#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q3r s VAL 10 N 0.00 3.33 0.33 0.44 1.01 -1.26 -4.88 120.40 119.37 2q3r s VAL 10 Ca 0.00 0.31 0.11 0.00 0.00 0.00 0.00 61.98 62.40 2q3r s VAL 10 Cb 0.00 -3.51 0.33 0.00 0.00 0.00 0.00 36.38 33.20 2q3r s VAL 10 CO 0.00 -0.37 1.74 -0.65 0.00 0.00 0.00 175.10 175.82 2q3r h PRO 11 N 14.19 0.53 -0.74 2.72 0.11 -1.97 -0.13 132.00 146.72 2q3r h PRO 11 Ca -0.33 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.72 2q3r h PRO 11 Cb 1.19 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 2q3r h PRO 11 CO 1.06 0.35 0.35 -0.07 -0.21 0.00 0.00 178.00 179.47 2q3r h LEU 12 N 0.55 0.96 -1.31 2.35 3.38 -1.87 -2.38 115.31 116.99 2q3r h LEU 12 Ca 0.64 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.49 2q3r h LEU 12 Cb 1.28 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2q3r h LEU 12 CO -0.44 0.82 0.00 0.18 0.09 0.00 0.00 178.44 179.09 2q3r n LEU 13 N -4.32 1.76 -4.85 1.67 7.99 -0.07 0.13 117.00 119.31 2q3r n LEU 13 Ca 0.07 -0.89 -0.37 0.00 -0.01 0.00 0.00 56.01 54.81 2q3r n LEU 13 Cb 0.14 -0.42 -0.06 0.00 -0.11 0.00 0.00 43.42 42.98 2q3r n LEU 13 CO 0.39 0.31 0.01 0.42 -1.51 0.00 0.00 177.39 177.00 2q3r s THR 14 N -1.52 5.20 0.97 -5.08 -4.23 -0.90 -4.54 115.64 105.54 2q3r s THR 14 Ca 0.12 0.60 -0.11 0.00 -1.18 0.00 0.00 61.69 61.12 2q3r s THR 14 Cb 0.09 -3.60 0.14 0.00 1.34 0.00 0.00 72.50 70.46 2q3r s THR 14 CO 0.05 0.58 0.89 -2.65 -0.54 0.00 0.00 174.62 172.95 2q3r n PRO 15 N 1.83 -0.73 -3.63 3.99 -0.02 -1.25 -3.76 135.00 131.43 2q3r n PRO 15 Ca -0.16 -0.16 -0.14 0.00 -2.02 0.00 0.00 63.50 61.02 2q3r n PRO 15 Cb 0.53 -2.19 -0.07 0.00 -0.02 0.00 0.00 33.50 31.75 2q3r n PRO 15 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2q3r s TYR 16 N -2.53 -0.77 -0.25 6.00 5.04 -1.07 -4.96 117.35 118.81 2q3r s TYR 16 Ca 0.64 1.85 -0.09 0.00 -2.44 0.00 0.00 57.07 57.03 2q3r s TYR 16 Cb -0.22 0.28 -0.04 0.00 0.35 0.00 0.00 41.96 42.33 2q3r s TYR 16 CO 0.62 -0.38 0.13 0.15 -1.34 0.00 0.00 175.55 174.73 2q3r s LYS 17 N 0.30 3.89 -0.59 4.97 1.02 -1.26 -2.02 119.74 126.04 2q3r s LYS 17 Ca -0.00 -0.36 0.02 0.00 0.02 0.00 0.00 55.97 55.65 2q3r s LYS 17 Cb -0.05 -3.48 0.15 0.00 -0.52 0.00 0.00 37.83 33.93 2q3r s LYS 17 CO 0.01 -0.08 0.37 1.41 -0.92 0.00 0.00 175.35 176.13 2q3r s MET 18 N 1.42 2.27 7.30 1.68 -2.45 -1.06 -4.98 119.30 123.48 2q3r s MET 18 Ca 0.06 -2.74 0.00 0.00 -1.25 0.00 0.00 55.69 51.76 2q3r s MET 18 Cb -0.15 -3.48 0.00 0.00 1.25 0.00 0.00 34.83 32.45 2q3r s MET 18 CO 0.06 -1.16 0.00 0.41 1.05 0.00 0.00 175.02 175.38 2q3r n GLY 19 N 3.00 1.99 0.35 2.11 0.00 -1.26 -3.06 105.19 108.32 2q3r n GLY 19 Ca 0.09 -0.42 0.10 0.00 0.00 0.00 0.00 46.02 45.78 2q3r n GLY 19 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2q3r n ARG 20 N 12.50 1.16 -2.56 1.61 3.00 -1.26 -4.92 116.66 126.19 2q3r n ARG 20 Ca 0.00 -0.71 -0.43 0.00 -0.00 0.00 0.00 57.85 56.71 2q3r n ARG 20 Cb 0.00 -1.42 -0.02 0.00 0.00 0.00 0.00 32.46 31.02 2q3r n ARG 20 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2q3r s PHE 21 N -2.44 3.28 -0.38 -0.14 0.40 -1.17 -5.02 117.98 112.51 2q3r s PHE 21 Ca 0.15 1.35 -0.13 0.00 -0.60 0.00 0.00 56.93 57.70 2q3r s PHE 21 Cb 0.16 -3.33 0.01 0.00 0.51 0.00 0.00 43.02 40.37 2q3r s PHE 21 CO 0.59 -0.87 0.26 -0.80 0.70 0.00 0.00 175.22 175.10 2q3r s ASN 22 N 1.37 6.00 -0.07 1.36 0.01 -1.26 -2.56 114.94 119.79 2q3r s ASN 22 Ca 0.52 -0.77 -0.21 0.00 -0.71 0.00 0.00 52.86 51.68 2q3r s ASN 22 Cb -0.21 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.29 2q3r s ASN 22 CO 0.18 -0.37 0.60 -0.76 -1.51 0.00 0.00 177.10 175.24 2q3r s LEU 23 N 1.67 4.33 0.51 0.60 1.43 -0.86 -4.77 118.68 121.60 2q3r s LEU 23 Ca 0.05 1.06 0.30 0.00 -1.03 0.00 0.00 54.13 54.51 2q3r s LEU 23 Cb -0.18 -2.92 1.21 0.00 0.03 0.00 0.00 46.19 44.33 2q3r s LEU 23 CO 0.09 -0.02 1.93 0.28 0.23 0.00 0.00 176.35 178.86 2q3r h SER 24 N 6.47 0.00 -5.05 2.29 0.02 -1.01 -2.83 113.55 113.44 2q3r h SER 24 Ca -0.42 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.52 2q3r h SER 24 Cb 1.19 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.63 2q3r h SER 24 CO 0.74 0.08 0.10 -1.38 -1.14 0.00 0.00 176.83 175.22 2q3r s HIS 25 N -3.68 -0.23 -1.85 3.45 0.00 -1.26 -3.91 115.29 107.81 2q3r s HIS 25 Ca 0.01 -0.10 0.17 0.00 -3.00 0.00 0.00 55.06 52.14 2q3r s HIS 25 Cb 0.09 0.47 0.51 0.00 -4.00 0.00 0.00 32.58 29.66 2q3r s HIS 25 CO 0.58 -0.94 1.42 0.54 -1.00 0.00 0.00 174.74 175.34 2q3r n ARG 26 N -0.36 2.46 -2.78 -0.38 1.74 0.36 -4.76 116.66 112.93 2q3r n ARG 26 Ca -0.11 -2.06 -0.43 0.00 -0.77 0.00 0.00 57.85 54.48 2q3r n ARG 26 Cb 0.63 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.53 2q3r n ARG 26 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2q3r s VAL 27 N -1.35 4.33 -0.00 1.55 1.01 -1.26 -3.43 120.40 121.25 2q3r s VAL 27 Ca 0.38 0.47 -0.13 0.00 0.00 0.00 0.00 61.98 62.70 2q3r s VAL 27 Cb 0.21 -4.56 -0.05 0.00 0.00 0.00 0.00 36.38 31.97 2q3r s VAL 27 CO 0.24 -1.12 0.36 -0.69 0.00 0.00 0.00 175.10 173.90 2q3r s VAL 28 N 4.12 5.11 -0.38 2.92 1.01 -1.17 -4.49 120.40 127.53 2q3r s VAL 28 Ca 0.34 0.67 -0.28 0.00 0.00 0.00 0.00 61.98 62.70 2q3r s VAL 28 Cb -0.11 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.64 2q3r s VAL 28 CO 0.21 0.53 1.07 -0.22 0.00 0.00 0.00 175.10 176.70 2q3r s LEU 29 N -1.22 3.85 0.71 3.92 2.96 0.13 -2.12 118.68 126.91 2q3r s LEU 29 Ca 0.24 0.79 -0.14 0.00 -0.22 0.00 0.00 54.13 54.80 2q3r s LEU 29 Cb -0.15 -3.50 0.03 0.00 0.50 0.00 0.00 46.19 43.06 2q3r s LEU 29 CO 0.13 -0.99 1.12 0.00 -1.32 0.00 0.00 176.35 175.29 2q3r s ALA 30 N 3.87 2.32 0.11 5.97 0.00 -1.00 -0.98 121.76 132.05 2q3r s ALA 30 Ca 0.45 0.53 -0.31 0.00 0.00 0.00 0.00 51.96 52.63 2q3r s ALA 30 Cb -0.11 -3.34 -0.08 0.00 0.00 0.00 0.00 23.12 19.60 2q3r s ALA 30 CO 0.21 -1.55 1.36 -1.25 0.00 0.00 0.00 175.76 174.53 2q3r s PRO 31 N -4.28 4.33 -0.24 0.00 0.04 -1.26 -4.68 135.00 128.92 2q3r s PRO 31 Ca 0.67 2.04 -0.03 0.00 0.04 0.00 0.00 61.00 63.71 2q3r s PRO 31 Cb -0.21 -3.26 0.08 0.00 0.04 0.00 0.00 34.50 31.14 2q3r s PRO 31 CO 0.46 -0.41 0.07 -0.51 0.04 0.00 0.00 177.00 176.65 2q3r s LEU 32 N 1.10 1.22 0.01 -3.56 1.43 -1.26 -4.87 118.68 112.75 2q3r s LEU 32 Ca 0.64 -1.07 -0.30 0.00 -1.03 0.00 0.00 54.13 52.37 2q3r s LEU 32 Cb -0.36 -0.57 -0.08 0.00 0.03 0.00 0.00 46.19 45.20 2q3r s LEU 32 CO 0.30 -0.36 1.96 -0.89 0.23 0.00 0.00 176.35 177.59 2q3r s THR 33 N 1.88 3.07 -0.11 5.49 2.01 -1.26 -4.25 115.64 122.47 2q3r s THR 33 Ca 0.04 0.09 0.03 0.00 0.31 0.00 0.00 61.69 62.15 2q3r s THR 33 Cb -0.17 -3.06 -0.03 0.00 0.01 0.00 0.00 72.50 69.25 2q3r s THR 33 CO -0.17 -0.01 0.11 0.54 -0.69 0.00 0.00 174.62 174.40 2q3r n ARG 34 N 7.59 4.91 -2.94 4.92 5.12 -1.26 -4.78 116.66 130.22 2q3r n ARG 34 Ca 0.20 -0.01 -0.20 0.00 -1.93 0.00 0.00 57.85 55.91 2q3r n ARG 34 Cb 0.41 -0.72 0.01 0.00 -1.16 0.00 0.00 32.46 31.01 2q3r n ARG 34 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2q3r n GLN 35 N -1.17 -3.52 -0.60 5.56 6.02 -1.26 -4.30 117.38 118.11 2q3r n GLN 35 Ca 0.00 0.72 0.04 0.00 -0.01 0.00 0.00 57.00 57.76 2q3r n GLN 35 Cb 0.05 -5.46 0.20 0.00 1.02 0.00 0.00 30.24 26.05 2q3r n GLN 35 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2q3r n ARG 36 N -3.57 1.64 -3.42 -1.09 1.74 -1.14 -4.62 116.66 106.21 2q3r n ARG 36 Ca -0.11 -3.22 -0.35 0.00 -0.77 0.00 0.00 57.85 53.40 2q3r n ARG 36 Cb 0.60 -1.66 -0.05 0.00 -1.02 0.00 0.00 32.46 30.34 2q3r n ARG 36 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2q3r n SER 37 N -1.14 4.66 -4.58 0.55 7.64 0.70 -4.38 113.62 117.08 2q3r n SER 37 Ca 0.22 -3.29 -0.63 0.00 1.01 0.00 0.00 58.87 56.18 2q3r n SER 37 Cb 0.76 -1.01 -0.09 0.00 -1.01 0.00 0.00 64.21 62.87 2q3r n SER 37 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2q3r n TYR 38 N 1.65 1.23 -1.07 1.43 0.53 -1.19 -0.15 117.16 119.58 2q3r n TYR 38 Ca 0.25 1.10 -0.02 0.00 -1.02 0.00 0.00 57.90 58.20 2q3r n TYR 38 Cb 0.37 -2.14 -0.01 0.00 -1.03 0.00 0.00 39.34 36.53 2q3r n TYR 38 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2q3r n GLY 39 N 2.81 0.40 1.40 2.72 0.00 -1.26 -1.39 105.19 109.87 2q3r n GLY 39 Ca 0.26 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2q3r n GLY 39 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2q3r n ASN 40 N -0.57 -2.10 -4.56 1.61 5.03 0.79 -4.99 115.26 110.48 2q3r n ASN 40 Ca -0.02 0.00 -0.35 0.00 0.87 0.00 0.00 54.58 55.08 2q3r n ASN 40 Cb 0.35 -0.35 -0.11 0.00 -1.02 0.00 0.00 39.78 38.65 2q3r n ASN 40 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2q3r s VAL 41 N -2.00 4.52 0.42 2.41 1.01 -0.49 -1.45 120.40 124.83 2q3r s VAL 41 Ca 0.00 -0.12 -0.24 0.00 0.00 0.00 0.00 61.98 61.61 2q3r s VAL 41 Cb 0.00 -3.05 -0.10 0.00 0.00 0.00 0.00 36.38 33.23 2q3r s VAL 41 CO 0.00 0.43 1.05 -2.65 0.00 0.00 0.00 175.10 173.92 2q3r n PRO 42 N 3.97 1.42 -4.14 2.72 -0.02 -1.26 -3.20 135.00 134.49 2q3r n PRO 42 Ca -0.16 0.51 -0.22 0.00 -2.02 0.00 0.00 63.50 61.60 2q3r n PRO 42 Cb 0.52 -2.09 -0.06 0.00 -0.02 0.00 0.00 33.50 31.85 2q3r n PRO 42 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2q3r s GLN 43 N -2.06 2.53 0.44 -0.52 -1.52 -1.26 -4.89 119.66 112.38 2q3r s GLN 43 Ca 0.63 -1.34 0.17 0.00 -1.95 0.00 0.00 55.36 52.87 2q3r s GLN 43 Cb -0.55 -2.31 1.09 0.00 -0.22 0.00 0.00 33.01 31.03 2q3r s GLN 43 CO 0.57 0.27 1.93 -1.35 -0.25 0.00 0.00 175.29 176.46 2q3r h PRO 44 N 1.62 0.36 -0.25 2.91 0.11 -1.94 -1.20 132.00 133.60 2q3r h PRO 44 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2q3r h PRO 44 Cb 1.25 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2q3r h PRO 44 CO 0.61 0.24 0.17 1.12 -0.21 0.00 0.00 178.00 179.92 2q3r h HIS 45 N 0.37 0.31 -0.95 0.65 2.07 -1.94 -2.31 115.15 113.36 2q3r h HIS 45 Ca 0.36 0.01 0.27 0.00 -2.85 0.00 0.00 60.37 58.15 2q3r h HIS 45 Cb 0.87 -0.11 -0.17 0.00 2.57 0.00 0.00 27.41 30.57 2q3r h HIS 45 CO -0.00 0.20 0.08 0.00 -3.07 0.00 0.00 177.93 175.13 2q3r h ALA 46 N 1.09 1.20 -0.63 6.11 0.00 -1.54 1.33 119.26 126.83 2q3r h ALA 46 Ca 0.09 0.31 0.13 0.00 0.00 0.00 0.00 54.91 55.45 2q3r h ALA 46 Cb -0.04 0.53 -0.10 0.00 0.00 0.00 0.00 17.79 18.19 2q3r h ALA 46 CO -0.02 -0.57 0.08 0.00 0.00 0.00 0.00 179.25 178.74 2q3r h ALA 47 N 1.93 0.71 -0.06 0.00 0.00 -1.49 0.32 119.26 120.67 2q3r h ALA 47 Ca 0.59 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.65 2q3r h ALA 47 Cb 1.22 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 2q3r h ALA 47 CO -0.86 -0.35 -0.02 0.82 0.00 0.00 0.00 179.25 178.84 2q3r h ILE 48 N 0.20 1.29 0.07 0.00 1.08 0.15 -2.84 117.51 117.46 2q3r h ILE 48 Ca 0.34 -0.92 0.01 0.00 -0.39 0.00 0.00 64.86 63.90 2q3r h ILE 48 Cb 0.54 1.78 -0.04 0.00 -3.07 0.00 0.00 36.82 36.03 2q3r h ILE 48 CO -0.48 0.25 -0.45 0.22 -0.69 0.00 0.00 178.15 177.01 2q3r h TYR 49 N -0.22 -1.31 -0.08 1.37 3.20 0.22 -0.43 116.97 119.72 2q3r h TYR 49 Ca 0.02 0.04 -0.12 0.00 3.14 0.00 0.00 58.73 61.80 2q3r h TYR 49 Cb 0.41 0.56 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 2q3r h TYR 49 CO 0.05 -0.50 -0.49 1.88 -1.64 0.00 0.00 178.16 177.46 2q3r h TYR 50 N -0.62 0.26 -0.69 -3.82 0.05 -0.62 -2.94 116.97 108.59 2q3r h TYR 50 Ca -0.00 -0.08 -0.03 0.00 0.05 0.00 0.00 58.73 58.66 2q3r h TYR 50 Cb 0.63 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 38.29 2q3r h TYR 50 CO -0.45 0.67 0.31 1.03 -1.05 0.00 0.00 178.16 178.67 2q3r h SER 51 N 0.17 0.91 0.04 3.88 0.87 -1.32 -1.75 113.55 116.35 2q3r h SER 51 Ca 0.01 -0.11 -0.05 0.00 -1.23 0.00 0.00 61.79 60.41 2q3r h SER 51 Cb 0.93 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 2q3r h SER 51 CO 0.07 0.79 -0.13 1.56 -0.53 0.00 0.00 176.83 178.60 2q3r h GLN 52 N 0.99 0.20 -0.29 2.24 4.20 -0.90 -2.73 115.11 118.83 2q3r h GLN 52 Ca 0.24 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2q3r h GLN 52 Cb 0.14 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.89 2q3r h GLN 52 CO -0.03 0.34 0.00 0.54 -0.67 0.00 0.00 178.83 179.01 2q3r n ARG 53 N -4.29 2.15 -3.29 1.46 