#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 4.45 0.29 2.46 1.01 -1.26 -4.95 120.40 122.40 2q3r s VAL 10 Ca 0.00 1.64 -0.05 0.00 0.00 0.00 0.00 61.98 63.57 2q3r s VAL 10 Cb 0.00 -4.45 0.45 0.00 0.00 0.00 0.00 36.38 32.38 2q3r s VAL 10 CO 0.00 -0.58 1.56 -0.65 0.00 0.00 0.00 175.10 175.43 2q3r h PRO 11 N 8.31 0.00 -0.02 2.72 0.11 -1.94 0.50 132.00 141.67 2q3r h PRO 11 Ca -0.21 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.91 2q3r h PRO 11 Cb 1.06 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2q3r h PRO 11 CO 1.05 0.00 0.02 -0.07 -0.21 0.00 0.00 178.00 178.79 2q3r h LEU 12 N 0.00 0.00 -2.09 2.35 3.38 -1.87 -1.07 115.31 116.02 2q3r h LEU 12 Ca 0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 2q3r h LEU 12 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2q3r h LEU 12 CO -1.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 177.71 2q3r n LEU 13 N -4.40 3.10 -4.78 1.67 7.99 0.17 0.21 117.00 120.96 2q3r n LEU 13 Ca -0.02 -1.56 -0.39 0.00 -0.01 0.00 0.00 56.01 54.03 2q3r n LEU 13 Cb 0.11 -0.41 -0.06 0.00 -0.11 0.00 0.00 43.42 42.96 2q3r n LEU 13 CO 0.33 0.65 0.41 0.42 -1.51 0.00 0.00 177.39 177.69 2q3r s THR 14 N -1.51 4.56 1.00 -5.08 -4.23 -0.41 -4.55 115.64 105.43 2q3r s THR 14 Ca 0.35 1.54 -0.12 0.00 -1.18 0.00 0.00 61.69 62.29 2q3r s THR 14 Cb 0.20 -4.06 0.16 0.00 1.34 0.00 0.00 72.50 70.14 2q3r s THR 14 CO 0.21 0.49 0.88 -2.65 -0.54 0.00 0.00 174.62 173.01 2q3r n PRO 15 N 1.94 -0.99 -3.65 3.99 -0.02 -1.25 -3.89 135.00 131.12 2q3r n PRO 15 Ca -0.06 -0.24 -0.09 0.00 -2.02 0.00 0.00 63.50 61.09 2q3r n PRO 15 Cb 0.50 -2.17 -0.08 0.00 -0.02 0.00 0.00 33.50 31.72 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 -2.51 -0.91 -0.20 6.00 5.04 -0.99 -4.94 117.35 118.84 2q3r s TYR 16 Ca 0.64 1.90 -0.16 0.00 -2.44 0.00 0.00 57.07 57.02 2q3r s TYR 16 Cb -0.22 0.49 -0.04 0.00 0.35 0.00 0.00 41.96 42.54 2q3r s TYR 16 CO 0.62 -0.46 0.40 0.21 -1.34 0.00 0.00 175.55 174.99 2q3r s LYS 17 N 1.32 4.17 -0.25 4.97 2.47 -1.26 -2.30 119.74 128.86 2q3r s LYS 17 Ca -0.08 0.21 0.02 0.00 -1.56 0.00 0.00 55.97 54.56 2q3r s LYS 17 Cb -0.06 -3.54 0.06 0.00 -1.46 0.00 0.00 37.83 32.83 2q3r s LYS 17 CO -0.14 -0.05 -0.09 1.41 0.16 0.00 0.00 175.35 176.63 2q3r s MET 18 N 1.36 2.04 0.00 4.03 -2.45 -0.91 -4.90 119.30 118.47 2q3r s MET 18 Ca 0.19 -1.24 0.00 0.00 -1.25 0.00 0.00 55.69 53.39 2q3r s MET 18 Cb -0.15 -2.80 0.00 0.00 1.25 0.00 0.00 34.83 33.14 2q3r s MET 18 CO 0.08 -0.58 0.00 0.41 1.05 0.00 0.00 175.02 175.98 2q3r n GLY 19 N 4.51 0.27 0.00 2.11 0.00 -1.26 -0.83 105.19 109.98 2q3r n GLY 19 Ca -0.13 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 0.00 0.00 -3.88 1.61 3.00 -1.26 -5.09 116.66 111.04 2q3r n ARG 20 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 57.85 57.49 2q3r n ARG 20 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.39 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 0.00 3.50 -0.39 -0.14 0.40 -0.01 -5.08 117.98 116.26 2q3r s PHE 21 Ca 0.00 0.43 -0.19 0.00 -0.60 0.00 0.00 56.93 56.57 2q3r s PHE 21 Cb 0.00 -2.00 0.01 0.00 0.51 0.00 0.00 43.02 41.54 2q3r s PHE 21 CO 0.00 0.57 0.54 -0.80 0.70 0.00 0.00 175.22 176.23 2q3r s ASN 22 N -0.57 6.30 -0.20 1.36 0.01 -1.26 -2.13 114.94 118.46 2q3r s ASN 22 Ca 0.12 -0.22 -0.10 0.00 -0.71 0.00 0.00 52.86 51.96 2q3r s ASN 22 Cb -0.12 -2.28 -0.05 0.00 0.41 0.00 0.00 41.25 39.22 2q3r s ASN 22 CO 0.02 -0.59 0.13 -0.76 -1.51 0.00 0.00 177.10 174.39 2q3r s LEU 23 N 2.49 4.19 0.46 0.60 1.43 -0.97 -4.75 118.68 122.12 2q3r s LEU 23 Ca 0.19 0.22 0.29 0.00 -1.03 0.00 0.00 54.13 53.81 2q3r s LEU 23 Cb -0.15 -2.08 1.07 0.00 0.03 0.00 0.00 46.19 45.06 2q3r s LEU 23 CO 0.15 0.18 1.85 0.28 0.23 0.00 0.00 176.35 179.05 2q3r h SER 24 N 6.66 0.00 -5.01 2.29 0.02 -1.18 -2.64 113.55 113.70 2q3r h SER 24 Ca -0.41 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.58 2q3r h SER 24 Cb 1.15 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.65 2q3r h SER 24 CO 0.76 0.00 0.23 -1.38 -1.14 0.00 0.00 176.83 175.29 2q3r s HIS 25 N -3.49 -0.08 -1.64 3.45 0.00 -1.26 -3.92 115.29 108.35 2q3r s HIS 25 Ca 0.03 -0.44 0.19 0.00 -3.00 0.00 0.00 55.06 51.85 2q3r s HIS 25 Cb 0.08 0.72 0.56 0.00 -4.00 0.00 0.00 32.58 29.95 2q3r s HIS 25 CO 0.54 -1.32 1.47 0.54 -1.00 0.00 0.00 174.74 174.97 2q3r n ARG 26 N -0.48 2.82 -2.77 -0.38 1.74 0.13 -4.78 116.66 112.94 2q3r n ARG 26 Ca -0.05 -2.52 -0.43 0.00 -0.77 0.00 0.00 57.85 54.08 2q3r n ARG 26 Cb 0.59 -1.51 -0.04 0.00 -1.02 0.00 0.00 32.46 30.49 