0.00 -2.27 0.00 0.00 64.05 60.71 2agw n THR 352 Cb 0.00 0.32 0.42 0.00 -2.10 0.00 0.00 70.33 68.97 2agw n THR 352 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2agw n HIS 353 N 0.62 0.46 -0.74 4.78 1.44 -1.26 -1.82 115.22 118.69 2agw n HIS 353 Ca 0.17 0.17 0.08 0.00 -2.01 0.00 0.00 57.72 56.13 2agw n HIS 353 Cb 0.61 -0.78 0.21 0.00 0.12 0.00 0.00 29.99 30.15 2agw n HIS 353 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2agw n LYS 354 N -1.91 2.78 -2.22 -1.40 5.02 -1.26 -1.48 118.16 117.68 2agw n LYS 354 Ca 0.03 -2.56 -0.38 0.00 -2.02 0.00 0.00 58.31 53.39 2agw n LYS 354 Cb 0.22 -1.63 -0.01 0.00 -0.02 0.00 0.00 35.03 33.59 2agw n LYS 354 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2agw s PHE 355 N -2.27 2.93 0.71 2.13 0.40 -0.76 -4.39 117.98 116.74 2agw s PHE 355 Ca 0.34 1.52 -0.16 0.00 -0.60 0.00 0.00 56.93 58.03 2agw s PHE 355 Cb 0.26 -3.45 0.02 0.00 0.51 0.00 0.00 43.02 40.36 2agw s PHE 355 CO 0.10 -1.57 1.13 -2.30 0.70 0.00 0.00 175.22 173.28 2agw n PRO 356 N -0.15 0.65 -2.16 0.24 -0.02 -1.26 -3.49 135.00 128.81 2agw n PRO 356 Ca 0.05 0.28 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 2agw n PRO 356 Cb 0.46 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 2agw n PRO 356 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2agw s ALA 357 N -1.73 3.60 0.10 3.55 0.00 0.26 -4.74 121.76 122.80 2agw s ALA 357 Ca 0.77 0.95 -0.10 0.00 0.00 0.00 0.00 51.96 53.58 2agw s ALA 357 Cb -0.35 -3.62 -0.17 0.00 0.00 0.00 0.00 23.12 18.99 2agw s ALA 357 CO 0.47 -0.95 1.24 0.00 0.00 0.00 0.00 175.76 176.52 2agw h ALA 358 N 7.92 0.23 -2.50 0.00 0.00 -1.44 -2.54 119.26 120.93 2agw h ALA 358 Ca -0.39 -0.70 -0.12 0.00 0.00 0.00 0.00 54.91 53.71 2agw h ALA 358 Cb 1.18 0.02 -0.16 0.00 0.00 0.00 0.00 17.79 18.83 2agw h ALA 358 CO 0.91 0.74 -0.54 -1.21 0.00 0.00 0.00 179.25 179.15 2agw s GLU 359 N -3.32 0.64 -0.22 0.00 2.02 -0.82 -0.77 118.70 116.23 2agw s GLU 359 Ca -0.08 -0.91 -0.09 0.00 0.02 0.00 0.00 54.97 53.90 2agw s GLU 359 Cb 0.08 0.24 -0.04 0.00 0.10 0.00 0.00 34.13 34.51 2agw s GLU 359 CO 0.90 -0.16 0.11 0.42 0.02 0.00 0.00 175.26 176.55 2agw s ILE 360 N -3.18 5.06 -0.05 -1.63 1.01 0.02 -1.03 121.20 121.40 2agw s ILE 360 Ca -0.00 0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.69 2agw s ILE 360 Cb 0.02 -3.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.12 2agw s ILE 360 CO -0.07 0.39 0.12 0.26 0.00 0.00 0.00 174.94 175.64 2agw s TRP 361 N 0.81 3.46 -0.27 3.97 0.52 -0.22 -1.46 118.94 125.75 2agw s TRP 361 Ca 0.06 0.36 -0.03 0.00 0.02 0.00 0.00 56.10 56.51 2agw s TRP 361 Cb -0.13 -1.84 0.03 0.00 -1.15 0.00 0.00 33.47 30.38 2agw s TRP 361 CO 0.02 0.63 -0.01 0.08 0.02 0.00 0.00 176.95 177.69 2agw s VAL 362 N -1.14 3.19 -0.10 4.03 1.01 0.13 -1.64 120.40 125.88 2agw s VAL 362 Ca 0.20 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 2agw s VAL 362 Cb -0.12 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 2agw s VAL 362 CO 0.11 0.12 -0.04 -0.04 0.00 0.00 0.00 175.10 175.25 2agw s MET 363 N 1.36 3.12 -0.46 2.72 1.00 0.91 -0.46 119.30 127.49 2agw s MET 363 Ca -0.00 -0.50 -0.23 0.00 0.00 0.00 0.00 55.69 54.96 2agw s MET 363 Cb -0.17 -2.76 0.03 0.00 0.00 0.00 0.00 34.83 31.93 2agw s MET 363 CO -0.02 0.54 0.80 0.34 0.00 0.00 0.00 175.02 176.68 2agw s ASP 364 N -0.45 6.41 0.24 3.03 -1.08 -0.07 -0.61 116.67 124.16 2agw s ASP 364 Ca 0.07 -0.11 0.25 0.00 -0.52 0.00 0.00 52.55 52.24 2agw s ASP 364 Cb -0.12 -2.39 0.91 0.00 -1.46 0.00 0.00 42.92 39.85 2agw s ASP 364 CO 0.02 -0.94 1.75 0.35 0.52 0.00 0.00 175.17 176.87 2agw n THR 365 N 6.16 0.72 0.05 1.71 -2.24 -1.08 -0.39 114.28 119.21 2agw n THR 365 Ca 0.03 -0.01 -0.20 0.00 -2.27 0.00 0.00 64.05 61.59 2agw n THR 365 Cb 0.48 -0.90 -0.15 0.00 -2.10 0.00 0.00 70.33 67.67 2agw n THR 365 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2agw h LYS 366 N 0.00 0.30 0.00 -0.78 1.57 -1.92 -3.35 116.57 112.39 2agw h LYS 366 Ca 0.00 -0.51 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 2agw h LYS 366 Cb 0.54 0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.04 2agw h LYS 366 CO 0.00 1.25 -0.46 0.25 -0.57 0.00 0.00 179.45 179.92 2agw n THR 367 N -4.11 0.10 -3.54 -0.16 -2.24 -1.19 -4.96 114.28 98.18 2agw n THR 367 Ca -0.14 -0.08 -0.23 0.00 -2.27 0.00 0.00 64.05 61.33 2agw n THR 367 Cb 0.83 0.04 0.08 0.00 -2.10 0.00 0.00 70.33 69.17 2agw n THR 367 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2agw n LYS 368 N -1.67 -7.60 -4.06 -0.78 5.02 0.48 -5.01 118.16 104.54 2agw n LYS 368 Ca 0.05 0.79 -0.12 0.00 -2.02 0.00 0.00 58.31 57.01 2agw n LYS 368 Cb 0.36 -5.73 -0.11 0.00 -0.02 0.00 0.00 35.03 29.53 2agw n LYS 368 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2agw s GLN 369 N -6.25 0.51 0.28 1.97 -1.52 -1.13 -4.92 119.66 108.60 2agw s GLN 369 Ca 0.56 -0.76 -0.29 0.00 -1.95 0.00 0.00 55.36 52.91 2agw s GLN 369 Cb -0.25 -0.24 -0.10 0.00 -0.22 0.00 0.00 33.01 32.20 2agw s GLN 369 CO 0.69 0.04 1.17 0.50 -0.25 0.00 0.00 175.29 177.43 2agw s ARG 370 N -1.65 4.55 -0.11 2.91 3.52 -1.26 -0.89 118.95 126.02 2agw s ARG 370 Ca -0.10 1.92 0.10 0.00 -0.13 0.00 0.00 55.73 57.52 2agw s ARG 370 Cb -0.09 -3.17 -0.14 0.00 -1.56 0.00 0.00 34.95 29.98 2agw s ARG 370 CO 0.00 0.07 0.05 1.33 -0.81 0.00 0.00 175.30 175.94 2agw n VAL 371 N 1.28 0.77 -3.68 7.11 0.24 0.39 -4.87 118.33 119.57 2agw n VAL 371 Ca -0.00 -0.48 -0.10 0.00 -2.04 0.00 0.00 64.34 61.71 2agw n VAL 371 Cb 0.44 -0.67 -0.04 0.00 -1.47 0.00 0.00 33.84 32.10 2agw n VAL 371 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2agw