1.74 -0.73 -4.51 116.66 109.19 2q3r n ARG 53 Ca -0.01 -1.74 -0.35 0.00 -0.77 0.00 0.00 57.85 54.98 2q3r n ARG 53 Cb 0.26 -1.45 -0.06 0.00 -1.02 0.00 0.00 32.46 30.18 2q3r n ARG 53 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2q3r s THR 54 N -1.64 4.78 0.07 0.55 2.01 -0.80 -4.96 115.64 115.65 2q3r s THR 54 Ca 0.35 0.93 0.03 0.00 0.31 0.00 0.00 61.69 63.31 2q3r s THR 54 Cb 0.20 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.93 2q3r s THR 54 CO 0.29 0.20 -0.08 0.42 -0.69 0.00 0.00 174.62 174.75 2q3r s THR 55 N -1.52 0.70 -0.52 -0.82 -4.23 -1.26 -4.95 115.64 103.03 2q3r s THR 55 Ca 0.40 -1.44 -0.30 0.00 -1.18 0.00 0.00 61.69 59.17 2q3r s THR 55 Cb -0.15 -1.09 -0.11 0.00 1.34 0.00 0.00 72.50 72.49 2q3r s THR 55 CO 0.20 -0.54 2.38 -2.65 -0.54 0.00 0.00 174.62 173.47 2q3r n PRO 56 N 0.85 0.94 -1.84 3.99 -0.02 -1.08 -0.37 135.00 137.47 2q3r n PRO 56 Ca -0.18 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 2q3r n PRO 56 Cb 0.57 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 2q3r n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q3r n GLY 57 N 6.26 0.50 3.88 -1.23 0.00 0.12 -4.33 105.19 110.37 2q3r n GLY 57 Ca 0.43 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 2q3r n GLY 57 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2q3r s GLY 58 N -2.92 2.27 -0.22 -0.02 0.00 0.51 -0.54 107.32 106.39 2q3r s GLY 58 Ca 0.00 -0.54 -0.18 0.00 0.00 0.00 0.00 44.72 44.00 2q3r s GLY 58 CO 0.00 -0.34 0.49 -0.12 0.00 0.00 0.00 173.10 173.13 2q3r s PHE 59 N -1.28 3.34 -0.05 1.90 5.99 -1.26 0.35 117.98 126.97 2q3r s PHE 59 Ca 0.27 0.69 0.03 0.00 0.00 0.00 0.00 56.93 57.92 2q3r s PHE 59 Cb -0.13 -2.65 0.00 0.00 0.00 0.00 0.00 43.02 40.24 2q3r s PHE 59 CO 0.15 -0.14 -0.13 -0.51 -0.00 0.00 0.00 175.22 174.59 2q3r s LEU 60 N 1.79 1.78 0.02 6.12 1.02 -0.76 -0.69 118.68 127.96 2q3r s LEU 60 Ca 0.22 -0.29 0.02 0.00 0.02 0.00 0.00 54.13 54.10 2q3r s LEU 60 Cb -0.15 -0.82 -0.04 0.00 0.02 0.00 0.00 46.19 45.20 2q3r s LEU 60 CO 0.09 0.08 0.01 -0.63 0.02 0.00 0.00 176.35 175.92 2q3r s ILE 61 N 0.33 4.15 0.71 -0.59 1.01 -0.15 -1.30 121.20 125.36 2q3r s ILE 61 Ca -0.08 -0.69 -0.09 0.00 0.00 0.00 0.00 60.65 59.79 2q3r s ILE 61 Cb -0.13 -2.89 0.05 0.00 0.01 0.00 0.00 42.46 39.50 2q3r s ILE 61 CO 0.02 0.31 1.06 0.42 0.00 0.00 0.00 174.94 176.75 2q3r s THR 62 N -1.15 2.72 0.92 2.92 -4.23 -0.93 -4.28 115.64 111.61 2q3r s THR 62 Ca 0.21 0.02 -0.10 0.00 -1.18 0.00 0.00 61.69 60.64 2q3r s THR 62 Cb -0.12 -3.19 0.14 0.00 1.34 0.00 0.00 72.50 70.67 2q3r s THR 62 CO 0.13 -0.23 1.09 -1.84 -0.54 0.00 0.00 174.62 173.23 2q3r n GLU 63 N -2.99 -0.44 -1.73 3.99 0.28 -1.26 -4.10 120.64 114.39 2q3r n GLU 63 Ca 0.07 -0.06 -0.42 0.00 -0.16 0.00 0.00 57.16 56.59 2q3r n GLU 63 Cb 0.59 -2.34 -0.01 0.00 1.43 0.00 0.00 31.44 31.12 2q3r n GLU 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2q3r n ALA 64 N -4.19 1.78 -2.72 -1.84 0.00 -1.26 -4.39 120.51 107.88 2q3r n ALA 64 Ca 0.12 0.36 -0.28 0.00 0.00 0.00 0.00 53.44 53.63 2q3r n ALA 64 Cb 0.52 -2.33 -0.16 0.00 0.00 0.00 0.00 19.45 17.48 2q3r n ALA 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2q3r s THR 65 N -1.02 1.69 0.31 0.00 2.01 0.61 -4.56 115.64 114.67 2q3r s THR 65 Ca 0.55 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 61.39 2q3r s THR 65 Cb -0.53 -1.43 -0.10 0.00 0.01 0.00 0.00 72.50 70.45 2q3r s THR 65 CO 0.62 0.48 1.27 -0.83 -0.69 0.00 0.00 174.62 175.47 2q3r s GLY 66 N -0.17 2.93 0.00 4.40 0.00 -1.14 0.42 107.32 113.76 2q3r s GLY 66 Ca -0.00 1.18 0.26 0.00 0.00 0.00 0.00 44.72 46.16 2q3r s GLY 66 CO 0.02 1.87 1.57 3.33 0.00 0.00 0.00 173.10 179.88 2q3r n VAL 67 N 1.12 0.00 0.00 1.40 0.24 -0.94 -2.50 118.33 117.64 2q3r n VAL 67 Ca 0.01 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 2q3r n VAL 67 Cb 0.42 0.37 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 2q3r n VAL 67 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2q3r n SER 68 N -0.71 0.00 0.00 -1.34 3.41 -1.26 -4.43 113.62 109.29 2q3r n SER 68 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 2q3r n SER 68 Cb 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 2q3r n SER 68 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2q3r n ASP 69 N 0.00 0.00 -0.39 4.04 5.68 -1.26 0.35 116.55 124.97 2q3r n ASP 69 Ca 0.00 0.16 0.07 0.00 -0.50 0.00 0.00 54.79 54.52 2q3r n ASP 69 Cb 0.00 -0.16 0.01 0.00 -1.14 0.00 0.00 41.12 39.83 2q3r n ASP 69 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2q3r n THR 70 N -1.09 0.00 0.13 2.12 -2.24 -1.26 -3.75 114.28 108.19 2q3r n THR 70 Ca 0.00 -0.37 0.06 0.00 -2.27 0.00 0.00 64.05 61.47 2q3r n THR 70 Cb 0.24 1.20 0.04 0.00 -2.10 0.00 0.00 70.33 69.70 2q3r n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2q3r h ALA 71 N 2.70 0.72 -2.31 6.98 0.00 -0.41 -3.43 119.26 123.51 2q3r h ALA 71 Ca 0.00 -0.33 -0.49 0.00 0.00 0.00 0.00 54.91 54.09 2q3r h ALA 71 Cb 0.54 0.03 0.05 0.00 0.00 0.00 0.00 17.79 18.40 2q3r h ALA 71 CO 0.00 0.41 0.38 -0.65 0.00 0.00 0.00 179.25 179.39 2q3r s GLN 72 N -3.09 3.49 0.00 0.00 1.11 -1.26 0.13 119.66 120.05 2q3r s GLN 72 Ca 0.03 1.15 0.00 0.00 0.01 0.00 0.00 55.36 56.55 2q3r s GLN 72 Cb 0.07 -2.06 0.00 0.00 -1.01 0.00 0.00 33.01 30.01 2q3r s GLN 72 CO 0.75 -0.66 0.00 0.41 0.01 0.00 0.00 175.29 175.79 2q3r n GLY 73 N -1.09 1.00 2.98 3.09 0.00 -1.26 -4.66 105.19 105.25 2q3r n GLY 73 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 2q3r n GLY 73 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2q3r s TYR 74 N 0.00 0.42 0.53 1.61 2.02 -1.26 -4.54 117.35 116.14 2q3r s TYR 74 Ca 0.00 -0.26 -0.20 0.00 -0.37 0.00 0.00 57.07 56.24 2q3r s TYR 74 Cb 0.00 -0.27 -0.06 0.00 -0.40 0.00 0.00 41.96 41.24 2q3r s TYR 74 CO 0.00 -0.05 1.16 -0.65 -1.57 0.00 0.00 175.55 174.44 2q3r s GLN 75 N -0.72 3.37 -0.53 -0.62 -0.21 -1.26 -3.53 119.66 116.15 2q3r s GLN 75 Ca -0.04 1.71 0.00 0.00 0.02 0.00 0.00 55.36 57.04 2q3r s GLN 75 Cb -0.05 -2.09 0.00 0.00 1.00 0.00 0.00 33.01 31.87 2q3r s GLN 75 CO -0.00 -0.85 0.00 -0.25 -2.12 0.00 0.00 175.29 172.07 2q3r n ASP 76 N -1.15 -4.26 -4.72 5.90 9.92 -1.26 -4.65 116.55 116.32 2q3r n ASP 76 Ca 0.11 0.12 -0.39 0.00 -0.53 0.00 0.00 54.79 54.10 2q3r n ASP 76 Cb 0.50 -3.02 -0.05 0.00 -0.64 0.00 0.00 41.12 37.91 2q3r n ASP 76 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2q3r s THR 77 N -1.24 5.04 1.01 -3.53 -4.23 -1.23 -0.21 115.64 111.25 2q3r s THR 77 Ca 0.00 1.35 -0.12 0.00 -1.18 0.00 0.00 61.69 61.74 2q3r s THR 77 Cb 0.00 -3.99 0.17 0.00 1.34 0.00 0.00 72.50 70.01 2q3r s THR 77 CO 0.00 0.29 0.89 -0.81 -0.54 0.00 0.00 174.62 174.45 2q3r n PRO 78 N 3.58 -1.09 -4.45 3.99 -0.04 -1.26 -4.37 135.00 131.35 2q3r n PRO 78 Ca -0.03 -0.27 -0.22 0.00 -0.04 0.00 0.00 63.50 62.94 2q3r n PRO 78 Cb 0.51 -2.17 -0.11 0.00 -0.04 0.00 0.00 33.50 31.69 2q3r n PRO 78 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2q3r s GLY 79 N -2.40 2.05 -0.21 0.55 0.00 -0.52 -2.89 107.32 103.90 2q3r s GLY 79 Ca 0.65 -2.05 0.19 0.00 0.00 0.00 0.00 44.72 43.51 2q3r s GLY 79 CO 0.62 -1.83 1.15 4.51 0.00 0.00 0.00 173.10 177.56 2q3r n ILE 80 N -0.68 1.38 0.67 0.90 3.06 -1.04 -4.69 119.36 118.95 2q3r n ILE 80 Ca -0.03 -2.83 0.08 0.00 -2.50 0.00 0.00 62.75 57.47 2q3r n ILE 80 Cb 0.66 0.53 0.05 0.00 0.54 0.00 0.00 39.64 41.43 2q3r n ILE 80 CO 0.00 0.00 0.00 -2.67 -2.50 0.00 0.00 176.55 171.38 2q3r n TRP 81 N -0.44 0.00 -4.60 9.51 2.14 -1.26 -4.77 117.44 118.01 2q3r n TRP 81 Ca 0.16 0.00 -0.31 0.00 2.07 0.00 0.00 57.50 59.43 2q3r n TRP 81 Cb 0.90 0.00 -0.12 0.00 -0.81 0.00 0.00 31.31 31.28 2q3r n TRP 81 CO 0.00 0.00 0.00 0.95 2.07 0.00 0.00 177.69 180.71 2q3r s THR 82 N -1.41 2.85 0.32 -1.67 -4.23 -1.26 -4.98 115.64 105.27 2q3r s THR 82 Ca 0.18 -1.20 0.10 0.00 -1.18 0.00 0.00 61.69 59.59 2q3r s THR 82 Cb 0.13 -2.22 0.34 0.00 1.34 0.00 0.00 72.50 72.09 2q3r s THR 82 CO 0.23 0.31 1.63 0.11 -0.54 0.00 0.00 174.62 176.36 2q3r h LYS 83 N 4.44 0.19 -0.97 3.99 1.57 -2.00 1.47 116.57 125.26 2q3r h LYS 83 Ca -0.48 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.31 2q3r h LYS 83 Cb 1.16 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.37 2q3r h LYS 83 CO 0.48 0.12 0.64 1.49 -0.57 0.00 0.00 179.45 181.61 2q3r h GLU 84 N 0.19 1.24 0.41 3.15 4.81 -1.99 -1.44 114.58 120.95 2q3r h GLU 84 Ca 0.68 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.81 2q3r h GLU 84 Cb 1.53 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2q3r h GLU 84 CO -0.69 0.82 -0.21 0.45 -0.73 0.00 0.00 179.01 178.65 2q3r h HIS 85 N 1.28 -0.54 -0.95 0.92 3.86 0.17 -1.93 115.15 117.95 2q3r h HIS 85 Ca 0.37 -0.01 0.19 0.00 -1.16 0.00 0.00 60.37 59.76 2q3r h HIS 85 Cb -0.09 0.18 -0.11 0.00 1.06 0.00 0.00 27.41 28.46 2q3r h HIS 85 CO -0.00 -0.33 0.53 0.28 0.86 0.00 0.00 177.93 179.26 2q3r h VAL 86 N -0.57 0.65 -0.09 2.45 2.07 -0.75 -1.40 116.25 118.61 2q3r h VAL 86 Ca -0.05 -0.22 -0.20 0.00 0.82 0.00 0.00 66.70 67.04 2q3r h VAL 86 Cb 0.45 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 2q3r h VAL 86 CO 0.08 0.12 -0.78 -0.33 0.02 0.00 0.00 177.57 176.68 2q3r h GLU 87 N 0.64 0.52 0.00 1.57 4.39 -0.94 -2.63 114.58 118.13 2q3r h GLU 87 Ca 0.56 -0.44 -0.12 0.00 0.34 0.00 0.00 59.36 59.70 2q3r h GLU 87 Cb 0.92 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.65 2q3r h GLU 87 CO -0.42 1.07 -0.56 0.00 -1.16 0.00 0.00 179.01 177.95 2q3r h ALA 88 N 0.79 1.05 -0.05 3.43 0.00 -0.88 -3.14 119.26 120.46 2q3r h ALA 88 Ca -0.05 -0.51 -0.21 0.00 0.00 0.00 0.00 54.91 54.15 2q3r h ALA 88 Cb 1.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2q3r h ALA 88 CO 0.14 0.70 -0.83 -1.49 0.00 0.00 0.00 179.25 177.77 2q3r h TRP 89 N 0.00 0.66 -0.71 0.00 4.06 -1.21 -3.35 115.95 115.40 2q3r h TRP 89 Ca -0.01 -0.32 0.08 0.00 2.06 0.00 0.00 58.89 60.70 2q3r h TRP 89 Cb 1.01 -0.09 -0.10 0.00 -1.00 0.00 0.00 29.16 28.97 2q3r h TRP 89 CO 0.00 1.12 -0.55 0.87 -3.56 0.00 0.00 178.44 176.31 2q3r h LYS 90 N 0.30 -0.18 0.00 0.49 1.57 -1.41 0.27 116.57 117.61 2q3r h LYS 90 Ca -0.06 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2q3r h LYS 90 Cb 1.44 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.80 2q3r h LYS 90 CO 0.15 -0.12 -0.00 -1.00 -0.57 0.00 0.00 179.45 177.90 2q3r h PRO 91 N -0.19 0.00 -0.05 3.15 0.13 -1.73 0.73 132.00 134.04 2q3r h PRO 91 Ca 0.13 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.24 2q3r h PRO 91 Cb 0.51 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.64 2q3r h PRO 91 CO -0.77 0.00 -0.07 0.82 -0.23 0.00 0.00 178.00 177.75 2q3r h ILE 92 N 0.00 1.41 -0.72 -3.56 2.04 -0.67 -1.90 117.51 114.11 2q3r h ILE 92 Ca -0.00 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.53 2q3r h ILE 92 Cb 0.03 2.18 -0.03 0.00 -0.74 0.00 0.00 36.82 38.25 2q3r h ILE 92 CO 0.00 0.36 0.42 0.58 0.00 0.00 0.00 178.15 179.51 2q3r h VAL 93 N -0.35 1.21 -0.33 1.67 2.07 -0.60 -2.20 116.25 117.72 2q3r h VAL 93 Ca 0.00 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 2q3r h VAL 93 Cb 0.62 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 2q3r h VAL 93 CO 0.02 0.23 0.20 0.44 0.02 0.00 0.00 177.57 178.47 2q3r h ASP 94 N 0.99 0.40 -0.33 0.57 5.19 -0.84 -0.93 116.42 121.46 2q3r h ASP 94 Ca 0.26 -0.06 -0.07 0.00 -0.62 0.00 0.00 57.03 56.54 2q3r h ASP 94 Cb -0.00 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.39 2q3r h ASP 94 CO -0.04 0.34 -0.01 0.00 -3.12 0.00 0.00 179.24 176.40 2q3r h ALA 95 N 1.08 1.18 -0.35 3.45 0.00 -1.22 0.23 119.26 123.63 2q3r h ALA 95 Ca 0.12 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2q3r h ALA 95 Cb 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2q3r h ALA 95 CO -0.02 0.53 0.13 0.28 0.00 0.00 0.00 179.25 180.17 2q3r h VAL 96 N 0.66 1.19 0.00 0.00 2.07 -1.03 -1.37 116.25 117.77 2q3r h VAL 96 Ca 0.13 -0.61 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 2q3r h VAL 96 Cb 0.42 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2q3r h VAL 96 CO 0.02 0.21 -0.17 0.45 0.02 0.00 0.00 177.57 178.10 