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 -1.05 4.29 -0.16 1.55 1.01 -1.25 -0.08 120.40 124.70 2q3r s VAL 27 Ca 0.42 0.42 -0.12 0.00 0.00 0.00 0.00 61.98 62.70 2q3r s VAL 27 Cb 0.22 -4.59 -0.05 0.00 0.00 0.00 0.00 36.38 31.96 2q3r s VAL 27 CO 0.28 -1.19 0.22 -0.69 0.00 0.00 0.00 175.10 173.72 2q3r s VAL 28 N 4.22 5.35 -0.31 2.92 1.01 0.32 -4.56 120.40 129.35 2q3r s VAL 28 Ca 0.33 0.39 -0.29 0.00 0.00 0.00 0.00 61.98 62.42 2q3r s VAL 28 Cb -0.11 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2q3r s VAL 28 CO 0.20 0.46 1.34 -0.22 0.00 0.00 0.00 175.10 176.88 2q3r s LEU 29 N 0.09 3.85 0.55 3.92 2.96 -0.99 -1.01 118.68 128.05 2q3r s LEU 29 Ca 0.14 1.20 -0.20 0.00 -0.22 0.00 0.00 54.13 55.05 2q3r s LEU 29 Cb -0.12 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.97 2q3r s LEU 29 CO 0.03 -1.13 1.16 0.00 -1.32 0.00 0.00 176.35 175.09 2q3r s ALA 30 N 4.55 2.68 0.29 5.97 0.00 -0.56 -1.22 121.76 133.47 2q3r s ALA 30 Ca 0.58 0.90 -0.30 0.00 0.00 0.00 0.00 51.96 53.14 2q3r s ALA 30 Cb -0.17 -3.39 -0.11 0.00 0.00 0.00 0.00 23.12 19.44 2q3r s ALA 30 CO 0.25 -0.89 1.59 -1.25 0.00 0.00 0.00 175.76 175.46 2q3r s PRO 31 N -3.23 4.13 -0.26 0.00 0.04 -1.23 -4.71 135.00 129.74 2q3r s PRO 31 Ca 0.73 2.57 -0.04 0.00 0.04 0.00 0.00 61.00 64.30 2q3r s PRO 31 Cb -0.27 -3.03 0.09 0.00 0.04 0.00 0.00 34.50 31.34 2q3r s PRO 31 CO 0.30 -0.63 0.12 -0.51 0.04 0.00 0.00 177.00 176.32 2q3r s LEU 32 N -0.49 0.49 -0.09 -3.56 1.43 -1.26 -4.83 118.68 110.38 2q3r s LEU 32 Ca 0.63 -1.10 -0.29 0.00 -1.03 0.00 0.00 54.13 52.34 2q3r s LEU 32 Cb -0.48 -0.32 -0.06 0.00 0.03 0.00 0.00 46.19 45.36 2q3r s LEU 32 CO 0.48 -0.41 1.84 -0.89 0.23 0.00 0.00 176.35 177.60 2q3r s THR 33 N 2.11 3.32 -0.62 5.49 2.01 -1.26 -4.16 115.64 122.53 2q3r s THR 33 Ca 0.07 0.38 0.09 0.00 0.31 0.00 0.00 61.69 62.53 2q3r s THR 33 Cb -0.16 -3.29 -0.05 0.00 0.01 0.00 0.00 72.50 69.01 2q3r s THR 33 CO -0.29 -0.09 0.48 0.54 -0.69 0.00 0.00 174.62 174.58 2q3r n ARG 34 N 7.66 3.13 -3.74 4.92 5.12 -1.26 -4.85 116.66 127.65 2q3r n ARG 34 Ca 0.21 -0.29 -0.25 0.00 -1.93 0.00 0.00 57.85 55.58 2q3r n ARG 34 Cb 0.43 -0.98 0.02 0.00 -1.16 0.00 0.00 32.46 30.77 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 -0.72 -3.18 -0.51 5.56 6.02 -1.26 -4.50 117.38 118.79 2q3r n GLN 35 Ca 0.03 0.52 0.02 0.00 -0.01 0.00 0.00 57.00 57.56 2q3r n GLN 35 Cb 0.16 -4.71 0.03 0.00 1.02 0.00 0.00 30.24 26.74 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 -4.22 0.21 -3.14 -1.09 1.74 -1.15 -4.45 116.66 104.56 2q3r n ARG 36 Ca -0.23 -1.34 -0.42 0.00 -0.77 0.00 0.00 57.85 55.09 2q3r n ARG 36 Cb 0.65 -0.63 -0.00 0.00 -1.02 0.00 0.00 32.46 31.46 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 -0.20 5.95 -4.11 0.55 7.64 -0.24 -4.42 113.62 118.79 2q3r n SER 37 Ca 0.03 -3.32 -0.58 0.00 1.01 0.00 0.00 58.87 56.01 2q3r n SER 37 Cb 0.72 -1.24 -0.08 0.00 -1.01 0.00 0.00 64.21 62.60 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 1.62 1.29 -1.01 1.43 0.53 -1.19 0.55 117.16 120.37 2q3r n TYR 38 Ca 0.26 0.99 -0.00 0.00 -1.02 0.00 0.00 57.90 58.12 2q3r n TYR 38 Cb 0.35 -1.93 -0.00 0.00 -1.03 0.00 0.00 39.34 36.73 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 2.93 0.26 1.41 2.72 0.00 -1.26 -1.70 105.19 109.55 2q3r n GLY 39 Ca 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.54 -2.11 -4.54 1.61 5.03 0.19 -4.98 115.26 109.92 2q3r n ASN 40 Ca -0.00 0.00 -0.34 0.00 0.87 0.00 0.00 54.58 55.10 2q3r n ASN 40 Cb 0.29 -0.35 -0.11 0.00 -1.02 0.00 0.00 39.78 38.58 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 4.27 0.43 2.41 1.01 -0.69 -1.35 120.40 124.48 2q3r s VAL 41 Ca 0.00 -0.22 -0.24 0.00 0.00 0.00 0.00 61.98 61.52 2q3r s VAL 41 Cb 0.00 -2.91 -0.10 0.00 0.00 0.00 0.00 36.38 33.37 2q3r s VAL 41 CO 0.00 0.46 1.11 -2.65 0.00 0.00 0.00 175.10 174.02 2q3r n PRO 42 N 3.71 1.53 -4.13 2.72 -0.02 -1.26 -3.19 135.00 134.35 2q3r n PRO 42 Ca -0.17 0.55 -0.22 0.00 -2.02 0.00 0.00 63.50 61.63 2q3r n PRO 42 Cb 0.52 -2.18 -0.06 0.00 -0.02 0.00 0.00 33.50 31.77 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 -2.14 2.57 0.46 -0.52 -1.52 -1.26 -4.81 119.66 112.43 2q3r s GLN 43 Ca 0.63 -1.32 0.20 0.00 -1.95 0.00 0.00 55.36 52.93 2q3r s GLN 43 Cb -0.53 -2.33 1.18 0.00 -0.22 0.00 0.00 33.01 31.11 2q3r s GLN 43 CO 0.56 0.29 1.92 -1.35 -0.25 0.00 0.00 175.29 176.46 2q3r h PRO 44 N 1.61 0.27 -0.08 2.91 0.11 -1.94 -1.36 132.00 133.51 2q3r h PRO 44 Ca -0.46 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.65 2q3r h PRO 44 Cb 1.25 