s ALA 372 N -2.30 -0.98 -0.09 2.33 0.00 -1.13 -5.01 121.76 114.59 2agw s ALA 372 Ca -0.06 -0.12 -0.07 0.00 0.00 0.00 0.00 51.96 51.71 2agw s ALA 372 Cb 0.04 0.81 0.03 0.00 0.00 0.00 0.00 23.12 24.00 2agw s ALA 372 CO 0.47 -0.75 0.23 -0.98 0.00 0.00 0.00 175.76 174.73 2agw s ARG 373 N -3.84 0.25 0.13 0.00 1.70 -1.26 -0.69 118.95 115.24 2agw s ARG 373 Ca 0.07 0.35 0.01 0.00 -0.47 0.00 0.00 55.73 55.68 2agw s ARG 373 Cb -0.00 0.09 -0.04 0.00 -0.57 0.00 0.00 34.95 34.42 2agw s ARG 373 CO -0.06 -0.05 -0.01 0.96 -1.08 0.00 0.00 175.30 175.06 2agw s ILE 374 N 0.30 0.51 0.43 4.99 -4.36 -0.53 -4.99 121.20 117.55 2agw s ILE 374 Ca -0.01 -1.94 -0.25 0.00 -0.26 0.00 0.00 60.65 58.19 2agw s ILE 374 Cb -0.03 -1.94 -0.09 0.00 1.25 0.00 0.00 42.46 41.64 2agw s ILE 374 CO -0.01 -0.62 1.25 -2.65 0.24 0.00 0.00 174.94 173.15 2agw n PRO 375 N -0.13 1.86 0.03 0.37 -0.02 -1.26 -0.80 135.00 135.06 2agw n PRO 375 Ca -0.08 0.67 0.11 0.00 -2.02 0.00 0.00 63.50 62.18 2agw n PRO 375 Cb 0.62 -2.37 0.07 0.00 -0.02 0.00 0.00 33.50 31.81 2agw n PRO 375 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2agw n GLY 376 N 0.84 -1.27 3.01 -1.23 0.00 0.05 -4.36 105.19 102.23 2agw n GLY 376 Ca 0.07 -0.36 -0.21 0.00 0.00 0.00 0.00 46.02 45.52 2agw n GLY 376 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2agw n ARG 377 N -1.98 -3.63 -2.21 1.61 1.74 -1.26 -1.80 116.66 109.13 2agw n ARG 377 Ca 0.02 0.70 -0.17 0.00 -0.77 0.00 0.00 57.85 57.63 2agw n ARG 377 Cb 0.43 -5.44 -0.02 0.00 -1.02 0.00 0.00 32.46 26.41 2agw n ARG 377 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2agw n ASP 378 N -2.27 -4.99 -4.79 0.55 8.00 -0.96 -4.83 116.55 107.26 2agw n ASP 378 Ca -0.09 0.15 -0.33 0.00 0.71 0.00 0.00 54.79 55.23 2agw n ASP 378 Cb 0.59 -4.25 0.02 0.00 -0.02 0.00 0.00 41.12 37.46 2agw n ASP 378 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2agw s ALA 379 N -2.78 2.68 0.00 2.24 0.00 -0.74 -4.36 121.76 118.78 2agw s ALA 379 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2agw s ALA 379 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2agw s ALA 379 CO 0.00 -0.89 0.00 1.28 0.00 0.00 0.00 175.76 176.15 2agw n LEU 380 N -1.97 1.07 -4.13 0.00 4.77 0.51 -0.57 117.00 116.66 2agw n LEU 380 Ca 0.09 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.95 2agw n LEU 380 Cb 0.52 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.51 2agw n LEU 380 CO 0.46 0.18 -0.40 -0.44 -1.33 0.00 0.00 177.39 175.86 2agw s SER 381 N -3.31 1.10 0.18 -1.43 0.01 -0.94 -0.94 113.70 108.38 2agw s SER 381 Ca 0.00 -0.81 -0.03 0.00 1.31 0.00 0.00 55.95 56.42 2agw s SER 381 Cb 0.00 0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.25 2agw s SER 381 CO 0.00 -0.33 0.17 0.00 0.41 0.00 0.00 173.24 