2q3r h HIS 97 N 0.42 0.00 -0.95 1.57 -0.00 -0.90 -2.46 115.15 112.82 2q3r h HIS 97 Ca 0.12 0.00 0.14 0.00 -0.00 0.00 0.00 60.37 60.62 2q3r h HIS 97 Cb 0.20 0.00 -0.08 0.00 -0.00 0.00 0.00 27.41 27.53 2q3r h HIS 97 CO 0.00 0.17 0.60 0.00 -0.00 0.00 0.00 177.93 178.71 2q3r h ALA 98 N 1.83 1.69 -0.56 2.45 0.00 0.22 0.28 119.26 125.16 2q3r h ALA 98 Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2q3r h ALA 98 Cb 0.37 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2q3r h ALA 98 CO 0.02 0.05 0.00 1.63 0.00 0.00 0.00 179.25 180.96 2q3r n LYS 99 N -4.60 4.68 -1.34 0.00 5.02 -0.94 -4.96 118.16 116.02 2q3r n LYS 99 Ca 0.19 -3.03 -0.13 0.00 -2.02 0.00 0.00 58.31 53.32 2q3r n LYS 99 Cb 0.43 -2.21 -0.06 0.00 -0.02 0.00 0.00 35.03 33.17 2q3r n LYS 99 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2q3r n GLY 100 N 0.65 1.25 3.55 0.72 0.00 0.99 -2.65 105.19 109.71 2q3r n GLY 100 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 2q3r n GLY 100 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2q3r s GLY 101 N -2.17 1.80 0.73 -0.02 0.00 -1.12 0.10 107.32 106.64 2q3r s GLY 101 Ca 0.00 -1.06 -0.17 0.00 0.00 0.00 0.00 44.72 43.49 2q3r s GLY 101 CO 0.00 1.32 -0.46 1.39 0.00 0.00 0.00 173.10 175.35 2q3r n ILE 102 N 5.50 0.00 -3.29 0.90 -0.00 0.16 -4.51 119.36 118.12 2q3r n ILE 102 Ca -0.04 -0.49 -0.15 0.00 -0.00 0.00 0.00 62.75 62.07 2q3r n ILE 102 Cb 0.49 0.00 -0.06 0.00 -0.00 0.00 0.00 39.64 40.06 2q3r n ILE 102 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.55 176.67 2q3r s PHE 103 N -1.94 -0.42 0.44 1.39 5.36 -1.26 -1.84 117.98 119.71 2q3r s PHE 103 Ca 0.47 -0.87 -0.21 0.00 -0.96 0.00 0.00 56.93 55.36 2q3r s PHE 103 Cb -0.33 -0.32 -0.11 0.00 -0.34 0.00 0.00 43.02 41.93 2q3r s PHE 103 CO 0.73 -1.01 0.96 -0.06 -1.46 0.00 0.00 175.22 174.38 2q3r s PHE 104 N 1.24 3.27 -0.20 10.12 0.40 -0.42 -3.07 117.98 129.33 2q3r s PHE 104 Ca 0.20 1.61 -0.08 0.00 -0.60 0.00 0.00 56.93 58.06 2q3r s PHE 104 Cb -0.11 -2.89 -0.04 0.00 0.51 0.00 0.00 43.02 40.50 2q3r s PHE 104 CO -0.05 -0.21 0.08 0.00 0.70 0.00 0.00 175.22 175.74 2q3r s GLN 106 N 0.63 4.22 -0.04 0.00 0.74 -1.26 -0.95 119.66 123.00 2q3r s GLN 106 Ca 0.04 0.33 0.04 0.00 0.05 0.00 0.00 55.36 55.83 2q3r s GLN 106 Cb -0.13 -3.38 -0.00 0.00 1.10 0.00 0.00 33.01 30.59 2q3r s GLN 106 CO 0.01 0.30 -0.17 0.96 -0.55 0.00 0.00 175.29 175.85 2q3r s ILE 107 N 0.19 1.38 0.35 -2.34 -4.36 -0.61 -0.29 121.20 115.52 2q3r s ILE 107 Ca 0.23 -0.69 0.05 0.00 -0.26 0.00 0.00 60.65 59.97 2q3r s ILE 107 Cb -0.15 -1.19 -0.03 0.00 1.25 0.00 0.00 42.46 42.34 2q3r s ILE 107 CO 0.09 0.40 0.19 -1.66 0.24 0.00 0.00 174.94 174.20 2q3r s TRP 108 N 0.03 1.71 -0.10 1.37 1.48 0.17 -1.12 118.94 122.47 2q3r s TRP 108 Ca -0.03 -1.44 -0.03 0.00 -1.06 0.00 0.00 56.10 53.54 2q3r s TRP 108 Cb -0.11 -0.92 0.05 0.00 -1.16 0.00 0.00 33.47 31.33 2q3r s TRP 108 CO 0.02 -0.56 0.16 -1.58 -4.06 0.00 0.00 176.95 170.93 2q3r s HIS 109 N -3.42 -0.15 -0.34 1.66 2.46 -1.26 -2.22 115.29 112.02 2q3r s HIS 109 Ca 0.33 0.48 0.25 0.00 0.47 0.00 0.00 55.06 56.59 2q3r s HIS 109 Cb 0.03 -0.32 1.09 0.00 -0.13 0.00 0.00 32.58 33.26 2q3r s HIS 109 CO 0.20 -0.33 1.77 -0.39 -2.47 0.00 0.00 174.74 173.51 2q3r h VAL 110 N 6.37 0.00 0.00 0.89 -1.51 0.86 0.31 116.25 123.17 2q3r h VAL 110 Ca -0.14 -0.25 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 2q3r h VAL 110 Cb 1.12 1.01 0.00 0.00 -2.13 0.00 0.00 31.29 31.29 2q3r h VAL 110 CO 0.17 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.12 2q3r n GLY 111 N -0.14 3.48 0.65 5.19 0.00 -1.26 -2.03 105.19 111.10 2q3r n GLY 111 Ca 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2q3r n GLY 111 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2q3r n ARG 112 N 13.96 0.77 -3.56 1.61 1.85 -1.25 -4.38 116.66 125.65 2q3r n ARG 112 Ca 0.00 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.49 2q3r n ARG 112 Cb 0.00 -1.30 -0.06 0.00 -1.05 0.00 0.00 32.46 30.05 2q3r n ARG 112 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2q3r n VAL 113 N 0.27 3.16 -3.49 8.89 0.31 -0.86 -4.79 118.33 121.82 2q3r n VAL 113 Ca 0.00 -5.20 0.00 0.00 -0.01 0.00 0.00 64.34 59.13 2q3r n VAL 113 Cb 0.25 -2.32 0.00 0.00 -0.91 0.00 0.00 33.84 30.86 2q3r n VAL 113 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2q3r n SER 114 N 2.05 0.00 -4.49 4.52 3.41 -1.26 -4.27 113.62 113.58 2q3r n SER 114 Ca 0.23 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.58 2q3r n SER 114 Cb 0.37 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.22 2q3r n SER 114 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2q3r s ASN 115 N -4.00 3.18 0.61 4.04 4.22 -1.26 -2.96 114.94 118.77 2q3r s ASN 115 Ca 0.00 -1.49 0.31 0.00 -2.14 0.00 0.00 52.86 49.55 2q3r s ASN 115 Cb 0.00 0.07 1.78 0.00 1.28 0.00 0.00 41.25 44.39 2q3r s ASN 115 CO 0.00 -0.68 2.12 0.77 -2.04 0.00 0.00 177.10 177.27 2q3r h SER 116 N 1.81 0.00 -0.58 3.54 4.64 -1.85 -2.33 113.55 118.79 2q3r h SER 116 Ca -0.41 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.24 2q3r h SER 116 Cb 1.26 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.30 2q3r h SER 116 CO 0.71 0.00 2.83 0.61 -0.87 0.00 0.00 176.83 180.11 2q3r n GLY 117 N -1.32 4.64 0.00 -0.77 0.00 -1.26 -3.48 105.19 103.00 2q3r n GLY 117 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 2q3r n GLY 117 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2q3r n PHE 118 N 2.54 0.00 -2.43 1.61 3.72 -0.88 -5.08 117.46 116.95 2q3r n PHE 118 Ca 0.68 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.84 2q3r n PHE 118 Cb 0.29 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.88 2q3r n PHE 118 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2q3r s GLN 119 N -0.96 2.45 0.88 -1.08 -1.52 -1.23 -4.84 119.66 113.36 2q3r s GLN 119 Ca 0.00 -0.43 -0.11 0.00 -1.95 0.00 0.00 55.36 52.87 2q3r s GLN 119 Cb 0.00 -2.32 0.12 0.00 -0.22 0.00 0.00 33.01 30.60 2q3r s GLN 119 CO 0.00 -0.93 1.15 -2.14 -0.25 0.00 0.00 175.29 173.12 2q3r s PRO 120 N -5.00 1.27 0.00 2.91 0.02 -1.25 -2.59 135.00 130.36 2q3r s PRO 120 Ca 0.58 1.56 0.00 0.00 0.02 0.00 0.00 61.00 63.15 2q3r s PRO 120 Cb -0.11 -1.75 0.00 0.00 0.02 0.00 0.00 34.50 32.66 2q3r s PRO 120 CO 0.42 -2.45 0.00 0.09 -0.33 0.00 0.00 177.00 174.73 2q3r n ASN 121 N -3.97 -0.61 -3.39 2.53 3.02 -1.26 -0.87 115.26 110.71 2q3r n ASN 121 Ca 0.12 0.31 -0.22 0.00 -0.03 0.00 0.00 54.58 54.75 2q3r n ASN 121 Cb 0.52 -0.78 -0.02 0.00 -0.61 0.00 0.00 39.78 38.90 2q3r n ASN 121 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q3r n GLY 122 N -0.31 -0.47 3.90 7.41 0.00 -1.07 -4.91 105.19 109.74 2q3r n GLY 122 Ca 0.00 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2q3r n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q3r s LYS 123 N -6.02 3.66 0.18 1.61 1.02 -0.05 -4.80 119.74 115.34 2q3r s LYS 123 Ca 0.39 0.02 -0.30 0.00 0.02 0.00 0.00 55.97 56.11 2q3r s LYS 123 Cb -0.22 -2.69 -0.17 0.00 -0.52 0.00 0.00 37.83 34.23 2q3r s LYS 123 CO 0.49 0.29 0.63 0.00 -0.92 0.00 0.00 175.35 175.83 2q3r n ALA 124 N -0.58 -2.85 -1.76 5.17 0.00 -1.26 -4.68 120.51 114.56 2q3r n ALA 124 Ca -0.02 0.46 -0.39 0.00 0.00 0.00 0.00 53.44 53.50 2q3r n ALA 124 Cb 0.53 -1.65 0.03 0.00 0.00 0.00 0.00 19.45 18.35 2q3r n ALA 124 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2q3r s PRO 125 N -0.87 3.43 -0.23 0.00 0.02 -1.26 -4.38 135.00 131.70 2q3r s PRO 125 Ca 0.68 2.26 -0.16 0.00 0.02 0.00 0.00 61.00 63.79 2q3r s PRO 125 Cb -0.97 -2.44 -0.04 0.00 0.02 0.00 0.00 34.50 31.08 2q3r s PRO 125 CO 0.56 -0.97 0.41 0.96 -0.33 0.00 0.00 177.00 177.63 2q3r s ILE 126 N -1.28 5.17 0.22 2.83 -4.36 -1.26 0.48 121.20 122.99 2q3r s ILE 126 Ca 0.66 0.69 0.02 0.00 -0.26 0.00 0.00 60.65 61.76 2q3r s ILE 126 Cb -0.40 -3.73 -0.05 0.00 1.25 0.00 0.00 42.46 39.52 2q3r s ILE 126 CO 0.50 0.19 0.05 -0.55 0.24 0.00 0.00 174.94 175.37 2q3r s SER 127 N 1.32 1.22 0.13 4.36 0.15 -1.20 -3.83 113.70 115.85 2q3r s SER 127 Ca 0.18 -1.28 0.10 0.00 0.70 0.00 0.00 55.95 55.64 2q3r s SER 127 Cb -0.15 0.14 0.51 0.00 -1.71 0.00 0.00 66.02 64.80 2q3r s SER 127 CO 0.09 -0.65 1.30 0.00 1.20 0.00 0.00 173.24 175.18 2q3r n SER 129 N -1.81 -0.55 -0.66 0.00 3.41 -1.26 -4.43 113.62 108.32 2q3r n SER 129 Ca -0.00 -1.91 0.06 0.00 -0.26 0.00 0.00 58.87 56.75 2q3r n SER 129 Cb 0.03 1.08 0.16 0.00 -0.26 0.00 0.00 64.21 65.21 2q3r n SER 129 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2q3r n ASP 130 N -2.03 2.97 -4.69 4.04 5.75 -1.26 -3.76 116.55 117.57 2q3r n ASP 130 Ca 0.01 -2.01 -0.42 0.00 -0.01 0.00 0.00 54.79 52.35 2q3r n ASP 130 Cb 0.27 -0.24 -0.03 0.00 -1.03 0.00 0.00 41.12 40.09 2q3r n ASP 130 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2q3r n LYS 131 N 0.53 2.82 -2.08 0.11 5.02 -1.26 -4.05 118.16 119.24 2q3r n LYS 131 Ca 0.12 1.02 -0.37 0.00 -2.02 0.00 0.00 58.31 57.07 2q3r n LYS 131 Cb 0.44 -2.93 0.01 0.00 -0.02 0.00 0.00 35.03 32.54 2q3r n LYS 131 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2q3r s PRO 132 N 2.81 3.39 -0.20 1.97 0.04 -1.26 -4.43 135.00 137.31 2q3r s PRO 132 Ca 0.82 1.89 -0.07 0.00 0.04 0.00 0.00 61.00 63.69 2q3r s PRO 132 Cb -0.47 -2.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 2q3r s PRO 132 CO 0.37 -0.89 0.06 -1.17 0.04 0.00 0.00 177.00 175.41 2q3r s LEU 133 N -3.46 3.64 -1.40 -3.56 2.96 -1.26 -4.65 118.68 110.95 2q3r s LEU 133 Ca 0.70 -0.04 -0.12 0.00 -0.22 0.00 0.00 54.13 54.45 2q3r s LEU 133 Cb -0.32 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.45 2q3r s LEU 133 CO 0.37 0.10 0.31 0.23 -1.32 0.00 0.00 176.35 176.05 2q3r n MET 134 N 4.00 -1.05 -0.31 1.98 2.81 -1.26 -4.56 117.12 118.73 2q3r n MET 134 Ca -0.16 0.14 0.31 0.00 -1.81 0.00 0.00 57.70 56.18 2q3r n MET 134 Cb 0.52 -3.40 0.68 0.00 -0.71 0.00 0.00 33.22 30.31 2q3r n MET 134 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2q3r h PRO 135 N -2.08 0.11 0.00 0.03 0.13 -1.94 0.22 132.00 128.47 2q3r h PRO 135 Ca -0.67 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 2q3r h PRO 135 Cb 1.40 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2q3r h PRO 135 CO 0.63 0.07 0.00 0.00 -0.23 0.00 0.00 178.00 178.47 2q3r n GLN 136 N -4.32 0.02 -3.99 0.86 0.00 -1.26 -4.63 117.38 104.06 2q3r n GLN 136 Ca 0.25 0.35 -0.35 0.00 0.00 0.00 0.00 57.00 57.25 2q3r n GLN 136 Cb 1.12 -1.50 -0.13 0.00 0.00 0.00 0.00 30.24 29.73 2q3r n GLN 136 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2q3r s ILE 137 N -2.92 3.71 0.30 -0.39 1.01 0.77 -5.07 121.20 118.62 2q3r s ILE 137 Ca 0.04 -0.39 0.10 0.00 0.00 0.00 0.00 60.65 60.41 2q3r s ILE 137 Cb 0.05 -2.69 -0.05 0.00 0.01 0.00 0.00 42.46 39.78 2q3r s ILE 137 CO 0.12 0.42 -0.10 -0.13 0.00 0.00 0.00 174.94 175.25 2q3r s ARG 138 N 1.27 1.91 0.65 2.79 3.00 -1.26 0.20 118.95 127.52 2q3r s ARG 138 Ca 0.04 -1.72 -0.17 0.00 0.00 0.00 0.00 55.73 53.88 2q3r s ARG 138 Cb -0.15 -1.87 -0.00 0.00 0.00 0.00 0.00 34.95 32.93 2q3r s ARG 138 CO 0.00 0.27 1.20 -1.12 0.00 0.00 0.00 175.30 175.64 2q3r s SER 139 N -3.60 4.79 -0.58 0.23 0.01 -1.00 -4.66 113.70 108.89 2q3r s SER 139 Ca 0.32 2.34 -0.34 0.00 1.31 0.00 0.00 55.95 59.57 2q3r s SER 139 Cb -0.03 -2.59 -0.15 0.00 0.21 0.00 0.00 66.02 63.46 2q3r s SER 139 CO 0.17 -1.86 2.36 0.59 0.41 0.00 0.00 173.24 174.91 2q3r n ASN 140 N -2.12 1.38 0.00 2.44 5.03 -1.26 -3.39 115.26 117.34 2q3r n ASN 140 Ca 0.13 0.24 0.00 0.00 0.87 0.00 0.00 54.58 55.83 2q3r n ASN 140 Cb 0.50 -1.15 0.00 0.00 -1.02 0.00 0.00 39.78 38.11 2q3r n ASN 140 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2q3r n GLY 141 N 6.63 1.90 3.51 7.41 0.00 -1.26 -5.06 105.19 118.32 2q3r n GLY 141 Ca 0.50 -0.70 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 2q3r n GLY 141 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2q3r n ILE 142 N 0.00 2.33 0.34 -0.61 -0.00 -1.22 -4.82 119.36 115.38 2q3r n ILE 142 Ca 0.00 -0.50 -0.01 0.00 -0.00 0.00 0.00 62.75 62.24 2q3r n ILE 142 Cb 0.00 -0.80 0.11 0.00 -0.00 0.00 0.00 39.64 38.95 2q3r n ILE 142 CO 