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2q3r h PRO 44 CO 0.61 0.18 0.01 1.12 -0.21 0.00 0.00 178.00 179.71 2q3r h HIS 45 N 0.27 0.02 -0.98 0.65 2.07 -1.95 -2.18 115.15 113.06 2q3r h HIS 45 Ca 0.37 0.01 0.30 0.00 -2.85 0.00 0.00 60.37 58.19 2q3r h HIS 45 Cb 1.04 0.00 -0.18 0.00 2.57 0.00 0.00 27.41 30.85 2q3r h HIS 45 CO -0.00 0.01 0.17 0.00 -3.07 0.00 0.00 177.93 175.03 2q3r h ALA 46 N 1.06 1.40 -0.57 6.11 0.00 -1.59 0.89 119.26 126.56 2q3r h ALA 46 Ca 0.04 0.31 0.11 0.00 0.00 0.00 0.00 54.91 55.37 2q3r h ALA 46 Cb 0.03 0.50 -0.11 0.00 0.00 0.00 0.00 17.79 18.21 2q3r h ALA 46 CO -0.05 -0.64 -0.21 0.00 0.00 0.00 0.00 179.25 178.35 2q3r h ALA 47 N 1.96 0.24 0.42 0.00 0.00 -1.47 0.31 119.26 120.72 2q3r h ALA 47 Ca 0.65 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.74 2q3r h ALA 47 Cb 1.43 0.55 0.00 0.00 0.00 0.00 0.00 17.79 19.77 2q3r h ALA 47 CO -0.85 -0.51 -0.20 0.82 0.00 0.00 0.00 179.25 178.50 2q3r h ILE 48 N -0.07 0.45 -0.80 0.00 1.08 0.61 -2.60 117.51 116.17 2q3r h ILE 48 Ca 0.26 -0.55 0.08 0.00 -0.39 0.00 0.00 64.86 64.26 2q3r h ILE 48 Cb 0.48 0.66 -0.11 0.00 -3.07 0.00 0.00 36.82 34.78 2q3r h ILE 48 CO -0.62 0.08 -0.58 0.22 -0.69 0.00 0.00 178.15 176.56 2q3r h TYR 49 N -0.93 -1.83 -0.08 1.37 3.20 0.37 0.37 116.97 119.42 2q3r h TYR 49 Ca -0.06 0.11 -0.13 0.00 3.14 0.00 0.00 58.73 61.80 2q3r h TYR 49 Cb 0.56 0.90 -0.01 0.00 1.54 0.00 0.00 36.73 39.72 2q3r h TYR 49 CO 0.02 -0.41 -0.52 1.88 -1.64 0.00 0.00 178.16 177.49 2q3r h TYR 50 N -0.13 0.27 -0.70 -3.82 0.05 -0.55 -3.03 116.97 109.06 2q3r h TYR 50 Ca 0.13 -0.09 -0.07 0.00 0.05 0.00 0.00 58.73 58.76 2q3r h TYR 50 Cb 0.47 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 2q3r h TYR 50 CO -0.93 0.69 0.18 1.03 -1.05 0.00 0.00 178.16 178.08 2q3r h SER 51 N 0.17 1.05 0.23 3.88 0.87 -0.85 -2.26 113.55 116.64 2q3r h SER 51 Ca 0.00 -0.22 -0.04 0.00 -1.23 0.00 0.00 61.79 60.31 2q3r h SER 51 Cb 0.97 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 2q3r h SER 51 CO 0.08 1.00 -0.17 1.56 -0.53 0.00 0.00 176.83 178.77 2q3r h GLN 52 N 1.06 0.00 -0.40 2.24 4.20 -0.20 -2.67 115.11 119.34 2q3r h GLN 52 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 2q3r h GLN 52 Cb 0.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.13 2q3r h GLN 52 CO -0.00 0.17 0.00 0.54 -0.67 0.00 0.00 178.83 178.87 2q3r n ARG 53 N -4.13 2.37 -3.40 1.46 1.74 -0.90 -4.44 116.66 109.36 2q3r n ARG 53 Ca -0.02 -2.08 -0.36 0.00 -0.77 0.00 0.00 57.85 54.62 2q3r n ARG 53 Cb 0.25 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.14 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 -1.48 4.90 0.09 0.55 2.01 -0.95 -4.96 115.64 115.82 2q3r s THR 54 Ca 0.38 0.82 0.03 0.00 0.31 0.00 0.00 61.69 63.24 2q3r s THR 54 Cb 0.22 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 2q3r s THR 54 CO 0.30 0.34 -0.10 0.42 -0.69 0.00 0.00 174.62 174.89 2q3r s THR 55 N -1.35 0.91 -0.45 -0.82 -4.23 -1.26 -4.98 115.64 103.46 2q3r s THR 55 Ca 0.34 -1.64 -0.31 0.00 -1.18 0.00 0.00 61.69 58.90 2q3r s THR 55 Cb -0.16 -1.35 -0.11 0.00 1.34 0.00 0.00 72.50 72.22 2q3r s THR 55 CO 0.18 -0.57 2.32 -2.65 -0.54 0.00 0.00 174.62 173.36 2q3r n PRO 56 N 0.55 1.07 -1.82 3.99 -0.02 -1.18 -0.03 135.00 137.56 2q3r n PRO 56 Ca -0.16 0.22 -0.00 0.00 -2.02 0.00 0.00 63.50 61.53 2q3r n PRO 56 Cb 0.58 -2.71 -0.00 0.00 -0.02 0.00 0.00 33.50 31.35 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 6.29 0.36 3.87 -1.23 0.00 0.63 -4.38 105.19 110.74 2q3r n GLY 57 Ca 0.42 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.98 2.32 -0.17 -0.02 0.00 0.96 -0.81 107.32 106.62 2q3r s GLY 58 Ca 0.00 -0.43 -0.17 0.00 0.00 0.00 0.00 44.72 44.12 2q3r s GLY 58 CO 0.00 -0.20 0.43 -0.12 0.00 0.00 0.00 173.10 173.21 2q3r s PHE 59 N -1.29 3.43 -0.03 1.90 5.99 -1.26 -0.32 117.98 126.41 2q3r s PHE 59 Ca 0.28 0.72 0.06 0.00 0.00 0.00 0.00 56.93 58.00 2q3r s PHE 59 Cb -0.14 -2.53 -0.01 0.00 0.00 0.00 0.00 43.02 40.34 2q3r s PHE 59 CO 0.16 0.07 -0.21 -0.51 -0.00 0.00 0.00 175.22 174.73 2q3r s LEU 60 N 1.01 2.02 -0.15 6.12 1.02 0.18 -2.35 118.68 126.51 2q3r s LEU 60 Ca 0.22 -0.40 -0.00 0.00 0.02 0.00 0.00 54.13 53.96 2q3r s LEU 60 Cb -0.15 -1.12 -0.00 0.00 0.02 0.00 0.00 46.19 44.93 2q3r s LEU 60 CO 0.08 0.24 -0.14 -0.63 0.02 0.00 0.00 176.35 175.92 2q3r s ILE 61 N -0.34 2.77 0.81 -0.59 1.01 -0.36 -0.87 121.20 123.63 2q3r s ILE 61 Ca 0.04 -0.74 -0.11 0.00 0.00 0.00 0.00 60.65 59.84 2q3r s ILE 61 Cb -0.10 -2.17 0.08 0.00 0.01 0.00 0.00 42.46 40.28 2q3r s ILE 61 CO 0.00 0.51 1.09 0.42 