173.49 2agw s MET 382 N -2.83 1.16 0.10 12.44 0.23 0.48 -0.72 119.30 130.16 2agw s MET 382 Ca 0.03 -1.48 -0.14 0.00 -1.03 0.00 0.00 55.69 53.08 2agw s MET 382 Cb -0.02 0.30 0.02 0.00 -1.53 0.00 0.00 34.83 33.60 2agw s MET 382 CO -0.02 -0.39 0.33 -0.08 -2.03 0.00 0.00 175.02 172.83 2agw s THR 383 N -4.09 0.09 -0.03 3.16 -1.32 -0.65 -4.81 115.64 108.00 2agw s THR 383 Ca 0.30 -0.77 0.07 0.00 -1.21 0.00 0.00 61.69 60.09 2agw s THR 383 Cb 0.06 -1.19 -0.02 0.00 -1.51 0.00 0.00 72.50 69.84 2agw s THR 383 CO 0.07 -0.42 -0.25 -0.63 -2.21 0.00 0.00 174.62 171.18 2agw s ILE 384 N -3.65 1.96 -0.26 5.08 -1.09 -1.26 -0.86 121.20 121.11 2agw s ILE 384 Ca 0.02 -1.05 -0.07 0.00 -2.23 0.00 0.00 60.65 57.33 2agw s ILE 384 Cb 0.02 -1.63 -0.01 0.00 -1.58 0.00 0.00 42.46 39.26 2agw s ILE 384 CO -0.11 0.55 0.06 -0.62 -1.23 0.00 0.00 174.94 173.60 2agw s ASP 385 N -0.48 5.04 0.01 3.58 -1.08 0.21 -4.93 116.67 119.01 2agw s ASP 385 Ca 0.07 -0.40 -0.25 0.00 -0.52 0.00 0.00 52.55 51.45 2agw s ASP 385 Cb -0.10 -1.89 -0.19 0.00 -1.46 0.00 0.00 42.92 39.28 2agw s ASP 385 CO 0.00 -0.09 1.38 1.56 0.52 0.00 0.00 175.17 178.54 2agw h GLN 386 N 8.23 -0.01 0.00 4.34 1.08 -1.93 -1.89 115.11 124.92 2agw h GLN 386 Ca -0.36 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 56.75 2agw h GLN 386 Cb 1.16 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.58 2agw h GLN 386 CO 0.59 0.35 -0.40 1.96 -0.95 0.00 0.00 178.83 180.38 2agw h GLN 387 N -0.38 0.00 -0.03 1.46 4.20 -1.97 -2.44 115.11 115.96 2agw h GLN 387 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2agw h GLN 387 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 2agw h GLN 387 CO 0.00 0.40 -0.08 0.54 -0.67 0.00 0.00 178.83 179.02 2agw n ARG 388 N -3.47 1.97 -3.48 1.46 3.00 -1.25 -5.01 116.66 109.89 2agw n ARG 388 Ca 0.00 -1.68 -0.20 0.00 -0.01 0.00 0.00 57.85 55.96 2agw n ARG 388 Cb 0.55 -1.43 0.06 0.00 0.00 0.00 0.00 32.46 31.64 2agw n ARG 388 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2agw n ASN 389 N 1.03 -4.25 -4.34 0.55 3.02 -0.80 -4.87 115.26 105.61 2agw n ASN 389 Ca 0.12 -0.78 -0.26 0.00 -0.03 0.00 0.00 54.58 53.64 2agw n ASN 389 Cb 0.54 -4.56 -0.12 0.00 -0.61 0.00 0.00 39.78 35.03 2agw n ASN 389 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2agw s LEU 390 N -6.09 2.34 -0.05 3.41 1.43 -0.78 -0.77 118.68 118.18 2agw s LEU 390 Ca 0.27 -0.75 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 2agw s LEU 390 Cb -0.06 -1.01 0.01 0.00 0.03 0.00 0.00 46.19 45.16 2agw s LEU 390 CO 0.78 0.09 -0.12 -0.32 0.23 0.00 0.00 176.35 177.01 2agw s MET 391 N -2.15 1.44 -0.07 1.70 -2.45 -0.20 -0.62 119.30 116.95 2agw s MET 391 Ca 0.12 -0.42 -0.03 0.00 -1.25 0.00 0.00 55.69 54.11 2agw s MET 391 Cb -0.09 -1.25 -0.04 0.00 1.25 0.00 0.00 