0.00 0.00 0.00 -0.90 -0.00 0.00 0.00 176.55 175.65 2q3r n ASP 143 N 0.58 2.79 -4.65 4.38 3.85 -1.26 -4.27 116.55 117.97 2q3r n ASP 143 Ca 0.11 -2.38 -0.40 0.00 -0.71 0.00 0.00 54.79 51.41 2q3r n ASP 143 Cb 0.43 -0.58 -0.06 0.00 -1.35 0.00 0.00 41.12 39.56 2q3r n ASP 143 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 2q3r s GLU 144 N -1.42 4.16 0.30 0.11 2.12 -1.26 -5.00 118.70 117.72 2q3r s GLU 144 Ca 0.18 0.50 -0.26 0.00 0.36 0.00 0.00 54.97 55.76 2q3r s GLU 144 Cb 0.14 -3.60 -0.15 0.00 0.26 0.00 0.00 34.13 30.79 2q3r s GLU 144 CO 0.05 -0.27 0.64 0.00 -0.54 0.00 0.00 175.26 175.14 2q3r n ALA 145 N 5.18 -1.71 -0.06 6.30 0.00 -1.26 -2.37 120.51 126.59 2q3r n ALA 145 Ca -0.03 0.32 -0.12 0.00 0.00 0.00 0.00 53.44 53.62 2q3r n ALA 145 Cb 0.50 -1.77 -0.06 0.00 0.00 0.00 0.00 19.45 18.12 2q3r n ALA 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2q3r h LEU 146 N 1.18 0.37 -8.29 0.00 5.85 -0.51 -3.39 115.31 110.52 2q3r h LEU 146 Ca -0.36 -0.37 -0.72 0.00 0.84 0.00 0.00 57.88 57.27 2q3r h LEU 146 Cb 1.40 -0.10 -0.24 0.00 0.37 0.00 0.00 40.66 42.09 2q3r h LEU 146 CO 0.56 0.65 -0.42 -0.36 -0.34 0.00 0.00 178.44 178.53 2q3r s PHE 147 N -4.74 3.27 -0.12 1.25 0.40 -1.26 -4.45 117.98 112.32 2q3r s PHE 147 Ca -0.14 -1.05 -0.34 0.00 -0.60 0.00 0.00 56.93 54.80 2q3r s PHE 147 Cb 0.06 -2.89 -0.11 0.00 0.51 0.00 0.00 43.02 40.59 2q3r s PHE 147 CO 0.74 -0.76 1.95 2.41 0.70 0.00 0.00 175.22 180.26 2q3r n THR 148 N 5.08 0.53 -1.48 0.64 -1.04 -1.15 -4.62 114.28 112.24 2q3r n THR 148 Ca -0.11 -0.15 -0.51 0.00 -2.04 0.00 0.00 64.05 61.23 2q3r n THR 148 Cb 0.44 -1.92 -0.05 0.00 -1.82 0.00 0.00 70.33 66.98 2q3r n THR 148 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2q3r n PRO 149 N 7.02 0.33 -2.32 -2.82 -0.02 -1.26 -4.43 135.00 131.50 2q3r n PRO 149 Ca 0.25 0.12 -0.41 0.00 -2.02 0.00 0.00 63.50 61.44 2q3r n PRO 149 Cb 0.30 -1.39 -0.03 0.00 -0.02 0.00 0.00 33.50 32.36 2q3r n PRO 149 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2q3r s PRO 150 N -0.61 4.49 -0.18 0.52 0.04 -1.26 -4.25 135.00 133.74 2q3r s PRO 150 Ca 0.74 1.96 -0.22 0.00 0.04 0.00 0.00 61.00 63.52 2q3r s PRO 150 Cb -1.00 -3.18 -0.02 0.00 0.04 0.00 0.00 34.50 30.34 2q3r s PRO 150 CO 0.56 -0.05 0.66 0.50 0.04 0.00 0.00 177.00 178.71 2q3r s ARG 151 N -0.89 4.24 0.03 4.56 3.52 0.18 -4.07 118.95 126.52 2q3r s ARG 151 Ca 0.50 0.69 -0.30 0.00 -0.13 0.00 0.00 55.73 56.49 2q3r s ARG 151 Cb -0.35 -3.57 -0.07 0.00 -1.56 0.00 0.00 34.95 29.41 2q3r s ARG 151 CO 0.42 -0.23 1.48 0.50 -0.81 0.00 0.00 175.30 176.66 2q3r s ARG 152 N 1.85 4.26 0.11 5.12 3.52 -1.25 -3.25 118.95 129.31 2q3r s ARG 152 Ca 0.31 2.09 -0.31 0.00 -0.13 0.00 0.00 55.73 57.69 2q3r s ARG 152 Cb -0.16 -3.55 -0.08 0.00 -1.56 0.00 0.00 34.95 29.61 2q3r s ARG 152 CO 0.11 -0.61 1.36 -0.51 -0.81 0.00 0.00 175.30 174.84 2q3r s LEU 153 N 2.34 4.37 0.54 -0.88 1.43 -1.17 -4.98 118.68 120.33 2q3r s LEU 153 Ca 0.67 2.28 -0.20 0.00 -1.03 0.00 0.00 54.13 55.85 2q3r s LEU 153 Cb -0.35 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.24 2q3r s LEU 153 CO 0.29 -0.63 1.18 -0.83 0.23 0.00 0.00 176.35 176.59 2q3r s GLY 154 N 1.10 2.72 0.46 -3.19 0.00 -1.26 -4.90 107.32 102.25 2q3r s GLY 154 Ca 0.64 0.94 0.17 0.00 0.00 0.00 0.00 44.72 46.47 2q3r s GLY 154 CO 0.30 1.34 2.01 1.19 0.00 0.00 0.00 173.10 177.94 2q3r h ILE 155 N 1.27 1.02 0.00 0.90 2.10 -2.03 0.39 117.51 121.17 2q3r h ILE 155 Ca -0.50 -0.59 0.00 0.00 1.08 0.00 0.00 64.86 64.84 2q3r h ILE 155 Cb 1.27 1.33 0.00 0.00 -1.09 0.00 0.00 36.82 38.33 2q3r h ILE 155 CO 0.57 0.16 0.00 -0.62 -1.08 0.00 0.00 178.15 177.19 2q3r n GLU 156 N -4.20 0.14 0.07 2.19 1.02 -1.26 -2.88 120.64 115.72 2q3r n GLU 156 Ca -0.02 0.40 -0.22 0.00 -0.02 0.00 0.00 57.16 57.30 2q3r n GLU 156 Cb 0.24 -1.78 -0.15 0.00 -0.02 0.00 0.00 31.44 29.73 2q3r n GLU 156 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2q3r h GLU 157 N 0.00 0.37 -1.11 3.49 5.08 -1.26 -3.36 114.58 117.78 2q3r h GLU 157 Ca 0.00 -0.63 0.34 0.00 -1.00 0.00 0.00 59.36 58.08 2q3r h GLU 157 Cb 0.30 0.23 -0.13 0.00 0.50 0.00 0.00 28.75 29.65 2q3r h GLU 157 CO 0.00 1.30 0.68 0.82 -1.00 0.00 0.00 179.01 180.81 2q3r h ILE 158 N -0.21 0.29 -0.41 3.13 2.04 -1.48 -2.39 117.51 118.49 2q3r h ILE 158 Ca -0.19 -0.09 0.09 0.00 1.00 0.00 0.00 64.86 65.66 2q3r h ILE 158 Cb 1.81 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.81 2q3r h ILE 158 CO 0.18 0.05 -0.24 -0.65 0.00 0.00 0.00 178.15 177.49 2q3r h PRO 159 N 0.27 -0.16 -0.76 2.37 0.11 -1.75 -0.12 132.00 131.96 2q3r h PRO 159 Ca 0.73 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.85 2q3r h PRO 159 Cb 1.91 0.04 0.00 0.00 0.11 0.00 0.00 31.00 33.06 2q3r h PRO 159 CO -0.48 -0.10 0.00 0.41 -0.21 0.00 0.00 178.00 177.61 2q3r n GLY 160 N -1.40 1.05 0.76 -0.55 0.00 -0.90 -2.34 105.19 101.82 2q3r n GLY 160 Ca 0.02 -0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.92 2q3r n GLY 160 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2q3r n ILE 161 N -0.06 0.37 0.30 -0.61 5.41 -0.21 -4.24 119.36 120.33 2q3r n ILE 161 Ca 0.02 -0.10 0.18 0.00 1.00 0.00 0.00 62.75 63.85 2q3r n ILE 161 Cb 0.25 -1.56 0.94 0.00 -0.71 0.00 0.00 39.64 38.55 2q3r n ILE 161 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2q3r h VAL 162 N -0.23 0.20 0.00 1.39 2.07 -1.15 -0.61 116.25 117.92 2q3r h VAL 162 Ca -0.17 -0.27 -0.13 0.00 0.82 0.00 0.00 66.70 66.95 2q3r h VAL 162 Cb 1.15 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 2q3r h VAL 162 CO -0.10 0.03 -0.70 -1.13 0.02 0.00 0.00 177.57 175.69 2q3r h ASN 163 N 0.00 0.00 0.40 0.57 -0.73 -1.70 -3.02 115.58 111.11 2q3r h ASN 163 Ca -0.00 0.00 -0.08 0.00 1.87 0.00 0.00 56.30 58.09 2q3r h ASN 163 Cb 0.21 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.79 2q3r h ASN 163 CO 0.00 0.60 -0.40 0.44 -0.37 0.00 0.00 177.43 177.70 2q3r h ASP 164 N 0.00 0.00 -0.02 1.15 3.32 -1.28 -1.20 116.42 118.40 2q3r h ASP 164 Ca -0.03 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 2q3r h ASP 164 Cb 1.48 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.03 2q3r h ASP 164 CO 0.07 0.40 -0.06 -0.26 -1.72 0.00 0.00 179.24 177.68 2q3r h PHE 165 N 0.00 0.09 -0.84 4.55 -1.00 -1.50 -0.23 116.94 118.02 2q3r h PHE 165 Ca -0.00 -0.04 0.03 0.00 2.81 0.00 0.00 57.97 60.77 2q3r h PHE 165 Cb 0.71 -0.01 -0.05 0.00 3.61 0.00 0.00 35.95 40.21 2q3r h PHE 165 CO 0.00 0.69 0.55 -0.09 -1.61 0.00 0.00 178.31 177.86 2q3r h ARG 166 N -0.54 1.03 0.00 1.51 2.43 -1.40 0.27 114.38 117.68 2q3r h ARG 166 Ca -0.00 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 2q3r h ARG 166 Cb 0.70 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2q3r h ARG 166 CO 0.01 0.68 -0.47 1.25 -1.51 0.00 0.00 179.97 179.94 2q3r h LEU 167 N 1.06 0.00 -0.26 3.80 6.46 -1.22 -1.68 115.31 123.46 2q3r h LEU 167 Ca 0.33 0.00 -0.19 0.00 -0.12 0.00 0.00 57.88 57.90 2q3r h LEU 167 Cb -0.01 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.92 2q3r h LEU 167 CO -0.09 0.47 -0.56 0.00 -0.62 0.00 0.00 178.44 177.64 2q3r h ALA 168 N 1.53 0.42 -0.80 1.25 0.00 0.12 -1.64 119.26 120.14 2q3r h ALA 168 Ca -0.00 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2q3r h ALA 168 Cb 1.05 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2q3r h ALA 168 CO 0.06 0.65 0.47 0.00 0.00 0.00 0.00 179.25 180.43 2q3r h ALA 169 N 0.65 1.31 -0.15 0.00 0.00 -0.69 -1.00 119.26 119.38 2q3r h ALA 169 Ca 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.83 2q3r h ALA 169 Cb 1.17 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2q3r h ALA 169 CO 0.12 0.58 0.05 -0.09 0.00 0.00 0.00 179.25 179.92 2q3r h ARG 170 N 1.11 0.12 0.00 0.00 9.65 -0.92 -1.82 114.38 122.53 2q3r h ARG 170 Ca 0.29 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.16 2q3r h ARG 170 Cb -0.02 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.53 2q3r h ARG 170 CO -0.05 0.08 0.00 -0.91 2.80 0.00 0.00 179.97 181.89 2q3r h ASN 171 N 0.12 0.00 0.16 -3.80 2.35 -0.74 -2.13 115.58 111.55 2q3r h ASN 171 Ca 0.06 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 2q3r h ASN 171 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 2q3r h ASN 171 CO -0.07 0.00 -0.08 0.00 -1.65 0.00 0.00 177.43 175.63 2q3r h ALA 172 N 2.01 -0.22 -0.87 -0.83 0.00 -0.37 -2.08 119.26 116.89 2q3r h ALA 172 Ca 0.00 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.81 2q3r h ALA 172 Cb 0.46 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 2q3r h ALA 172 CO 0.00 -0.46 0.53 0.52 0.00 0.00 0.00 179.25 179.84 2q3r h MET 173 N -0.55 0.92 -0.84 0.00 2.86 -1.13 -1.51 114.93 114.68 2q3r h MET 173 Ca -0.02 -0.06 0.11 0.00 -2.06 0.00 0.00 59.70 57.67 2q3r h MET 173 Cb 0.42 -0.21 -0.08 0.00 0.06 0.00 0.00 31.60 31.79 2q3r h MET 173 CO 0.04 0.61 0.48 1.49 1.06 0.00 0.00 176.91 180.58 2q3r h GLU 174 N 0.95 0.75 0.00 1.72 4.81 -1.17 0.43 114.58 122.07 2q3r h GLU 174 Ca 0.39 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.57 2q3r h GLU 174 Cb 0.23 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2q3r h GLU 174 CO -0.19 0.49 0.00 0.00 -0.73 0.00 0.00 179.01 178.58 2q3r n ALA 175 N -2.38 2.16 -0.29 2.92 0.00 -0.63 -4.91 120.51 117.38 2q3r n ALA 175 Ca 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2q3r n ALA 175 Cb 0.32 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2q3r n ALA 175 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q3r n GLY 176 N 0.90 0.81 3.71 0.00 0.00 0.15 -4.40 105.19 106.36 2q3r n GLY 176 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2q3r n GLY 176 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2q3r n PHE 177 N -2.22 2.12 -0.05 1.61 3.01 -0.87 -4.93 117.46 116.13 2q3r n PHE 177 Ca 0.00 0.47 -0.14 0.00 1.01 0.00 0.00 57.45 58.79 2q3r n PHE 177 Cb 0.00 -2.36 -0.08 0.00 -0.01 0.00 0.00 39.48 37.03 2q3r n PHE 177 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 2q3r h ASP 178 N 1.81 0.41 -4.31 4.37 3.32 -1.89 -3.41 116.42 116.72 2q3r h ASP 178 Ca -0.49 -0.53 -0.37 0.00 0.02 0.00 0.00 57.03 55.66 2q3r h ASP 178 Cb 1.30 -0.12 -0.09 0.00 0.22 0.00 0.00 39.33 40.64 2q3r h ASP 178 CO 0.58 0.86 -0.31 0.61 -1.72 0.00 0.00 179.24 179.26 2q3r n GLY 179 N 0.34 2.66 3.16 2.75 0.00 -1.26 -4.87 105.19 107.97 2q3r n GLY 179 Ca -0.07 -1.76 -0.26 0.00 0.00 0.00 0.00 46.02 43.93 2q3r n GLY 179 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q3r s VAL 180 N -3.06 1.46 -0.24 1.61 1.01 0.14 -0.80 120.40 120.53 2q3r s VAL 180 Ca 0.33 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2q3r s VAL 180 Cb 0.01 -1.24 0.05 0.00 0.00 0.00 0.00 36.38 35.20 2q3r s VAL 180 CO 0.23 0.42 -0.13 -0.70 0.00 0.00 0.00 175.10 174.92 2q3r s GLU 181 N -0.18 2.44 0.06 2.72 2.12 -0.12 0.36 118.70 126.09 2q3r s GLU 181 Ca 0.01 -1.20 -0.29 0.00 0.36 0.00 0.00 54.97 53.86 2q3r s GLU 181 Cb -0.10 -2.79 -0.05 0.00 0.26 0.00 0.00 34.13 31.45 2q3r s GLU 181 CO 0.01 -0.47 0.92 0.42 -0.54 0.00 0.00 175.26 175.60 2q3r s ILE 182 N 1.16 4.68 -0.92 -3.70 1.01 0.92 -1.58 121.20 122.78 2q3r s ILE 182 Ca -0.05 1.96 -0.13 0.00 0.00 0.00 0.00 60.65 62.42 2q3r s ILE 182 Cb -0.18 -4.27 0.22 0.00 0.01 0.00 0.00 42.46 38.24 2q3r s ILE 182 CO -0.07 0.27 0.90 -2.28 0.00 0.00 0.00 174.94 173.76 2q3r s HIS 183 N 0.34 3.82 -0.48 3.97 5.65 -0.28 -1.45 115.29 126.87 2q3r s HIS 183 Ca 0.46 -2.11 0.03 0.00 0.25 0.00 0.00 55.06 53.69 2q3r s HIS 183 Cb -0.22 -3.88 0.46 0.00 -1.18 0.00 0.00 32.58 27.76 2q3r s HIS 183 CO 0.27 -1.04 1.63 0.41 -0.65 0.00 0.00 174.74 175.37 2q3r n GLY 184 N 3.80 6.06 0.00 1.59 0.00 -0.97 -4.54 105.19 111.14 2q3r n GLY 184 Ca 0.18 -2.41 0.00 0.00 0.00 0.00 0.00 46.02 43.79 2q3r n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q3r n ALA 185 N -0.84 0.00 -4.36 4.61 0.00 -1.18 -3.30 120.51 115.45 2q3r n ALA 185 Ca 0.53 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.60 2q3r n ALA 185 Cb 0.83 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.22 2q3r n ALA 185 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2q3r n