0.00 0.00 0.00 174.94 176.96 2q3r s THR 62 N 0.77 3.15 0.94 2.92 -4.23 0.51 -3.47 115.64 116.22 2q3r s THR 62 Ca -0.06 0.37 -0.10 0.00 -1.18 0.00 0.00 61.69 60.72 2q3r s THR 62 Cb -0.15 -2.94 0.16 0.00 1.34 0.00 0.00 72.50 70.91 2q3r s THR 62 CO 0.01 -0.49 1.13 -1.83 -0.54 0.00 0.00 174.62 172.90 2q3r s GLU 63 N -4.98 0.85 0.40 3.99 -1.05 -1.26 -3.77 118.70 112.89 2q3r s GLU 63 Ca 0.61 1.48 -0.27 0.00 -0.15 0.00 0.00 54.97 56.64 2q3r s GLU 63 Cb -0.17 -1.71 -0.10 0.00 -0.44 0.00 0.00 34.13 31.71 2q3r s GLU 63 CO 0.56 -2.72 1.44 0.00 0.95 0.00 0.00 175.26 175.49 2q3r n ALA 64 N -4.29 2.13 -3.76 -0.84 0.00 -1.26 -4.25 120.51 108.24 2q3r n ALA 64 Ca 0.11 0.31 -0.28 0.00 0.00 0.00 0.00 53.44 53.59 2q3r n ALA 64 Cb 0.52 -2.39 -0.16 0.00 0.00 0.00 0.00 19.45 17.42 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 -1.14 0.63 0.31 0.00 2.01 -1.12 -4.40 115.64 111.93 2q3r s THR 65 Ca 0.56 -0.57 -0.26 0.00 0.31 0.00 0.00 61.69 61.73 2q3r s THR 65 Cb -0.48 -1.08 -0.14 0.00 0.01 0.00 0.00 72.50 70.82 2q3r s THR 65 CO 0.62 -0.15 0.76 0.61 -0.69 0.00 0.00 174.62 175.77 2q3r n GLY 66 N 5.01 -0.97 0.08 4.40 0.00 0.23 -3.61 105.19 110.33 2q3r n GLY 66 Ca -0.09 0.24 0.09 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.18 0.54 -3.67 1.61 0.24 -1.20 0.16 118.33 115.84 2q3r n VAL 67 Ca 0.12 -0.57 -0.06 0.00 -2.04 0.00 0.00 64.34 61.79 2q3r n VAL 67 Cb 0.33 -0.30 -0.01 0.00 -1.47 0.00 0.00 33.84 32.40 2q3r n VAL 67 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2q3r n SER 68 N -2.58 -0.72 0.00 -1.34 7.64 -1.26 -4.31 113.62 111.05 2q3r n SER 68 Ca -0.04 -1.81 0.11 0.00 1.01 0.00 0.00 58.87 58.14 2q3r n SER 68 Cb 0.63 1.29 0.58 0.00 -1.01 0.00 0.00 64.21 65.70 2q3r n SER 68 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2q3r n ASP 69 N -1.72 0.00 0.00 6.43 5.68 -1.26 -3.01 116.55 122.67 2q3r n ASP 69 Ca -0.01 -0.05 0.00 0.00 -0.50 0.00 0.00 54.79 54.23 2q3r n ASP 69 Cb 0.26 -0.28 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 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 -1.28 0.31 0.23 2.12 -2.24 -1.26 -4.49 114.28 107.66 2q3r n THR 70 Ca 0.11 -0.63 0.11 0.00 -2.27 0.00 0.00 64.05 61.37 2q3r n THR 70 Cb 0.18 0.87 0.45 0.00 -2.10 0.00 0.00 70.33 69.74 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 0.00 0.99 -2.40 6.98 0.00 -1.91 -3.45 119.26 119.47 2q3r h ALA 71 Ca 0.00 -0.17 -0.49 0.00 0.00 0.00 0.00 54.91 54.24 2q3r h ALA 71 Cb 0.18 -0.03 0.07 0.00 0.00 0.00 0.00 17.79 18.01 2q3r h ALA 71 CO 0.00 0.23 0.38 -0.65 0.00 0.00 0.00 179.25 179.22 2q3r s GLN 72 N -3.58 3.25 0.00 0.00 1.11 -1.26 0.91 119.66 120.09 2q3r s GLN 72 Ca 0.01 1.32 0.00 0.00 0.01 0.00 0.00 55.36 56.71 2q3r s GLN 72 Cb 0.09 -2.02 0.00 0.00 -1.01 0.00 0.00 33.01 30.08 2q3r s GLN 72 CO 0.63 -0.88 0.68 0.41 0.01 0.00 0.00 175.29 176.14 2q3r n GLY 73 N -0.63 -0.63 0.00 3.09 0.00 -1.26 -4.70 105.19 101.07 2q3r n GLY 73 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2q3r n GLY 73 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2q3r n TYR 74 N 0.00 0.00 -4.32 1.61 4.01 -1.26 -4.42 117.16 112.78 2q3r n TYR 74 Ca 0.00 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.54 2q3r n TYR 74 Cb 0.59 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.49 2q3r n TYR 74 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2q3r s GLN 75 N 1.61 0.94 -1.53 -0.72 1.11 -1.26 -4.84 119.66 114.97 2q3r s GLN 75 Ca 0.00 -0.84 0.00 0.00 0.01 0.00 0.00 55.36 54.53 2q3r s GLN 75 Cb 0.00 -0.97 0.00 0.00 -1.01 0.00 0.00 33.01 31.03 2q3r s GLN 75 CO 0.00 0.23 0.00 -0.25 0.01 0.00 0.00 175.29 175.28 2q3r n ASP 76 N 1.70 -5.09 -4.77 5.90 8.00 -1.26 -4.70 116.55 116.32 2q3r n ASP 76 Ca -0.19 0.10 -0.37 0.00 0.71 0.00 0.00 54.79 55.04 2q3r n ASP 76 Cb 0.54 -4.29 -0.06 0.00 -0.02 0.00 0.00 41.12 37.29 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 -2.84 5.21 0.48 -3.53 -4.23 -1.26 -1.08 115.64 108.39 2q3r s THR 77 Ca 0.00 0.71 -0.24 0.00 -1.18 0.00 0.00 61.69 60.98 2q3r s THR 77 Cb 0.00 -3.68 -0.07 0.00 1.34 0.00 0.00 72.50 70.08 2q3r s THR 77 CO 0.00 0.45 1.35 -0.81 -0.54 0.00 0.00 174.62 175.07 2q3r n PRO 78 N 2.94 1.94 -3.57 3.99 -0.04 -1.26 -4.41 135.00 134.58 2q3r n PRO 78 Ca -0.12 0.70 -0.20 0.00 -0.04 0.00 0.00 63.50 63.84 2q3r n PRO 78 Cb 0.52 -2.54 -0.02 0.00 -0.04 0.00 0.00 33.50 31.42 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 -0.66 1.90 -0.20 0.55 0.00 -0.46 0.74 107.32 109.19 2q3r s GLY 79 Ca 0.65 -1.71 0.17 0.00 0.00 0.00 0.00 44.72 43.83 2q3r s GLY 79 CO 