#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 3.09 0.29 0.44 1.01 -1.26 -4.88 120.40 119.09 2q3r s VAL 10 Ca 0.00 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.09 2q3r s VAL 10 Cb 0.00 -3.08 0.36 0.00 0.00 0.00 0.00 36.38 33.66 2q3r s VAL 10 CO 0.00 -0.03 1.60 -0.65 0.00 0.00 0.00 175.10 176.03 2q3r h PRO 11 N 11.86 0.08 0.00 2.72 0.11 -1.96 0.61 132.00 145.41 2q3r h PRO 11 Ca -0.46 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 2q3r h PRO 11 Cb 1.23 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2q3r h PRO 11 CO 0.95 0.05 -0.14 -0.07 -0.21 0.00 0.00 178.00 178.58 2q3r h LEU 12 N 0.08 0.00 -2.21 2.35 3.38 -1.85 -2.07 115.31 114.99 2q3r h LEU 12 Ca 0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.53 2q3r h LEU 12 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2q3r h LEU 12 CO -0.80 0.14 0.00 0.18 0.09 0.00 0.00 178.44 178.05 2q3r n LEU 13 N -3.74 3.29 -4.79 1.67 7.99 0.21 -1.84 117.00 119.79 2q3r n LEU 13 Ca -0.02 -1.65 -0.39 0.00 -0.01 0.00 0.00 56.01 53.94 2q3r n LEU 13 Cb 0.25 -0.43 -0.06 0.00 -0.11 0.00 0.00 43.42 43.07 2q3r n LEU 13 CO 0.31 0.67 0.25 0.42 -1.51 0.00 0.00 177.39 177.53 2q3r s THR 14 N -1.55 4.87 0.92 -5.08 -4.23 -0.78 -4.80 115.64 105.00 2q3r s THR 14 Ca 0.37 1.16 -0.11 0.00 -1.18 0.00 0.00 61.69 61.93 2q3r s THR 14 Cb 0.22 -3.88 0.12 0.00 1.34 0.00 0.00 72.50 70.30 2q3r s THR 14 CO 0.21 0.49 0.96 -2.65 -0.54 0.00 0.00 174.62 173.10 2q3r n PRO 15 N 2.22 -0.40 -3.69 3.99 -0.02 -1.19 -3.86 135.00 132.04 2q3r n PRO 15 Ca -0.09 -0.06 -0.14 0.00 -2.02 0.00 0.00 63.50 61.20 2q3r n PRO 15 Cb 0.51 -2.25 -0.09 0.00 -0.02 0.00 0.00 33.50 31.65 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 -2.56 -0.57 -0.47 6.00 5.04 -0.33 -4.89 117.35 119.58 2q3r s TYR 16 Ca 0.65 1.38 -0.12 0.00 -2.44 0.00 0.00 57.07 56.53 2q3r s TYR 16 Cb -0.23 0.20 0.10 0.00 0.35 0.00 0.00 41.96 42.38 2q3r s TYR 16 CO 0.60 -0.28 0.37 0.21 -1.34 0.00 0.00 175.55 175.11 2q3r s LYS 17 N 0.23 2.74 -0.60 4.97 2.20 -1.26 0.15 119.74 128.17 2q3r s LYS 17 Ca -0.00 -1.58 -0.25 0.00 -0.36 0.00 0.00 55.97 53.78 2q3r s LYS 17 Cb -0.04 -4.02 0.04 0.00 -1.51 0.00 0.00 37.83 32.31 2q3r s LYS 17 CO 0.01 -1.12 1.03 1.41 -0.36 0.00 0.00 175.35 176.32 2q3r s MET 18 N 1.50 3.30 4.24 4.03 -2.45 -0.87 -4.88 119.30 124.16 2q3r s MET 18 Ca 0.04 -0.29 0.00 0.00 -1.25 0.00 0.00 55.69 54.19 2q3r s MET 18 Cb -0.26 -4.10 0.00 0.00 1.25 0.00 0.00 34.83 31.72 2q3r s MET 18 CO 0.03 -1.67 0.00 0.41 1.05 0.00 0.00 175.02 174.83 2q3r n GLY 19 N 5.19 3.14 0.25 2.11 0.00 -1.26 0.13 105.19 114.73 2q3r n GLY 19 Ca 0.02 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2q3r n GLY 19 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2q3r h ARG 20 N 0.00 0.00 -7.34 1.61 9.65 -1.90 -3.44 114.38 112.96 2q3r h ARG 20 Ca 0.00 0.00 -0.50 0.00 -1.10 0.00 0.00 59.98 58.38 2q3r h ARG 20 Cb 0.00 0.00 0.12 0.00 -1.39 0.00 0.00 29.97 28.70 2q3r h ARG 20 CO 0.00 0.12 0.33 -0.06 2.80 0.00 0.00 179.97 183.16 2q3r s PHE 21 N -3.66 2.75 -0.27 2.20 0.40 0.34 -5.04 117.98 114.70 2q3r s PHE 21 Ca 0.01 1.39 -0.00 0.00 -0.60 0.00 0.00 56.93 57.73 2q3r s PHE 21 Cb 0.10 -3.03 0.08 0.00 0.51 0.00 0.00 43.02 40.68 2q3r s PHE 21 CO 0.60 -1.72 0.04 1.21 0.70 0.00 0.00 175.22 176.06 2q3r s ASN 22 N -3.61 3.83 -0.02 1.36 3.84 -1.26 -2.05 114.94 117.03 2q3r s ASN 22 Ca 0.60 -1.41 -0.10 0.00 0.21 0.00 0.00 52.86 52.17 2q3r s ASN 22 Cb -0.16 -0.97 -0.05 0.00 -0.55 0.00 0.00 41.25 39.53 2q3r s ASN 22 CO 0.56 -0.34 0.30 -0.76 -2.79 0.00 0.00 177.10 174.06 2q3r s LEU 23 N 1.54 4.40 0.26 3.21 1.43 0.12 -4.91 118.68 124.73 2q3r s LEU 23 Ca 0.04 0.69 0.13 0.00 -1.03 0.00 0.00 54.13 53.96 2q3r s LEU 23 Cb -0.18 -2.54 0.22 0.00 0.03 0.00 0.00 46.19 43.72 2q3r s LEU 23 CO -0.15 0.30 1.51 0.77 0.23 0.00 0.00 176.35 179.01 2q3r h SER 24 N 4.41 0.00 -5.09 2.29 4.64 -1.23 -0.86 113.55 117.71 2q3r h SER 24 Ca -0.52 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.74 2q3r h SER 24 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 2q3r h SER 24 CO 0.63 0.63 0.19 -1.38 -0.87 0.00 0.00 176.83 176.03 2q3r s HIS 25 N -3.21 0.29 -1.84 4.77 0.00 -1.25 -3.19 115.29 110.86 2q3r s HIS 25 Ca 0.01 -0.89 0.15 0.00 -3.00 0.00 0.00 55.06 51.34 2q3r s HIS 25 Cb 0.10 0.68 0.17 0.00 -4.00 0.00 0.00 32.58 29.54 2q3r s HIS 25 CO 0.75 -1.50 1.05 0.54 -1.00 0.00 0.00 174.74 174.59 2q3r n ARG 26 N -0.54 1.43 -2.55 -0.38 1.74 -0.77 -4.67 116.66 110.93 2q3r n ARG 26 Ca -0.07 -1.56 -0.41 0.00 -0.77 0.00 0.00 57.85 55.04 2q3r n ARG 26 Cb 0.60 -1.31 -0.04 0.00 -1.02 0.00 0.00 32.46 30.69 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 -1.25 4.07 -0.11 1.55 1.01 -1.26 -1.14 120.40 123.28 2q3r s VAL 27 Ca 0.20 1.69 -0.01 0.00 0.00 0.00 0.00 61.98 63.86 2q3r s VAL 27 Cb 0.14 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 32.47 2q3r s VAL 27 CO 0.20 0.25 -0.01 -0.69 0.00 0.00 0.00 175.10 174.84 2q3r s VAL 28 N 0.12 0.59 -0.06 2.92 1.01 0.19 -4.41 120.40 120.76 2q3r s VAL 28 Ca 0.51 -0.12 -0.31 0.00 0.00 0.00 0.00 61.98 62.05 2q3r s VAL 28 Cb -0.28 -0.77 -0.09 0.00 0.00 0.00 0.00 36.38 35.23 2q3r s VAL 28 CO 0.33 0.20 2.00 -0.11 0.00 0.00 0.00 175.10 177.52 2q3r n LEU 29 N 5.07 3.71 -4.69 3.92 7.94 -1.26 0.82 117.00 132.51 2q3r n LEU 29 Ca -0.09 0.79 -0.42 0.00 -1.11 0.00 0.00 56.01 55.18 2q3r n LEU 29 Cb 0.49 -1.47 -0.03 0.00 0.53 0.00 0.00 43.42 42.95 2q3r n LEU 29 CO 0.13 -0.06 0.89 0.00 -1.11 0.00 0.00 177.39 177.24 2q3r s ALA 30 N 5.09 3.44 -0.45 1.96 0.00 0.24 -3.99 121.76 128.04 2q3r s ALA 30 Ca 0.93 0.59 -0.43 0.00 0.00 0.00 0.00 51.96 53.05 2q3r s ALA 30 Cb -0.52 -3.48 -0.18 0.00 0.00 0.00 0.00 23.12 18.94 2q3r s ALA 30 CO 0.45 -0.65 1.47 -0.35 0.00 0.00 0.00 175.76 176.67 2q3r n PRO 31 N 4.92 0.00 -3.63 0.00 -0.04 -1.25 -4.62 135.00 130.38 2q3r n PRO 31 Ca 0.10 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.28 2q3r n PRO 31 Cb 0.47 -1.36 -0.16 0.00 -0.04 0.00 0.00 33.50 32.41 2q3r n PRO 31 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2q3r s LEU 32 N 2.80 0.92 -0.06 1.53 1.43 -1.26 -4.90 118.68 119.13 2q3r s LEU 32 Ca 0.96 -1.11 -0.33 0.00 -1.03 0.00 0.00 54.13 52.62 2q3r s LEU 32 Cb -1.36 -0.46 -0.11 0.00 0.03 0.00 0.00 46.19 44.28 2q3r s LEU 32 CO 0.74 -0.39 1.93 0.41 0.23 0.00 0.00 176.35 179.27 2q3r n THR 33 N 5.15 0.63 0.99 5.49 -1.04 -1.26 -4.34 114.28 119.90 2q3r n THR 33 Ca -0.06 -0.13 0.10 0.00 -2.04 0.00 0.00 64.05 61.92 2q3r n THR 33 Cb 0.45 -2.03 -0.09 0.00 -1.82 0.00 0.00 70.33 66.84 2q3r n THR 33 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2q3r n ARG 34 N 7.04 0.01 -0.96 -2.82 5.12 -1.26 -4.96 116.66 118.82 2q3r n ARG 34 Ca 0.23 -0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.14 2q3r n ARG 34 Cb 0.33 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.13 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 -1.51 -1.01 -1.03 5.56 1.13 -1.26 -4.79 117.38 114.48 2q3r n GLN 35 Ca 0.04 0.25 -0.08 0.00 -1.94 0.00 0.00 57.00 55.27 2q3r n GLN 35 Cb 0.33 -4.11 0.29 0.00 0.11 0.00 0.00 30.24 26.86 2q3r n GLN 35 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2q3r n ARG 36 N -0.83 3.52 -3.36 -1.09 3.00 -1.25 -4.68 116.66 111.98 2q3r n ARG 36 Ca 0.00 -2.98 -0.39 0.00 -0.01 0.00 0.00 57.85 54.47 2q3r n ARG 36 Cb 0.25 -2.19 -0.03 0.00 0.00 0.00 0.00 32.46 30.49 2q3r n ARG 36 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2q3r n SER 37 N -0.23 5.12 -4.66 0.55 7.64 -0.95 -4.57 113.62 116.53 2q3r n SER 37 Ca 0.42 -3.23 -0.50 0.00 1.01 0.00 0.00 58.87 56.57 2q3r n SER 37 Cb 1.40 -1.15 -0.05 0.00 -1.01 0.00 0.00 64.21 63.39 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 1.95 2.06 -1.26 1.43 0.53 -1.24 -1.11 117.16 119.52 2q3r n TYR 38 Ca 0.25 0.34 -0.09 0.00 -1.02 0.00 0.00 57.90 57.37 2q3r n TYR 38 Cb 0.37 -2.51 -0.04 0.00 -1.03 0.00 0.00 39.34 36.13 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 3.61 1.04 2.56 2.72 0.00 -1.26 -1.91 105.19 111.95 2q3r n GLY 39 Ca 0.21 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.05 -2.09 -4.67 1.61 5.03 -0.27 -5.00 115.26 109.81 2q3r n ASN 40 Ca -0.09 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 54.99 2q3r n ASN 40 Cb 0.36 -0.75 -0.08 0.00 -1.02 0.00 0.00 39.78 38.29 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 -2.51 5.27 0.42 2.41 1.01 -0.80 -1.23 120.40 124.97 2q3r s VAL 41 Ca 0.00 0.49 -0.26 0.00 0.00 0.00 0.00 61.98 62.21 2q3r s VAL 41 Cb 0.00 -3.63 -0.10 0.00 0.00 0.00 0.00 36.38 32.65 2q3r s VAL 41 CO 0.00 0.30 1.36 -2.65 0.00 0.00 0.00 175.10 174.11 2q3r n PRO 42 N 4.29 2.16 -4.37 2.72 -0.02 -1.26 -3.64 135.00 134.87 2q3r n PRO 42 Ca -0.11 0.77 -0.24 0.00 -2.02 0.00 0.00 63.50 61.90 2q3r n PRO 42 Cb 0.51 -2.50 -0.09 0.00 -0.02 0.00 0.00 33.50 31.40 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 -2.25 2.01 0.36 -0.52 -1.52 -1.26 -4.76 119.66 111.71 2q3r s GLN 43 Ca 0.60 -1.57 0.07 0.00 -1.95 0.00 0.00 55.36 52.51 2q3r s GLN 43 Cb -0.49 -1.99 0.77 0.00 -0.22 0.00 0.00 33.01 31.08 2q3r s GLN 43 CO 0.59 0.35 1.94 -1.35 -0.25 0.00 0.00 175.29 176.57 2q3r h PRO 44 N 2.11 0.71 -0.02 2.91 0.11 -1.94 -1.29 132.00 134.59 2q3r h PRO 44 Ca -0.42 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.65 2q3r h PRO 44 Cb 1.25 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2q3r h PRO 44 CO 0.60 0.47 0.02 1.12 -0.21 0.00 0.00 178.00 180.00 2q3r h HIS 45 N 0.73 0.00 -0.17 0.65 2.07 -1.94 -0.16 115.15 116.33 2q3r h HIS 45 Ca 0.34 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.84 2q3r h HIS 45 Cb 0.38 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.35 2q3r h HIS 45 CO -0.00 0.00 -0.02 0.00 -3.07 0.00 0.00 177.93 174.84 2q3r h ALA 46 N 1.98 1.65 -0.54 6.11 0.00 -1.58 -1.79 119.26 125.10 2q3r h ALA 46 Ca 0.01 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2q3r h ALA 46 Cb 0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2q3r h ALA 46 CO -0.00 0.26 0.15 0.00 0.00 0.00 0.00 179.25 179.66 2q3r h ALA 47 N 1.74 0.70 0.96 0.00 0.00 -1.13 0.16 119.26 121.70 2q3r h ALA 47 Ca 0.06 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2q3r h ALA 47 Cb 0.20 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2q3r h ALA 47 CO 0.01 0.38 -0.49 0.82 0.00 0.00 0.00 179.25 179.97 2q3r h ILE 48 N 0.75 0.00 -0.51 0.00 1.08 -1.40 0.06 117.51 117.49 2q3r h ILE 48 Ca 0.17 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.74 2q3r h ILE 48 Cb 0.31 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 33.96 2q3r h ILE 48 CO -0.00 0.00 -0.12 0.22 -0.69 0.00 0.00 178.15 177.56 2q3r h TYR 49 N -1.33 -0.25 -0.04 1.37 3.20 -1.23 -0.32 116.97 118.36 2q3r h TYR 49 Ca -0.13 0.05 -0.16 0.00 3.14 0.00 0.00 58.73 61.63 2q3r h TYR 49 Cb 1.03 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 2q3r h TYR 49 CO -0.03 -0.21 -0.68 1.88 -1.64 0.00 0.00 178.16 177.48 2q3r h TYR 50 N 0.01 0.27 -0.07 -3.82 0.05 -0.65 -3.16 116.97 109.61 2q3r h TYR 50 Ca 0.24 -0.12 -0.15 0.00 0.05 0.00 0.00 58.73 58.76 2q3r h TYR 50 Cb 0.37 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 2q3r h TYR 50 CO -0.42 0.82 -0.61 1.03 -1.05 0.00 0.00 178.16 177.93 2q3r h SER 51 N 0.14 0.28 0.25 3.88 0.87 -0.49 -3.20 113.55 115.28 2q3r h SER 51 Ca -0.02 -0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.37 2q3r h SER 51 Cb 1.22 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2q3r h SER 51 CO 0.10 0.82 -0.12 1.56 -0.53 0.00 0.00 176.83 178.66 2q3r h GLN 52 N 0.18 -0.33 -0.04 2.24 4.20 -1.06 -2.73 115.11 117.57 2q3r h GLN 52 Ca -0.01 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2q3r h GLN 52 Cb 1.12 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.97 