ASN 186 N -1.25 -1.43 0.00 0.00 3.02 -1.26 -1.88 115.26 112.46 2q3r n ASN 186 Ca 0.00 -1.17 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 2q3r n ASN 186 Cb 0.00 -2.02 0.00 0.00 -0.61 0.00 0.00 39.78 37.15 2q3r n ASN 186 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q3r n GLY 187 N -1.58 0.42 1.40 7.41 0.00 -1.24 -4.74 105.19 106.86 2q3r n GLY 187 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 2q3r n GLY 187 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2q3r n TYR 188 N -2.51 -3.64 -0.17 1.61 4.01 -0.79 -4.62 117.16 111.05 2q3r n TYR 188 Ca 0.00 -0.52 -0.09 0.00 -0.16 0.00 0.00 57.90 57.12 2q3r n TYR 188 Cb 0.12 -0.32 -0.05 0.00 -0.31 0.00 0.00 39.34 38.79 2q3r n TYR 188 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2q3r h LEU 189 N 0.00 -1.51 -0.43 7.72 5.85 -0.34 0.72 115.31 127.33 2q3r h LEU 189 Ca -0.14 0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2q3r h LEU 189 Cb 0.43 0.67 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 2q3r h LEU 189 CO 0.12 -0.35 0.24 0.40 -0.34 0.00 0.00 178.44 178.51 2q3r h ILE 190 N -0.27 1.15 -0.70 4.05 2.04 -1.80 -2.33 117.51 119.65 2q3r h ILE 190 Ca 0.16 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 65.71 2q3r h ILE 190 Cb 0.57 0.63 -0.06 0.00 -0.74 0.00 0.00 36.82 37.22 2q3r h ILE 190 CO -0.64 0.16 0.38 -0.78 0.00 0.00 0.00 178.15 177.26 2q3r h ASP 191 N 0.56 0.54 -0.41 1.72 3.58 -1.38 -2.47 116.42 118.55 2q3r h ASP 191 Ca 0.15 0.04 0.08 0.00 0.42 0.00 0.00 57.03 57.72 2q3r h ASP 191 Cb 0.04 -0.06 -0.07 0.00 1.72 0.00 0.00 39.33 40.96 2q3r h ASP 191 CO -0.03 0.33 -0.07 1.56 -2.88 0.00 0.00 179.24 178.15 2q3r h GLN 192 N 0.67 0.03 -0.47 0.28 4.20 -0.33 0.23 115.11 119.72 2q3r h GLN 192 Ca 0.33 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.03 2q3r h GLN 192 Cb 0.27 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 2q3r h GLN 192 CO -0.22 0.02 0.26 0.74 -0.67 0.00 0.00 178.83 178.96 2q3r h PHE 193 N 0.03 0.62 -0.14 2.96 -1.00 -1.20 -3.05 116.94 115.17 2q3r h PHE 193 Ca 0.20 -0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.84 2q3r h PHE 193 Cb 0.30 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 39.66 2q3r h PHE 193 CO -0.33 0.44 -0.45 0.52 -1.61 0.00 0.00 178.31 176.87 2q3r h MET 194 N 0.65 0.55 -6.28 1.51 2.86 -0.80 -3.42 114.93 110.01 2q3r h MET 194 Ca 0.17 -0.41 -0.55 0.00 -2.06 0.00 0.00 59.70 56.85 2q3r h MET 194 Cb 0.02 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 2q3r h MET 194 CO -0.03 1.03 0.90 0.15 1.06 0.00 0.00 176.91 180.02 2q3r s LYS 195 N -3.83 4.25 0.00 1.72 -0.14 -0.07 -4.86 119.74 116.80 2q3r s LYS 195 Ca -0.13 1.90 0.16 0.00 -1.36 0.00 0.00 55.97 56.54 2q3r s LYS 195 Cb 0.06 -3.72 0.84 0.00 -1.68 0.00 0.00 37.83 33.33 2q3r s LYS 195 CO 0.83 -0.66 1.43 -0.40 -0.76 0.00 0.00 175.35 175.78 2q3r n ASP 196 N 6.12 0.00 0.00 2.83 5.75 -1.26 -0.52 116.55 129.47 2q3r n ASP 196 Ca 0.14 -0.10 0.11 0.00 -0.01 0.00 0.00 54.79 54.93 2q3r n ASP 196 Cb 0.44 -0.20 -0.01 0.00 -1.03 0.00 0.00 41.12 40.32 2q3r n ASP 196 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2q3r n THR 197 N -1.20 0.03 -0.07 2.12 -2.24 -1.24 -4.49 114.28 107.18 2q3r n THR 197 Ca 0.09 -0.06 -0.12 0.00 -2.27 0.00 0.00 64.05 61.69 2q3r n THR 197 Cb 0.11 0.64 -0.07 0.00 -2.10 0.00 0.00 70.33 68.91 2q3r n THR 197 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2q3r n VAL 198 N -1.61 0.85 -2.99 2.28 0.31 -0.30 -4.92 118.33 111.94 2q3r n VAL 198 Ca 0.04 -0.30 -0.44 0.00 -0.01 0.00 0.00 64.34 63.63 2q3r n VAL 198 Cb 0.36 -1.16 -0.05 0.00 -0.91 0.00 0.00 33.84 32.09 2q3r n VAL 198 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2q3r s ASN 199 N -5.62 6.22 -0.34 4.52 2.47 0.32 -4.53 114.94 117.98 2q3r s ASN 199 Ca -0.20 -0.96 0.07 0.00 0.42 0.00 0.00 52.86 52.19 2q3r s ASN 199 Cb 0.06 -2.36 0.55 0.00 -1.45 0.00 0.00 41.25 38.05 2q3r s ASN 199 CO 0.33 -1.18 1.59 -0.90 -3.72 0.00 0.00 177.10 173.21 2q3r n ASP 200 N 6.94 2.80 -4.76 -4.21 5.75 -1.26 -4.47 116.55 117.35 2q3r n ASP 200 Ca -0.05 -3.75 -0.38 0.00 -0.01 0.00 0.00 54.79 50.60 2q3r n ASP 200 Cb 0.45 -0.69 0.03 0.00 -1.03 0.00 0.00 41.12 39.88 2q3r n ASP 200 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2q3r s ARG 201 N -3.27 3.30 -0.21 0.11 0.52 -1.26 -4.78 118.95 113.36 2q3r s ARG 201 Ca 0.48 2.12 0.15 0.00 -0.52 0.00 0.00 55.73 57.95 2q3r s ARG 201 Cb 0.43 -2.29 0.49 0.00 0.52 0.00 0.00 34.95 34.09 2q3r s ARG 201 CO 0.02 -1.03 1.40 0.25 0.02 0.00 0.00 175.30 175.97 2q3r n THR 202 N -0.89 2.31 -3.91 0.02 -2.24 -1.26 -1.21 114.28 107.11 2q3r n THR 202 Ca 0.10 -2.19 0.00 0.00 -2.27 0.00 0.00 64.05 59.69 2q3r n THR 202 Cb 0.46 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 2q3r n THR 202 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2q3r n ASP 203 N -0.82 1.94 0.13 3.42 3.85 -1.26 -5.01 116.55 118.80 2q3r n ASP 203 Ca 0.24 -0.91 0.10 0.00 -0.71 0.00 0.00 54.79 53.51 2q3r n ASP 203 Cb 0.90 0.00 0.48 0.00 -1.35 0.00 0.00 41.12 41.15 2q3r n ASP 203 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 2q3r n GLU 204 N 0.00 0.13 -0.23 0.11 0.28 -1.26 -2.01 120.64 117.66 2q3r n GLU 204 Ca 0.00 0.54 0.10 0.00 -0.16 0.00 0.00 57.16 57.64 2q3r n GLU 204 Cb 0.00 -1.86 0.27 0.00 1.43 0.00 0.00 31.44 31.28 2q3r n GLU 204 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2q3r n TYR 205 N -2.12 0.62 -3.85 -1.84 4.01 -1.26 -4.49 117.16 108.22 2q3r n TYR 205 Ca 0.00 -0.31 -0.06 0.00 -0.16 0.00 0.00 57.90 57.37 2q3r n TYR 205 Cb 0.09 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.15 2q3r n TYR 205 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2q3r s GLY 206 N -1.24 0.28 0.00 2.72 0.00 -0.85 -4.00 107.32 104.23 2q3r s GLY 206 Ca 0.39 -0.60 0.00 0.00 0.00 0.00 0.00 44.72 44.51 2q3r s GLY 206 CO 0.29 1.17 0.00 0.61 0.00 0.00 0.00 173.10 175.16 2q3r n GLY 207 N -0.63 0.74 3.58 0.20 0.00 -0.35 -4.25 105.19 104.48 2q3r n GLY 207 Ca -0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 2q3r n GLY 207 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2q3r s SER 208 N -2.78 -0.27 0.21 1.61 1.04 -1.26 -5.00 113.70 107.25 2q3r s SER 208 Ca 0.00 0.21 -0.12 0.00 0.48 0.00 0.00 55.95 56.52 2q3r s SER 208 Cb 0.00 0.24 0.27 0.00 0.10 0.00 0.00 66.02 66.63 2q3r s SER 208 CO 0.00 -0.31 1.65 0.25 0.98 0.00 0.00 173.24 175.81 2q3r h LEU 209 N 2.29 -0.37 0.50 2.42 5.85 -1.95 0.36 115.31 124.42 2q3r h LEU 209 Ca -0.15 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2q3r h LEU 209 Cb 1.18 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 42.49 2q3r h LEU 209 CO 0.28 -0.14 -0.43 1.56 -0.34 0.00 0.00 178.44 179.36 2q3r h GLN 210 N 0.07 -0.89 -0.44 1.25 4.20 -1.98 -1.92 115.11 115.40 2q3r h GLN 210 Ca 0.31 0.06 0.03 0.00 0.06 0.00 0.00 58.65 59.11 2q3r h GLN 210 Cb 0.50 0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 2q3r h GLN 210 CO -0.56 -0.60 0.30 -0.91 -0.67 0.00 0.00 178.83 176.39 2q3r h ASN 211 N -0.93 0.41 0.24 1.46 4.21 -1.59 -1.89 115.58 117.49 2q3r h ASN 211 Ca -0.05 -0.01 -0.08 0.00 1.21 0.00 0.00 56.30 57.38 2q3r h ASN 211 Cb 0.80 -0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.89 2q3r h ASN 211 CO -0.02 0.29 -0.31 0.03 -1.29 0.00 0.00 177.43 176.12 2q3r h ARG 212 N 0.48 0.12 -0.07 0.81 3.08 0.18 -2.67 114.38 116.31 2q3r h ARG 212 Ca 0.18 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2q3r h ARG 212 Cb 0.12 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2q3r h ARG 212 CO -0.04 0.42 0.00 0.00 -1.07 0.00 0.00 179.97 179.28 2q3r h LYS 214 N 2.06 -0.26 0.14 0.00 3.64 -1.35 -1.53 116.57 119.28 2q3r h LYS 214 Ca 0.00 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2q3r h LYS 214 Cb 0.44 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2q3r h LYS 214 CO 0.00 -0.17 -0.34 0.35 -2.27 0.00 0.00 179.45 177.01 2q3r h PHE 215 N -0.27 -0.95 -0.44 1.91 3.57 -1.78 0.22 116.94 119.20 2q3r h PHE 215 Ca 0.02 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.55 2q3r h PHE 215 Cb 0.27 0.40 -0.03 0.00 2.79 0.00 0.00 35.95 39.38 2q3r h PHE 215 CO -0.14 -0.46 0.28 -1.00 -2.23 0.00 0.00 178.31 174.76 2q3r h PRO 216 N -0.59 0.54 -0.21 6.41 0.13 -1.81 -1.59 132.00 134.88 2q3r h PRO 216 Ca 0.02 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 2q3r h PRO 216 Cb 0.61 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 2q3r h PRO 216 CO -0.19 0.36 -0.02 -0.07 -0.23 0.00 0.00 178.00 177.85 2q3r h LEU 217 N 0.56 0.29 -0.94 1.56 3.38 -0.96 -0.22 115.31 118.98 2q3r h LEU 217 Ca 0.17 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 2q3r h LEU 217 Cb -0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2q3r h LEU 217 CO -0.06 0.37 -0.39 -0.33 0.09 0.00 0.00 178.44 178.12 2q3r h GLU 218 N 0.31 0.28 0.01 1.13 5.08 0.04 -0.82 114.58 120.61 2q3r h GLU 218 Ca 0.07 -0.13 -0.17 0.00 -1.00 0.00 0.00 59.36 58.13 2q3r h GLU 218 Cb 0.25 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.51 2q3r h GLU 218 CO 0.01 0.63 -0.69 0.82 -1.00 0.00 0.00 179.01 178.78 2q3r h ILE 219 N 0.23 1.41 -0.01 3.13 2.04 -0.36 -2.51 117.51 121.45 2q3r h ILE 219 Ca 0.02 -2.14 0.02 0.00 1.00 0.00 0.00 64.86 63.76 2q3r h ILE 219 Cb 0.79 2.62 -0.02 0.00 -0.74 0.00 0.00 36.82 39.47 2q3r h ILE 219 CO 0.06 0.63 -0.09 0.58 0.00 0.00 0.00 178.15 179.33 2q3r h VAL 220 N -0.06 0.76 -0.08 1.67 2.07 -0.99 -1.66 116.25 117.97 2q3r h VAL 220 Ca -0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.46 2q3r h VAL 220 Cb 1.40 0.76 -0.06 0.00 -1.52 0.00 0.00 31.29 31.87 2q3r h VAL 220 CO 0.13 0.00 -0.54 -0.78 0.02 0.00 0.00 177.57 176.40 2q3r h ASP 221 N -0.15 -1.70 -0.20 0.57 3.58 -1.16 0.11 116.42 117.47 2q3r h ASP 221 Ca 0.04 0.20 0.05 0.00 0.42 0.00 0.00 57.03 57.74 2q3r h ASP 221 Cb 0.20 0.66 -0.05 0.00 1.72 0.00 0.00 39.33 41.86 2q3r h ASP 221 CO -0.10 -0.50 -0.14 0.00 -2.88 0.00 0.00 179.24 175.61 2q3r h ALA 222 N -0.34 0.00 -0.28 -0.78 0.00 -1.28 -1.30 119.26 115.27 2q3r h ALA 222 Ca 0.02 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2q3r h ALA 222 Cb 0.70 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2q3r h ALA 222 CO -0.40 -0.57 0.18 0.28 0.00 0.00 0.00 179.25 178.74 2q3r h VAL 223 N -0.14 1.08 -0.94 0.00 2.07 -1.09 -1.48 116.25 115.75 2q3r h VAL 223 Ca 0.12 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 2q3r h VAL 223 Cb 0.32 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 2q3r h VAL 223 CO -0.29 0.07 0.56 0.00 0.02 0.00 0.00 177.57 177.94 2q3r h ALA 224 N 1.10 1.20 -0.50 1.67 0.00 -0.46 -0.71 119.26 121.56 2q3r h ALA 224 Ca 0.10 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2q3r h ALA 224 Cb -0.04 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 2q3r h ALA 224 CO -0.02 0.66 -0.16 0.87 0.00 0.00 0.00 179.25 180.60 2q3r h LYS 225 N 1.30 0.97 0.48 0.00 1.57 -1.09 0.75 116.57 120.55 2q3r h LYS 225 Ca 0.34 -0.38 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2q3r h LYS 225 Cb -0.05 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2q3r h LYS 225 CO -0.06 1.05 -0.26 1.49 -0.57 0.00 0.00 179.45 181.10 2q3r h GLU 226 N 0.86 -0.66 -0.59 3.15 4.57 -0.49 -3.34 114.58 118.09 2q3r h GLU 226 Ca 0.12 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 2q3r h GLU 226 Cb 0.72 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.46 2q3r h GLU 226 CO 0.06 -0.44 0.00 0.44 -1.18 0.00 0.00 179.01 177.88 2q3r n ILE 227 N -3.96 0.94 0.00 2.32 -5.35 -0.35 -5.07 119.36 107.90 2q3r n ILE 227 Ca -0.08 -0.97 0.00 0.00 -0.27 0.00 0.00 62.75 61.42 2q3r n ILE 227 Cb 0.28 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 38.73 2q3r n ILE 227 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2q3r n GLY 228 N 1.31 -1.63 0.31 3.28 0.00 0.26 -4.50 105.19 104.22 2q3r n GLY 228 Ca 0.20 -1.20 0.13 0.00 0.00 0.00 0.00 46.02 45.15 2q3r n GLY 228 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2q3r h PRO 229 N 0.00 0.00 0.00 1.61 0.13 -1.82 -2.52 132.00 129.40 2q3r h PRO 229 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2q3r