0.54 -1.58 1.17 4.51 0.00 0.00 0.00 173.10 177.75 2q3r n ILE 80 N -1.54 1.52 0.25 0.90 0.13 0.43 -4.72 119.36 116.34 2q3r n ILE 80 Ca 0.02 -2.91 0.04 0.00 -1.10 0.00 0.00 62.75 58.80 2q3r n ILE 80 Cb 0.60 0.25 -0.05 0.00 -0.84 0.00 0.00 39.64 39.60 2q3r n ILE 80 CO 0.00 0.00 0.00 -2.67 2.80 0.00 0.00 176.55 176.68 2q3r n TRP 81 N -0.49 0.00 -4.46 9.51 2.14 -1.25 -4.76 117.44 118.13 2q3r n TRP 81 Ca 0.19 0.00 -0.33 0.00 2.07 0.00 0.00 57.50 59.44 2q3r n TRP 81 Cb 0.90 -0.06 -0.10 0.00 -0.81 0.00 0.00 31.31 31.24 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 3.81 0.33 -1.67 -4.23 -1.26 -4.98 115.64 105.65 2q3r s THR 82 Ca 0.01 -0.63 0.11 0.00 -1.18 0.00 0.00 61.69 59.99 2q3r s THR 82 Cb 0.06 -2.64 0.33 0.00 1.34 0.00 0.00 72.50 71.59 2q3r s THR 82 CO 0.32 0.45 1.65 0.11 -0.54 0.00 0.00 174.62 176.62 2q3r h LYS 83 N 4.70 0.26 0.58 3.99 1.57 -2.01 0.52 116.57 126.19 2q3r h LYS 83 Ca -0.49 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.26 2q3r h LYS 83 Cb 1.17 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2q3r h LYS 83 CO 0.54 0.17 -0.44 1.49 -0.57 0.00 0.00 179.45 180.65 2q3r h GLU 84 N 0.27 -0.95 -0.96 3.15 4.81 -2.01 -2.47 114.58 116.43 2q3r h GLU 84 Ca 0.68 0.06 0.23 0.00 -0.13 0.00 0.00 59.36 60.21 2q3r h GLU 84 Cb 1.51 0.22 -0.18 0.00 0.63 0.00 0.00 28.75 30.93 2q3r h GLU 84 CO -0.64 -0.63 -0.07 0.45 -0.73 0.00 0.00 179.01 177.39 2q3r h HIS 85 N -0.98 -0.22 -0.76 0.92 3.86 -1.23 0.24 115.15 116.98 2q3r h HIS 85 Ca -0.07 0.08 0.13 0.00 -1.16 0.00 0.00 60.37 59.34 2q3r h HIS 85 Cb 0.83 0.25 -0.09 0.00 1.06 0.00 0.00 27.41 29.46 2q3r h HIS 85 CO -0.17 -0.41 0.34 0.28 0.86 0.00 0.00 177.93 178.84 2q3r h VAL 86 N 0.02 0.74 -0.03 2.45 2.07 -1.07 0.54 116.25 120.96 2q3r h VAL 86 Ca 0.53 -0.18 -0.15 0.00 0.82 0.00 0.00 66.70 67.72 2q3r h VAL 86 Cb 0.99 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2q3r h VAL 86 CO -0.92 0.10 -0.65 -0.33 0.02 0.00 0.00 177.57 175.78 2q3r h GLU 87 N 0.53 0.14 -0.60 1.57 4.39 -0.33 0.25 114.58 120.53 2q3r h GLU 87 Ca 0.40 -0.11 -0.10 0.00 0.34 0.00 0.00 59.36 59.89 2q3r h GLU 87 Cb 0.54 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 2q3r h GLU 87 CO -0.35 0.74 -0.00 0.00 -1.16 0.00 0.00 179.01 178.24 2q3r h ALA 88 N 1.23 0.82 0.00 3.43 0.00 -0.86 -3.23 119.26 120.64 2q3r h ALA 88 Ca -0.01 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2q3r h ALA 88 Cb 1.17 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2q3r h ALA 88 CO 0.09 0.66 -0.00 -1.49 0.00 0.00 0.00 179.25 178.52 2q3r h TRP 89 N 0.97 -0.00 -0.41 0.00 4.06 -0.51 -3.37 115.95 116.69 2q3r h TRP 89 Ca 0.17 -0.00 0.04 0.00 2.06 0.00 0.00 58.89 61.16 2q3r h TRP 89 Cb 0.57 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.68 2q3r h TRP 89 CO 0.04 0.53 -0.24 1.63 -3.56 0.00 0.00 178.44 176.84 2q3r n LYS 90 N -4.83 -0.18 0.29 0.49 5.02 0.86 0.10 118.16 119.91 2q3r n LYS 90 Ca -0.09 0.83 0.17 0.00 -2.02 0.00 0.00 58.31 57.20 2q3r n LYS 90 Cb 0.27 -1.23 0.94 0.00 -0.02 0.00 0.00 35.03 35.00 2q3r n LYS 90 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2q3r h PRO 91 N 0.00 0.00 -0.46 1.97 0.13 -1.72 -1.03 132.00 130.89 2q3r h PRO 91 Ca 0.06 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.07 2q3r h PRO 91 Cb 0.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.28 2q3r h PRO 91 CO -0.38 0.00 -0.21 0.82 -0.23 0.00 0.00 178.00 178.00 2q3r h ILE 92 N 0.00 1.27 -0.58 -3.56 2.04 0.51 -2.31 117.51 114.88 2q3r h ILE 92 Ca 0.01 -1.37 -0.08 0.00 1.00 0.00 0.00 64.86 64.43 2q3r h ILE 92 Cb 0.10 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 2q3r h ILE 92 CO -0.00 0.47 0.06 0.58 0.00 0.00 0.00 178.15 179.25 2q3r h VAL 93 N 0.80 1.26 -0.72 1.67 2.07 -0.61 -2.62 116.25 118.11 2q3r h VAL 93 Ca 0.11 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.53 2q3r h VAL 93 Cb 0.78 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 2q3r h VAL 93 CO 0.06 0.38 0.26 0.44 0.02 0.00 0.00 177.57 178.73 2q3r h ASP 94 N 0.88 1.02 0.25 0.57 3.32 -1.20 0.22 116.42 121.48 2q3r h ASP 94 Ca 0.17 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 2q3r h ASP 94 Cb 0.47 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2q3r h ASP 94 CO 0.02 0.93 -0.23 0.00 -1.72 0.00 0.00 179.24 178.24 2q3r h ALA 95 N 1.12 1.57 0.07 3.45 0.00 -1.29 0.54 119.26 124.73 2q3r h ALA 95 Ca 0.24 -0.21 -0.25 0.00 0.00 0.00 0.00 54.91 54.69 2q3r h ALA 95 Cb 0.26 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.03 2q3r h ALA 95 CO -0.01 0.29 -1.00 0.28 0.00 0.00 