34.83 34.70 2agw s MET 391 CO 0.06 0.11 0.06 -0.51 1.05 0.00 0.00 175.02 175.79 2agw s LEU 392 N 0.36 3.89 0.20 4.11 1.43 -0.04 -0.53 118.68 128.09 2agw s LEU 392 Ca -0.08 0.23 0.08 0.00 -1.03 0.00 0.00 54.13 53.33 2agw s LEU 392 Cb -0.12 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 44.03 2agw s LEU 392 CO 0.02 0.35 -0.16 0.42 0.23 0.00 0.00 176.35 177.22 2agw s THR 393 N -1.02 1.81 -0.09 5.49 -4.23 -0.16 -1.63 115.64 115.81 2agw s THR 393 Ca 0.17 -2.13 -0.04 0.00 -1.18 0.00 0.00 61.69 58.50 2agw s THR 393 Cb -0.12 -1.99 0.04 0.00 1.34 0.00 0.00 72.50 71.77 2agw s THR 393 CO 0.06 -0.50 0.20 -0.22 -0.54 0.00 0.00 174.62 173.63 2agw s LEU 394 N -3.13 0.55 0.00 4.79 2.96 0.10 -0.61 118.68 123.34 2agw s LEU 394 Ca 0.21 0.43 0.19 0.00 -0.22 0.00 0.00 54.13 54.74 2agw s LEU 394 Cb -0.03 0.58 0.55 0.00 0.50 0.00 0.00 46.19 47.80 2agw s LEU 394 CO 0.07 -0.16 1.46 -0.90 -1.32 0.00 0.00 176.35 175.51 2agw n ASP 395 N 4.20 3.68 0.00 3.68 5.68 -1.01 -0.37 116.55 132.41 2agw n ASP 395 Ca -0.26 -2.00 0.00 0.00 -0.50 0.00 0.00 54.79 52.03 2agw n ASP 395 Cb 0.52 -0.42 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 2agw n ASP 395 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2agw n GLY 396 N 1.34 2.14 0.00 6.12 0.00 -1.21 -4.77 105.19 108.81 2agw n GLY 396 Ca 0.21 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2agw n GLY 396 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2agw n GLY 397 N 0.00 0.00 3.32 -0.02 0.00 -1.26 -0.82 105.19 106.41 2agw n GLY 397 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2agw n GLY 397 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2agw s ASN 398 N -1.88 3.04 -0.19 1.61 0.01 -1.26 -0.23 114.94 116.03 2agw s ASN 398 Ca 0.00 -0.54 -0.03 0.00 -0.71 0.00 0.00 52.86 51.58 2agw s ASN 398 Cb 0.00 -0.30 -0.01 0.00 0.41 0.00 0.00 41.25 41.35 2agw s ASN 398 CO 0.00 0.27 -0.05 -0.69 -1.51 0.00 0.00 177.10 175.12 2agw s VAL 399 N -0.73 3.48 -0.15 1.60 1.01 -0.39 -2.41 120.40 122.80 2agw s VAL 399 Ca 0.11 -0.48 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 2agw s VAL 399 Cb -0.10 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 2agw s VAL 399 CO 0.01 0.45 0.14 0.20 0.00 0.00 0.00 175.10 175.90 2agw s ASN 400 N 1.06 6.31 -0.20 3.32 0.01 0.22 0.09 114.94 125.75 2agw s ASN 400 Ca 0.01 0.37 -0.05 0.00 -0.71 0.00 0.00 52.86 52.47 2agw s ASN 400 Cb -0.15 -2.08 -0.02 0.00 0.41 0.00 0.00 41.25 39.41 2agw s ASN 400 CO -0.00 0.31 0.00 -0.69 -1.51 0.00 0.00 177.10 175.21 2agw s VAL 401 N -0.41 3.95 -0.01 1.60 1.01 -0.09 -0.99 120.40 125.47 2agw s VAL 401 Ca 0.12 -0.31 0.07 0.00 0.00 0.00 0.00 61.98 61.86 2agw s VAL 401 Cb -0.12 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 2agw s VAL 401 CO 0.01 0.42 -0.23 -0.31 