h PRO 229 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2q3r h PRO 229 CO 0.00 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.37 2q3r n ASP 230 N -4.38 0.00 -0.58 1.44 3.85 -1.26 -1.74 116.55 113.87 2q3r n ASP 230 Ca 0.01 0.38 0.06 0.00 -0.71 0.00 0.00 54.79 54.53 2q3r n ASP 230 Cb 0.27 -0.42 0.20 0.00 -1.35 0.00 0.00 41.12 39.81 2q3r n ASP 230 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2q3r n ARG 231 N -1.42 1.58 -5.05 0.11 1.74 -0.95 -4.66 116.66 108.01 2q3r n ARG 231 Ca 0.03 -3.22 -0.29 0.00 -0.77 0.00 0.00 57.85 53.60 2q3r n ARG 231 Cb 0.09 -1.62 -0.17 0.00 -1.02 0.00 0.00 32.46 29.74 2q3r n ARG 231 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2q3r s VAL 232 N -3.20 1.77 -0.05 1.55 1.01 -0.71 0.25 120.40 121.03 2q3r s VAL 232 Ca 0.38 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 2q3r s VAL 232 Cb 0.36 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 35.24 2q3r s VAL 232 CO -0.05 0.50 0.03 -0.83 0.00 0.00 0.00 175.10 174.74 2q3r s GLY 233 N 0.19 0.30 -0.08 4.51 0.00 0.16 -1.09 107.32 111.31 2q3r s GLY 233 Ca -0.11 0.09 -0.04 0.00 0.00 0.00 0.00 44.72 44.66 2q3r s GLY 233 CO 0.05 1.14 0.09 -1.50 0.00 0.00 0.00 173.10 172.88 2q3r s ILE 234 N 1.85 4.96 -0.20 0.90 2.07 -1.05 -0.05 121.20 129.68 2q3r s ILE 234 Ca 0.02 -0.09 -0.04 0.00 -1.41 0.00 0.00 60.65 59.13 2q3r s ILE 234 Cb -0.12 -3.17 -0.02 0.00 0.13 0.00 0.00 42.46 39.27 2q3r s ILE 234 CO -0.03 0.54 -0.02 -0.60 -1.91 0.00 0.00 174.94 172.92 2q3r s ARG 235 N -1.19 3.53 0.19 3.50 3.52 -0.53 -1.12 118.95 126.86 2q3r s ARG 235 Ca 0.17 -0.56 0.08 0.00 -0.13 0.00 0.00 55.73 55.28 2q3r s ARG 235 Cb -0.12 -3.03 -0.05 0.00 -1.56 0.00 0.00 34.95 30.19 2q3r s ARG 235 CO 0.06 -0.04 -0.15 -0.51 -0.81 0.00 0.00 175.30 173.86 2q3r s LEU 236 N 1.11 2.54 -0.45 -0.88 1.43 -0.15 -2.30 118.68 119.99 2q3r s LEU 236 Ca 0.02 -1.00 0.07 0.00 -1.03 0.00 0.00 54.13 52.20 2q3r s LEU 236 Cb -0.14 -0.67 0.31 0.00 0.03 0.00 0.00 46.19 45.72 2q3r s LEU 236 CO 0.01 -0.16 0.99 -1.20 0.23 0.00 0.00 176.35 176.21 2q3r n SER 237 N -0.27 -1.76 0.11 2.29 7.64 -1.26 -2.74 113.62 117.64 2q3r n SER 237 Ca -0.09 -3.48 0.07 0.00 1.01 0.00 0.00 58.87 56.38 2q3r n SER 237 Cb 0.60 1.35 0.37 0.00 -1.01 0.00 0.00 64.21 65.52 2q3r n SER 237 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2q3r n PRO 238 N 0.59 0.09 0.00 1.43 -0.04 -1.26 -2.23 135.00 133.58 2q3r n PRO 238 Ca 0.11 0.57 0.11 0.00 -0.04 0.00 0.00 63.50 64.25 2q3r n PRO 238 Cb 0.67 -1.85 0.09 0.00 -0.04 0.00 0.00 33.50 32.37 2q3r n PRO 238 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2q3r n PHE 239 N -1.98 0.04 -2.62 0.54 3.01 -1.26 -4.53 117.46 110.67 2q3r n PHE 239 Ca -0.01 0.01 -0.22 0.00 1.01 0.00 0.00 57.45 58.24 2q3r n PHE 239 Cb 0.08 -0.19 0.07 0.00 -0.01 0.00 0.00 39.48 39.42 2q3r n PHE 239 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2q3r s ALA 240 N -3.03 3.82 0.00 4.37 0.00 -0.95 -4.75 121.76 121.23 2q3r s ALA 240 Ca 0.09 -1.52 0.05 0.00 0.00 0.00 0.00 51.96 50.58 2q3r s ALA 240 Cb 0.16 -2.04 0.08 0.00 0.00 0.00 0.00 23.12 21.33 2q3r s ALA 240 CO 0.77 -1.07 1.02 -0.40 0.00 0.00 0.00 175.76 176.08 2q3r n ASP 241 N -2.57 0.19 -4.61 0.00 5.68 -1.26 -3.97 116.55 110.01 2q3r n ASP 241 Ca 0.11 -1.97 -0.50 0.00 -0.50 0.00 0.00 54.79 51.93 2q3r n ASP 241 Cb 0.60 -0.21 -0.05 0.00 -1.14 0.00 0.00 41.12 40.32 2q3r n ASP 241 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2q3r n TYR 242 N 0.10 1.70 -3.37 2.11 9.36 -1.26 -1.67 117.16 124.12 2q3r n TYR 242 Ca 0.01 0.54 -0.17 0.00 3.32 0.00 0.00 57.90 61.60 2q3r n TYR 242 Cb 0.78 -2.38 0.07 0.00 -0.63 0.00 0.00 39.34 37.19 2q3r n TYR 242 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 2q3r n MET 243 N 2.57 -4.14 -4.08 2.98 2.81 -1.26 -3.37 117.12 112.62 2q3r n MET 243 Ca 0.17 0.83 -0.42 0.00 -1.81 0.00 0.00 57.70 56.46 2q3r n MET 243 Cb 0.23 -5.73 0.00 0.00 -0.71 0.00 0.00 33.22 27.02 2q3r n MET 243 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2q3r n GLU 244 N -3.71 -0.53 -0.44 0.03 1.02 -0.67 -4.85 120.64 111.49 2q3r n GLU 244 Ca -0.18 0.11 0.07 0.00 -0.02 0.00 0.00 57.16 57.15 2q3r n GLU 244 Cb 0.64 -2.89 0.16 0.00 -0.02 0.00 0.00 31.44 29.33 2q3r n GLU 244 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2q3r n SER 245 N -2.34 1.82 -4.77 1.62 3.41 -0.90 -4.81 113.62 107.65 2q3r n SER 245 Ca -0.15 -3.35 -0.32 0.00 -0.26 0.00 0.00 58.87 54.79 2q3r n SER 245 Cb 0.59 -0.46 0.07 0.00 -0.26 0.00 0.00 64.21 64.16 2q3r n SER 245 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2q3r s GLY 246 N -2.89 1.84 -0.01 5.00 0.00 -1.25 -4.53 107.32 105.47 2q3r s GLY 246 Ca 0.33 0.34 0.07 0.00 0.00 0.00 0.00 44.72 45.47 2q3r s GLY 246 CO -0.03 0.69 -0.22 -0.35 0.00 0.00 0.00 173.10 173.18 2q3r s ASP 247 N -3.15 2.64 0.51 1.64 -1.08 -1.26 -3.60 116.67 112.37 2q3r s ASP 247 Ca 0.63 -0.41 0.29 0.00 -0.52 0.00 0.00 52.55 52.53 2q3r s ASP 247 Cb -0.18 -0.29 1.30 0.00 -1.46 0.00 0.00 42.92 42.29 2q3r s ASP 247 CO 0.51 0.27 1.98 0.71 0.52 0.00 0.00 175.17 179.16 2q3r h THR 248 N 4.57 0.38 -2.04 1.71 1.35 -1.95 -3.28 112.91 113.64 2q3r h THR 248 Ca -0.41 -0.72 -0.55 0.00 -0.55 0.00 0.00 66.41 64.18 2q3r h THR 248 Cb 1.13 1.52 -0.40 0.00 -1.73 0.00 0.00 68.15 68.68 2q3r h THR 248 CO 0.47 0.12 -1.03 -3.20 -0.25 0.00 0.00 175.52 171.64 2q3r n ASN 249 N -3.37 0.98 0.33 5.36 2.85 -1.26 -4.95 115.26 115.20 2q3r n ASN 249 Ca -0.01 -2.89 0.21 0.00 -0.11 0.00 0.00 54.58 51.79 2q3r n ASN 249 Cb 0.32 -0.64 1.12 0.00 1.24 0.00 0.00 39.78 41.82 2q3r n ASN 249 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2q3r h PRO 250 N 3.84 0.00 -0.11 1.20 0.13 -1.80 -2.21 132.00 133.05 2q3r h PRO 250 Ca 0.10 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.01 2q3r h PRO 250 Cb 0.85 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.98 2q3r h PRO 250 CO 0.54 0.00 -0.79 0.78 -0.23 0.00 0.00 178.00 178.30 2q3r h GLY 251 N 0.29 0.70 1.06 1.56 0.00 -1.92 -2.82 103.07 101.94 2q3r h GLY 251 Ca -0.00 -1.02 -0.16 0.00 0.00 0.00 0.00 47.33 46.15 2q3r h GLY 251 CO 0.00 0.91 -0.44 0.00 0.00 0.00 0.00 176.54 177.00 2q3r h ALA 252 N 0.69 0.43 -0.14 3.60 0.00 -1.84 -2.78 119.26 119.22 2q3r h ALA 252 Ca -0.05 -0.47 0.03 0.00 0.00 0.00 0.00 54.91 54.41 2q3r h ALA 252 Cb 1.40 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 2q3r h ALA 252 CO 0.15 0.57 -0.03 1.25 0.00 0.00 0.00 179.25 181.19 2q3r h LEU 253 N 0.55 -0.11 0.07 0.00 5.85 -1.58 -2.05 115.31 118.04 2q3r h LEU 253 Ca 0.02 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 2q3r h LEU 253 Cb 1.05 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2q3r h LEU 253 CO 0.10 -0.04 -0.12 1.23 -0.34 0.00 0.00 178.44 179.27 2q3r h GLY 254 N 0.01 -1.03 -0.15 3.75 0.00 -1.40 -1.84 103.07 102.41 2q3r h GLY 254 Ca 0.07 0.47 0.09 0.00 0.00 0.00 0.00 47.33 47.95 2q3r h GLY 254 CO -0.13 -0.36 -0.27 -2.00 0.00 0.00 0.00 176.54 173.77 2q3r h LEU 255 N -0.21 -0.92 -0.72 3.11 5.85 -1.51 -1.07 115.31 119.84 2q3r h LEU 255 Ca -0.01 0.18 0.13 0.00 0.84 0.00 0.00 57.88 59.03 2q3r h LEU 255 Cb 0.19 0.46 -0.09 0.00 0.37 0.00 0.00 40.66 41.59 2q3r h LEU 255 CO -0.04 -0.29 0.26 0.22 -0.34 0.00 0.00 178.44 178.26 2q3r h TYR 256 N -0.19 0.45 -0.36 1.25 3.20 -1.30 0.84 116.97 120.85 2q3r h TYR 256 Ca 0.20 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 62.07 2q3r h TYR 256 Cb 0.50 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 2q3r h TYR 256 CO -0.51 0.05 0.11 0.52 -1.64 0.00 0.00 178.16 176.68 2q3r h MET 257 N 0.41 0.57 0.88 1.82 2.86 -0.37 0.70 114.93 121.80 2q3r h MET 257 Ca 0.39 -0.13 -0.04 0.00 -2.06 0.00 0.00 59.70 57.86 2q3r h MET 257 Cb 0.58 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.16 2q3r h MET 257 CO -0.40 0.60 -0.46 0.00 1.06 0.00 0.00 176.91 177.71 2q3r h ALA 258 N 0.95 -1.31 -0.65 6.32 0.00 -0.32 0.05 119.26 124.30 2q3r h ALA 258 Ca 0.12 -0.27 0.13 0.00 0.00 0.00 0.00 54.91 54.89 2q3r h ALA 258 Cb 0.27 0.53 -0.12 0.00 0.00 0.00 0.00 17.79 18.46 2q3r h ALA 258 CO -0.00 -1.24 -0.19 0.93 0.00 0.00 0.00 179.25 178.75 2q3r h GLU 259 N -1.23 -0.02 -0.76 0.00 5.08 -0.86 -0.12 114.58 116.66 2q3r h GLU 259 Ca -0.12 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2q3r h GLU 259 Cb 0.96 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.17 2q3r h GLU 259 CO 0.17 -0.02 0.49 0.77 -1.00 0.00 0.00 179.01 179.43 2q3r h SER 260 N -0.03 0.83 -0.17 1.42 0.02 -0.65 -2.99 113.55 111.98 2q3r h SER 260 Ca 0.31 -0.01 -0.17 0.00 -0.84 0.00 0.00 61.79 61.07 2q3r h SER 260 Cb 0.49 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.84 2q3r h SER 260 CO -0.68 0.59 -0.52 -0.07 -1.14 0.00 0.00 176.83 175.01 2q3r h LEU 261 N 0.98 0.83 -1.46 5.07 3.38 0.45 -3.08 115.31 121.49 2q3r h LEU 261 Ca 0.30 -0.43 0.22 0.00 0.09 0.00 0.00 57.88 58.06 2q3r h LEU 261 Cb -0.04 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.40 2q3r h LEU 261 CO -0.09 1.19 0.63 0.78 0.09 0.00 0.00 178.44 181.04 2q3r h ASN 262 N 0.59 0.43 -0.96 -0.43 2.35 -0.93 0.87 115.58 117.49 2q3r h ASN 262 Ca 0.02 0.05 0.20 0.00 -0.55 0.00 0.00 56.30 56.02 2q3r h ASN 262 Cb 1.09 -0.02 -0.09 0.00 0.05 0.00 0.00 38.32 39.35 2q3r h ASN 262 CO 0.11 0.14 0.61 0.50 -1.65 0.00 0.00 177.43 177.15 2q3r h LYS 263 N 0.41 0.57 0.00 0.81 3.64 -1.54 0.19 116.57 120.64 2q3r h LYS 263 Ca 0.51 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.86 2q3r h LYS 263 Cb 1.28 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2q3r h LYS 263 CO -0.21 0.38 -0.11 0.66 -2.27 0.00 0.00 179.45 177.89 2q3r n TYR 264 N -4.63 0.32 -3.74 1.91 4.02 0.30 -4.95 117.16 110.39 2q3r n TYR 264 Ca 0.22 0.09 -0.25 0.00 -0.01 0.00 0.00 57.90 57.94 2q3r n TYR 264 Cb 0.65 -0.61 0.05 0.00 -0.02 0.00 0.00 39.34 39.40 2q3r n TYR 264 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2q3r n GLY 265 N 1.43 -0.46 3.87 2.72 0.00 0.65 -4.86 105.19 108.55 2q3r n GLY 265 Ca 0.06 0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 2q3r n GLY 265 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2q3r s ILE 266 N -3.38 2.01 0.10 -0.61 -4.36 -1.26 -4.47 121.20 109.22 2q3r s ILE 266 Ca 0.45 0.00 -0.19 0.00 -0.26 0.00 0.00 60.65 60.65 2q3r s ILE 266 Cb -0.22 -2.94 -0.07 0.00 1.25 0.00 0.00 42.46 40.48 2q3r s ILE 266 CO 0.79 -0.00 1.62 0.25 0.24 0.00 0.00 174.94 177.83 2q3r h LEU 267 N -1.16 0.34 -7.64 0.37 5.85 -0.31 -3.43 115.31 109.33 2q3r h LEU 267 Ca -0.47 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.01 2q3r h LEU 267 Cb 1.33 -0.09 -0.11 0.00 0.37 0.00 0.00 40.66 42.16 2q3r h LEU 267 CO 0.65 0.44 -0.06 -0.72 -0.34 0.00 0.00 178.44 178.41 2q3r s TYR 268 N -5.45 -0.06 -0.14 1.25 -0.85 -0.96 -1.30 117.35 109.84 2q3r s TYR 268 Ca -0.14 -0.27 0.01 0.00 -0.52 0.00 0.00 57.07 56.15 2q3r s TYR 268 Cb 0.08 0.27 0.02 0.00 0.38 0.00 0.00 41.96 42.71 2q3r s TYR 268 CO 0.72 -0.81 -0.15 0.00 -1.52 0.00 0.00 175.55 173.79 2q3r s HIS 270 N 1.29 3.02 0.02 0.00 5.04 -0.28 0.26 115.29 124.64 2q3r s HIS 270 Ca 0.01 -1.24 0.05 0.00 -1.54 0.00 0.00 55.06 52.33 2q3r s HIS 270 Cb -0.14 -2.09 -0.02 0.00 0.04 0.00 0.00 32.58 30.37 2q3r s HIS 270 CO -0.07 -0.64 -0.15 0.08 -2.34 0.00 0.00 174.74 171.62 2q3r s VAL 271 N 1.41 1.16 -0.20 0.89 1.01 0.21 -0.97 120.40 123.91 2q3r s VAL 271 Ca 0.03 -0.86 -0.14 0.00 0.00 0.00 0.00 61.98 61.00 2q3r s VAL 271 Cb -0.16 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2q3r s VAL 271 CO -0.04 0.14 0.33 -0.63 0.00 0.00 0.00 175.10 174.90 2q3r s ILE 272 N -0.64 5.26 0.54 2.22 1.01 -1.11 0.22 121.20 128.69 2q3r s ILE 272 Ca 0.04 0.57 -0.21 0.00 0.00 0.00 0.00 60.65 61.04 2q3r s ILE 272 Cb -0.07 -3.66 -0.05 0.00 0.01 0.00 0.00 42.46 38.69 2q3r s ILE 272 CO 0.01 0.31 1.28 -0.70 0.00 0.00 0.00 174.94 175.83 2q3r s GLU 273 N 1.04 3.21 0.54 2.79 2.56 0.23 -4.77 118.70 124.29 2q3r s GLU 273 Ca 0.16 2.04 -0.21 0.00 0.00 0.00 0.00 54.97 56.96 2q3r s GLU 273 Cb -0.14 -2.20 -0.05 0.00 2.00 0.00 0.00 34.13 33.74 2q3r s GLU 