0.00 179.25 178.80 2q3r h VAL 96 N 0.00 1.34 -0.15 0.00 2.07 -1.01 -3.19 116.25 115.32 2q3r h VAL 96 Ca -0.00 -2.33 -0.15 0.00 0.82 0.00 0.00 66.70 65.04 2q3r h VAL 96 Cb 0.42 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 2q3r h VAL 96 CO 0.03 0.70 -0.54 0.45 0.02 0.00 0.00 177.57 178.23 2q3r h HIS 97 N 0.14 0.54 0.00 1.57 -0.00 -0.66 -1.60 115.15 115.13 2q3r h HIS 97 Ca -0.15 -0.19 0.00 0.00 -0.00 0.00 0.00 60.37 60.04 2q3r h HIS 97 Cb 1.70 -0.10 0.00 0.00 -0.00 0.00 0.00 27.41 29.01 2q3r h HIS 97 CO 0.13 0.88 0.00 0.00 -0.00 0.00 0.00 177.93 178.94 2q3r h ALA 98 N 1.09 1.00 -0.47 2.45 0.00 0.01 -1.14 119.26 122.20 2q3r h ALA 98 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2q3r h ALA 98 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2q3r h ALA 98 CO 0.09 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.97 2q3r n LYS 99 N -2.31 2.52 -0.64 0.00 5.02 -1.04 -4.99 118.16 116.72 2q3r n LYS 99 Ca 0.01 -2.29 0.00 0.00 -2.02 0.00 0.00 58.31 54.02 2q3r n LYS 99 Cb 0.20 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 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 1.26 0.80 3.80 0.72 0.00 -0.43 -3.13 105.19 108.21 2q3r n GLY 100 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.69 2.13 -0.29 -0.02 0.00 -0.63 -0.26 107.32 106.55 2q3r s GLY 101 Ca 0.00 0.41 -0.10 0.00 0.00 0.00 0.00 44.72 45.03 2q3r s GLY 101 CO 0.00 0.73 0.16 -0.42 0.00 0.00 0.00 173.10 173.57 2q3r s ILE 102 N -2.44 4.94 -0.29 0.90 1.09 0.57 -4.45 121.20 121.51 2q3r s ILE 102 Ca 0.64 -0.09 0.00 0.00 -1.10 0.00 0.00 60.65 60.10 2q3r s ILE 102 Cb -0.16 -3.41 0.06 0.00 -1.06 0.00 0.00 42.46 37.89 2q3r s ILE 102 CO 0.37 0.19 -0.04 0.12 -0.10 0.00 0.00 174.94 175.49 2q3r s PHE 103 N 1.69 3.30 -0.04 3.97 5.36 -1.26 -0.65 117.98 130.35 2q3r s PHE 103 Ca 0.06 -2.13 -0.02 0.00 -0.96 0.00 0.00 56.93 53.88 2q3r s PHE 103 Cb -0.16 -2.10 -0.04 0.00 -0.34 0.00 0.00 43.02 40.38 2q3r s PHE 103 CO 0.08 -0.85 0.08 -0.06 -1.46 0.00 0.00 175.22 173.01 2q3r s PHE 104 N 1.17 3.31 -0.29 10.12 0.40 -0.05 -2.11 117.98 130.53 2q3r s PHE 104 Ca -0.06 0.26 -0.10 0.00 -0.60 0.00 0.00 56.93 56.43 2q3r s PHE 104 Cb -0.20 -1.78 -0.02 0.00 0.51 0.00 0.00 43.02 41.53 2q3r s PHE 104 CO -0.03 0.56 0.15 0.00 0.70 0.00 0.00 175.22 176.60 2q3r s GLN 106 N 1.66 4.04 -0.10 0.00 0.74 -1.25 -2.01 119.66 122.74 2q3r s GLN 106 Ca 0.06 2.05 0.03 0.00 0.05 0.00 0.00 55.36 57.55 2q3r s GLN 106 Cb -0.16 -2.77 0.01 0.00 1.10 0.00 0.00 33.01 31.19 2q3r s GLN 106 CO 0.07 -0.40 -0.18 0.96 -0.55 0.00 0.00 175.29 175.19 2q3r s ILE 107 N -1.29 1.67 0.00 -2.34 -4.36 0.21 -2.81 121.20 112.28 2q3r s ILE 107 Ca 0.56 -0.77 0.00 0.00 -0.26 0.00 0.00 60.65 60.18 2q3r s ILE 107 Cb -0.36 -1.48 0.00 0.00 1.25 0.00 0.00 42.46 41.87 2q3r s ILE 107 CO 0.46 0.47 0.00 -2.67 0.24 0.00 0.00 174.94 173.44 2q3r n TRP 108 N 3.91 0.00 -3.25 1.37 4.27 -1.24 -0.69 117.44 121.82 2q3r n TRP 108 Ca -0.20 0.00 0.04 0.00 -3.89 0.00 0.00 57.50 53.45 2q3r n TRP 108 Cb 0.52 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.44 2q3r n TRP 108 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 2q3r s HIS 109 N -1.23 -0.44 0.52 -2.67 2.46 -1.26 -3.23 115.29 109.43 2q3r s HIS 109 Ca 0.00 0.64 0.32 0.00 0.47 0.00 0.00 55.06 56.49 2q3r s HIS 109 Cb 0.00 0.22 1.77 0.00 -0.13 0.00 0.00 32.58 34.44 2q3r s HIS 109 CO 0.00 -0.23 2.20 -0.39 -2.47 0.00 0.00 174.74 173.85 2q3r h VAL 110 N 5.31 0.43 0.00 0.89 -1.51 0.25 0.10 116.25 121.72 2q3r h VAL 110 Ca -0.14 -0.22 0.00 0.00 -1.23 0.00 0.00 66.70 65.11 2q3r h VAL 110 Cb 1.14 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 2q3r h VAL 110 CO 0.00 0.04 0.00 0.61 -1.23 0.00 0.00 177.57 177.00 2q3r n GLY 111 N -0.98 1.86 0.00 5.19 0.00 -1.26 -1.89 105.19 108.11 2q3r n GLY 111 Ca -0.02 -0.54 0.06 0.00 0.00 0.00 0.00 46.02 45.52 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 13.05 0.39 -2.72 1.61 1.85 -0.92 -4.12 116.66 125.80 2q3r n ARG 112 Ca 0.00 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.42 2q3r n ARG 112 Cb 0.00 -1.50 0.01 0.00 -1.05 0.00 0.00 32.46 29.92 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 -1.00 4.75 -2.94 8.89 0.31 -1.09 -4.85 118.33 122.41 2q3r n VAL 113 Ca 0.09 -5.10 0.00 0.00 -0.01 0.00 0.00 64.34 59.32 2q3r n VAL 113 Cb 0.04 -2.27 0.00 0.00 -0.91 0.00 0.00 33.84 30.70 2q3r n VAL 113 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2q3r n SER 114 N 2.93 0.00 -3.80 4.52 2.88 -1.26 -4.02 113.62 114.86 2q3r n SER 114 Ca 0.33 -0.82 -0.10 0.00 -1.33 0.00 