2q3r h GLN 52 CO 0.10 -0.09 0.00 0.54 -0.67 0.00 0.00 178.83 178.70 2q3r n ARG 53 N -5.16 0.52 -3.65 1.46 1.74 -1.20 -4.77 116.66 105.61 2q3r n ARG 53 Ca -0.09 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.62 2q3r n ARG 53 Cb 0.21 -1.02 -0.06 0.00 -1.02 0.00 0.00 32.46 30.57 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 -1.92 5.20 0.09 0.55 2.01 -1.03 -4.96 115.64 115.58 2q3r s THR 54 Ca 0.00 0.52 0.04 0.00 0.31 0.00 0.00 61.69 62.56 2q3r s THR 54 Cb 0.00 -3.60 -0.03 0.00 0.01 0.00 0.00 72.50 68.88 2q3r s THR 54 CO 0.00 0.51 -0.11 0.42 -0.69 0.00 0.00 174.62 174.75 2q3r s THR 55 N -1.15 0.98 -0.13 -0.82 -4.23 -1.26 -5.01 115.64 104.02 2q3r s THR 55 Ca 0.24 -1.48 -0.29 0.00 -1.18 0.00 0.00 61.69 58.97 2q3r s THR 55 Cb -0.15 -1.20 -0.07 0.00 1.34 0.00 0.00 72.50 72.43 2q3r s THR 55 CO 0.12 -0.42 2.12 -2.65 -0.54 0.00 0.00 174.62 173.25 2q3r n PRO 56 N 0.88 2.25 -0.86 3.99 -0.02 -0.97 -0.57 135.00 139.70 2q3r n PRO 56 Ca -0.18 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2q3r n PRO 56 Cb 0.56 -3.10 0.00 0.00 -0.02 0.00 0.00 33.50 30.94 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 5.33 0.49 3.86 -1.23 0.00 0.86 -4.63 105.19 109.86 2q3r n GLY 57 Ca 0.27 -0.90 -0.36 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.83 2.37 -0.21 -0.02 0.00 0.26 -0.88 107.32 106.01 2q3r s GLY 58 Ca 0.00 -0.36 -0.12 0.00 0.00 0.00 0.00 44.72 44.24 2q3r s GLY 58 CO 0.00 -0.09 0.21 -0.12 0.00 0.00 0.00 173.10 173.10 2q3r s PHE 59 N -1.26 3.38 -0.01 1.90 5.99 -1.26 -0.64 117.98 126.08 2q3r s PHE 59 Ca 0.28 0.39 0.02 0.00 0.00 0.00 0.00 56.93 57.62 2q3r s PHE 59 Cb -0.15 -2.29 -0.00 0.00 0.00 0.00 0.00 43.02 40.58 2q3r s PHE 59 CO 0.15 0.16 -0.08 -0.51 -0.00 0.00 0.00 175.22 174.94 2q3r s LEU 60 N 0.77 1.91 -0.22 6.12 1.02 -0.62 -4.10 118.68 123.56 2q3r s LEU 60 Ca 0.11 -0.15 0.01 0.00 0.02 0.00 0.00 54.13 54.12 2q3r s LEU 60 Cb -0.13 -0.43 0.03 0.00 0.02 0.00 0.00 46.19 45.68 2q3r s LEU 60 CO 0.03 0.08 -0.14 -0.63 0.02 0.00 0.00 176.35 175.71 2q3r s ILE 61 N -0.02 2.35 1.19 -0.59 1.01 -1.26 -1.94 121.20 121.94 2q3r s ILE 61 Ca 0.01 -1.11 -0.16 0.00 0.00 0.00 0.00 60.65 59.38 2q3r s ILE 61 Cb -0.05 -2.14 0.28 0.00 0.01 0.00 0.00 42.46 40.56 2q3r s ILE 61 CO -0.00 0.31 1.04 0.42 0.00 0.00 0.00 174.94 176.71 2q3r s THR 62 N 1.26 1.75 1.00 2.92 -4.23 -1.05 -3.86 115.64 113.42 2q3r s THR 62 Ca 0.00 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.38 2q3r s THR 62 Cb -0.16 -2.28 0.08 0.00 1.34 0.00 0.00 72.50 71.48 2q3r s THR 62 CO -0.08 0.00 0.45 -1.84 -0.54 0.00 0.00 174.62 172.61 2q3r n GLU 63 N -4.85 -0.72 -1.97 3.99 0.28 -1.26 -4.07 120.64 112.03 2q3r n GLU 63 Ca 0.08 -0.17 -0.41 0.00 -0.16 0.00 0.00 57.16 56.50 2q3r n GLU 63 Cb 0.58 -1.91 -0.01 0.00 1.43 0.00 0.00 31.44 31.52 2q3r n GLU 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2q3r s ALA 64 N -2.39 3.54 -0.09 -1.84 0.00 -1.25 -4.14 121.76 115.58 2q3r s ALA 64 Ca 0.59 1.40 0.03 0.00 0.00 0.00 0.00 51.96 53.98 2q3r s ALA 64 Cb -0.20 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.39 2q3r s ALA 64 CO 0.66 -0.82 -0.19 0.99 0.00 0.00 0.00 175.76 176.39 2q3r s THR 65 N -1.05 1.67 0.50 0.00 2.01 0.28 -4.32 115.64 114.73 2q3r s THR 65 Ca 0.51 -0.79 -0.24 0.00 0.31 0.00 0.00 61.69 61.49 2q3r s THR 65 Cb -0.43 -1.47 -0.07 0.00 0.01 0.00 0.00 72.50 70.54 2q3r s THR 65 CO 0.57 0.47 1.41 0.61 -0.69 0.00 0.00 174.62 176.99 2q3r n GLY 66 N 3.68 0.93 0.11 4.40 0.00 0.30 -0.00 105.19 114.62 2q3r n GLY 66 Ca -0.21 0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.03 2q3r n GLY 66 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2q3r n VAL 67 N -0.59 0.00 -3.87 1.61 0.24 -0.93 -1.79 118.33 113.00 2q3r n VAL 67 Ca 0.08 -0.06 -0.05 0.00 -2.04 0.00 0.00 64.34 62.27 2q3r n VAL 67 Cb 0.43 0.92 0.02 0.00 -1.47 0.00 0.00 33.84 33.74 2q3r n VAL 67 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2q3r s SER 68 N -2.87 0.02 0.02 -1.34 1.04 -1.26 -4.62 113.70 104.68 2q3r s SER 68 Ca 0.11 -0.82 0.16 0.00 0.48 0.00 0.00 55.95 55.89 2q3r s SER 68 Cb 0.17 0.60 0.70 0.00 0.10 0.00 0.00 66.02 67.58 2q3r s SER 68 CO 0.77 -1.19 1.52 -0.90 0.98 0.00 0.00 173.24 174.42 2q3r n ASP 69 N -1.32 0.04 -0.22 7.02 5.75 -1.26 -2.52 116.55 124.03 2q3r n ASP 69 Ca -0.04 0.51 0.02 0.00 -0.01 0.00 0.00 54.79 55.27 2q3r n ASP 69 Cb 0.59 -0.52 0.05 0.00 -1.03 0.00 0.00 41.12 40.22 2q3r n ASP 69 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2q3r n THR 70 N -1.55 0.92 0.32 2.12 -2.24 -1.26 -4.46 114.28 108.12 2q3r n THR 70 Ca 0.04 -0.96 0.13 0.00 -2.27 0.00 0.00 64.05 60.99 2q3r n THR 70 Cb 0.19 0.55 0.32 0.00 -2.10 0.00 0.00 70.33 69.29 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 0.74 1.00 -2.32 6.98 0.00 -1.83 -3.43 119.26 120.39 2q3r h ALA 71 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.45 2q3r h ALA 71 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2q3r h ALA 71 CO 0.00 0.00 0.37 -0.65 0.00 0.00 0.00 179.25 178.97 2q3r s GLN 72 N -3.27 4.19 0.00 0.00 1.11 -1.26 -0.11 119.66 120.32 2q3r s GLN 72 Ca 0.07 1.32 0.00 0.00 0.01 0.00 0.00 55.36 56.76 2q3r s GLN 72 Cb 0.07 -2.38 0.00 0.00 -1.01 0.00 0.00 33.01 29.69 2q3r s GLN 72 CO 0.62 -0.09 0.00 0.41 0.01 0.00 0.00 175.29 176.24 2q3r n GLY 73 N -0.05 1.00 3.22 3.09 0.00 -1.26 -4.82 105.19 106.38 2q3r n GLY 73 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 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 1.14 0.08 1.61 2.02 -1.26 -4.48 117.35 116.46 2q3r s TYR 74 Ca 0.00 -1.06 -0.28 0.00 -0.37 0.00 0.00 57.07 55.36 2q3r s TYR 74 Cb 0.00 -0.65 -0.06 0.00 -0.40 0.00 0.00 41.96 40.85 2q3r s TYR 74 CO 0.00 -0.27 0.87 -0.65 -1.57 0.00 0.00 175.55 173.92 2q3r s GLN 75 N -3.94 4.60 -1.26 -0.62 -0.21 -1.26 -4.25 119.66 112.72 2q3r s GLN 75 Ca 0.24 1.26 -0.00 0.00 0.02 0.00 0.00 55.36 56.88 2q3r s GLN 75 Cb 0.06 -3.37 -0.00 0.00 1.00 0.00 0.00 33.01 30.71 2q3r s GLN 75 CO 0.03 0.26 0.82 -0.25 -2.12 0.00 0.00 175.29 174.03 2q3r n ASP 76 N 2.75 -1.59 -4.82 5.90 8.00 -1.26 -4.69 116.55 120.84 2q3r n ASP 76 Ca -0.00 -0.74 -0.35 0.00 0.71 0.00 0.00 54.79 54.41 2q3r n ASP 76 Cb 0.50 -4.49 -0.07 0.00 -0.02 0.00 0.00 41.12 37.04 2q3r n ASP 76 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2q3r s THR 77 N -3.54 5.04 0.50 -3.53 -4.23 -1.25 -2.24 115.64 106.38 2q3r s THR 77 Ca 0.01 -0.15 -0.21 0.00 -1.18 0.00 0.00 61.69 60.16 2q3r s THR 77 Cb -0.00 -3.26 -0.07 0.00 1.34 0.00 0.00 72.50 70.51 2q3r s THR 77 CO 0.78 0.46 1.15 -2.16 -0.54 0.00 0.00 174.62 174.31 2q3r s PRO 78 N -1.44 3.56 0.43 3.99 0.04 -1.26 -4.10 135.00 136.23 2q3r s PRO 78 Ca 0.20 1.70 0.07 0.00 0.04 0.00 0.00 61.00 63.01 2q3r s PRO 78 Cb -0.12 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 2q3r s PRO 78 CO 0.10 -0.70 0.18 0.20 0.04 0.00 0.00 177.00 176.82 2q3r s GLY 79 N -1.55 2.40 -0.32 0.56 0.00 -0.37 0.11 107.32 108.16 2q3r s GLY 79 Ca 0.68 -1.91 0.15 0.00 0.00 0.00 0.00 44.72 43.64 2q3r s GLY 79 CO 0.31 -1.94 1.44 4.51 0.00 0.00 0.00 173.10 177.42 2q3r n ILE 80 N -1.28 0.30 0.59 0.90 3.06 -0.74 -4.73 119.36 117.47 2q3r n ILE 80 Ca -0.03 -1.45 0.06 0.00 -2.50 0.00 0.00 62.75 58.83 2q3r n ILE 80 Cb 0.65 1.07 -0.04 0.00 0.54 0.00 0.00 39.64 41.85 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 -1.32 0.00 -4.33 9.51 2.14 -1.26 -4.60 117.44 117.59 2q3r n TRP 81 Ca -0.12 0.00 -0.24 0.00 2.07 0.00 0.00 57.50 59.21 2q3r n TRP 81 Cb 0.86 0.00 -0.08 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 -1.98 2.73 0.27 -1.67 -4.23 -1.26 -5.02 115.64 104.49 2q3r s THR 82 Ca 0.07 -1.99 0.01 0.00 -1.18 0.00 0.00 61.69 58.61 2q3r s THR 82 Cb 0.10 -2.77 0.07 0.00 1.34 0.00 0.00 72.50 71.24 2q3r s THR 82 CO 0.45 -0.23 1.72 0.11 -0.54 0.00 0.00 174.62 176.12 2q3r h LYS 83 N 1.84 0.56 -0.46 3.99 6.56 -2.00 -2.42 116.57 124.64 2q3r h LYS 83 Ca -0.43 -0.20 0.03 0.00 -1.06 0.00 0.00 60.65 59.00 2q3r h LYS 83 Cb 1.25 -0.04 -0.04 0.00 -0.57 0.00 0.00 32.23 32.83 2q3r h LYS 83 CO 0.65 0.73 0.24 1.49 -2.06 0.00 0.00 179.45 180.51 2q3r h GLU 84 N 0.50 0.47 -0.11 3.15 4.81 -2.00 -1.35 114.58 120.06 2q3r h GLU 84 Ca 0.08 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2q3r h GLU 84 Cb 0.63 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2q3r h GLU 84 CO 0.04 0.31 0.02 0.45 -0.73 0.00 0.00 179.01 179.11 2q3r h HIS 85 N 0.49 0.03 -0.55 0.92 3.86 -1.82 -2.06 115.15 116.03 2q3r h HIS 85 Ca 0.20 0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.52 2q3r h HIS 85 Cb 0.08 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.45 2q3r h HIS 85 CO -0.09 0.01 -0.07 0.28 0.86 0.00 0.00 177.93 178.92 2q3r h VAL 86 N 0.07 0.50 -0.51 2.45 2.07 -0.94 -1.08 116.25 118.81 2q3r h VAL 86 Ca 0.05 -0.02 -0.06 0.00 0.82 0.00 0.00 66.70 67.49 2q3r h VAL 86 Cb 0.04 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 2q3r h VAL 86 CO -0.06 0.01 0.07 -0.33 0.02 0.00 0.00 177.57 177.28 2q3r h GLU 87 N 0.05 0.82 -0.04 1.57 4.39 -0.85 -2.75 114.58 117.77 2q3r h GLU 87 Ca 0.27 -0.19 -0.18 0.00 0.34 0.00 0.00 59.36 59.61 2q3r h GLU 87 Cb 0.43 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 2q3r h GLU 87 CO -0.52 0.77 -0.76 0.00 -1.16 0.00 0.00 179.01 177.35 2q3r h ALA 88 N 1.30 0.63 0.00 3.43 0.00 -0.68 -3.21 119.26 120.74 2q3r h ALA 88 Ca 0.16 -0.64 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 2q3r h ALA 88 Cb 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2q3r h ALA 88 CO 0.01 0.81 -0.33 -1.49 0.00 0.00 0.00 179.25 178.24 2q3r h TRP 89 N 0.18 0.00 0.14 0.00 4.06 -1.09 -3.35 115.95 115.90 2q3r h TRP 89 Ca -0.03 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.92 2q3r h TRP 89 Cb 1.33 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.47 2q3r h TRP 89 CO 0.03 0.33 -0.24 -0.22 -3.56 0.00 0.00 178.44 174.79 2q3r h LYS 90 N 0.00 -0.39 -0.07 0.49 3.64 -1.49 -1.44 116.57 117.30 2q3r h LYS 90 Ca -0.00 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2q3r h LYS 90 Cb 0.86 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.76 2q3r h LYS 90 CO 0.04 -0.26 0.39 -1.00 -2.27 0.00 0.00 179.45 176.35 2q3r h PRO 91 N -0.41 0.00 -0.09 1.90 0.13 -1.75 0.36 132.00 132.14 2q3r h PRO 91 Ca -0.02 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.89 2q3r h PRO 91 Cb 0.38 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.52 2q3r h PRO 91 CO -0.08 0.00 -0.84 0.82 -0.23 0.00 0.00 178.00 177.67 2q3r h ILE 92 N 0.00 1.31 -0.18 -3.56 2.04 -1.49 -2.31 117.51 113.32 2q3r h ILE 92 Ca 0.03 -2.11 -0.17 0.00 1.00 0.00 0.00 64.86 63.61 2q3r h ILE 92 Cb 0.80 2.13 0.01 0.00 -0.74 0.00 0.00 36.82 39.02 2q3r h ILE 92 CO -0.00 0.65 -0.55 0.58 0.00 0.00 0.00 178.15 178.83 2q3r h VAL 93 N 0.42 1.31 -0.75 1.67 2.07 0.59 -2.91 116.25 118.66 2q3r h VAL 93 Ca -0.07 -1.79 -0.03 0.00 0.82 0.00 0.00 66.70 65.63 2q3r h VAL 93 Cb 1.46 1.94 -0.03 0.00 -1.52 0.00 0.00 31.29 33.14 2q3r h VAL 93 CO 0.16 0.56 0.34 0.44 0.02 0.00 0.00 177.57 179.09 2q3r h ASP 94 N 0.38 0.99 -0.38 0.57 3.32 -0.96 -0.84 116.42 119.50 2q3r h ASP 94 Ca -0.02 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 2q3r h ASP 94 Cb 1.18 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 2q3r h ASP 94 CO 0.12 0.85 0.21 0.00 -1.72 0.00 0.00 179.24 178.69 2q3r h ALA 95 N 1.30 0.49 0.27 3.45 0.00 -1.42 0.12 119.26 123.46 2q3r h ALA 95 Ca 0.26 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2q3r h ALA 95 Cb 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2q3r h ALA 95 CO -0.03 0.01 -0.13 0.28 0.00 0.00 0.00 179.25 179.38 2q3r h VAL 96 N 0.48 0.76 -0.29 0.00 2.07 -1.27 -2.00 116.25 116.00 2q3r h VAL 96 Ca 0.13 -0.17 