273 CO 0.06 -1.08 1.30 0.00 -0.56 0.00 0.00 175.26 174.99 2q3r s ALA 274 N -1.42 2.80 0.48 6.30 0.00 -1.26 -4.88 121.76 123.78 2q3r s ALA 274 Ca 0.72 1.22 -0.24 0.00 0.00 0.00 0.00 51.96 53.66 2q3r s ALA 274 Cb -0.36 -3.52 -0.07 0.00 0.00 0.00 0.00 23.12 19.17 2q3r s ALA 274 CO 0.41 -1.23 1.41 -2.13 0.00 0.00 0.00 175.76 174.22 2q3r n ARG 275 N -1.03 2.07 0.00 0.00 0.63 -1.26 -5.11 116.66 111.96 2q3r n ARG 275 Ca 0.10 0.74 0.00 0.00 -0.92 0.00 0.00 57.85 57.78 2q3r n ARG 275 Cb 0.46 -2.61 0.00 0.00 0.45 0.00 0.00 32.46 30.76 2q3r n ARG 275 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2q3r n MET 276 N -0.46 0.00 -0.44 -0.14 0.00 -1.26 -5.17 117.12 109.66 2q3r n MET 276 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 57.70 57.49 2q3r n MET 276 Cb 0.42 0.00 0.23 0.00 0.00 0.00 0.00 33.22 33.88 2q3r n MET 276 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 2q3r n HIS 287 N 0.00 -2.42 0.00 3.17 8.25 -1.26 -5.25 115.22 117.72 2q3r n HIS 287 Ca 0.00 -0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.16 2q3r n HIS 287 Cb 0.00 -1.48 0.00 0.00 1.12 0.00 0.00 29.99 29.63 2q3r n HIS 287 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2q3r n THR 288 N -5.07 0.00 0.06 1.59 5.66 -1.26 -5.02 114.28 110.24 2q3r n THR 288 Ca 0.06 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.95 2q3r n THR 288 Cb 0.54 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.18 2q3r n THR 288 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 2q3r h LEU 289 N 0.00 0.18 -0.63 1.09 4.07 -2.00 -3.38 115.31 114.64 2q3r h LEU 289 Ca 0.00 -0.23 0.09 0.00 0.08 0.00 0.00 57.88 57.82 2q3r h LEU 289 Cb 0.00 -0.06 -0.07 0.00 1.08 0.00 0.00 40.66 41.61 2q3r h LEU 289 CO 0.00 1.18 0.27 0.24 -1.08 0.00 0.00 178.44 179.06 2q3r h MET 290 N 0.03 0.47 -0.89 1.13 2.86 -1.95 0.43 114.93 117.00 2q3r h MET 290 Ca -0.14 -0.03 0.09 0.00 -2.06 0.00 0.00 59.70 57.56 2q3r h MET 290 Cb 1.91 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 33.39 2q3r h MET 290 CO 0.14 0.31 0.54 -1.35 1.06 0.00 0.00 176.91 177.62 2q3r h PRO 291 N 0.48 0.91 -0.44 -0.22 0.11 -1.99 0.26 132.00 131.11 2q3r h PRO 291 Ca 0.31 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.26 2q3r h PRO 291 Cb 0.36 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 2q3r h PRO 291 CO -0.28 0.60 -0.16 0.52 -0.21 0.00 0.00 178.00 178.47 2q3r h MET 292 N 0.93 0.88 0.32 1.05 2.86 -1.54 -2.29 114.93 117.15 2q3r h MET 292 Ca 0.42 -0.36 -0.02 0.00 -2.06 0.00 0.00 59.70 57.68 2q3r h MET 292 Cb 0.31 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2q3r h MET 292 CO -0.22 1.01 -0.15 -0.09 1.06 0.00 0.00 176.91 178.51 2q3r h ARG 293 N 0.71 -0.41 -0.06 1.72 9.65 0.35 0.00 114.38 126.35 2q3r h ARG 293 Ca 0.11 0.03 0.02 0.00 -1.10 0.00 0.00 59.98 59.03 2q3r h ARG 293 Cb 0.71 0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 29.38 2q3r h ARG 293 CO 0.05 -0.28 0.27 0.87 2.80 0.00 0.00 179.97 183.69 2q3r h LYS 294 N -0.46 0.00 0.00 0.20 1.57 -0.63 0.37 116.57 117.62 2q3r h LYS 294 Ca -0.04 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 2q3r h LYS 294 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 2q3r h LYS 294 CO 0.07 0.00 -0.71 0.00 -0.57 0.00 0.00 179.45 178.25 2q3r h ALA 295 N 1.51 0.70 -2.21 3.86 0.00 -1.17 -3.44 119.26 118.51 2q3r h ALA 295 Ca 0.03 -0.25 -0.67 0.00 0.00 0.00 0.00 54.91 54.02 2q3r h ALA 295 Cb 0.57 0.04 -0.17 0.00 0.00 0.00 0.00 17.79 18.23 2q3r h ALA 295 CO -0.00 0.29 0.03 0.12 0.00 0.00 0.00 179.25 179.69 2q3r s PHE 296 N -3.16 3.09 0.35 0.00 5.36 0.13 -4.62 117.98 119.12 2q3r s PHE 296 Ca 0.02 -0.22 0.05 0.00 -0.96 0.00 0.00 56.93 55.83 2q3r s PHE 296 Cb 0.08 -3.27 0.64 0.00 -0.34 0.00 0.00 43.02 40.13 2q3r s PHE 296 CO 0.75 -0.86 1.88 0.87 -1.46 0.00 0.00 175.22 176.40 2q3r h LYS 297 N 8.86 0.46 0.00 10.12 1.79 -1.86 -3.45 116.57 132.50 2q3r h LYS 297 Ca -0.26 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.11 2q3r h LYS 297 Cb 1.10 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.68 2q3r h LYS 297 CO 0.88 0.52 0.00 0.41 -1.08 0.00 0.00 179.45 180.18 2q3r n GLY 298 N -0.87 -0.76 3.77 3.86 0.00 -1.26 -5.02 105.19 104.91 2q3r n GLY 298 Ca 0.01 -1.68 -0.37 0.00 0.00 0.00 0.00 46.02 43.98 2q3r n GLY 298 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q3r s THR 299 N -0.37 3.10 -0.04 2.61 2.01 -0.42 -4.88 115.64 117.65 2q3r s THR 299 Ca 0.00 0.84 0.07 0.00 0.31 0.00 0.00 61.69 62.90 2q3r s THR 299 Cb 0.00 -3.43 -0.01 0.00 0.01 0.00 0.00 72.50 69.07 2q3r s THR 299 CO 0.00 -0.00 -0.25 0.12 -0.69 0.00 0.00 174.62 173.79 2q3r s PHE 300 N -1.53 2.40 -0.12 4.92 5.36 -1.26 -0.76 117.98 126.98 2q3r s PHE 300 Ca 0.63 -0.62 0.01 0.00 -0.96 0.00 0.00 56.93 55.99 2q3r s PHE 300 Cb -0.29 -1.56 0.02 0.00 -0.34 0.00 0.00 43.02 40.85 2q3r s PHE 300 CO 0.35 -0.15 -0.14 0.42 -1.46 0.00 0.00 175.22 174.25 2q3r s ILE 301 N -0.33 1.43 0.06 3.12 1.01 0.14 -1.28 121.20 125.35 2q3r s ILE 301 Ca 0.02 -0.58 0.04 0.00 0.00 0.00 0.00 60.65 60.13 2q3r s ILE 301 Cb -0.12 -1.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 2q3r s ILE 301 CO 0.02 0.43 0.01 -0.44 0.00 0.00 0.00 174.94 174.96 2q3r s SER 302 N 1.24 5.11 0.06 3.58 0.01 -0.06 0.65 113.70 124.29 2q3r s SER 302 Ca -0.02 -0.11 -0.08 0.00 1.31 0.00 0.00 55.95 57.05 2q3r s SER 302 Cb -0.14 -1.27 -0.00 0.00 0.21 0.00 0.00 66.02 64.82 2q3r s SER 302 CO -0.05 0.20 0.17 0.00 0.41 0.00 0.00 173.24 173.97 2q3r s ALA 303 N -1.26 -0.24 0.00 1.44 0.00 0.13 -2.28 121.76 119.56 2q3r s ALA 303 Ca 0.24 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.72 2q3r s ALA 303 Cb -0.12 0.36 0.00 0.00 0.00 0.00 0.00 23.12 23.36 2q3r s ALA 303 CO 0.16 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.92 2q3r n GLY 304 N 0.38 1.60 2.45 0.00 0.00 -1.26 0.75 105.19 109.11 2q3r n GLY 304 Ca -0.17 -0.44 -0.18 0.00 0.00 0.00 0.00 46.02 45.23 2q3r n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q3r n GLY 305 N 0.00 -0.50 3.77 -0.02 0.00 -1.26 -4.83 105.19 102.34 2q3r n GLY 305 Ca 0.00 0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 2q3r n GLY 305 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q3r s PHE 306 N -2.89 3.06 0.39 1.61 0.40 -1.26 -5.04 117.98 114.24 2q3r s PHE 306 Ca 0.02 1.54 0.08 0.00 -0.60 0.00 0.00 56.93 57.96 2q3r s PHE 306 Cb -0.01 -3.44 -0.01 0.00 0.51 0.00 0.00 43.02 40.08 2q3r s PHE 306 CO 0.02 -1.41 0.45 0.95 0.70 0.00 0.00 175.22 175.93 2q3r s THR 307 N -1.37 3.16 0.12 0.64 -4.23 -1.26 -4.94 115.64 107.75 2q3r s THR 307 Ca 0.56 -1.16 -0.24 0.00 -1.18 0.00 0.00 61.69 59.67 2q3r s THR 307 Cb -0.32 -3.10 -0.06 0.00 1.34 0.00 0.00 72.50 70.36 2q3r s THR 307 CO 0.41 -0.05 1.67 -0.09 -0.54 0.00 0.00 174.62 176.01 2q3r h ARG 308 N 0.90 -0.24 -0.12 3.99 2.43 -2.00 -1.53 114.38 117.80 2q3r h ARG 308 Ca -0.42 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 58.69 2q3r h ARG 308 Cb 1.27 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.86 2q3r h ARG 308 CO 0.52 -0.16 -0.27 0.93 -1.51 0.00 0.00 179.97 179.48 2q3r h GLU 309 N -0.25 0.22 -0.01 0.20 3.07 -2.00 -2.45 114.58 113.36 2q3r h GLU 309 Ca 0.06 -0.07 0.03 0.00 -0.50 0.00 0.00 59.36 58.87 2q3r h GLU 309 Cb 0.33 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.19 2q3r h GLU 309 CO -0.16 0.48 -0.16 -0.44 -1.40 0.00 0.00 179.01 177.33 2q3r h ASP 310 N 0.20 -0.46 -0.56 1.42 3.32 -1.78 -2.65 116.42 115.89 2q3r h ASP 310 Ca 0.03 0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.09 2q3r h ASP 310 Cb 0.59 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 2q3r h ASP 310 CO 0.04 -0.22 0.13 1.23 -1.72 0.00 0.00 179.24 178.70 2q3r h GLY 311 N -0.26 0.98 0.18 2.75 0.00 -1.07 -2.53 103.07 103.13 2q3r h GLY 311 Ca 0.06 -0.62 0.13 0.00 0.00 0.00 0.00 47.33 46.89 2q3r h GLY 311 CO -0.16 0.58 0.23 3.43 0.00 0.00 0.00 176.54 180.62 2q3r h ASN 312 N 0.81 0.16 -0.30 0.19 2.35 -1.30 -0.80 115.58 116.70 2q3r h ASN 312 Ca 0.18 0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 55.98 2q3r h ASN 312 Cb 0.36 0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 2q3r h ASN 312 CO 0.00 0.07 -0.04 -0.08 -1.65 0.00 0.00 177.43 175.74 2q3r h GLU 313 N 0.37 0.56 -0.59 0.81 4.81 -1.28 0.95 114.58 120.20 2q3r h GLU 313 Ca 0.37 -0.20 0.04 0.00 -0.13 0.00 0.00 59.36 59.44 2q3r h GLU 313 Cb 0.54 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 2q3r h GLU 313 CO -0.40 0.73 0.34 0.00 -0.73 0.00 0.00 179.01 178.95 2q3r h ALA 314 N 0.81 0.77 -0.22 2.92 0.00 -1.04 0.43 119.26 122.94 2q3r h ALA 314 Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2q3r h ALA 314 Cb 0.50 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2q3r h ALA 314 CO 0.02 0.03 -0.15 0.28 0.00 0.00 0.00 179.25 179.43 2q3r h VAL 315 N 0.65 1.31 0.39 0.00 2.07 -1.06 0.27 116.25 119.88 2q3r h VAL 315 Ca 0.25 -1.26 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 2q3r h VAL 315 Cb 0.10 1.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 2q3r h VAL 315 CO -0.14 0.39 -0.23 0.77 0.02 0.00 0.00 177.57 178.38 2q3r h SER 316 N 0.19 -0.58 0.00 0.57 4.64 -0.34 -1.92 113.55 116.12 2q3r h SER 316 Ca 0.04 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2q3r h SER 316 Cb 0.67 0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2q3r h SER 316 CO 0.04 -0.37 0.00 0.29 -0.87 0.00 0.00 176.83 175.92 2q3r n LYS 317 N -5.36 0.68 -1.85 4.77 4.76 0.10 -4.87 118.16 116.39 2q3r n LYS 317 Ca -0.10 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.21 2q3r n LYS 317 Cb 0.27 -1.39 -0.03 0.00 -1.84 0.00 0.00 35.03 32.04 2q3r n LYS 317 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2q3r n GLY 318 N 0.32 0.52 0.00 0.72 0.00 -0.72 -4.90 105.19 101.13 2q3r n GLY 318 Ca 0.13 -0.40 0.13 0.00 0.00 0.00 0.00 46.02 45.88 2q3r n GLY 318 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q3r n ARG 319 N -2.39 0.40 -3.58 1.61 5.12 0.91 -4.84 116.66 113.88 2q3r n ARG 319 Ca -0.14 0.03 -0.05 0.00 -1.93 0.00 0.00 57.85 55.76 2q3r n ARG 319 Cb 0.52 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 30.30 2q3r n ARG 319 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2q3r s THR 320 N -2.54 0.00 -0.24 0.55 -1.32 -1.20 -4.92 115.64 105.96 2q3r s THR 320 Ca 0.26 -0.09 -0.00 0.00 -1.21 0.00 0.00 61.69 60.65 2q3r s THR 320 Cb 0.18 -1.21 -0.15 0.00 -1.51 0.00 0.00 72.50 69.81 2q3r s THR 320 CO 0.40 0.00 -0.23 0.47 -2.21 0.00 0.00 174.62 173.05 2q3r n ASP 321 N -0.23 2.08 -4.18 8.08 8.00 -0.87 -4.28 116.55 125.15 2q3r n ASP 321 Ca -0.05 -0.06 -0.20 0.00 0.71 0.00 0.00 54.79 55.19 2q3r n ASP 321 Cb 0.60 -0.44 -0.13 0.00 -0.02 0.00 0.00 41.12 41.14 2q3r n ASP 321 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2q3r s LEU 322 N -6.56 2.24 -0.19 0.64 1.43 -0.41 -4.92 118.68 110.90 2q3r s LEU 322 Ca -0.33 -0.56 -0.00 0.00 -1.03 0.00 0.00 54.13 52.20 2q3r s LEU 322 Cb 0.09 -0.61 0.05 0.00 0.03 0.00 0.00 46.19 45.75 2q3r s LEU 322 CO 0.54 -0.01 -0.05 -0.69 0.23 0.00 0.00 176.35 176.37 2q3r s VAL 323 N -1.09 1.25 0.08 -1.59 1.01 -1.22 -0.88 120.40 117.95 2q3r s VAL 323 Ca 0.01 -0.85 -0.26 0.00 0.00 0.00 0.00 61.98 60.87 2q3r s VAL 323 Cb -0.09 -1.47 -0.06 0.00 0.00 0.00 0.00 36.38 34.76 2q3r s VAL 323 CO 0.02 0.03 0.81 0.00 0.00 0.00 0.00 175.10 175.96 2q3r s ALA 324 N 1.55 3.35 -0.15 5.51 0.00 -0.96 -3.02 121.76 128.04 2q3r s ALA 324 Ca -0.02 0.36 -0.01 0.00 0.00 0.00 0.00 51.96 52.30 2q3r s ALA 324 Cb -0.17 -3.06 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 2q3r s ALA 324 CO -0.07 0.07 -0.12 0.71 0.00 0.00 0.00 175.76 176.35 2q3r s TYR 325 N -0.19 2.83 0.00 0.00 2.02 -0.90 -4.43 117.35 116.68 2q3r s TYR 325 Ca 0.40 -0.80 0.00 0.00 -0.37 0.00 0.00 57.07 56.30 2q3r s TYR 325 Cb -0.21 -1.90 0.00 0.00 -0.40 0.00 0.00 41.96 39.45 2q3r s TYR 325 CO 0.25 -0.33 0.00 0.41 -1.57 0.00 0.00 175.55 174.31 2q3r n GLY 326 N 3.87 -0.05 0.32 0.71 0.00 -1.26 -2.37 105.19 106.41 2q3r n GLY 326 Ca -0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.69 2q3r n GLY 326 