0.00 58.87 56.96 2q3r n SER 114 Cb 0.36 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.76 2q3r n SER 114 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2q3r s ASN 115 N -0.45 -0.10 0.28 -3.46 3.84 -1.26 -3.29 114.94 110.50 2q3r s ASN 115 Ca 0.00 -0.59 0.02 0.00 0.21 0.00 0.00 52.86 52.50 2q3r s ASN 115 Cb 0.00 0.47 0.59 0.00 -0.55 0.00 0.00 41.25 41.76 2q3r s ASN 115 CO 0.00 -0.91 1.82 0.77 -2.79 0.00 0.00 177.10 175.99 2q3r h SER 116 N 2.43 0.89 -0.02 -4.21 4.64 -1.86 0.55 113.55 115.96 2q3r h SER 116 Ca -0.32 0.06 0.01 0.00 -0.47 0.00 0.00 61.79 61.07 2q3r h SER 116 Cb 1.24 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2q3r h SER 116 CO 0.46 0.44 0.03 1.23 -0.87 0.00 0.00 176.83 178.12 2q3r h GLY 117 N 0.94 0.00 0.73 -0.77 0.00 -1.88 -1.76 103.07 100.33 2q3r h GLY 117 Ca 0.51 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.58 2q3r h GLY 117 CO -0.29 0.00 -1.24 0.74 0.00 0.00 0.00 176.54 175.75 2q3r h PHE 118 N 0.00 0.58 -3.73 5.60 0.04 -1.26 -3.47 116.94 114.69 2q3r h PHE 118 Ca 0.01 -0.42 -0.51 0.00 2.80 0.00 0.00 57.97 59.85 2q3r h PHE 118 Cb 0.08 -0.02 0.02 0.00 2.20 0.00 0.00 35.95 38.22 2q3r h PHE 118 CO 0.00 1.48 0.48 -0.65 -0.60 0.00 0.00 178.31 179.03 2q3r s GLN 119 N -2.48 4.62 0.71 1.51 -1.52 -0.66 -4.97 119.66 116.86 2q3r s GLN 119 Ca -0.16 1.80 -0.16 0.00 -1.95 0.00 0.00 55.36 54.89 2q3r s GLN 119 Cb 0.03 -3.21 0.00 0.00 -0.22 0.00 0.00 33.01 29.62 2q3r s GLN 119 CO 0.82 0.16 1.03 -2.30 -0.25 0.00 0.00 175.29 174.75 2q3r n PRO 120 N 1.51 0.61 -1.09 2.91 -0.02 -1.26 -1.71 135.00 135.94 2q3r n PRO 120 Ca 0.00 0.26 -0.08 0.00 -2.02 0.00 0.00 63.50 61.66 2q3r n PRO 120 Cb 0.45 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.62 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 -1.75 -3.51 -1.28 2.55 3.02 -1.26 -0.67 115.26 112.36 2q3r n ASN 121 Ca 0.14 0.20 -0.17 0.00 -0.03 0.00 0.00 54.58 54.72 2q3r n ASN 121 Cb 0.49 -2.88 -0.07 0.00 -0.61 0.00 0.00 39.78 36.71 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 0.08 1.67 3.58 7.41 0.00 -0.70 -4.97 105.19 112.25 2q3r n GLY 122 Ca -0.08 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 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 -3.41 -0.01 0.38 1.61 1.02 0.16 -4.76 119.74 114.73 2q3r s LYS 123 Ca 0.00 1.17 -0.24 0.00 0.02 0.00 0.00 55.97 56.93 2q3r s LYS 123 Cb 0.00 -1.64 -0.10 0.00 -0.52 0.00 0.00 37.83 35.57 2q3r s LYS 123 CO 0.00 -3.21 0.97 0.00 -0.92 0.00 0.00 175.35 172.19 2q3r s ALA 124 N -2.55 3.11 0.80 5.17 0.00 -1.26 -4.32 121.76 122.70 2q3r s ALA 124 Ca 0.68 0.53 -0.14 0.00 0.00 0.00 0.00 51.96 53.03 2q3r s ALA 124 Cb -0.24 -3.20 0.08 0.00 0.00 0.00 0.00 23.12 19.76 2q3r s ALA 124 CO 0.61 0.05 1.22 -2.14 0.00 0.00 0.00 175.76 175.50 2q3r s PRO 125 N -2.56 1.68 0.15 0.00 0.02 -1.26 -4.73 135.00 128.30 2q3r s PRO 125 Ca 0.56 1.80 0.07 0.00 0.02 0.00 0.00 61.00 63.45 2q3r s PRO 125 Cb -0.16 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 2q3r s PRO 125 CO 0.21 -2.19 -0.03 0.96 -0.33 0.00 0.00 177.00 175.62 2q3r s ILE 126 N -2.07 3.66 0.32 2.83 -4.36 -1.26 -1.29 121.20 119.03 2q3r s ILE 126 Ca 0.74 -1.35 -0.10 0.00 -0.26 0.00 0.00 60.65 59.68 2q3r s ILE 126 Cb -0.30 -2.80 0.04 0.00 1.25 0.00 0.00 42.46 40.65 2q3r s ILE 126 CO 0.50 -0.03 0.61 -0.24 0.24 0.00 0.00 174.94 176.01 2q3r n SER 127 N 0.15 -1.76 0.23 4.36 2.88 -1.08 -2.17 113.62 116.24 2q3r n SER 127 Ca -0.11 -2.35 0.14 0.00 -1.33 0.00 0.00 58.87 55.22 2q3r n SER 127 Cb 0.54 2.97 0.38 0.00 -0.75 0.00 0.00 64.21 67.34 2q3r n SER 127 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2q3r s SER 129 N -5.87 1.36 -0.31 0.00 1.04 -1.26 -4.47 113.70 104.19 2q3r s SER 129 Ca 0.05 -1.66 0.10 0.00 0.48 0.00 0.00 55.95 54.92 2q3r s SER 129 Cb 0.07 0.55 0.64 0.00 0.10 0.00 0.00 66.02 67.39 2q3r s SER 129 CO 0.61 -1.08 1.68 -0.90 0.98 0.00 0.00 173.24 174.54 2q3r n ASP 130 N -1.37 3.98 -4.65 7.02 5.75 -1.26 -3.74 116.55 122.29 2q3r n ASP 130 Ca 0.06 -3.37 -0.43 0.00 -0.01 0.00 0.00 54.79 51.04 2q3r n ASP 130 Cb 0.63 -0.70 -0.02 0.00 -1.03 0.00 0.00 41.12 40.00 2q3r n ASP 130 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2q3r s LYS 131 N -3.07 4.17 0.52 0.11 1.02 -1.26 -4.62 119.74 116.60 2q3r s LYS 131 Ca 0.51 1.30 -0.22 0.00 0.02 0.00 0.00 55.97 57.58 2q3r s LYS 131 Cb 0.42 -3.71 -0.06 0.00 -0.52 0.00 0.00 37.83 33.97 2q3r s LYS 131 CO 0.09 -0.77 1.30 -1.25 -0.92 0.00 0.00 175.35 173.81 2q3r s PRO 132 N 3.46 3.34 -0.17 -1.68 0.04 -1.26 -4.63 135.00 134.10 2q3r s PRO 132 Ca 0.47 