0.00 0.00 0.00 175.10 175.00 2agw s TYR 402 N 1.03 2.08 -0.28 5.22 1.51 0.30 0.07 117.35 127.29 2agw s TYR 402 Ca 0.02 -0.39 -0.24 0.00 -1.01 0.00 0.00 57.07 55.45 2agw s TYR 402 Cb -0.14 -1.33 -0.00 0.00 -0.11 0.00 0.00 41.96 40.38 2agw s TYR 402 CO 0.02 -0.01 0.81 0.34 -1.11 0.00 0.00 175.55 175.59 2agw s ASP 403 N -0.65 6.74 -0.25 2.29 2.15 0.24 -1.03 116.67 126.16 2agw s ASP 403 Ca 0.09 0.84 0.11 0.00 0.43 0.00 0.00 52.55 54.02 2agw s ASP 403 Cb -0.09 -2.42 0.47 0.00 -0.30 0.00 0.00 42.92 40.58 2agw s ASP 403 CO -0.00 -0.57 1.38 2.30 -0.17 0.00 0.00 175.17 178.11 2agw n ILE 404 N 5.41 2.40 0.29 4.11 -5.35 0.05 -1.10 119.36 125.17 2agw n ILE 404 Ca 0.05 -2.73 0.17 0.00 -0.27 0.00 0.00 62.75 59.97 2agw n ILE 404 Cb 0.48 -0.29 0.81 0.00 -1.74 0.00 0.00 39.64 38.90 2agw n ILE 404 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2agw h SER 405 N 1.01 0.00 -2.26 7.28 4.64 -1.90 -3.43 113.55 118.88 2agw h SER 405 Ca 0.13 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.87 2agw h SER 405 Cb 1.44 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.39 2agw h SER 405 CO 0.25 0.04 -0.70 0.00 -0.87 0.00 0.00 176.83 175.56 2agw s GLN 406 N -3.90 1.71 0.32 4.77 0.00 -1.26 -5.06 119.66 116.24 2agw s GLN 406 Ca -0.01 -1.86 0.04 0.00 -0.00 0.00 0.00 55.36 53.53 2agw s GLN 406 Cb 0.11 -1.57 0.66 0.00 0.00 0.00 0.00 33.01 32.21 2agw s GLN 406 CO 0.53 0.16 1.88 -1.35 0.00 0.00 0.00 175.29 176.50 2agw h PRO 407 N 2.15 0.85 -5.73 9.60 0.11 -1.97 -3.37 132.00 133.63 2agw h PRO 407 Ca -0.41 -0.05 -0.60 0.00 0.11 0.00 0.00 66.00 65.05 2agw h PRO 407 Cb 1.25 -0.19 -0.10 0.00 0.11 0.00 0.00 31.00 32.07 2agw h PRO 407 CO 0.67 0.56 0.38 -2.00 -0.21 0.00 0.00 178.00 177.41 2agw s GLU 408 N -5.82 4.06 0.46 1.05 2.12 -1.26 -4.83 118.70 114.48 2agw s GLU 408 Ca -0.11 0.70 -0.24 0.00 0.36 0.00 0.00 54.97 55.68 2agw s GLU 408 Cb 0.21 -3.69 -0.07 0.00 0.26 0.00 0.00 34.13 30.84 2agw s GLU 408 CO 0.80 -0.58 1.34 -2.14 -0.54 0.00 0.00 175.26 174.13 2agw s PRO 409 N 2.84 3.66 -0.17 4.30 0.02 -1.26 -4.87 135.00 139.53 2agw s PRO 409 Ca 0.32 2.21 -0.00 0.00 0.02 0.00 0.00 61.00 63.55 2agw s PRO 409 Cb -0.15 -2.57 0.00 0.00 0.02 0.00 0.00 34.50 31.81 2agw s PRO 409 CO 0.10 -0.76 -0.14 0.21 -0.33 0.00 0.00 177.00 176.07 2agw s LYS 410 N -2.51 3.20 -0.04 5.54 2.47 -0.25 -4.96 119.74 123.19 2agw s LYS 410 Ca 0.62 -0.74 -0.30 0.00 -1.56 0.00 0.00 55.97 53.99 2agw s LYS 410 Cb -0.39 -2.67 -0.05 0.00 -1.46 0.00 0.00 37.83 33.26 2agw s LYS 410 CO 0.49 -0.05 1.45 -1.17 0.16 0.00 0.00 175.35 176.24 2agw s LEU 411 N 0.98 4.30 -0.21 5.43 2.96 -1.26 -0.59 118.68 130.28 2agw s LEU 411 Ca -0.02 2.08 -0.05 0.00 -0.22 0.00 0.00 54.13 55.92 2agw s LEU 411 Cb -0.15 -3.55 -0.20 0.00 0.50 0.00 0.00 46.19 42.80 2agw