0.08 0.00 0.82 0.00 0.00 66.70 67.56 2q3r h VAL 96 Cb 0.06 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2q3r h VAL 96 CO -0.02 0.04 0.22 0.45 0.02 0.00 0.00 177.57 178.28 2q3r h HIS 97 N -0.46 0.00 -0.54 1.57 -0.00 -1.03 -0.41 115.15 114.29 2q3r h HIS 97 Ca -0.04 0.00 0.06 0.00 -0.00 0.00 0.00 60.37 60.39 2q3r h HIS 97 Cb 0.34 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.72 2q3r h HIS 97 CO -0.03 0.00 0.36 0.00 -0.00 0.00 0.00 177.93 178.26 2q3r h ALA 98 N 1.83 1.87 -0.58 2.45 0.00 0.02 -0.06 119.26 124.79 2q3r h ALA 98 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2q3r h ALA 98 Cb 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2q3r h ALA 98 CO -0.00 0.04 0.00 1.63 0.00 0.00 0.00 179.25 180.92 2q3r n LYS 99 N -4.47 4.07 -1.15 0.00 5.02 -0.18 -4.96 118.16 116.48 2q3r n LYS 99 Ca 0.07 -2.97 -0.05 0.00 -2.02 0.00 0.00 58.31 53.34 2q3r n LYS 99 Cb 0.24 -2.01 -0.02 0.00 -0.02 0.00 0.00 35.03 33.22 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 0.80 0.78 3.84 0.72 0.00 -0.03 -2.29 105.19 109.00 2q3r n GLY 100 Ca 0.26 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.83 1.97 -0.23 -0.02 0.00 -1.07 -0.10 107.32 105.04 2q3r s GLY 101 Ca 0.00 0.15 -0.10 0.00 0.00 0.00 0.00 44.72 44.77 2q3r s GLY 101 CO 0.00 0.43 0.14 -0.42 0.00 0.00 0.00 173.10 173.25 2q3r s ILE 102 N -2.74 5.27 -0.17 0.90 1.09 0.18 -4.45 121.20 121.29 2q3r s ILE 102 Ca 0.59 0.15 0.01 0.00 -1.10 0.00 0.00 60.65 60.29 2q3r s ILE 102 Cb -0.11 -3.44 0.03 0.00 -1.06 0.00 0.00 42.46 37.88 2q3r s ILE 102 CO 0.38 0.37 -0.13 0.12 -0.10 0.00 0.00 174.94 175.58 2q3r s PHE 103 N 0.89 2.29 -0.10 3.97 5.36 -1.26 -1.59 117.98 127.53 2q3r s PHE 103 Ca 0.07 -1.36 0.01 0.00 -0.96 0.00 0.00 56.93 54.69 2q3r s PHE 103 Cb -0.13 -1.63 -0.02 0.00 -0.34 0.00 0.00 43.02 40.90 2q3r s PHE 103 CO 0.03 -0.70 -0.13 -0.06 -1.46 0.00 0.00 175.22 172.90 2q3r s PHE 104 N 1.45 2.78 -0.20 10.12 0.40 -0.82 -0.79 117.98 130.91 2q3r s PHE 104 Ca 0.03 -0.41 -0.17 0.00 -0.60 0.00 0.00 56.93 55.78 2q3r s PHE 104 Cb -0.14 -1.75 -0.04 0.00 0.51 0.00 0.00 43.02 41.60 2q3r s PHE 104 CO -0.10 -0.03 0.46 0.00 0.70 0.00 0.00 175.22 176.25 2q3r s GLN 106 N 1.52 3.57 0.03 0.00 0.74 -1.26 -1.05 119.66 123.21 2q3r s GLN 106 Ca 0.21 0.26 -0.15 0.00 0.05 0.00 0.00 55.36 55.73 2q3r s GLN 106 Cb -0.15 -3.95 -0.06 0.00 1.10 0.00 0.00 33.01 29.95 2q3r s GLN 106 CO 0.09 -1.40 0.45 0.96 -0.55 0.00 0.00 175.29 174.83 2q3r s ILE 107 N 4.26 4.96 0.14 -2.34 -4.36 0.01 0.98 121.20 124.86 2q3r s ILE 107 Ca 0.41 0.90 -0.14 0.00 -0.26 0.00 0.00 60.65 61.56 2q3r s ILE 107 Cb -0.09 -3.75 0.02 0.00 1.25 0.00 0.00 42.46 39.89 2q3r s ILE 107 CO 0.27 0.55 0.38 -1.66 0.24 0.00 0.00 174.94 174.72 2q3r s TRP 108 N -1.12 -0.02 -0.10 1.37 1.48 1.00 -1.16 118.94 120.39 2q3r s TRP 108 Ca 0.26 -0.32 -0.00 0.00 -1.06 0.00 0.00 56.10 54.97 2q3r s TRP 108 Cb -0.17 0.19 0.02 0.00 -1.16 0.00 0.00 33.47 32.35 2q3r s TRP 108 CO 0.15 -0.73 -0.06 -1.58 -4.06 0.00 0.00 176.95 170.66 2q3r s HIS 109 N -3.86 1.28 0.34 1.66 2.46 -1.26 -2.18 115.29 113.73 2q3r s HIS 109 Ca 0.07 -0.57 0.07 0.00 0.47 0.00 0.00 55.06 55.10 2q3r s HIS 109 Cb 0.02 -1.10 0.63 0.00 -0.13 0.00 0.00 32.58 32.00 2q3r s HIS 109 CO -0.08 -0.43 1.83 -0.39 -2.47 0.00 0.00 174.74 173.20 2q3r h VAL 110 N 6.18 1.22 0.00 0.89 -1.51 -0.81 -3.06 116.25 119.17 2q3r h VAL 110 Ca -0.29 -1.03 0.00 0.00 -1.23 0.00 0.00 66.70 64.16 2q3r h VAL 110 Cb 1.14 1.30 0.00 0.00 -2.13 0.00 0.00 31.29 31.60 2q3r h VAL 110 CO 0.39 0.32 0.00 0.61 -1.23 0.00 0.00 177.57 177.66 2q3r n GLY 111 N -0.64 0.98 0.43 5.19 0.00 -1.26 0.37 105.19 110.27 2q3r n GLY 111 Ca -0.01 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 12.44 0.64 -3.51 1.61 1.85 -1.02 -4.24 116.66 124.43 2q3r n ARG 112 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.50 2q3r n ARG 112 Cb 0.00 -1.27 -0.06 0.00 -1.05 0.00 0.00 32.46 30.08 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 0.09 3.22 -3.11 8.89 0.31 -1.23 -4.77 118.33 121.73 2q3r n VAL 113 Ca 0.00 -5.25 0.00 0.00 -0.01 0.00 0.00 64.34 59.08 2q3r n VAL 113 Cb 0.14 -2.28 0.00 0.00 -0.91 0.00 0.00 33.84 30.79 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 1.87 0.00 -4.23 4.52 3.41 -1.26 -4.21 113.62 113.72 2q3r n SER 114 Ca 0.24 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.72 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 1.47 0.57 4.04 4.22 -1.26 -4.35 114.94 115.62 2q3r s ASN 115 Ca 0.00 -1.07 0.30 0.00 -2.14 0.00 0.00 52.86 49.95 2q3r s ASN 115 Cb 0.00 0.05 1.44 0.00 1.28 0.00 0.00 41.25 44.02 2q3r s ASN 115 CO 0.00 -0.45 1.83 0.28 -2.04 0.00 0.00 177.10 176.72 2q3r h SER 116 N 2.78 0.00 0.38 3.54 0.02 -1.85 0.33 113.55 118.75 2q3r h SER 116 Ca -0.36 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2q3r h SER 116 Cb 1.19 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.73 2q3r h SER 116 CO 0.64 0.00 -0.02 1.23 -1.14 0.00 0.00 176.83 177.54 2q3r h GLY 117 N 0.00 0.00 -0.96 -3.77 0.00 -1.87 -1.27 103.07 95.21 2q3r h GLY 117 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 2q3r h GLY 117 CO -0.00 0.00 -0.15 0.69 0.00 0.00 0.00 176.54 177.08 2q3r n PHE 118 N -3.20 0.00 -4.21 5.60 3.72 0.11 -4.93 117.46 114.54 2q3r n PHE 118 Ca -0.02 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.05 2q3r n PHE 118 Cb 0.17 -0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 38.61 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 -2.19 2.94 0.36 -1.08 -1.52 -0.48 -4.76 119.66 112.93 2q3r s GLN 119 Ca 0.28 -0.52 -0.28 0.00 -1.95 0.00 0.00 55.36 52.89 2q3r s GLN 119 Cb 0.20 -2.77 -0.11 0.00 -0.22 0.00 0.00 33.01 30.10 2q3r s GLN 119 CO 0.41 0.65 1.45 -2.30 -0.25 0.00 0.00 175.29 175.25 2q3r n PRO 120 N 1.43 2.53 -1.46 2.91 -0.02 -1.26 -1.36 135.00 137.77 2q3r n PRO 120 Ca -0.15 0.89 -0.16 0.00 -2.02 0.00 0.00 63.50 62.07 2q3r n PRO 120 Cb 0.53 -2.59 -0.07 0.00 -0.02 0.00 0.00 33.50 31.35 2q3r n PRO 120 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2q3r n ASN 121 N 0.76 -5.20 -0.52 2.55 3.02 -1.26 -1.91 115.26 112.70 2q3r n ASN 121 Ca 0.03 0.39 -0.07 0.00 -0.03 0.00 0.00 54.58 54.90 2q3r n ASN 121 Cb 0.38 -4.09 -0.03 0.00 -0.61 0.00 0.00 39.78 35.43 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 -0.64 0.65 3.70 7.41 0.00 -0.47 -4.94 105.19 110.91 2q3r n GLY 122 Ca -0.16 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.57 1.58 0.70 1.61 -0.14 -0.80 -4.76 119.74 115.37 2q3r s LYS 123 Ca 0.00 1.62 -0.16 0.00 -1.36 0.00 0.00 55.97 56.07 2q3r s LYS 123 Cb 0.00 -1.78 0.02 0.00 -1.68 0.00 0.00 37.83 34.39 2q3r s LYS 123 CO 0.00 -2.23 1.22 0.00 -0.76 0.00 0.00 175.35 173.59 2q3r s ALA 124 N -2.37 2.23 0.79 5.17 0.00 -1.26 -4.50 121.76 121.82 2q3r s ALA 124 Ca 0.70 0.96 -0.12 0.00 0.00 0.00 0.00 51.96 53.49 2q3r s ALA 124 Cb -0.25 -3.48 0.07 0.00 0.00 0.00 0.00 23.12 19.46 2q3r s ALA 124 CO 0.52 -1.72 1.15 -2.14 0.00 0.00 0.00 175.76 173.57 2q3r s PRO 125 N -3.74 1.86 0.05 0.00 0.02 -1.26 -4.69 135.00 127.24 2q3r s PRO 125 Ca 0.76 1.51 0.04 0.00 0.02 0.00 0.00 61.00 63.33 2q3r s PRO 125 Cb -0.31 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.35 2q3r s PRO 125 CO 0.43 -1.99 -0.04 0.96 -0.33 0.00 0.00 177.00 176.02 2q3r s ILE 126 N -2.47 3.77 0.28 2.83 -4.36 -1.26 -0.66 121.20 119.33 2q3r s ILE 126 Ca 0.68 -0.90 -0.10 0.00 -0.26 0.00 0.00 60.65 60.07 2q3r s ILE 126 Cb -0.23 -2.71 0.00 0.00 1.25 0.00 0.00 42.46 40.76 2q3r s ILE 126 CO 0.52 0.26 0.48 -0.55 0.24 0.00 0.00 174.94 175.89 2q3r s SER 127 N -1.83 0.20 0.17 4.36 0.15 -0.94 -2.42 113.70 113.39 2q3r s SER 127 Ca 0.21 -1.12 -0.11 0.00 0.70 0.00 0.00 55.95 55.62 2q3r s SER 127 Cb -0.11 0.62 0.08 0.00 -1.71 0.00 0.00 66.02 64.89 2q3r s SER 127 CO 0.12 -1.21 1.71 0.00 1.20 0.00 0.00 173.24 175.06 2q3r n SER 129 N -4.41 3.28 -1.80 0.00 3.41 -1.26 -3.79 113.62 109.05 2q3r n SER 129 Ca 0.04 -3.17 -0.04 0.00 -0.26 0.00 0.00 58.87 55.44 2q3r n SER 129 Cb 0.20 0.38 0.30 0.00 -0.26 0.00 0.00 64.21 64.82 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 -1.31 4.59 -4.67 4.04 5.75 -1.26 -3.88 116.55 119.81 2q3r n ASP 130 Ca -0.20 -3.24 -0.43 0.00 -0.01 0.00 0.00 54.79 50.92 2q3r n ASP 130 Cb 0.63 -0.71 -0.02 0.00 -1.03 0.00 0.00 41.12 39.98 2q3r n ASP 130 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2q3r s LYS 131 N -2.99 4.26 0.35 0.11 2.20 -1.26 -4.65 119.74 117.76 2q3r s LYS 131 Ca 0.53 1.66 -0.28 0.00 -0.36 0.00 0.00 55.97 57.52 2q3r s LYS 131 Cb 0.43 -3.71 -0.10 0.00 -1.51 0.00 0.00 37.83 32.94 2q3r s LYS 131 CO 0.12 -0.64 1.35 -1.25 -0.36 0.00 0.00 175.35 174.57 2q3r s PRO 132 N 3.17 4.24 -0.21 4.03 0.04 -1.26 -4.69 135.00 140.32 2q3r s PRO 132 Ca 0.55 2.29 -0.19 0.00 0.04 0.00 0.00 61.00 63.68 2q3r s PRO 132 Cb -0.22 -3.00 -0.03 0.00 0.04 0.00 0.00 34.50 31.29 2q3r s PRO 132 CO 0.16 -0.31 0.58 -1.17 0.04 0.00 0.00 177.00 176.30 2q3r s LEU 133 N -1.96 4.12 -0.02 -3.56 2.96 -1.26 -4.60 118.68 114.36 2q3r s LEU 133 Ca 0.51 0.72 -0.02 0.00 -0.22 0.00 0.00 54.13 55.12 2q3r s LEU 133 Cb -0.41 -2.79 0.00 0.00 0.50 0.00 0.00 46.19 43.49 2q3r s LEU 133 CO 0.55 -0.26 0.03 0.23 -1.32 0.00 0.00 176.35 175.58 2q3r n MET 134 N 5.11 -0.08 -0.38 1.98 2.81 -1.26 -4.61 117.12 120.69 2q3r n MET 134 Ca -0.03 0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 2q3r n MET 134 Cb 0.50 -0.09 0.00 0.00 -0.71 0.00 0.00 33.22 32.92 2q3r n MET 134 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2q3r n PRO 135 N 0.09 0.88 -0.10 0.03 -0.04 -1.26 -3.98 135.00 130.62 2q3r n PRO 135 Ca -0.00 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.22 2q3r n PRO 135 Cb 0.03 -1.06 -0.12 0.00 -0.04 0.00 0.00 33.50 32.32 2q3r n PRO 135 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2q3r n GLN 136 N 1.42 0.63 -2.30 0.54 10.64 -1.26 -4.98 117.38 122.07 2q3r n GLN 136 Ca 0.00 0.33 -0.37 0.00 -1.83 0.00 0.00 57.00 55.12 2q3r n GLN 136 Cb 0.44 -1.61 -0.02 0.00 -0.86 0.00 0.00 30.24 28.20 2q3r n GLN 136 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2q3r s ILE 137 N -2.48 3.19 0.06 -0.39 1.01 -1.26 -5.06 121.20 116.28 2q3r s ILE 137 Ca -0.32 0.92 -0.18 0.00 0.00 0.00 0.00 60.65 61.07 2q3r s ILE 137 Cb 0.10 -3.48 0.04 0.00 0.01 0.00 0.00 42.46 39.12 2q3r s ILE 137 CO 0.59 0.02 0.41 -0.13 0.00 0.00 0.00 174.94 175.83 2q3r s ARG 138 N -2.57 0.96 0.00 2.79 0.52 -1.26 -4.37 118.95 115.03 2q3r s ARG 138 Ca 0.61 -0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.37 2q3r s ARG 138 Cb -0.28 0.43 0.00 0.00 0.52 0.00 0.00 34.95 35.61 2q3r s ARG 138 CO 0.35 -0.34 0.00 0.43 0.02 0.00 0.00 175.30 175.76 2q3r n SER 139 N 0.32 0.00 -4.19 0.23 7.64 -0.54 -4.96 113.62 112.12 2q3r n SER 139 Ca -0.18 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.34 2q3r n SER 139 Cb 0.61 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.68 2q3r n SER 139 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2q3r s ASN 140 N -1.79 5.08 0.00 6.43 3.84 -1.26 -5.01 114.94 122.23 2q3r s ASN 140 Ca 0.00 -1.38 0.00 0.00 0.21 0.00 0.00 52.86 51.69 2q3r s ASN 140 Cb 0.00 -1.78 0.00 0.00 -0.55 0.00 0.00 41.25 38.92 2q3r s ASN 140 CO 0.00 -0.33 0.00 0.61 -2.79 0.00 0.00 177.10 174.59 2q3r n GLY 141 N 4.67 -0.04 0.00 1.21 0.00 -1.26 -5.09 105.19 104.68 2q3r n GLY 141 Ca -0.11 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.53 2q3r n GLY 141 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2q3r n ILE 142 N 9.00 0.00 -0.24 -0.61 -6.64 -1.26 -4.56 119.36 115.05 2q3r n ILE 142 Ca 0.00 0.00 -0.01 0.00 -1.77 0.00 0.00 62.75 60.97 2q3r n ILE 142 Cb 0.00 0.00 -0.01 0.00 -1.44 0.00 0.00 39.64 38.19 2q3r n ILE 142 CO 0.00 0.00 0.00 -0.90 -1.77 0.00 0.00 176.55 173.88 2q3r n ASP 143 N -0.81 2.27 0.00 7.28 3.85 -1.26 -4.73 116.55 123.14 2q3r n ASP 143 Ca 0.00 -1.64 0.00 0.00 -0.71 0.00 0.00 54.79 52.44 2q3r n ASP 143 Cb 0.00 -0.50 0.00 0.00 -1.35 0.00 0.00 41.12 39.27 2q3r n ASP 143 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 2q3r n GLU 144 N 1.92 3.05 0.00 0.11 2.13 -1.26 -5.10 120.64 121.48 2q3r n GLU 144 Ca 0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.84 2q3r n GLU 144 Cb 0.24 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.95 2q3r n GLU 144 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2q3r n ALA 145 N -3.00 0.00 -0.54 4.31 0.00 -1.26 -4.99 120.51 115.03 2q3r n ALA 145 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2q3r n ALA 145 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2q3r n ALA 145 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2q3r n LEU 146 N 0.00 0.00 -3.39 0.00 7.94 -1.26 -1.47 117.00 118.82 2q3r n LEU 146 Ca 0.00 0.00 -0.39 0.00 -1.11 0.00 0.00 56.01 54.51 2q3r n LEU 146 Cb 0.00 0.11 -0.02 0.00 0.53 0.00 0.00 43.42 44.04 2q3r n LEU 146 CO 0.00 -0.11 3.06 0.49 -1.11 0.00 0.00 177.39 179.72 2q3r n PHE 147 N -1.31 2.52 -1.58 1.96 0.99 -1.26 -4.54 117.46 114.24 2q3r n PHE 147 Ca 0.00 -3.01 -0.62 0.00 -0.00 0.00 0.00 57.45 53.83 2q3r n PHE 147 Cb 0.00 -2.29 -0.09 0.00 -1.00 0.00 0.00 39.48 36.09 2q3r n PHE 147 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2q3r n THR 148 N 3.08 0.00 -1.38 4.37 -2.24 -1.26 -4.66 114.28 112.18 2q3r n THR 148 Ca 0.72 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 62.12 2q3r n THR 148 Cb 0.24 -0.45 0.03 0.00 -2.10 0.00 0.00 70.33 68.04 2q3r n THR 148 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2q3r n PRO 149 N 3.73 0.31 -2.86 -0.78 -0.02 -1.26 -4.68 135.00 129.44 2q3r n PRO 149 Ca 0.29 0.12 -0.26 0.00 -2.02 0.00 0.00 63.50 61.63 2q3r n PRO 149 Cb -0.05 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 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 -1.64 3.40 -0.22 0.52 0.04 -1.26 -4.54 135.00 131.30 2q3r s PRO 150 Ca 0.64 -0.06 -0.15 0.00 0.04 0.00 0.00 61.00 61.47 2q3r s PRO 150 Cb -0.48 -2.47 -0.04 0.00 0.04 0.00 0.00 34.50 31.56 2q3r s PRO 150 CO 0.59 -0.17 0.34 0.50 0.04 0.00 0.00 177.00 178.30 2q3r s ARG 151 N -4.63 4.13 0.06 4.56 3.52 0.16 -4.43 118.95 122.33 2q3r s ARG 151 Ca 0.46 0.08 -0.31 0.00 -0.13 0.00 0.00 55.73 55.83 2q3r s ARG 151 Cb -0.10 -3.55 -0.08 0.00 -1.56 0.00 0.00 34.95 29.66 2q3r s ARG 151 CO 0.42 -0.04 1.58 0.50 -0.81 0.00 0.00 175.30 176.95 2q3r s ARG 152 N 1.33 4.22 0.34 5.12 3.52 -1.25 -2.21 118.95 130.02 2q3r s ARG 152 Ca 0.16 2.24 -0.28 0.00 -0.13 0.00 0.00 55.73 57.72 2q3r s ARG 152 Cb -0.15 -3.56 -0.12 0.00 -1.56 0.00 0.00 34.95 29.56 2q3r s ARG 152 CO 0.07 -0.68 1.36 1.28 -0.81 0.00 0.00 175.30 176.52 2q3r n LEU 153 N 5.44 3.83 -4.83 -0.88 4.77 -0.41 -4.95 117.00 119.96 2q3r n LEU 153 Ca 0.15 1.20 -0.31 0.00 -0.03 0.00 0.00 56.01 57.02 2q3r n LEU 153 Cb 0.41 -1.52 0.03 0.00 -2.33 0.00 0.00 43.42 40.01 2q3r n LEU 153 CO 0.62 -0.31 0.71 -0.83 -1.33 0.00 0.00 177.39 176.25 2q3r s GLY 154 N -0.18 1.78 0.07 -0.72 0.00 -1.26 -4.95 107.32 102.06 2q3r s GLY 154 Ca 0.56 0.12 -0.24 0.00 0.00 0.00 0.00 44.72 45.16 2q3r s GLY 154 CO 0.61 0.42 1.64 1.19 0.00 0.00 0.00 173.10 176.95 2q3r h ILE 155 N -0.29 1.02 0.00 0.90 2.10 -2.01 -1.78 117.51 117.45 2q3r h ILE 155 Ca -0.45 -0.21 0.00 0.00 1.08 0.00 0.00 64.86 65.28 2q3r h ILE 155 Cb 1.21 1.16 0.00 0.00 -1.09 0.00 0.00 36.82 38.09 2q3r h ILE 155 CO 0.58 0.05 0.00 -0.62 -1.08 0.00 0.00 178.15 177.09 2q3r n GLU 156 N -5.07 0.48 -0.28 2.19 1.02 -1.26 -2.78 120.64 114.92 2q3r n GLU 156 Ca -0.08 0.05 0.12 0.00 -0.02 0.00 0.00 57.16 57.23 2q3r n GLU 156 Cb 0.09 -1.50 0.27 0.00 -0.02 0.00 0.00 31.44 30.29 2q3r n GLU 156 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2q3r n GLU 157 N -1.14 2.61 -0.02 3.49 2.13 -0.68 -4.35 120.64 122.69 2q3r n GLU 157 Ca 0.13 -2.47 -0.19 0.00 0.66 0.00 0.00 57.16 55.29 2q3r n GLU 157 Cb 0.11 -1.54 -0.14 0.00 0.27 0.00 0.00 31.44 30.14 2q3r n GLU 157 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2q3r n ILE 158 N 1.57 1.73 0.15 6.31 5.41 -1.12 -4.21 119.36 129.20 2q3r n ILE 158 Ca 0.22 -0.66 0.11 0.00 1.00 0.00 0.00 62.75 63.42 2q3r n ILE 158 Cb 0.61 -1.60 0.63 0.00 -0.71 0.00 0.00 39.64 38.57 2q3r n ILE 158 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 2q3r h PRO 159 N 0.06 0.06 -0.00 0.38 0.11 -1.79 0.55 132.00 131.37 2q3r h PRO 159 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2q3r h PRO 159 Cb 2.02 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 33.12 2q3r h PRO 159 CO 0.07 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.30 2q3r n GLY 160 N -1.56 -0.99 0.45 -0.55 0.00 -1.26 -2.41 105.19 98.86 2q3r n GLY 160 Ca 0.02 -0.06 -0.02 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.64 0.15 0.37 -0.61 5.41 0.06 -4.17 119.36 119.94 2q3r n ILE 161 Ca 0.07 -0.05 0.04 0.00 1.00 0.00 0.00 62.75 63.82 2q3r n ILE 161 Cb 0.03 -1.04 0.21 0.00 -0.71 0.00 0.00 39.64 38.13 2q3r n ILE 161 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2q3r n VAL 162 N -2.84 1.06 -0.03 1.39 0.31 -0.48 -0.34 118.33 117.41 2q3r n VAL 162 Ca -0.05 0.26 0.06 0.00 -0.01 0.00 0.00 64.34 64.60 2q3r n VAL 162 Cb 0.54 -1.12 -0.16 0.00 -0.91 0.00 0.00 33.84 32.19 2q3r n VAL 162 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2q3r n ASN 163 N -1.38 0.02 -0.21 4.52 6.94 -1.01 -4.07 115.26 120.07 2q3r n ASN 163 Ca 0.03 0.01 -0.08 0.00 -0.02 0.00 0.00 54.58 54.52 2q3r n ASN 163 Cb 0.08 1.71 0.02 0.00 -2.36 0.00 0.00 39.78 39.24 2q3r n ASN 163 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2q3r h ASP 164 N 0.00 0.84 0.24 0.53 3.32 -0.85 0.15 116.42 120.65 2q3r h ASP 164 Ca -0.14 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.71 2q3r h ASP 164 Cb 1.32 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.66 2q3r h ASP 164 CO 0.01 0.81 0.00 0.49 -1.72 0.00 0.00 179.24 178.83 2q3r n PHE 165 N -4.43 0.00 -0.06 4.55 3.01 -1.07 -1.54 117.46 117.91 2q3r n PHE 165 Ca 0.03 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.45 2q3r n PHE 165 Cb 0.20 -0.22 -0.02 0.00 -0.01 0.00 0.00 39.48 39.42 2q3r n PHE 165 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2q3r h ARG 166 N 0.00 0.00 0.00 -1.08 2.43 -0.89 -3.30 114.38 111.54 2q3r h ARG 166 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2q3r h ARG 166 Cb 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2q3r h ARG 166 CO 0.00 0.16 0.00 -0.11 -1.51 0.00 0.00 179.97 178.51 2q3r n LEU 167 N -4.69 0.00 -0.00 3.80 7.94 -0.72 -2.20 117.00 121.12 2q3r n LEU 167 Ca -0.05 0.00 -0.20 0.00 -1.11 0.00 0.00 56.01 54.64 2q3r n LEU 167 Cb 0.17 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 43.98 2q3r n LEU 167 CO 0.08 0.00 -0.26 0.00 -1.11 0.00 0.00 177.39 176.10 2q3r h ALA 168 N 3.53 0.11 -0.23 1.96 0.00 -1.42 -2.95 119.26 120.27 2q3r h ALA 168 Ca 0.00 -0.96 -0.05 0.00 0.00 0.00 0.00 54.91 53.90 2q3r h ALA 168 Cb 0.00 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2q3r h ALA 168 CO 0.00 0.64 -0.06 0.00 0.00 0.00 0.00 179.25 179.83 2q3r h ALA 169 N -0.06 1.48 -0.08 0.00 0.00 -1.51 -2.15 119.26 116.92 2q3r h ALA 169 Ca -0.25 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 2q3r h ALA 169 Cb 1.62 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 2q3r h ALA 169 CO 0.04 0.37 0.05 -0.09 0.00 0.00 0.00 179.25 179.62 2q3r h ARG 170 N 0.34 0.12 0.00 0.00 9.65 -1.55 -1.86 114.38 121.08 2q3r h ARG 170 Ca 0.07 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.91 2q3r h ARG 170 Cb 0.33 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 28.88 2q3r h ARG 170 CO 0.01 0.16 -0.14 -0.91 2.80 0.00 0.00 179.97 181.90 2q3r h ASN 171 N 0.04 0.00 0.18 -3.80 4.21 -1.29 -1.36 115.58 113.56 2q3r h ASN 171 Ca 0.03 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.53 2q3r h ASN 171 Cb 0.08 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.28 2q3r h ASN 171 CO -0.00 0.14 -0.09 0.00 -1.29 0.00 0.00 177.43 176.19 2q3r h ALA 172 N 1.86 -0.24 -0.68 -0.83 0.00 -0.85 -1.17 119.26 117.35 2q3r h ALA 172 Ca -0.00 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.80 2q3r h ALA 172 Cb 0.46 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 2q3r h ALA 172 CO 0.02 -0.48 0.39 0.52 0.00 0.00 0.00 179.25 179.70 2q3r h MET 173 N -0.55 0.70 -0.89 0.00 2.86 -1.00 -1.36 114.93 114.69 2q3r h MET 173 Ca -0.02 -0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.66 2q3r h MET 173 Cb 0.42 -0.16 -0.06 0.00 0.06 0.00 0.00 31.60 31.86 2q3r h MET 173 CO 0.04 0.46 0.58 0.93 1.06 0.00 0.00 176.91 179.98 2q3r h GLU 174 N 0.72 0.91 0.00 1.72 5.08 -1.06 0.21 114.58 122.16 2q3r h GLU 174 Ca 0.30 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2q3r h GLU 174 Cb 0.17 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2q3r h GLU 174 CO -0.18 0.60 0.00 0.00 -1.00 0.00 0.00 179.01 178.43 2q3r n ALA 175 N -2.40 2.12 -0.06 3.43 0.00 -0.46 -4.91 120.51 118.22 2q3r n ALA 175 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2q3r n ALA 175 Cb 0.26 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 1.02 0.76 3.71 0.00 0.00 0.75 -4.28 105.19 107.15 2q3r n GLY 176 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 2q3r n GLY 176 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q3r s PHE 177 N -2.06 1.87 -0.77 1.61 0.40 -0.86 -4.90 117.98 113.27 2q3r s PHE 177 Ca 0.00 1.62 0.26 0.00 -0.60 0.00 0.00 56.93 58.22 2q3r s PHE 177 Cb 0.00 -3.54 0.88 0.00 0.51 0.00 0.00 43.02 40.87 2q3r s PHE 177 CO 0.00 -2.87 1.80 -0.25 0.70 0.00 0.00 175.22 174.60 2q3r n ASP 178 N -2.94 0.68 0.00 1.36 8.00 0.03 -4.59 116.55 119.09 2q3r n ASP 178 Ca 0.14 0.57 0.00 0.00 0.71 0.00 0.00 54.79 56.21 2q3r n ASP 178 Cb 0.50 -0.75 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 2q3r n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2q3r n GLY 179 N 1.29 -1.26 2.99 0.44 0.00 -1.23 -4.76 105.19 102.65 2q3r n GLY 179 Ca 0.06 -0.