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2q3r h ARG 327 N 0.00 -0.58 0.00 1.61 3.08 -1.97 0.45 114.38 116.97 2q3r h ARG 327 Ca 0.00 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2q3r h ARG 327 Cb 0.00 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.18 2q3r h ARG 327 CO 0.00 -0.39 0.00 0.91 -1.07 0.00 0.00 179.97 179.42 2q3r n TRP 328 N -5.40 0.00 -0.01 3.04 5.03 -1.26 -0.01 117.44 118.82 2q3r n TRP 328 Ca -0.09 0.00 -0.01 0.00 3.03 0.00 0.00 57.50 60.43 2q3r n TRP 328 Cb 0.31 0.00 -0.02 0.00 -1.03 0.00 0.00 31.31 30.57 2q3r n TRP 328 CO 0.00 0.00 0.00 0.34 -0.03 0.00 0.00 177.69 178.00 2q3r n PHE 329 N -0.99 0.00 -0.16 -5.99 -0.00 -0.43 -4.09 117.46 105.80 2q3r n PHE 329 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.45 57.37 2q3r n PHE 329 Cb 0.00 -0.14 0.01 0.00 -0.00 0.00 0.00 39.48 39.35 2q3r n PHE 329 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 2q3r h LEU 330 N 0.00 0.58 -0.14 -2.13 6.46 0.36 -3.18 115.31 117.27 2q3r h LEU 330 Ca -0.07 -0.11 -0.24 0.00 -0.12 0.00 0.00 57.88 57.34 2q3r h LEU 330 Cb 1.06 -0.15 0.01 0.00 -0.73 0.00 0.00 40.66 40.84 2q3r h LEU 330 CO 0.00 0.53 -0.95 0.00 -0.62 0.00 0.00 178.44 177.41 2q3r h ALA 331 N 1.08 0.30 -2.62 1.25 0.00 -1.30 -3.43 119.26 114.54 2q3r h ALA 331 Ca 0.16 -0.69 -0.73 0.00 0.00 0.00 0.00 54.91 53.65 2q3r h ALA 331 Cb 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 17.79 17.58 2q3r h ALA 331 CO -0.02 0.76 -0.38 -0.80 0.00 0.00 0.00 179.25 178.81 2q3r s ASN 332 N -7.14 5.74 0.55 0.00 0.02 -1.20 -4.70 114.94 108.21 2q3r s ASN 332 Ca -0.07 -1.93 0.24 0.00 -1.02 0.00 0.00 52.86 50.08 2q3r s ASN 332 Cb 0.08 -2.02 1.50 0.00 0.02 0.00 0.00 41.25 40.83 2q3r s ASN 332 CO 0.89 -0.70 2.11 1.55 0.02 0.00 0.00 177.10 180.96 2q3r h PRO 333 N 8.45 0.00 -0.85 -0.60 0.13 -1.83 -1.34 132.00 135.96 2q3r h PRO 333 Ca -0.21 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.34 2q3r h PRO 333 Cb 1.07 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.87 2q3r h PRO 333 CO 0.87 0.00 0.10 -0.40 -0.23 0.00 0.00 178.00 178.34 2q3r n ASP 334 N -4.17 6.04 -0.27 1.44 3.85 -1.26 -4.06 116.55 118.13 2q3r n ASP 334 Ca 0.02 -3.77 0.07 0.00 -0.71 0.00 0.00 54.79 50.39 2q3r n ASP 334 Cb 0.30 -0.69 0.18 0.00 -1.35 0.00 0.00 41.12 39.56 2q3r n ASP 334 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 2q3r h LEU 335 N 1.96 -0.28 0.03 -2.12 5.85 -1.55 -0.26 115.31 118.95 2q3r h LEU 335 Ca 0.48 0.19 0.02 0.00 0.84 0.00 0.00 57.88 59.42 2q3r h LEU 335 Cb 1.24 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 42.56 2q3r h LEU 335 CO 1.15 -0.17 -0.21 -0.65 -0.34 0.00 0.00 178.44 178.22 2q3r h PRO 336 N 0.13 -0.33 -0.21 5.25 0.11 -1.87 0.32 132.00 135.40 2q3r h PRO 336 Ca 0.44 0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.62 2q3r h PRO 336 Cb 0.79 0.08 -0.04 0.00 0.11 0.00 0.00 31.00 31.94 2q3r h PRO 336 CO -0.66 -0.22 -0.07 -0.22 -0.21 0.00 0.00 178.00 176.61 2q3r h LYS 337 N -0.35 -0.03 -0.81 1.05 1.63 -1.64 0.23 116.57 116.64 2q3r h LYS 337 Ca 0.05 0.00 0.09 0.00 -0.85 0.00 0.00 60.65 59.95 2q3r h LYS 337 Cb 0.41 0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 31.99 2q3r h LYS 337 CO -0.17 -0.02 0.53 0.00 -3.45 0.00 0.00 179.45 176.34 2q3r h ARG 338 N -0.04 0.75 -0.28 1.90 3.08 -0.79 -1.17 114.38 117.83 2q3r h ARG 338 Ca 0.11 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.96 2q3r h ARG 338 Cb 0.19 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 2q3r h ARG 338 CO -0.23 0.49 -0.41 0.74 -1.07 0.00 0.00 179.97 179.49 2q3r h PHE 339 N 0.77 0.95 -0.95 3.04 0.04 0.74 0.99 116.94 122.53 2q3r h PHE 339 Ca 0.37 -0.32 0.08 0.00 2.80 0.00 0.00 57.97 60.91 2q3r h PHE 339 Cb 0.43 -0.19 -0.07 0.00 2.20 0.00 0.00 35.95 38.32 2q3r h PHE 339 CO -0.00 1.11 0.61 0.37 -0.60 0.00 0.00 178.31 179.80 2q3r h GLN 340 N 0.53 0.99 0.00 1.51 4.15 0.57 -1.08 115.11 121.78 2q3r h GLN 340 Ca 0.03 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.39 2q3r h GLN 340 Cb 1.00 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.47 2q3r h GLN 340 CO 0.09 0.66 -0.84 0.28 -1.93 0.00 0.00 178.83 177.09 2q3r n VAL 341 N -4.53 0.02 -3.63 2.39 0.31 -0.80 -4.97 118.33 107.12 2q3r n VAL 341 Ca 0.16 -0.04 -0.22 0.00 -0.01 0.00 0.00 64.34 64.23 2q3r n VAL 341 Cb 0.25 0.62 0.04 0.00 -0.91 0.00 0.00 33.84 33.84 2q3r n VAL 341 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2q3r n ASP 342 N -1.57 -2.31 -4.93 4.52 -0.08 0.29 -4.99 116.55 107.49 2q3r n ASP 342 Ca 0.04 -0.82 -0.25 0.00 -1.51 0.00 0.00 54.79 52.26 2q3r n ASP 342 Cb 0.35 -4.18 0.02 0.00 2.34 0.00 0.00 41.12 39.65 2q3r n ASP 342 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2q3r s ALA 343 N -3.59 3.52 0.79 -1.67 0.00 0.16 -4.99 121.76 115.98 2q3r s ALA 343 Ca 0.11 -0.86 -0.13 0.00 0.00 0.00 0.00 51.96 51.08 2q3r s ALA 343 Cb -0.03 -2.38 0.08 0.00 0.00 0.00 0.00 23.12 20.78 2q3r s ALA 343 CO 0.80 -0.59 1.16 -1.25 0.00 0.00 0.00 175.76 175.88 2q3r s PRO 344 N -4.78 1.83 0.10 0.00 0.04 -1.26 -4.76 135.00 126.16 2q3r s PRO 344 Ca 0.51 1.56 0.02 0.00 0.04 0.00 0.00 61.00 63.13 2q3r s PRO 344 Cb -0.10 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 2q3r s PRO 344 CO 0.42 -2.03 0.16 -0.51 0.04 0.00 0.00 177.00 175.08 2q3r s LEU 345 N -5.76 4.06 0.66 -3.56 1.43 -1.26 -5.01 118.68 109.25 2q3r s LEU 345 Ca 0.69 0.09 -0.17 0.00 -1.03 0.00 0.00 54.13 53.71 2q3r s LEU 345 Cb -0.24 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.29 2q3r s LEU 345 CO 0.51 0.14 1.24 0.20 0.23 0.00 0.00 176.35 178.66 2q3r s ASN 346 N -2.67 4.63 0.48 2.29 0.01 -1.26 -5.00 114.94 113.42 2q3r s ASN 346 Ca 0.32 2.45 -0.10 0.00 -0.71 0.00 0.00 52.86 54.82 2q3r s ASN 346 Cb -0.12 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 38.88 2q3r s ASN 346 CO 0.25 -1.98 0.85 -0.54 -1.51 0.00 0.00 177.10 174.18 2q3r s LYS 347 N -3.56 3.71 -0.03 -0.60 -0.14 -1.26 -4.74 119.74 113.12 2q3r s LYS 347 Ca 0.78 0.52 0.01 0.00 -1.36 0.00 0.00 55.97 55.92 2q3r s LYS 347 Cb -0.32 -2.29 0.02 0.00 -1.68 0.00 0.00 37.83 33.55 2q3r s LYS 347 CO 0.40 -0.21 -0.03 1.52 -0.76 0.00 0.00 175.35 176.26 2q3r s TYR 348 N -2.66 0.49 -0.24 3.18 -0.85 -1.26 -4.87 117.35 111.14 2q3r s TYR 348 Ca 0.52 -0.09 -0.05 0.00 -0.52 0.00 0.00 57.07 56.93 2q3r s TYR 348 Cb -0.10 -0.44 -0.01 0.00 0.38 0.00 0.00 41.96 41.79 2q3r s TYR 348 CO 0.39 -0.11 0.00 0.34 -1.52 0.00 0.00 175.55 174.66 2q3r s ASP 349 N 0.60 4.64 0.27 -0.18 2.15 -1.26 -5.00 116.67 117.88 2q3r s ASP 349 Ca -0.07 -0.44 0.00 0.00 0.43 0.00 0.00 52.55 52.47 2q3r s ASP 349 Cb -0.10 -1.80 0.57 0.00 -0.30 0.00 0.00 42.92 41.29 2q3r s ASP 349 CO -0.01 -0.06 1.78 0.03 -0.17 0.00 0.00 175.17 176.74 2q3r h ARG 350 N 8.16 0.68 0.00 4.34 3.08 -2.01 0.53 114.38 129.15 2q3r h ARG 350 Ca -0.38 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.63 2q3r h ARG 350 Cb 1.15 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.05 2q3r h ARG 350 CO 0.60 0.45 0.03 -2.30 -1.07 0.00 0.00 179.97 177.67 2q3r n PRO 351 N -4.82 0.00 0.00 0.04 -0.02 -1.26 0.70 135.00 129.64 2q3r n PRO 351 Ca 0.18 0.10 0.05 0.00 -2.02 0.00 0.00 63.50 61.81 2q3r n PRO 351 Cb 0.45 -1.53 -0.00 0.00 -0.02 0.00 0.00 33.50 32.40 2q3r n PRO 351 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2q3r n THR 352 N -1.02 0.00 0.18 3.45 -1.04 0.18 -4.64 114.28 111.39 2q3r n THR 352 Ca 0.00 -0.40 -0.15 0.00 -2.04 0.00 0.00 64.05 61.47 2q3r n THR 352 Cb 0.03 1.11 -0.08 0.00 -1.82 0.00 0.00 70.33 69.57 2q3r n THR 352 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 2q3r h PHE 353 N 1.05 -0.38 -0.67 -1.42 -1.00 0.23 -3.35 116.94 111.40 2q3r h PHE 353 Ca 0.00 -0.01 -0.46 0.00 2.81 0.00 0.00 57.97 60.31 2q3r h PHE 353 Cb 0.33 0.13 -0.30 0.00 3.61 0.00 0.00 35.95 39.71 2q3r h PHE 353 CO 0.00 -0.20 -0.28 0.66 -1.61 0.00 0.00 178.31 176.89 2q3r n TYR 354 N -5.24 2.31 -2.20 -0.55 4.01 -1.26 -4.67 117.16 109.56 2q3r n TYR 354 Ca -0.10 -2.21 -0.27 0.00 -0.16 0.00 0.00 57.90 55.16 2q3r n TYR 354 Cb 0.20 -0.60 0.05 0.00 -0.31 0.00 0.00 39.34 38.68 2q3r n TYR 354 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2q3r s THR 355 N -4.26 2.97 -0.77 -0.72 2.01 -1.26 -4.86 115.64 108.76 2q3r s THR 355 Ca 0.52 -0.03 0.23 0.00 0.31 0.00 0.00 61.69 62.72 2q3r s THR 355 Cb 0.43 -3.25 -0.11 0.00 0.01 0.00 0.00 72.50 69.58 2q3r s THR 355 CO 0.01 -0.28 1.09 -1.54 -0.69 0.00 0.00 174.62 173.22 2q3r n SER 356 N -2.84 0.65 -4.76 3.53 3.41 -1.26 -4.49 113.62 107.87 2q3r n SER 356 Ca 0.06 -0.35 -0.39 0.00 -0.26 0.00 0.00 58.87 57.93 2q3r n SER 356 Cb 0.59 0.71 0.03 0.00 -0.26 0.00 0.00 64.21 65.28 2q3r n SER 356 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2q3r s ASP 357 N -3.55 5.49 0.36 4.04 2.15 -1.26 -4.86 116.67 119.03 2q3r s ASP 357 Ca 0.06 2.80 0.16 0.00 0.43 0.00 0.00 52.55 56.00 2q3r s ASP 357 Cb 0.15 -2.64 0.66 0.00 -0.30 0.00 0.00 42.92 40.79 2q3r s ASP 357 CO 0.79 -1.42 1.74 -0.65 -0.17 0.00 0.00 175.17 175.46 2q3r h PRO 358 N 1.76 0.00 0.00 4.34 0.11 -1.93 -3.39 132.00 132.89 2q3r h PRO 358 Ca -0.51 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.50 2q3r h PRO 358 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2q3r h PRO 358 CO 0.59 0.42 -1.33 0.28 -0.21 0.00 0.00 178.00 177.74 2q3r n VAL 359 N -3.71 0.33 -1.67 3.15 0.31 -1.26 -4.34 118.33 111.14 2q3r n VAL 359 Ca -0.01 -0.08 -0.44 0.00 -0.01 0.00 0.00 64.34 63.79 2q3r n VAL 359 Cb 0.50 -1.56 -0.04 0.00 -0.91 0.00 0.00 33.84 31.83 2q3r n VAL 359 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2q3r n VAL 360 N -3.25 0.70 -1.14 2.52 0.31 -1.26 -0.54 118.33 115.67 2q3r n VAL 360 Ca -0.12 -0.13 -0.05 0.00 -0.01 0.00 0.00 64.34 64.04 2q3r n VAL 360 Cb 0.58 -2.16 -0.02 0.00 -0.91 0.00 0.00 33.84 31.33 2q3r n VAL 360 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2q3r n GLY 361 N 4.50 0.61 0.34 2.92 0.00 -1.26 -4.67 105.19 107.64 2q3r n GLY 361 Ca 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2q3r n GLY 361 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2q3r n TYR 362 N -2.43 0.00 1.04 1.61 9.36 0.30 -4.80 117.16 122.24 2q3r n TYR 362 Ca -0.05 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.29 2q3r n TYR 362 Cb 0.37 0.01 0.08 0.00 -0.63 0.00 0.00 39.34 39.17 2q3r n TYR 362 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 2q3r n THR 363 N -1.48 0.00 0.02 2.97 -2.24 -0.44 -4.42 114.28 108.69 2q3r n THR 363 Ca 0.00 -0.32 0.04 0.00 -2.27 0.00 0.00 64.05 61.49 2q3r n THR 363 Cb 0.00 1.24 0.21 0.00 -2.10 0.00 0.00 70.33 69.68 2q3r n THR 363 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2q3r n ASP 364 N 0.37 3.46 -4.63 3.42 3.85 -0.96 -4.82 116.55 117.23 2q3r n ASP 364 Ca 0.11 -2.48 -0.42 0.00 -0.71 0.00 0.00 54.79 51.30 2q3r n ASP 364 Cb 0.50 -0.59 -0.04 0.00 -1.35 0.00 0.00 41.12 39.63 2q3r n ASP 364 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 2q3r s TYR 365 N -1.91 3.25 0.38 2.11 2.02 -1.26 -4.88 117.35 117.05 2q3r s TYR 365 Ca 0.28 0.98 -0.26 0.00 -0.37 0.00 0.00 57.07 57.71 2q3r s TYR 365 Cb 0.22 -3.18 -0.09 0.00 -0.40 0.00 0.00 41.96 38.51 2q3r s TYR 365 CO 0.08 -0.51 1.13 -1.25 -1.57 0.00 0.00 175.55 173.44 2q3r s PRO 366 N 2.96 4.19 0.69 -1.71 0.04 -1.26 -4.70 135.00 135.20 2q3r s PRO 366 Ca 0.34 1.76 -0.11 0.00 0.04 0.00 0.00 61.00 63.03 2q3r s PRO 366 Cb -0.14 -2.74 0.00 0.00 0.04 0.00 0.00 34.50 31.66 2q3r s PRO 366 CO 0.10 -0.18 1.06 -0.06 0.04 0.00 0.00 177.00 177.97 2q3r s PHE 367 N -1.42 3.23 -0.43 0.56 0.40 -1.26 -4.69 117.98 114.37 2q3r s PHE 367 Ca 0.55 1.31 -0.28 0.00 -0.60 0.00 0.00 56.93 57.90 2q3r s PHE 367 Cb -0.29 -2.89 0.03 0.00 0.51 0.00 0.00 43.02 40.37 2q3r s PHE 367 CO 0.37 -1.16 1.09 -1.17 0.70 0.00 0.00 175.22 175.04 2q3r s LEU 368 N -5.46 3.77 0.00 -0.37 0.20 -1.26 -5.13 118.68 110.43 2q3r s LEU 368 Ca 0.58 0.59 0.00 0.00 0.69 0.00 0.00 54.13 55.99 2q3r s LEU 368 Cb -0.13 -3.49 0.00 0.00 -0.43 0.00 0.00 46.19 42.14 2q3r s LEU 368 CO 0.54 -1.11 0.00 -0.62 -0.29 0.00 0.00 176.35 174.87