s LEU 411 CO -0.03 -0.79 -0.01 0.18 -1.32 0.00 0.00 176.35 174.39 2agw n LEU 412 N 6.06 2.62 -3.65 -0.68 4.77 0.11 -4.95 117.00 121.28 2agw n LEU 412 Ca 0.14 0.10 -0.02 0.00 -0.03 0.00 0.00 56.01 56.20 2agw n LEU 412 Cb 0.43 -0.97 -0.01 0.00 -2.33 0.00 0.00 43.42 40.54 2agw n LEU 412 CO 0.59 0.80 0.90 0.00 -1.33 0.00 0.00 177.39 178.35 2agw s ARG 413 N -2.52 0.69 -0.04 3.23 1.70 -1.19 -5.01 118.95 115.81 2agw s ARG 413 Ca -0.31 -0.36 0.04 0.00 -0.47 0.00 0.00 55.73 54.63 2agw s ARG 413 Cb 0.09 0.25 -0.00 0.00 -0.57 0.00 0.00 34.95 34.72 2agw s ARG 413 CO 0.64 -0.32 -0.17 0.99 -1.08 0.00 0.00 175.30 175.37 2agw s THR 414 N -2.78 1.39 -0.45 4.99 2.01 -1.26 -0.91 115.64 118.62 2agw s THR 414 Ca 0.12 -0.69 -0.13 0.00 0.31 0.00 0.00 61.69 61.29 2agw s THR 414 Cb 0.01 -1.20 0.07 0.00 0.01 0.00 0.00 72.50 71.40 2agw s THR 414 CO -0.02 0.40 0.34 -0.63 -0.69 0.00 0.00 174.62 174.02 2agw s ILE 415 N 0.07 4.92 0.11 1.82 1.01 0.11 -4.97 121.20 124.27 2agw s ILE 415 Ca -0.04 -1.13 -0.25 0.00 0.00 0.00 0.00 60.65 59.22 2agw s ILE 415 Cb -0.12 -3.94 -0.07 0.00 0.01 0.00 0.00 42.46 38.35 2agw s ILE 415 CO 0.02 -0.53 0.77 -1.61 0.00 0.00 0.00 174.94 173.59 2agw s GLU 416 N 1.58 4.52 -0.82 2.79 0.41 -1.26 -1.27 118.70 124.65 2agw s GLU 416 Ca 0.04 1.11 -0.02 0.00 -0.41 0.00 0.00 54.97 55.69 2agw s GLU 416 Cb -0.23 -3.31 0.00 0.00 -1.78 0.00 0.00 34.13 28.81 2agw s GLU 416 CO 0.05 0.44 0.24 0.41 -0.49 0.00 0.00 175.26 175.91 2agw n GLY 417 N 1.97 0.03 0.26 -1.39 0.00 -1.16 -4.91 105.19 100.00 2agw n GLY 417 Ca -0.04 -0.35 0.15 0.00 0.00 0.00 0.00 46.02 45.78 2agw n GLY 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2agw h ALA 418 N 0.51 1.01 -2.99 4.61 0.00 -0.76 -3.46 119.26 118.19 2agw h ALA 418 Ca -0.27 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.59 2agw h ALA 418 Cb 1.19 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.87 2agw h ALA 418 CO 0.29 0.09 0.22 0.00 0.00 0.00 0.00 179.25 179.85 2agw s ALA 419 N -3.66 -1.49 -0.06 0.00 0.00 -1.03 -4.85 121.76 110.67 2agw s ALA 419 Ca 0.01 0.26 -0.05 0.00 0.00 0.00 0.00 51.96 52.18 2agw s ALA 419 Cb 0.09 0.87 -0.27 0.00 0.00 0.00 0.00 23.12 23.81 2agw s ALA 419 CO 0.58 -0.85 0.60 0.93 0.00 0.00 0.00 175.76 177.01 2agw h GLU 420 N 2.00 0.27 -0.77 0.00 5.08 -1.87 -3.38 114.58 115.90 2agw h GLU 420 Ca -0.29 -0.46 -0.30 0.00 -1.00 0.00 0.00 59.36 57.30 2agw h GLU 420 Cb 1.29 0.17 -0.21 0.00 0.50 0.00 0.00 28.75 30.50 2agw h GLU 420 CO 0.33 1.14 -0.65 0.00 -1.00 0.00 0.00 179.01 178.83 2agw n ALA 421 N -2.83 -0.42 -2.78 3.43 0.00 -1.20 -4.69 120.51 112.02 2agw n ALA 421 Ca -0.25 -1.86 -0.33 0.00 0.00 0.00 0.00 53.44 51.00 2agw n ALA 421 Cb 1.06 -1.22 -0.12 0.00 0.00 0.00 0.00 19.45 19.16 2agw n ALA 421 