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.96 2q3r n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q3r s VAL 180 N -3.00 0.37 -0.24 1.61 0.11 -1.00 -1.66 120.40 116.59 2q3r s VAL 180 Ca 0.00 -0.58 -0.07 0.00 -2.93 0.00 0.00 61.98 58.41 2q3r s VAL 180 Cb 0.00 -0.39 -0.03 0.00 -1.53 0.00 0.00 36.38 34.44 2q3r s VAL 180 CO 0.00 -0.15 0.05 -0.70 -3.33 0.00 0.00 175.10 170.97 2q3r s GLU 181 N -0.78 3.62 -0.31 1.54 2.12 -0.22 -2.44 118.70 122.23 2q3r s GLU 181 Ca -0.05 -0.50 -0.29 0.00 0.36 0.00 0.00 54.97 54.50 2q3r s GLU 181 Cb -0.06 -3.26 0.01 0.00 0.26 0.00 0.00 34.13 31.08 2q3r s GLU 181 CO -0.00 -0.17 1.25 0.42 -0.54 0.00 0.00 175.26 176.23 2q3r s ILE 182 N 1.53 4.21 -1.23 -3.70 1.01 -0.27 -0.81 121.20 121.94 2q3r s ILE 182 Ca 0.06 1.36 -0.20 0.00 0.00 0.00 0.00 60.65 61.87 2q3r s ILE 182 Cb -0.15 -4.23 0.02 0.00 0.01 0.00 0.00 42.46 38.11 2q3r s ILE 182 CO 0.02 -0.51 1.78 -2.28 0.00 0.00 0.00 174.94 173.96 2q3r s HIS 183 N 4.26 2.48 -0.46 3.97 2.46 -0.31 -3.18 115.29 124.51 2q3r s HIS 183 Ca 0.54 -0.87 0.02 0.00 0.47 0.00 0.00 55.06 55.22 2q3r s HIS 183 Cb -0.15 -4.51 0.55 0.00 -0.13 0.00 0.00 32.58 28.34 2q3r s HIS 183 CO 0.22 -1.64 1.88 0.41 -2.47 0.00 0.00 174.74 173.15 2q3r n GLY 184 N 5.70 4.60 0.56 1.59 0.00 -1.24 -4.71 105.19 111.70 2q3r n GLY 184 Ca 0.46 -1.28 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 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 -0.90 0.09 -4.20 4.61 0.00 -1.25 -4.20 120.51 114.65 2q3r n ALA 185 Ca 0.55 -0.35 -0.36 0.00 0.00 0.00 0.00 53.44 53.28 2q3r n ALA 185 Cb 1.31 0.23 -0.03 0.00 0.00 0.00 0.00 19.45 20.96 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 -1.81 -3.37 -0.70 0.00 3.02 -1.26 -2.70 115.26 108.43 2q3r n ASN 186 Ca -0.01 -0.99 -0.09 0.00 -0.03 0.00 0.00 54.58 53.45 2q3r n ASN 186 Cb 0.10 -2.76 -0.04 0.00 -0.61 0.00 0.00 39.78 36.47 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 -1.38 1.05 3.58 7.41 0.00 -1.24 -4.77 105.19 109.85 2q3r n GLY 187 Ca 0.08 -0.42 -0.37 0.00 0.00 0.00 0.00 46.02 45.32 2q3r n GLY 187 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2q3r s TYR 188 N -2.24 3.22 0.00 1.61 2.02 -1.10 -4.65 117.35 116.21 2q3r s TYR 188 Ca 0.00 0.00 0.00 0.00 -0.37 0.00 0.00 57.07 56.70 2q3r s TYR 188 Cb 0.00 -2.26 0.00 0.00 -0.40 0.00 0.00 41.96 39.30 2q3r s TYR 188 CO 0.00 -0.09 0.00 -0.11 -1.57 0.00 0.00 175.55 173.78 2q3r n LEU 189 N 4.53 0.00 0.16 -1.29 7.94 0.16 -0.98 117.00 127.52 2q3r n LEU 189 Ca -0.15 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.61 2q3r n LEU 189 Cb 0.52 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.39 2q3r n LEU 189 CO 0.33 0.00 0.51 0.40 -1.11 0.00 0.00 177.39 177.53 2q3r h ILE 190 N 0.00 0.00 -0.79 1.96 2.04 -1.84 -0.46 117.51 118.41 2q3r h ILE 190 Ca 0.00 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.07 2q3r h ILE 190 Cb 0.00 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.04 2q3r h ILE 190 CO 0.00 0.00 0.56 -0.78 0.00 0.00 0.00 178.15 177.93 2q3r h ASP 191 N -0.69 0.10 -0.43 1.72 3.58 -1.23 0.33 116.42 119.80 2q3r h ASP 191 Ca -0.03 0.01 0.04 0.00 0.42 0.00 0.00 57.03 57.48 2q3r h ASP 191 Cb 0.65 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 2q3r h ASP 191 CO -0.15 0.04 0.29 1.56 -2.88 0.00 0.00 179.24 178.11 2q3r h GLN 192 N 0.10 0.39 0.00 0.28 4.20 -1.20 -2.05 115.11 116.84 2q3r h GLN 192 Ca 0.38 -0.02 -0.22 0.00 0.06 0.00 0.00 58.65 58.85 2q3r h GLN 192 Cb 1.37 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 29.06 2q3r h GLN 192 CO -0.04 0.26 -0.93 0.74 -0.67 0.00 0.00 178.83 178.18 2q3r h PHE 193 N 0.41 0.53 -0.20 2.96 -1.00 0.05 -3.13 116.94 116.56 2q3r h PHE 193 Ca 0.18 -0.29 -0.18 0.00 2.81 0.00 0.00 57.97 60.49 2q3r h PHE 193 Cb 0.22 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.72 2q3r h PHE 193 CO -0.00 1.11 -0.60 0.52 -1.61 0.00 0.00 178.31 177.73 2q3r h MET 194 N 0.20 0.67 -6.19 1.51 2.86 -1.27 -3.43 114.93 109.28 2q3r h MET 194 Ca -0.07 -0.45 -0.57 0.00 -2.06 0.00 0.00 59.70 56.55 2q3r h MET 194 Cb 1.57 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 33.25 2q3r h MET 194 CO 0.16 1.07 0.69 0.15 1.06 0.00 0.00 176.91 180.04 2q3r s LYS 195 N -3.96 4.34 0.31 1.72 -0.14 -0.89 -4.80 119.74 116.33 2q3r s LYS 195 Ca -0.09 1.42 -0.01 0.00 -1.36 0.00 0.00 55.97 55.94 2q3r s LYS 195 Cb 0.10 -3.60 0.50 0.00 -1.68 0.00 0.00 37.83 33.15 2q3r s LYS 195 CO 0.86 -0.48 1.97 0.38 -0.76 0.00 0.00 175.35 177.33 2q3r h ASP 196 N 7.35 0.87 0.45 2.83 3.04 -1.85 1.17 116.42 130.28 2q3r h ASP 196 Ca -0.26 -0.03 0.00 0.00 -3.24 0.00 0.00 57.03 53.50 2q3r h ASP 196 Cb 1.11 -0.22 0.00 0.00 -1.04 0.00 0.00 39.33 39.18 2q3r h ASP 196 CO 0.91 0.65 0.00 0.35 -2.04 0.00 0.00 179.24 179.11 2q3r n THR 197 N -4.41 0.89 -0.07 1.15 -2.24 -1.26 -3.46 114.28 104.88 2q3r n THR 197 Ca 0.08 0.43 -0.15 0.00 -2.27 0.00 0.00 64.05 62.14 2q3r n THR 197 Cb 0.04 -1.39 -0.05 0.00 -2.10 0.00 0.00 70.33 66.82 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 -2.28 0.81 -2.39 2.28 0.31 -0.03 -4.93 118.33 112.10 2q3r n VAL 198 Ca 0.01 -0.22 -0.43 0.00 -0.01 0.00 0.00 64.34 63.69 2q3r n VAL 198 Cb 0.16 -1.63 -0.02 0.00 -0.91 0.00 0.00 33.84 31.43 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 -6.24 6.36 -0.27 4.52 3.84 0.38 -4.66 114.94 118.87 2q3r s ASN 199 Ca -0.20 0.71 0.16 0.00 0.21 0.00 0.00 52.86 53.74 2q3r s ASN 199 Cb 0.08 -2.54 0.49 0.00 -0.55 0.00 0.00 41.25 38.72 2q3r s ASN 199 CO 0.27 -1.44 1.15 -0.90 -2.79 0.00 0.00 177.10 173.38 2q3r n ASP 200 N 8.76 3.01 -4.92 -4.21 5.75 -1.26 -4.63 116.55 119.05 2q3r n ASP 200 Ca 0.15 -2.77 -0.26 0.00 -0.01 0.00 0.00 54.79 51.90 2q3r n ASP 200 Cb 0.48 -0.42 -0.01 0.00 -1.03 0.00 0.00 41.12 40.15 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 -3.68 3.54 -0.10 0.11 0.52 -1.26 -4.93 118.95 113.15 2q3r s ARG 201 Ca 0.37 0.03 0.14 0.00 -0.52 0.00 0.00 55.73 55.76 2q3r s ARG 201 Cb 0.36 -2.48 0.22 0.00 0.52 0.00 0.00 34.95 33.57 2q3r s ARG 201 CO -0.01 -0.06 1.12 0.25 0.02 0.00 0.00 175.30 176.62 2q3r n THR 202 N -2.00 1.44 -3.23 0.02 -2.24 -1.26 -2.35 114.28 104.66 2q3r n THR 202 Ca -0.01 -1.75 0.00 0.00 -2.27 0.00 0.00 64.05 60.02 2q3r n THR 202 Cb 0.55 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 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 -1.09 1.57 -0.11 3.42 3.85 -1.26 -5.00 116.55 117.92 2q3r n ASP 203 Ca 0.12 -0.45 -0.01 0.00 -0.71 0.00 0.00 54.79 53.74 2q3r n ASP 203 Cb 0.66 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.43 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 -0.10 -0.08 -3.75 0.11 0.28 -1.26 -3.57 120.64 112.27 2q3r n GLU 204 Ca 0.00 0.43 -0.37 0.00 -0.16 0.00 0.00 57.16 57.06 2q3r n GLU 204 Cb 0.00 -0.64 -0.12 0.00 1.43 0.00 0.00 31.44 32.12 2q3r n GLU 204 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2q3r s TYR 205 N -5.23 3.38 0.00 -1.84 2.02 -1.26 -4.84 117.35 109.58 2q3r s TYR 205 Ca -0.04 -1.86 0.00 0.00 -0.37 0.00 0.00 57.07 54.80 2q3r s TYR 205 Cb 0.05 -2.72 0.00 0.00 -0.40 0.00 0.00 41.96 38.89 2q3r s TYR 205 CO 0.19 -0.85 0.00 0.41 -1.57 0.00 0.00 175.55 173.73 2q3r n GLY 206 N 4.73 4.30 0.35 0.71 0.00 -1.23 -4.44 105.19 109.61 2q3r n GLY 206 Ca -0.09 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.48 2q3r n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q3r n GLY 207 N -1.92 0.65 3.63 -0.02 0.00 -0.99 -4.64 105.19 101.90 2q3r n GLY 207 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.10 -0.29 0.16 1.61 1.04 -1.26 -5.02 113.70 107.84 2q3r s SER 208 Ca 0.00 -0.22 -0.16 0.00 0.48 0.00 0.00 55.95 56.05 2q3r s SER 208 Cb 0.00 0.47 0.06 0.00 0.10 0.00 0.00 66.02 66.64 2q3r s SER 208 CO 0.00 -0.82 1.77 0.25 0.98 0.00 0.00 173.24 175.42 2q3r h LEU 209 N 2.00 0.23 0.35 2.42 5.85 -1.95 0.87 115.31 125.09 2q3r h LEU 209 Ca -0.24 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 2q3r h LEU 209 Cb 1.24 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 2q3r h LEU 209 CO 0.28 0.17 -0.29 -0.61 -0.34 0.00 0.00 178.44 177.65 2q3r h GLN 210 N 0.35 -0.63 -0.25 1.25 -0.00 -1.97 0.76 115.11 114.61 2q3r h GLN 210 Ca 0.16 0.04 -0.00 0.00 -0.00 0.00 0.00 58.65 58.86 2q3r h GLN 210 Cb 0.10 0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.71 2q3r h GLN 210 CO -0.13 -0.42 0.15 -0.91 0.00 0.00 0.00 178.83 177.52 2q3r h ASN 211 N -0.65 0.29 0.03 -0.69 2.35 -1.82 -2.25 115.58 112.84 2q3r h ASN 211 Ca -0.03 -0.01 -0.23 0.00 -0.55 0.00 0.00 56.30 55.48 2q3r h ASN 211 Cb 0.58 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.88 2q3r h ASN 211 CO -0.02 0.23 -0.88 0.03 -1.65 0.00 0.00 177.43 175.13 2q3r h ARG 212 N 0.34 0.65 -0.04 0.81 3.08 -0.23 -3.19 114.38 115.81 2q3r h ARG 212 Ca 0.09 -0.61 0.00 0.00 0.07 0.00 0.00 59.98 59.53 2q3r h ARG 212 Cb -0.01 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2q3r h ARG 212 CO -0.02 1.22 0.00 0.00 -1.07 0.00 0.00 179.97 180.10 2q3r h LYS 214 N 1.13 0.21 -0.42 0.00 1.57 -1.40 -2.70 116.57 114.96 2q3r h LYS 214 Ca 0.00 -0.09 0.09 0.00 -1.87 0.00 0.00 60.65 58.78 2q3r h LYS 214 Cb 0.24 -0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.45 2q3r h LYS 214 CO 0.00 0.55 -0.28 0.35 -0.57 0.00 0.00 179.45 179.50 2q3r h PHE 215 N -0.14 -0.75 0.08 -1.35 3.57 -1.75 0.16 116.94 116.76 2q3r h PHE 215 Ca 0.02 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 2q3r h PHE 215 Cb 0.48 0.39 0.00 0.00 2.79 0.00 0.00 35.95 39.61 2q3r h PHE 215 CO 0.06 -0.35 -0.04 -1.00 -2.23 0.00 0.00 178.31 174.76 2q3r h PRO 216 N -0.20 -0.11 -0.97 6.41 0.13 -1.80 -2.03 132.00 133.43 2q3r h PRO 216 Ca 0.19 0.01 0.14 0.00 -0.87 0.00 0.00 66.00 65.47 2q3r h PRO 216 Cb 0.51 0.02 -0.08 0.00 0.13 0.00 0.00 31.00 31.58 2q3r h PRO 216 CO -0.53 0.21 0.61 -0.07 -0.23 0.00 0.00 178.00 177.99 2q3r h LEU 217 N -0.43 0.81 -1.27 1.56 3.38 -1.25 0.61 115.31 118.71 2q3r h LEU 217 Ca -0.01 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 2q3r h LEU 217 Cb 0.37 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2q3r h LEU 217 CO 0.02 0.40 -0.21 -0.33 0.09 0.00 0.00 178.44 178.41 2q3r h GLU 218 N 0.85 0.00 -0.08 1.13 5.08 -0.91 -2.48 114.58 118.17 2q3r h GLU 218 Ca 0.49 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.67 2q3r h GLU 218 Cb 0.64 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.91 2q3r h GLU 218 CO -0.26 0.21 -0.66 0.82 -1.00 0.00 0.00 179.01 178.11 2q3r h ILE 219 N 0.00 1.35 -0.67 3.13 2.04 0.90 -2.09 117.51 122.17 2q3r h ILE 219 Ca -0.00 -1.97 0.11 0.00 1.00 0.00 0.00 64.86 64.00 2q3r h ILE 219 Cb 0.67 2.26 -0.04 0.00 -0.74 0.00 0.00 36.82 38.97 2q3r h ILE 219 CO 0.03 0.60 0.45 0.58 0.00 0.00 0.00 178.15 179.80 2q3r h VAL 220 N 0.21 0.87 0.15 1.67 2.07 -0.84 -1.46 116.25 118.91 2q3r h VAL 220 Ca -0.06 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2q3r h VAL 220 Cb 1.32 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2q3r h VAL 220 CO 0.13 0.08 -0.07 -0.78 0.02 0.00 0.00 177.57 176.95 2q3r h ASP 221 N 0.44 -0.17 0.18 0.57 3.58 -0.99 -1.95 116.42 118.07 2q3r h ASP 221 Ca 0.32 -0.29 -0.03 0.00 0.42 0.00 0.00 57.03 57.45 2q3r h ASP 221 Cb 0.64 0.04 -0.00 0.00 1.72 0.00 0.00 39.33 41.73 2q3r h ASP 221 CO -0.10 0.22 -0.13 0.00 -2.88 0.00 0.00 179.24 176.36 2q3r h ALA 222 N 0.16 1.62 0.00 -0.78 0.00 -0.86 -2.16 119.26 117.25 2q3r h ALA 222 Ca -0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2q3r h ALA 222 Cb 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2q3r h ALA 222 CO 0.03 0.16 -0.00 0.28 0.00 0.00 0.00 179.25 179.72 2q3r h VAL 223 N 0.00 1.61 -0.62 0.00 2.07 -1.30 -3.13 116.25 114.89 2q3r h VAL 223 Ca -0.00 -2.13 0.00 0.00 0.82 0.00 0.00 66.70 65.39 2q3r h VAL 223 Cb 0.25 3.01 -0.03 0.00 -1.52 0.00 0.00 31.29 33.00 2q3r h VAL 223 CO 0.02 0.53 0.40 0.00 0.02 0.00 0.00 177.57 178.54 2q3r h ALA 224 N -0.04 0.79 0.00 1.67 0.00 -1.30 -0.55 119.26 119.82 2q3r h ALA 224 Ca -0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2q3r h ALA 224 Cb 0.88 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2q3r h ALA 224 CO 0.00 0.23 -0.03 0.87 0.00 0.00 0.00 179.25 180.32 2q3r h LYS 225 N 0.84 0.00 0.00 0.00 1.57 -1.53 2.10 116.57 119.55 2q3r h LYS 225 Ca 0.23 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.88 2q3r h LYS 225 Cb -0.08 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 2q3r h LYS 225 CO -0.05 0.03 -1.46 -1.91 -0.57 0.00 0.00 179.45 175.50 2q3r n GLU 226 N -3.31 0.63 0.00 3.15 4.07 -0.35 -4.67 120.64 120.14 2q3r n GLU 226 Ca -0.02 0.14 0.00 0.00 -0.06 0.00 0.00 57.16 57.22 2q3r n GLU 226 Cb 0.16 -1.76 0.00 0.00 -0.06 0.00 0.00 31.44 29.78 2q3r n GLU 226 CO 0.00 0.00 0.00 0.44 -0.06 0.00 0.00 177.13 177.51 2q3r n ILE 227 N -2.76 0.00 0.00 6.31 -5.35 -0.38 -4.81 119.36 112.37 2q3r n ILE 227 Ca -0.09 -0.05 0.00 0.00 -0.27 0.00 0.00 62.75 62.35 2q3r n ILE 227 Cb 0.77 0.43 0.00 0.00 -1.74 0.00 0.00 39.64 39.10 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 0.57 2.61 0.36 3.28 0.00 0.71 -4.79 105.19 107.93 2q3r n GLY 228 Ca 0.00 -1.17 0.17 0.00 0.00 0.00 0.00 46.02 45.02 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 0.59 0.00 1.61 0.13 -1.90 -0.07 132.00 132.36 2q3r h PRO 229 Ca 0.00 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2q3r h PRO 229 Cb 0.00 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.00 2q3r h PRO 229 CO 0.00 0.39 0.00 -0.40 -0.23 0.00 0.00 178.00 177.76 2q3r n ASP 230 N -4.77 0.00 -1.46 1.44 3.85 -1.26 -0.90 116.55 113.45 2q3r n ASP 230 Ca 0.25 0.35 -0.11 0.00 -0.71 0.00 0.00 54.79 54.57 2q3r n ASP 230 Cb 0.70 -0.36 0.10 0.00 -1.35 0.00 0.00 41.12 40.21 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 -1.36 2.72 -4.58 0.11 1.74 -0.04 -4.66 116.66 110.59 2q3r n ARG 231 Ca 0.00 -3.78 -0.24 0.00 -0.77 0.00 0.00 57.85 53.06 2q3r n ARG 231 Cb 0.00 -1.97 -0.16 0.00 -1.02 0.00 0.00 32.46 29.31 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 -3.98 1.10 -0.05 1.55 1.01 -0.07 -2.38 120.40 117.58 2q3r s VAL 232 Ca 0.45 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.96 2q3r s VAL 232 Cb 0.39 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.79 2q3r s VAL 232 CO -0.01 0.34 -0.04 -0.83 0.00 0.00 0.00 175.10 174.56 2q3r s GLY 233 N 0.54 0.45 -0.10 4.51 0.00 -1.02 -1.94 107.32 109.76 2q3r s GLY 233 Ca -0.12 -0.06 -0.03 0.00 0.00 0.00 0.00 44.72 44.51 2q3r s GLY 233 CO 0.03 0.46 0.03 -1.50 0.00 0.00 0.00 173.10 172.12 2q3r s ILE 234 N 0.95 4.56 -0.12 0.90 2.07 -1.20 -1.11 121.20 127.25 2q3r s ILE 234 Ca -0.11 -0.15 -0.02 0.00 -1.41 0.00 0.00 60.65 58.97 2q3r s ILE 234 Cb -0.14 -2.94 -0.03 0.00 0.13 0.00 0.00 42.46 39.48 2q3r s ILE 234 CO -0.00 0.60 -0.05 -0.60 -1.91 0.00 0.00 174.94 172.98 2q3r s ARG 235 N -0.86 3.31 0.24 3.50 3.52 -1.19 -1.60 118.95 125.88 2q3r s ARG 235 Ca 0.13 -0.53 0.12 0.00 -0.13 0.00 0.00 55.73 55.32 2q3r s ARG 235 Cb -0.12 -2.78 -0.05 0.00 -1.56 0.00 0.00 34.95 30.44 2q3r s ARG 235 CO 0.03 0.41 -0.21 -0.51 -0.81 0.00 0.00 175.30 174.20 2q3r s LEU 236 N -0.11 2.53 -0.38 -0.88 1.43 0.12 -3.63 118.68 117.76 2q3r s LEU 236 Ca 0.02 -0.97 0.11 0.00 -1.03 0.00 0.00 54.13 52.26 2q3r s LEU 236 Cb -0.13 -1.11 0.40 0.00 0.03 0.00 0.00 46.19 45.38 2q3r s LEU 236 CO 0.03 0.06 1.37 -0.24 0.23 0.00 0.00 176.35 177.80 2q3r n SER 237 N -0.27 -1.57 0.00 2.29 2.88 -1.26 -0.97 113.62 114.71 2q3r n SER 237 Ca -0.08 -2.42 0.06 0.00 -1.33 0.00 0.00 58.87 55.09 2q3r n SER 237 Cb 0.58 0.84 0.26 0.00 -0.75 0.00 0.00 64.21 65.15 2q3r n SER 237 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2q3r n PRO 238 N -0.75 0.04 -0.16 -1.46 -0.04 -1.26 -2.58 135.00 128.79 2q3r n PRO 238 Ca -0.05 0.27 0.12 0.00 -0.04 0.00 0.00 63.50 63.80 2q3r n PRO 238 Cb 0.85 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 33.04 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 -1.45 0.43 -3.51 0.54 3.01 -1.26 -4.31 117.46 110.92 2q3r n PHE 239 Ca 0.04 -0.22 -0.23 0.00 1.01 0.00 0.00 57.45 58.05 2q3r n PHE 239 Cb 0.13 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.61 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 -1.57 4.45 -0.02 4.37 0.00 -1.06 -4.78 121.76 123.15 2q3r s ALA 240 Ca 0.37 -1.69 0.10 0.00 0.00 0.00 0.00 51.96 50.74 2q3r s ALA 240 Cb 0.22 -1.06 0.18 0.00 0.00 0.00 0.00 23.12 22.45 2q3r s ALA 240 CO 0.31 -0.52 1.07 -0.40 0.00 0.00 0.00 175.76 176.22 2q3r n ASP 241 N -1.87 0.58 -4.64 0.00 5.68 -1.26 -2.44 116.55 112.59 2q3r n ASP 241 Ca 0.05 -2.18 -0.53 0.00 -0.50 0.00 0.00 54.79 51.63 2q3r n ASP 241 Cb 0.63 -0.26 -0.06 0.00 -1.14 0.00 0.00 41.12 40.28 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 -0.02 2.04 -3.37 2.11 9.36 -1.26 -1.49 117.16 124.53 2q3r n TYR 242 Ca 0.04 0.32 -0.19 0.00 3.32 0.00 0.00 57.90 61.39 2q3r n TYR 242 Cb 0.83 -2.54 0.06 0.00 -0.63 0.00 0.00 39.34 37.07 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 6.40 -2.48 -1.53 2.98 2.81 -1.26 -2.51 117.12 121.53 2q3r n MET 243 Ca 0.29 0.78 -0.18 0.00 -1.81 0.00 0.00 57.70 56.77 2q3r n MET 243 Cb 0.20 -5.47 -0.08 0.00 -0.71 0.00 0.00 33.22 27.16 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 -3.53 -1.45 0.00 0.03 -0.58 -0.56 -4.82 120.64 109.73 2q3r n GLU 244 Ca -0.10 1.14 0.14 0.00 -0.42 0.00 0.00 57.16 57.92 2q3r n GLU 244 Cb 0.62 -5.51 0.79 0.00 -0.57 0.00 0.00 31.44 26.77 2q3r n GLU 244 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2q3r n SER 245 N -1.23 0.00 -4.74 1.62 3.41 -1.00 -4.68 113.62 107.00 2q3r n SER 245 Ca -0.18 -0.55 -0.42 0.00 -0.26 0.00 0.00 58.87 57.46 2q3r n SER 245 Cb 0.65 -0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 64.44 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 -2.26 2.01 0.09 5.00 0.00 -1.02 -4.56 107.32 106.58 2q3r s GLY 246 Ca 0.36 1.39 0.01 0.00 0.00 0.00 0.00 44.72 46.48 2q3r s GLY 246 CO 0.38 2.46 0.24 -0.35 0.00 0.00 0.00 173.10 175.82 2q3r s ASP 247 N 0.66 6.35 0.00 1.64 -1.08 -1.26 -4.28 116.67 118.69 2q3r s ASP 247 Ca 0.64 0.23 0.23 0.00 -0.52 0.00 0.00 52.55 53.13 2q3r s ASP 247 Cb -0.44 -1.94 1.22 0.00 -1.46 0.00 0.00 42.92 40.31 2q3r s ASP 247 CO 0.40 0.13 1.74 0.35 0.52 0.00 0.00 175.17 178.31 2q3r n THR 248 N -0.02 0.20 -2.81 1.71 -2.24 -1.26 -3.97 114.28 105.89 2q3r n THR 248 Ca -0.06 0.05 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 2q3r n THR 248 Cb 0.52 -0.68 0.02 0.00 -2.10 0.00 0.00 70.33 68.09 2q3r n THR 248 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2q3r n ASN 249 N -1.19 -2.76 0.02 3.42 2.85 -1.26 -5.01 115.26 111.33 2q3r n ASN 249 Ca 0.13 -3.12 -0.02 0.00 -0.11 0.00 0.00 54.58 51.46 2q3r n ASN 249 Cb 0.14 1.55 0.24 0.00 1.24 0.00 0.00 39.78 42.95 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 4.36 0.46 -0.44 1.20 0.13 -1.78 -2.73 132.00 133.20 2q3r h PRO 250 Ca -0.06 -0.15 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 2q3r h PRO 250 Cb 1.04 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.11 2q3r h PRO 250 CO 0.25 0.64 0.27 0.78 -0.23 0.00 0.00 178.00 179.71 2q3r h GLY 251 N 0.97 0.63 0.92 1.56 0.00 -1.95 -0.94 103.07 104.26 2q3r h GLY 251 Ca 0.07 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 2q3r h GLY 251 CO 0.04 0.24 -0.11 0.00 0.00 0.00 0.00 176.54 176.71 2q3r h ALA 252 N 1.14 0.45 -0.01 3.60 0.00 -1.98 -1.79 119.26 120.67 2q3r h ALA 252 Ca 0.16 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.78 2q3r h ALA 252 Cb -0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2q3r h ALA 252 CO -0.03 0.32 -0.12 1.25 0.00 0.00 0.00 179.25 180.67 2q3r h LEU 253 N 0.42 -0.35 0.36 0.00 5.85 -1.38 0.08 115.31 120.30 2q3r h LEU 253 Ca 0.08 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2q3r h LEU 253 Cb 0.62 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 2q3r h LEU 253 CO 0.04 -0.17 -0.21 1.23 -0.34 0.00 0.00 178.44 178.99 2q3r h GLY 254 N -0.20 -0.56 0.97 3.75 0.00 -1.09 -1.46 103.07 104.47 2q3r h GLY 254 Ca 0.05 0.23 0.02 0.00 0.00 0.00 0.00 47.33 47.62 2q3r h GLY 254 CO -0.12 -0.21 0.50 -2.00 0.00 0.00 0.00 176.54 174.70 2q3r h LEU 255 N -0.54 0.85 -0.38 3.11 5.85 -1.26 0.44 115.31 123.39 2q3r h LEU 255 Ca -0.04 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 2q3r h LEU 255 Cb 0.44 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2q3r h LEU 255 CO 0.05 0.61 0.23 0.22 -0.34 0.00 0.00 178.44 179.21 2q3r h TYR 256 N 1.01 0.50 -0.28 1.25 3.20 -0.81 -1.33 116.97 120.51 2q3r h TYR 256 Ca 0.29 -0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.98 2q3r h TYR 256 Cb -0.08 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.03 2q3r h TYR 256 CO -0.02 0.36 -0.49 0.52 -1.64 0.00 0.00 178.16 176.89 2q3r h MET 257 N 0.49 0.82 0.00 1.82 2.86 -0.92 0.14 114.93 120.14 2q3r h MET 257 Ca 0.14 -0.52 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 2q3r h MET 257 Cb 0.01 0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.73 2q3r h MET 257 CO -0.02 1.15 0.00 0.00 1.06 0.00 0.00 176.91 179.09 2q3r n ALA 258 N -2.55 1.63 -0.10 6.32 0.00 0.15 -1.06 120.51 124.89 2q3r n ALA 258 Ca -0.05 -0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.21 2q3r n ALA 258 Cb 0.60 -1.22 -0.11 0.00 0.00 0.00 0.00 19.45 18.72 2q3r n ALA 258 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2q3r n GLU 259 N -1.47 0.68 0.11 0.00 0.00 -0.52 -3.03 120.64 116.41 2q3r n GLU 259 Ca 0.04 0.10 -0.03 0.00 0.00 0.00 0.00 57.16 57.27 2q3r n GLU 259 Cb 0.15 -1.44 0.17 0.00 0.00 0.00 0.00 31.44 30.32 2q3r n GLU 259 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 2q3r h SER 260 N 0.00 0.15 0.04 4.31 0.02 -0.28 -3.30 113.55 114.49 2q3r h SER 260 Ca -0.48 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.38 2q3r h SER 260 Cb 1.82 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 64.32 2q3r h SER 260 CO -0.06 0.69 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.23 2q3r h LEU 261 N 0.10 -0.05 -1.84 5.07 3.38 -1.33 -3.24 115.31 117.40 2q3r h LEU 261 Ca -0.00 -0.63 0.31 0.00 0.09 0.00 0.00 57.88 57.65 2q3r h LEU 261 Cb 1.04 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 2q3r h LEU 261 CO 0.08 0.69 0.89 -1.13 0.09 0.00 0.00 178.44 179.06 2q3r h ASN 262 N -0.87 0.00 -0.84 -0.43 -1.24 -1.73 1.59 115.58 112.05 2q3r h ASN 262 Ca -0.01 0.00 0.09 0.00 0.71 0.00 0.00 56.30 57.09 2q3r h ASN 262 Cb 0.68 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 39.66 2q3r h ASN 262 CO 0.01 0.00 0.50 0.50 -1.29 0.00 0.00 177.43 177.15 2q3r h LYS 263 N 0.00 0.82 0.00 6.67 3.64 -1.63 -0.07 116.57 125.99 2q3r h LYS 263 Ca 0.51 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.84 2q3r h LYS 263 Cb 2.29 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.92 2q3r h LYS 263 CO -0.01 0.54 0.00 0.66 -2.27 0.00 0.00 179.45 178.38 2q3r n TYR 264 N -4.71 0.00 -3.49 1.91 4.02 0.54 -4.91 117.16 110.53 2q3r n TYR 264 Ca 0.14 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.84 2q3r n TYR 264 Cb 0.26 -0.25 0.07 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 0.35 -0.43 3.95 2.72 0.00 -0.04 -4.97 105.19 106.76 2q3r n GLY 265 Ca 0.10 0.16 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.44 2.98 0.00 -0.61 -4.36 -1.26 -4.56 121.20 109.95 2q3r s ILE 266 Ca 0.05 -0.45 -0.01 0.00 -0.26 0.00 0.00 60.65 59.98 2q3r s ILE 266 Cb -0.01 -3.16 -0.01 0.00 1.25 0.00 0.00 42.46 40.54 2q3r s ILE 266 CO 0.75 -0.13 1.02 0.25 0.24 0.00 0.00 174.94 177.08 2q3r h LEU 267 N -0.05 -0.06 -8.70 0.37 5.85 -1.41 -3.44 115.31 107.88 2q3r h LEU 267 Ca -0.44 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.00 2q3r h LEU 267 Cb 1.29 0.02 -0.15 0.00 0.37 0.00 0.00 40.66 42.19 2q3r h LEU 267 CO 0.56 -0.03 -0.63 -0.72 -0.34 0.00 0.00 178.44 177.28 2q3r s TYR 268 N -3.12 1.28 -0.14 1.25 -0.85 -1.22 -1.89 117.35 112.67 2q3r s TYR 268 Ca -0.01 -1.19 -0.01 0.00 -0.52 0.00 0.00 57.07 55.35 2q3r s TYR 268 Cb 0.00 -0.72 0.04 0.00 0.38 0.00 0.00 41.96 41.66 2q3r s TYR 268 CO 0.02 -0.39 -0.05 0.00 -1.52 0.00 0.00 175.55 173.62 2q3r s HIS 270 N 1.72 3.01 0.04 0.00 5.04 -0.62 0.16 115.29 124.64 2q3r s HIS 270 Ca 0.03 -0.79 0.06 0.00 -1.54 0.00 0.00 55.06 52.82 2q3r s HIS 270 Cb -0.14 -2.15 -0.02 0.00 0.04 0.00 0.00 32.58 30.30 2q3r s HIS 270 CO -0.08 -0.49 -0.18 0.08 -2.34 0.00 0.00 174.74 171.73 2q3r s VAL 271 N 1.52 1.45 -0.26 0.89 1.01 0.18 0.11 120.40 125.31 2q3r s VAL 271 Ca 0.06 -1.14 -0.13 0.00 0.00 0.00 0.00 61.98 60.77 2q3r s VAL 271 Cb -0.15 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 2q3r s VAL 271 CO -0.01 0.11 0.29 -0.63 0.00 0.00 0.00 175.10 174.86 2q3r s ILE 272 N -0.84 5.25 0.60 2.22 1.01 -0.15 -1.35 121.20 127.94 2q3r s ILE 272 Ca 0.05 0.41 -0.18 0.00 0.00 0.00 0.00 60.65 60.94 2q3r s ILE 272 Cb -0.08 -3.62 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 2q3r s ILE 272 CO 0.02 0.23 1.14 -0.70 0.00 0.00 0.00 174.94 175.62 2q3r s GLU 273 N 1.71 3.05 0.53 2.79 2.56 -0.94 -4.74 118.70 123.66 2q3r s GLU 273 Ca 0.12 1.57 -0.22 0.00 0.00 0.00 0.00 54.97 56.44 2q3r s GLU 273 Cb -0.15 -1.97 -0.06 0.00 2.00 0.00 0.00 34.13 33.95 2q3r s GLU 273 CO 0.09 -1.08 1.37 0.00 -0.56 0.00 0.00 175.26 175.07 2q3r s ALA 274 N -1.96 2.90 -0.60 6.30 0.00 -1.26 -4.72 121.76 122.43 2q3r s ALA 274 Ca 0.71 1.35 -0.41 0.00 0.00 0.00 0.00 51.96 53.62 2q3r s ALA 274 Cb -0.24 -3.57 -0.19 0.00 0.00 0.00 0.00 23.12 19.12 2q3r s ALA 274 CO 0.34 -1.33 2.26 -2.13 0.00 0.00 0.00 175.76 174.90 2q3r n ARG 275 N -0.86 0.06 -4.11 0.00 0.63 -1.26 -5.11 116.66 106.01 2q3r n ARG 275 Ca 0.09 0.01 -0.23 0.00 -0.92 0.00 0.00 57.85 56.81 2q3r n ARG 275 Cb 0.44 -1.56 -0.05 0.00 0.45 0.00 0.00 32.46 31.75 2q3r n ARG 275 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2q3r s MET 276 N 6.65 2.92 -0.06 -0.14 0.23 -1.26 -5.21 119.30 122.43 2q3r s MET 276 Ca 1.23 -1.02 -0.30 0.00 -1.03 0.00 0.00 55.69 54.57 2q3r s MET 276 Cb -1.41 -2.58 -0.04 0.00 -1.53 0.00 0.00 34.83 29.28 2q3r s MET 276 CO 0.61 0.42 1.29 -1.58 -2.03 0.00 0.00 175.02 173.74 2q3r s HIS 287 N -2.06 2.97 0.00 3.16 5.65 -1.26 -4.99 115.29 118.76 2q3r s HIS 287 Ca 0.32 1.01 0.00 0.00 0.25 0.00 0.00 55.06 56.64 2q3r s HIS 287 Cb -0.08 -3.53 0.00 0.00 -1.18 0.00 0.00 32.58 27.78 2q3r s HIS 287 CO 0.25 -1.86 0.00 -2.37 -0.65 0.00 0.00 174.74 170.11 2q3r n THR 288 N 4.81 0.00 0.01 0.89 5.66 -1.26 -4.87 114.28 119.51 2q3r n THR 288 Ca 0.12 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.98 2q3r n THR 288 Cb 0.45 -0.86 -0.03 0.00 -1.55 0.00 0.00 70.33 68.33 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 0.76 -0.56 1.09 4.07 -2.00 -3.34 115.31 115.33 2q3r h LEU 289 Ca 0.00 -0.50 0.09 0.00 0.08 0.00 0.00 57.88 57.55 2q3r h LEU 289 Cb 0.00 -0.22 -0.07 0.00 1.08 0.00 0.00 40.66 41.45 2q3r h LEU 289 CO 0.00 1.28 0.18 0.24 -1.08 0.00 0.00 178.44 179.05 2q3r h MET 290 N 0.43 0.33 -0.79 1.13 2.86 -1.96 0.39 114.93 117.32 2q3r h MET 290 Ca -0.05 -0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.67 2q3r h MET 290 Cb 1.37 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 32.91 2q3r h MET 290 CO 0.15 0.22 0.51 -1.35 1.06 0.00 0.00 176.91 177.50 2q3r h PRO 291 N 0.34 0.71 -0.19 -0.22 0.11 -1.90 0.73 132.00 131.58 2q3r h PRO 291 Ca 0.28 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.23 2q3r h PRO 291 Cb 0.35 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.30 2q3r h PRO 291 CO -0.31 0.47 -0.35 0.52 -0.21 0.00 0.00 178.00 178.13 2q3r h MET 292 N 0.73 0.58 -0.15 1.05 2.86 -1.18 -1.97 114.93 116.86 2q3r h MET 292 Ca 0.36 -0.36 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2q3r h MET 292 Cb 0.43 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 2q3r h MET 292 CO -0.14 0.97 0.10 -0.09 1.06 0.00 0.00 176.91 178.81 2q3r h ARG 293 N 0.24 0.20 -0.23 1.72 9.65 0.11 -0.91 114.38 125.17 2q3r h ARG 293 Ca 0.01 -0.01 0.02 0.00 -1.10 0.00 0.00 59.98 58.90 2q3r h ARG 293 Cb 0.94 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.45 2q3r h ARG 293 CO 0.08 0.15 0.07 0.87 2.80 0.00 0.00 179.97 183.94 2q3r h LYS 294 N 0.19 0.17 0.00 0.20 1.79 0.43 -2.50 116.57 116.84 2q3r h LYS 294 Ca 0.05 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.48 2q3r h LYS 294 Cb -0.00 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.60 2q3r h LYS 294 CO -0.01 0.11 -0.16 0.00 -1.08 0.00 0.00 179.45 178.31 2q3r h ALA 295 N 1.15 1.62 -2.63 3.86 0.00 -1.13 -3.40 119.26 118.72 2q3r h ALA 295 Ca 0.10 -0.15 -0.64 0.00 0.00 0.00 0.00 54.91 54.22 2q3r h ALA 295 Cb 0.07 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 17.69 2q3r h ALA 295 CO -0.11 0.20 -0.21 0.12 0.00 0.00 0.00 179.25 179.25 2q3r s PHE 296 N -4.57 3.22 -0.35 0.00 5.36 -0.37 -4.64 117.98 116.64 2q3r s PHE 296 Ca -0.04 0.26 0.21 0.00 -0.96 0.00 0.00 56.93 56.40 2q3r s PHE 296 Cb 0.15 -2.67 0.24 0.00 -0.34 0.00 0.00 43.02 40.40 2q3r s PHE 296 CO 0.67 -0.34 1.51 -0.22 -1.46 0.00 0.00 175.22 175.38 2q3r h LYS 297 N 8.30 0.00 0.00 10.12 3.11 -1.79 -3.45 116.57 132.86 2q3r h LYS 297 Ca -0.30 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 57.48 2q3r h LYS 297 Cb 1.15 0.00 0.02 0.00 -1.00 0.00 0.00 32.23 32.40 2q3r h LYS 297 CO 0.68 0.14 0.06 0.41 -2.81 0.00 0.00 179.45 177.92 2q3r n GLY 298 N 1.14 -1.17 3.70 5.01 0.00 -1.26 -5.00 105.19 107.61 2q3r n GLY 298 Ca 0.03 -1.68 -0.37 0.00 0.00 0.00 0.00 46.02 44.00 2q3r n GLY 298 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2q3r n THR 299 N -2.24 4.45 -4.32 2.61 -1.04 -0.79 -4.80 114.28 108.14 2q3r n THR 299 Ca 0.02 -0.50 -0.23 0.00 -2.04 0.00 0.00 64.05 61.30 2q3r n THR 299 Cb 0.08 -1.41 -0.17 0.00 -1.82 0.00 0.00 70.33 67.01 2q3r n THR 299 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 2q3r s PHE 300 N -1.41 1.21 -0.06 -1.42 5.36 -1.26 0.34 117.98 120.74 2q3r s PHE 300 Ca 0.79 -0.45 0.05 0.00 -0.96 0.00 0.00 56.93 56.37 2q3r s PHE 300 Cb -0.40 -0.95 -0.01 0.00 -0.34 0.00 0.00 43.02 41.31 2q3r s PHE 300 CO 0.43 -0.29 -0.22 0.42 -1.46 0.00 0.00 175.22 174.11 2q3r s ILE 301 N 0.94 2.33 0.17 3.12 1.01 0.42 -2.33 121.20 126.86 2q3r s ILE 301 Ca -0.10 -0.97 0.09 0.00 0.00 0.00 0.00 60.65 59.67 2q3r s ILE 301 Cb -0.15 -1.87 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 2q3r s ILE 301 CO 0.01 0.57 -0.19 -0.44 0.00 0.00 0.00 174.94 174.89 2q3r s SER 302 N -0.26 2.73 0.25 3.58 0.01 -1.02 0.49 113.70 119.48 2q3r s SER 302 Ca -0.00 -0.86 -0.18 0.00 1.31 0.00 0.00 55.95 56.21 2q3r s SER 302 Cb -0.13 -0.16 0.02 0.00 0.21 0.00 0.00 66.02 65.95 2q3r s SER 302 CO 0.03 -0.03 0.60 0.00 0.41 0.00 0.00 173.24 174.25 2q3r s ALA 303 N -2.03 -0.88 0.00 1.44 0.00 -0.46 -0.24 121.76 119.59 2q3r s ALA 303 Ca 0.16 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 51.69 2q3r s ALA 303 Cb -0.06 0.92 0.00 0.00 0.00 0.00 0.00 23.12 23.98 2q3r s ALA 303 CO 0.07 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.31 2q3r n GLY 304 N -0.41 1.14 2.50 0.00 0.00 -1.24 -2.22 105.19 104.96 2q3r n GLY 304 Ca -0.05 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.22 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 0.34 0.31 3.76 -0.02 0.00 -1.26 -4.83 105.19 103.49 2q3r n GLY 305 Ca 0.00 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.55 2.90 0.42 1.61 0.40 -1.26 -5.01 117.98 115.47 2q3r s PHE 306 Ca 0.00 1.15 0.08 0.00 -0.60 0.00 0.00 56.93 57.56 2q3r s PHE 306 Cb 0.00 -3.85 0.00 0.00 0.51 0.00 0.00 43.02 39.68 2q3r s PHE 306 CO 0.00 -2.60 0.53 0.95 0.70 0.00 0.00 175.22 174.79 2q3r s THR 307 N -0.61 2.98 0.09 0.64 -4.23 -1.26 -4.94 115.64 108.31 2q3r s THR 307 Ca 0.55 -1.07 -0.32 0.00 -1.18 0.00 0.00 61.69 59.67 2q3r s THR 307 Cb -0.43 -3.02 -0.14 0.00 1.34 0.00 0.00 72.50 70.25 2q3r s THR 307 CO 0.51 -0.01 1.61 -0.09 -0.54 0.00 0.00 174.62 176.10 2q3r h ARG 308 N 0.73 -0.76 -0.57 3.99 2.43 -1.98 0.18 114.38 118.40 2q3r h ARG 308 Ca -0.41 0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 58.77 2q3r h ARG 308 Cb 1.28 0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.97 2q3r h ARG 308 CO 0.48 -0.50 0.17 0.93 -1.51 0.00 0.00 179.97 179.53 2q3r h GLU 309 N -0.79 0.90 -0.21 0.20 3.07 -1.98 0.21 114.58 115.98 2q3r h GLU 309 Ca -0.03 -0.20 0.06 0.00 -0.50 0.00 0.00 59.36 58.69 2q3r h GLU 309 Cb 0.69 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 2q3r h GLU 309 CO -0.04 0.82 0.15 0.22 -1.40 0.00 0.00 179.01 178.76 2q3r h ASP 310 N 0.81 0.00 0.06 1.42 3.58 -1.92 0.26 116.42 120.63 2q3r h ASP 310 Ca 0.18 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.55 2q3r h ASP 310 Cb 0.30 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.36 2q3r h ASP 310 CO -0.00 0.00 -0.38 1.23 -2.88 0.00 0.00 179.24 177.21 2q3r h GLY 311 N 0.00 0.16 0.68 -0.78 0.00 0.54 -1.65 103.07 102.01 2q3r h GLY 311 Ca 0.10 -0.40 0.04 0.00 0.00 0.00 0.00 47.33 47.07 2q3r h GLY 311 CO -0.00 0.35 0.07 3.43 0.00 0.00 0.00 176.54 180.39 2q3r h ASN 312 N -0.72 0.05 -0.26 0.19 2.35 -0.02 0.18 115.58 117.35 2q3r h ASN 312 Ca -0.07 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 2q3r h ASN 312 Cb 1.29 0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.70 2q3r h ASN 312 CO 0.07 0.06 0.09 -0.08 -1.65 0.00 0.00 177.43 175.92 2q3r h GLU 313 N 0.19 0.46 -0.34 0.81 4.57 -0.60 -1.35 114.58 118.32 2q3r h GLU 313 Ca 0.14 -0.06 -0.15 0.00 -1.18 0.00 0.00 59.36 58.10 2q3r h GLU 313 Cb 0.14 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 2q3r h GLU 313 CO -0.17 0.42 -0.39 0.00 -1.18 0.00 0.00 179.01 177.69 2q3r h ALA 314 N 1.65 0.66 0.28 2.92 0.00 -0.06 -2.59 119.26 122.12 2q3r h ALA 314 Ca 0.11 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2q3r h ALA 314 Cb 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2q3r h ALA 314 CO -0.01 0.67 -0.13 0.28 0.00 0.00 0.00 179.25 180.06 2q3r h VAL 315 N 0.68 0.41 -1.01 0.00 2.07 -0.13 0.12 116.25 118.39 2q3r h VAL 315 Ca 0.06 -0.86 0.17 0.00 0.82 0.00 0.00 66.70 66.89 2q3r h VAL 315 Cb 0.96 0.69 -0.10 0.00 -1.52 0.00 0.00 31.29 31.31 2q3r h VAL 315 CO 0.09 0.10 0.62 0.77 0.02 0.00 0.00 177.57 179.17 2q3r h SER 316 N -1.00 0.82 -0.12 0.57 4.64 -1.37 0.59 113.55 117.69 2q3r h SER 316 Ca -0.04 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2q3r h SER 316 Cb 0.46 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2q3r h SER 316 CO 0.06 0.33 0.00 0.29 -0.87 0.00 0.00 176.83 176.64 2q3r n LYS 317 N -4.73 1.60 -1.20 4.77 4.76 -0.97 -4.86 118.16 117.52 2q3r n LYS 317 Ca 0.22 -0.57 -0.07 0.00 -2.87 0.00 0.00 58.31 55.02 2q3r n LYS 317 Cb 0.52 -1.45 -0.03 0.00 -1.84 0.00 0.00 35.03 32.23 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 0.35 0.85 0.18 0.72 0.00 0.20 -4.91 105.19 102.58 2q3r n GLY 318 Ca 0.05 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 2q3r n GLY 318 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2q3r h ARG 319 N 0.18 0.53 -4.87 1.61 2.47 -0.93 -3.47 114.38 109.90 2q3r h ARG 319 Ca -0.14 -0.21 -0.44 0.00 -1.26 0.00 0.00 59.98 57.93 2q3r h ARG 319 Cb 0.68 -0.03 -0.13 0.00 -1.65 0.00 0.00 29.97 28.83 2q3r h ARG 319 CO 0.21 0.74 -0.51 0.95 0.56 0.00 0.00 179.97 181.92 2q3r s THR 320 N -4.76 0.06 -0.01 2.04 -4.23 -0.96 -5.01 115.64 102.77 2q3r s THR 320 Ca -0.13 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.42 2q3r s THR 320 Cb 0.08 -2.49 -0.07 0.00 1.34 0.00 0.00 72.50 71.36 2q3r s THR 320 CO 0.77 0.00 0.08 0.47 -0.54 0.00 0.00 174.62 175.41 2q3r n ASP 321 N -1.32 3.97 -3.81 3.99 8.00 -0.98 -4.56 116.55 121.84 2q3r n ASP 321 Ca 0.05 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.44 2q3r n ASP 321 Cb 0.63 1.10 -0.09 0.00 -0.02 0.00 0.00 41.12 42.75 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 -3.48 1.17 -0.05 0.64 1.43 -1.09 -4.66 118.68 112.64 2q3r s LEU 322 Ca -0.02 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 2q3r s LEU 322 Cb 0.03 1.04 0.01 0.00 0.03 0.00 0.00 46.19 47.30 2q3r s LEU 322 CO 0.18 -0.47 -0.12 -0.69 0.23 0.00 0.00 176.35 175.49 2q3r s VAL 323 N -1.78 1.05 -0.24 -1.59 1.01 -0.29 -2.44 120.40 116.11 2q3r s VAL 323 Ca -0.11 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.33 2q3r s VAL 323 Cb -0.04 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 2q3r s VAL 323 CO 0.01 0.33 0.12 0.00 0.00 0.00 0.00 175.10 175.55 2q3r s ALA 324 N 0.50 3.40 -0.23 5.51 0.00 0.66 0.55 121.76 132.16 2q3r s ALA 324 Ca -0.11 -0.99 -0.05 0.00 0.00 0.00 0.00 51.96 50.82 2q3r s ALA 324 Cb -0.14 -2.19 -0.01 0.00 0.00 0.00 0.00 23.12 20.78 2q3r s ALA 324 CO 0.03 -0.29 -0.01 0.71 0.00 0.00 0.00 175.76 176.19 2q3r s TYR 325 N 1.26 2.99 0.00 0.00 2.02 0.24 -3.73 117.35 120.13 2q3r s TYR 325 Ca 0.06 -0.79 0.00 0.00 -0.37 0.00 0.00 57.07 55.97 2q3r s TYR 325 Cb -0.14 -2.14 0.00 0.00 -0.40 0.00 0.00 41.96 39.27 2q3r s TYR 325 CO 0.05 -0.49 0.00 0.41 -1.57 0.00 0.00 175.55 173.95 2q3r n GLY 326 N 4.83 1.13 0.29 0.71 0.00 -1.26 0.80 105.19 111.69 2q3r n GLY 326 Ca -0.18 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.22 -0.81 1.61 3.08 -1.97 -0.74 114.38 115.34 2q3r h ARG 327 Ca 0.00 0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.24 2q3r h ARG 327 Cb 0.00 0.05 -0.11 0.00 0.08 0.00 0.00 29.97 29.99 2q3r h ARG 327 CO 0.00 -0.15 0.29 -1.49 -1.07 0.00 0.00 179.97 177.56 2q3r h TRP 328 N -0.23 0.48 -0.01 3.04 -0.00 -1.96 0.20 115.95 117.47 2q3r h TRP 328 Ca 0.16 0.04 -0.15 0.00 -0.00 0.00 0.00 58.89 58.94 2q3r h TRP 328 Cb 0.48 -0.09 -0.02 0.00 -0.00 0.00 0.00 29.16 29.54 2q3r h TRP 328 CO -0.45 -0.03 -0.71 0.35 -0.00 0.00 0.00 178.44 177.60 2q3r h PHE 329 N 0.37 0.10 -0.67 0.49 3.04 -1.55 -0.04 116.94 118.69 2q3r h PHE 329 Ca 0.47 -0.05 0.04 0.00 3.98 0.00 0.00 57.97 62.42 2q3r h PHE 329 Cb 0.82 -0.02 -0.05 0.00 2.56 0.00 0.00 35.95 39.27 2q3r h PHE 329 CO -0.19 0.75 0.40 1.25 -2.02 0.00 0.00 178.31 178.50 2q3r h LEU 330 N 0.05 0.64 -0.07 0.59 6.46 0.74 -2.57 115.31 121.16 2q3r h LEU 330 Ca -0.01 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2q3r h LEU 330 Cb 1.25 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.06 2q3r h LEU 330 CO 0.10 0.43 -0.32 0.00 -0.62 0.00 0.00 178.44 178.03 2q3r n ALA 331 N -2.32 3.14 -3.73 1.25 0.00 0.14 -4.70 120.51 114.29 2q3r n ALA 331 Ca 0.07 -0.29 -0.30 0.00 0.00 0.00 0.00 53.44 52.93 2q3r n ALA 331 Cb 0.12 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.20 2q3r n ALA 331 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2q3r s ASN 332 N -2.90 3.92 0.42 0.00 0.01 -0.06 -4.47 114.94 111.86 2q3r s ASN 332 Ca 0.15 -1.95 0.15 0.00 -0.71 0.00 0.00 52.86 50.50 2q3r s ASN 332 Cb 0.18 -0.93 1.01 0.00 0.41 0.00 0.00 41.25 41.93 2q3r s ASN 332 CO 0.62 -0.37 1.91 1.55 -1.51 0.00 0.00 177.10 179.30 2q3r h PRO 333 N 7.66 0.45 -0.93 -0.60 0.13 -1.81 -0.69 132.00 136.21 2q3r h PRO 333 Ca -0.09 -0.03 -0.63 0.00 -0.87 0.00 0.00 66.00 64.39 2q3r h PRO 333 Cb 0.99 -0.10 -0.31 0.00 0.13 0.00 0.00 31.00 31.70 2q3r h PRO 333 CO 0.47 0.29 0.48 -0.40 -0.23 0.00 0.00 178.00 178.61 2q3r n ASP 334 N -4.49 6.71 -0.32 1.44 3.85 -1.26 -4.06 116.55 118.42 2q3r n ASP 334 Ca 0.15 -3.77 0.03 0.00 -0.71 0.00 0.00 54.79 50.49 2q3r n ASP 334 Cb 0.51 -0.83 0.11 0.00 -1.35 0.00 0.00 41.12 39.57 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 1.94 -0.91 0.11 -2.12 5.85 -1.46 -1.04 115.31 117.69 2q3r h LEU 335 Ca 0.55 0.27 0.01 0.00 0.84 0.00 0.00 57.88 59.56 2q3r h LEU 335 Cb 1.12 0.58 -0.03 0.00 0.37 0.00 0.00 40.66 42.70 2q3r h LEU 335 CO 1.35 -0.30 -0.19 -0.65 -0.34 0.00 0.00 178.44 178.31 2q3r h PRO 336 N -0.01 -0.36 -0.93 5.25 0.11 -1.87 -1.67 132.00 132.53 2q3r h PRO 336 Ca 0.42 0.02 0.10 0.00 0.11 0.00 0.00 66.00 66.65 2q3r h PRO 336 Cb 0.65 0.08 -0.07 0.00 0.11 0.00 0.00 31.00 31.77 2q3r h PRO 336 CO -0.92 -0.24 0.60 -0.22 -0.21 0.00 0.00 178.00 177.01 2q3r h LYS 337 N -0.37 0.91 -0.39 1.05 3.64 -1.63 0.13 116.57 119.91 2q3r h LYS 337 Ca 0.03 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2q3r h LYS 337 Cb 0.39 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 2q3r h LYS 337 CO -0.11 0.60 0.13 0.00 -2.27 0.00 0.00 179.45 177.81 2q3r h ARG 338 N 0.94 0.60 0.00 1.90 3.08 -0.89 -1.59 114.38 118.42 2q3r h ARG 338 Ca 0.44 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.34 2q3r h ARG 338 Cb 0.41 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 2q3r h ARG 338 CO -0.20 0.59 -0.09 0.74 -1.07 0.00 0.00 179.97 179.95 2q3r h PHE 339 N 0.49 0.00 -0.58 3.04 0.04 -0.21 0.94 116.94 120.66 2q3r h PHE 339 Ca 0.13 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.85 2q3r h PHE 339 Cb 0.24 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.36 2q3r h PHE 339 CO 0.01 0.09 0.18 0.37 -0.60 0.00 0.00 178.31 178.36 2q3r h GLN 340 N 0.00 0.87 -0.07 1.51 4.15 0.22 -3.07 115.11 118.71 2q3r h GLN 340 Ca -0.00 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.26 2q3r h GLN 340 Cb 0.43 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.98 2q3r h GLN 340 CO 0.01 0.75 0.00 0.28 -1.93 0.00 0.00 178.83 177.94 2q3r n VAL 341 N -4.29 0.94 -3.94 2.39 0.31 -0.82 -4.92 118.33 107.99 2q3r n VAL 341 Ca 0.05 -0.97 -0.35 0.00 -0.01 0.00 0.00 64.34 63.05 2q3r n VAL 341 Cb 0.20 0.53 0.01 0.00 -0.91 0.00 0.00 33.84 33.67 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 -0.26 -3.16 -4.92 4.52 -0.08 0.30 -4.95 116.55 108.00 2q3r n ASP 342 Ca 0.02 -1.14 -0.26 0.00 -1.51 0.00 0.00 54.79 51.90 2q3r n ASP 342 Cb 0.27 -2.53 0.01 0.00 2.34 0.00 0.00 41.12 41.21 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 -3.70 3.44 0.25 -1.67 0.00 0.29 -4.99 121.76 115.39 2q3r s ALA 343 Ca 0.33 -0.66 -0.30 0.00 0.00 0.00 0.00 51.96 51.33 2q3r s ALA 343 Cb -0.15 -2.50 -0.10 0.00 0.00 0.00 0.00 23.12 20.37 2q3r s ALA 343 CO 0.92 -0.44 1.51 -1.25 0.00 0.00 0.00 175.76 176.50 2q3r s PRO 344 N -4.75 4.21 0.24 0.00 0.04 -1.26 -4.79 135.00 128.70 2q3r s PRO 344 Ca 0.48 2.40 -0.15 0.00 0.04 0.00 0.00 61.00 63.78 2q3r s PRO 344 Cb -0.10 -3.09 -0.08 0.00 0.04 0.00 0.00 34.50 31.27 2q3r s PRO 344 CO 0.43 -0.51 0.65 -0.51 0.04 0.00 0.00 177.00 177.10 2q3r s LEU 345 N -0.22 4.21 0.76 -3.56 1.43 -1.26 -5.05 118.68 114.99 2q3r s LEU 345 Ca 0.62 1.19 -0.14 0.00 -1.03 0.00 0.00 54.13 54.77 2q3r s LEU 345 Cb -0.44 -3.70 0.05 0.00 0.03 0.00 0.00 46.19 42.13 2q3r s LEU 345 CO 0.43 -0.05 1.19 0.20 0.23 0.00 0.00 176.35 178.34 2q3r s ASN 346 N -2.03 4.08 0.15 2.29 0.01 -1.26 -4.99 114.94 113.19 2q3r s ASN 346 Ca 0.47 2.28 -0.22 0.00 -0.71 0.00 0.00 52.86 54.67 2q3r s ASN 346 Cb -0.13 -2.58 -0.08 0.00 0.41 0.00 0.00 41.25 38.88 2q3r s ASN 346 CO 0.19 -2.34 0.70 -0.54 -1.51 0.00 0.00 177.10 173.61 2q3r s LYS 347 N -4.08 4.40 -0.06 -0.60 3.01 -1.26 -4.82 119.74 116.32 2q3r s LYS 347 Ca 0.72 0.97 0.02 0.00 -1.01 0.00 0.00 55.97 56.67 2q3r s LYS 347 Cb -0.27 -3.19 -0.03 0.00 -1.01 0.00 0.00 37.83 33.33 2q3r s LYS 347 CO 0.47 0.56 -0.09 1.52 0.51 0.00 0.00 175.35 178.33 2q3r s TYR 348 N -1.20 2.87 -0.24 3.18 -0.85 -1.26 -4.92 117.35 114.93 2q3r s TYR 348 Ca 0.35 -0.03 0.01 0.00 -0.52 0.00 0.00 57.07 56.88 2q3r s TYR 348 Cb -0.21 -1.69 0.04 0.00 0.38 0.00 0.00 41.96 40.48 2q3r s TYR 348 CO 0.23 0.29 -0.11 0.34 -1.52 0.00 0.00 175.55 174.78 2q3r s ASP 349 N -0.79 4.08 0.23 -0.18 2.15 -1.26 -5.01 116.67 115.89 2q3r s ASP 349 Ca 0.12 -1.03 -0.07 0.00 0.43 0.00 0.00 52.55 52.00 2q3r s ASP 349 Cb -0.11 -1.57 0.40 0.00 -0.30 0.00 0.00 42.92 41.33 2q3r s ASP 349 CO 0.01 -0.12 1.68 0.03 -0.17 0.00 0.00 175.17 176.60 2q3r h ARG 350 N 7.90 0.22 0.00 4.34 3.08 -2.02 0.32 114.38 128.23 2q3r h ARG 350 Ca -0.31 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.73 2q3r h ARG 350 Cb 1.09 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.09 2q3r h ARG 350 CO 0.55 0.15 0.01 -2.30 -1.07 0.00 0.00 179.97 177.30 2q3r n PRO 351 N -5.19 0.00 0.00 0.04 -0.02 -1.26 -0.59 135.00 127.99 2q3r n PRO 351 Ca 0.12 0.13 0.08 0.00 -2.02 0.00 0.00 63.50 61.80 2q3r n PRO 351 Cb 0.41 -1.51 -0.01 0.00 -0.02 0.00 0.00 33.50 32.38 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 -1.10 0.00 0.00 3.45 -1.04 0.11 -3.95 114.28 111.75 2q3r n THR 352 Ca 0.00 -0.33 -0.13 0.00 -2.04 0.00 0.00 64.05 61.56 2q3r n THR 352 Cb 0.01 1.17 -0.00 0.00 -1.82 0.00 0.00 70.33 69.69 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 1.64 0.82 0.00 -1.42 0.04 -0.88 -3.31 116.94 113.83 2q3r h PHE 353 Ca 0.00 -0.33 -0.09 0.00 2.80 0.00 0.00 57.97 60.35 2q3r h PHE 353 Cb 0.52 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 2q3r h PHE 353 CO 0.00 1.12 -1.32 0.66 -0.60 0.00 0.00 178.31 178.17 2q3r n TYR 354 N -3.92 0.87 -1.52 -0.55 4.01 -1.26 -4.79 117.16 110.01 2q3r n TYR 354 Ca -0.05 0.27 -0.53 0.00 -0.16 0.00 0.00 57.90 57.43 2q3r n TYR 354 Cb 0.68 -0.98 -0.06 0.00 -0.31 0.00 0.00 39.34 38.68 2q3r n TYR 354 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2q3r n THR 355 N -2.74 0.66 -1.05 -0.72 -1.04 -1.25 -4.81 114.28 103.33 2q3r n THR 355 Ca -0.06 -0.17 -0.25 0.00 -2.04 0.00 0.00 64.05 61.54 2q3r n THR 355 Cb 0.70 -0.36 0.08 0.00 -1.82 0.00 0.00 70.33 68.93 2q3r n THR 355 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2q3r n SER 356 N 1.87 6.38 -4.68 8.00 3.41 -1.26 -4.92 113.62 122.42 2q3r n SER 356 Ca 0.18 -3.43 -0.37 0.00 -0.26 0.00 0.00 58.87 54.99 2q3r n SER 356 Cb 0.18 -0.96 -0.09 0.00 -0.26 0.00 0.00 64.21 63.08 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 -0.93 6.25 0.62 4.04 2.15 -1.26 -4.92 116.67 122.62 2q3r s ASP 357 Ca 0.49 0.28 0.23 0.00 0.43 0.00 0.00 52.55 53.98 2q3r s ASP 357 Cb 0.39 -2.15 1.02 0.00 -0.30 0.00 0.00 42.92 41.88 2q3r s ASP 357 CO 0.01 0.04 1.51 -0.65 -0.17 0.00 0.00 175.17 175.91 2q3r h PRO 358 N 7.31 0.00 0.00 4.34 0.11 -1.95 -3.16 132.00 138.65 2q3r h PRO 358 Ca -0.38 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.71 2q3r h PRO 358 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 2q3r h PRO 358 CO 0.69 0.00 -0.55 0.28 -0.21 0.00 0.00 178.00 178.22 2q3r n VAL 359 N -3.17 0.85 -1.66 3.15 0.31 -1.26 -4.71 118.33 111.84 2q3r n VAL 359 Ca 0.10 0.21 -0.49 0.00 -0.01 0.00 0.00 64.34 64.15 2q3r n VAL 359 Cb 1.00 -1.63 -0.05 0.00 -0.91 0.00 0.00 33.84 32.25 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 -3.44 0.50 -1.52 2.52 0.31 -1.20 -0.44 118.33 115.07 2q3r n VAL 360 Ca -0.04 -0.14 -0.16 0.00 -0.01 0.00 0.00 64.34 63.99 2q3r n VAL 360 Cb 0.26 -1.83 -0.07 0.00 -0.91 0.00 0.00 33.84 31.29 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 4.70 1.52 0.00 2.92 0.00 -1.26 -4.42 105.19 108.65 2q3r n GLY 361 Ca 0.25 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.61 0.00 -1.77 1.61 9.36 0.42 -4.77 117.16 119.40 2q3r n TYR 362 Ca -0.16 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.06 2q3r n TYR 362 Cb 0.54 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.25 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 -0.88 0.00 1.35 2.97 -2.24 -0.56 -4.76 114.28 110.16 2q3r n THR 363 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 2q3r n THR 363 Cb 0.02 0.35 0.40 0.00 -2.10 0.00 0.00 70.33 69.01 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 0.00 1.94 -4.74 3.42 3.85 -1.25 -4.89 116.55 114.88 2q3r n ASP 364 Ca 0.00 -1.65 -0.42 0.00 -0.71 0.00 0.00 54.79 52.02 2q3r n ASP 364 Cb 0.37 -0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.12 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 -2.00 3.00 0.30 2.11 2.02 -1.26 -4.93 117.35 116.59 2q3r s TYR 365 Ca 0.35 0.92 -0.29 0.00 -0.37 0.00 0.00 57.07 57.68 2q3r s TYR 365 Cb 0.21 -3.86 -0.10 0.00 -0.40 0.00 0.00 41.96 37.80 2q3r s TYR 365 CO 0.32 -2.91 1.31 -1.25 -1.57 0.00 0.00 175.55 171.46 2q3r s PRO 366 N -0.07 4.37 0.00 -1.71 0.04 -1.26 -4.72 135.00 131.64 2q3r s PRO 366 Ca 0.62 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.84 2q3r s PRO 366 Cb -0.43 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.01 2q3r s PRO 366 CO 0.41 -0.20 0.00 1.19 0.04 0.00 0.00 177.00 178.44 2q3r n PHE 367 N 1.28 0.00 -3.70 0.56 0.99 -1.26 -4.59 117.46 110.75 2q3r n PHE 367 Ca 0.02 0.00 -0.14 0.00 -0.00 0.00 0.00 57.45 57.33 2q3r n PHE 367 Cb 0.42 0.00 -0.09 0.00 -1.00 0.00 0.00 39.48 38.81 2q3r n PHE 367 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2q3r s LEU 368 N 0.00 0.28 0.00 4.37 1.43 -1.26 -4.97 118.68 118.53 2q3r s LEU 368 Ca 0.00 0.62 0.29 0.00 -1.03 0.00 0.00 54.13 54.02 2q3r s LEU 368 Cb 0.00 1.65 1.35 0.00 0.03 0.00 0.00 46.19 49.22 2q3r s LEU 368 CO 0.00 -0.33 1.92 -0.62 0.23 0.00 0.00 176.35 177.54