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2agw s SER 422 N -0.98 4.48 -0.13 0.00 0.15 0.00 -1.40 113.70 115.83 2agw s SER 422 Ca 0.32 -0.14 0.18 0.00 0.70 0.00 0.00 55.95 57.01 2agw s SER 422 Cb 0.16 -1.39 0.30 0.00 -1.71 0.00 0.00 66.02 63.38 2agw s SER 422 CO -0.18 0.27 1.17 0.18 1.20 0.00 0.00 173.24 175.88 2agw n LEU 423 N 2.87 2.50 -3.67 3.45 4.77 -1.26 -3.34 117.00 122.32 2agw n LEU 423 Ca -0.18 -3.01 -0.09 0.00 -0.03 0.00 0.00 56.01 52.70 2agw n LEU 423 Cb 0.53 -0.42 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 2agw n LEU 423 CO 0.29 0.69 0.08 -1.58 -1.33 0.00 0.00 177.39 175.55 2agw s GLN 424 N -2.75 0.41 0.04 3.23 0.74 -1.26 -4.55 119.66 115.52 2agw s GLN 424 Ca 0.31 0.97 0.06 0.00 0.05 0.00 0.00 55.36 56.75 2agw s GLN 424 Cb 0.27 0.18 -0.02 0.00 1.10 0.00 0.00 33.01 34.54 2agw s GLN 424 CO 0.04 -0.20 -0.17 0.54 -0.55 0.00 0.00 175.29 174.95 2agw s VAL 425 N 1.98 1.33 -0.01 1.34 0.11 -1.26 -1.35 120.40 122.54 2agw s VAL 425 Ca -0.06 -1.07 -0.03 0.00 -2.93 0.00 0.00 61.98 57.89 2agw s VAL 425 Cb -0.10 -1.18 -0.00 0.00 -1.53 0.00 0.00 36.38 33.57 2agw s VAL 425 CO -0.14 0.08 0.05 -1.10 -3.33 0.00 0.00 175.10 170.67 2agw s GLN 426 N -1.15 0.23 0.46 1.54 -0.21 -0.51 -4.54 119.66 115.48 2agw s GLN 426 Ca 0.04 -0.22 -0.18 0.00 0.02 0.00 0.00 55.36 55.02 2agw s GLN 426 Cb -0.08 0.09 -0.09 0.00 1.00 0.00 0.00 33.01 33.93 2agw s GLN 426 CO 0.01 -0.04 0.94 -0.06 -2.12 0.00 0.00 175.29 174.02 2agw s PHE 427 N -0.69 3.38 0.19 0.91 0.40 -1.26 -0.10 117.98 120.80 2agw s PHE 427 Ca -0.08 1.50 -0.31 0.00 -0.60 0.00 0.00 56.93 57.44 2agw s PHE 427 Cb -0.05 -2.79 -0.10 0.00 0.51 0.00 0.00 43.02 40.59 2agw s PHE 427 CO 0.00 -0.20 1.56 -1.58 0.70 0.00 0.00 175.22 175.70 2agw s HIS 428 N -2.36 3.02 0.34 0.36 2.46 -0.29 -4.90 115.29 113.92 2agw s HIS 428 Ca 0.60 0.69 -0.28 0.00 0.47 0.00 0.00 55.06 56.53 2agw s HIS 428 Cb -0.10 -3.93 -0.10 0.00 -0.13 0.00 0.00 32.58 28.32 2agw s HIS 428 CO 0.22 -3.37 1.33 -2.14 -2.47 0.00 0.00 174.74 168.32 2agw s PRO 429 N 0.76 4.29 0.00 2.88 0.02 -1.26 -4.88 135.00 136.81 2agw s PRO 429 Ca 0.68 2.27 0.00 0.00 0.02 0.00 0.00 61.00 63.97 2agw s PRO 429 Cb -0.44 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.05 2agw s PRO 429 CO 0.35 -0.27 0.00 1.33 -0.33 0.00 0.00 177.00 178.08 2agw n VAL 430 N 0.69 0.00 0.22 3.83 0.24 -1.26 -4.63 118.33 117.41 2agw n VAL 430 Ca 0.00 -0.39 0.10 0.00 -2.04 0.00 0.00 64.34 62.02 2agw n VAL 430 Cb 0.41 0.90 0.45 0.00 -1.47 0.00 0.00 33.84 34.14 2agw n VAL 430 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2agw h GLY 431 N 0.00 0.00 0.00 7.63 0.00 -1.92 -3.52 103.07 105.27 2agw h GLY 431 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2agw h GLY 431 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15