2.10 -0.04 0.00 0.04 0.00 0.00 61.00 63.56 2q3r s PRO 132 Cb -0.15 -2.31 -0.03 0.00 0.04 0.00 0.00 34.50 32.05 2q3r s PRO 132 CO 0.11 -0.99 -0.02 -1.17 0.04 0.00 0.00 177.00 174.98 2q3r s LEU 133 N -3.36 3.28 -1.06 -3.56 2.96 -1.26 -4.72 118.68 110.97 2q3r s LEU 133 Ca 0.69 -0.15 -0.17 0.00 -0.22 0.00 0.00 54.13 54.28 2q3r s LEU 133 Cb -0.37 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.51 2q3r s LEU 133 CO 0.44 0.13 0.76 0.23 -1.32 0.00 0.00 176.35 176.59 2q3r n MET 134 N 3.81 -1.22 0.22 1.98 2.81 -1.26 -4.61 117.12 118.86 2q3r n MET 134 Ca -0.17 0.59 0.14 0.00 -1.81 0.00 0.00 57.70 56.45 2q3r n MET 134 Cb 0.52 -4.00 0.78 0.00 -0.71 0.00 0.00 33.22 29.81 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 -1.49 0.00 0.00 0.03 0.13 -1.97 -2.06 132.00 126.65 2q3r h PRO 135 Ca -0.59 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.52 2q3r h PRO 135 Cb 1.33 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 2q3r h PRO 135 CO 0.45 0.00 -0.09 -0.56 -0.23 0.00 0.00 178.00 177.57 2q3r h GLN 136 N 0.00 0.00 -5.67 0.86 -0.00 -2.01 -3.40 115.11 104.89 2q3r h GLN 136 Ca 0.06 0.00 -0.62 0.00 -0.00 0.00 0.00 58.65 58.09 2q3r h GLN 136 Cb 0.26 0.00 -0.13 0.00 -0.00 0.00 0.00 27.48 27.61 2q3r h GLN 136 CO -0.00 0.09 0.88 0.42 -0.00 0.00 0.00 178.83 180.22 2q3r s ILE 137 N -4.01 4.20 0.20 1.86 1.01 -0.78 -5.01 121.20 118.69 2q3r s ILE 137 Ca -0.02 -0.51 0.06 0.00 0.00 0.00 0.00 60.65 60.18 2q3r s ILE 137 Cb 0.12 -4.82 -0.04 0.00 0.01 0.00 0.00 42.46 37.73 2q3r s ILE 137 CO 0.56 -1.64 0.19 -0.13 0.00 0.00 0.00 174.94 173.92 2q3r s ARG 138 N 4.31 3.00 0.00 2.79 0.52 -1.26 -1.51 118.95 126.80 2q3r s ARG 138 Ca 0.31 -0.91 0.00 0.00 -0.52 0.00 0.00 55.73 54.61 2q3r s ARG 138 Cb -0.10 -2.66 0.00 0.00 0.52 0.00 0.00 34.95 32.71 2q3r s ARG 138 CO 0.04 0.45 0.00 0.43 0.02 0.00 0.00 175.30 176.24 2q3r n SER 139 N -0.77 0.00 -4.17 0.23 7.64 -1.23 -4.85 113.62 110.47 2q3r n SER 139 Ca -0.08 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.44 2q3r n SER 139 Cb 0.56 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.63 2q3r n SER 139 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2q3r s ASN 140 N -1.60 5.07 -1.33 6.43 4.22 -1.26 -4.64 114.94 121.83 2q3r s ASN 140 Ca 0.00 -1.52 0.00 0.00 -2.14 0.00 0.00 52.86 49.20 2q3r s ASN 140 Cb 0.00 -1.77 0.00 0.00 1.28 0.00 0.00 41.25 40.76 2q3r s ASN 140 CO 0.00 -0.37 0.00 0.61 -2.04 0.00 0.00 177.10 175.30 2q3r n GLY 141 N 4.63 1.28 0.00 0.45 0.00 -1.26 -4.96 105.19 105.33 2q3r n GLY 141 Ca -0.09 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.44 0.00 0.00 -0.61 5.41 -1.26 -5.06 119.36 115.41 2q3r n ILE 142 Ca -0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.62 2q3r n ILE 142 Cb 0.51 -0.24 0.00 0.00 -0.71 0.00 0.00 39.64 39.20 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 0.00 1.31 -4.57 4.38 3.85 -1.26 -4.81 116.55 115.45 2q3r n ASP 143 Ca 0.00 -0.04 -0.40 0.00 -0.71 0.00 0.00 54.79 53.64 2q3r n ASP 143 Cb 0.00 0.34 -0.03 0.00 -1.35 0.00 0.00 41.12 40.08 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 -0.60 2.73 1.00 0.11 2.56 -1.26 -4.88 118.70 118.36 2q3r s GLU 144 Ca 0.00 1.48 -0.15 0.00 0.00 0.00 0.00 54.97 56.30 2q3r s GLU 144 Cb 0.00 -4.42 0.03 0.00 2.00 0.00 0.00 34.13 31.74 2q3r s GLU 144 CO 0.00 -2.57 0.12 0.00 -0.56 0.00 0.00 175.26 172.25 2q3r n ALA 145 N 13.08 -3.41 -0.03 6.30 0.00 -1.26 -3.52 120.51 131.68 2q3r n ALA 145 Ca 0.29 -0.83 -0.12 0.00 0.00 0.00 0.00 53.44 52.79 2q3r n ALA 145 Cb 0.50 -1.63 -0.07 0.00 0.00 0.00 0.00 19.45 18.26 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 -1.63 0.16 -8.39 0.00 5.85 -1.58 -3.37 115.31 106.35 2q3r h LEU 146 Ca -0.46 -0.24 -0.70 0.00 0.84 0.00 0.00 57.88 57.32 2q3r h LEU 146 Cb 1.31 -0.04 -0.19 0.00 0.37 0.00 0.00 40.66 42.10 2q3r h LEU 146 CO 0.34 0.36 -0.09 -0.36 -0.34 0.00 0.00 178.44 178.35 2q3r s PHE 147 N -5.23 3.12 -0.18 1.25 0.40 -1.26 -4.75 117.98 111.33 2q3r s PHE 147 Ca -0.14 -0.60 -0.38 0.00 -0.60 0.00 0.00 56.93 55.21 2q3r s PHE 147 Cb 0.05 -3.33 -0.14 0.00 0.51 0.00 0.00 43.02 40.11 2q3r s PHE 147 CO 0.69 -0.91 1.77 2.41 0.70 0.00 0.00 175.22 179.88 2q3r n THR 148 N 5.48 0.38 -1.56 0.64 -1.04 -1.21 -4.68 114.28 112.29 2q3r n THR 148 Ca -0.08 -0.07 -0.49 0.00 -2.04 0.00 0.00 64.05 61.37 2q3r n THR 148 Cb 0.45 -1.44 -0.04 0.00 -1.82 0.00 0.00 70.33 67.48 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 5.62 1.01 -2.39 -2.82 -0.02 -1.26 -4.48 135.00 130.66 2q3r n PRO 149 Ca 0.24 0.36 -0.39 0.00 -2.02 0.00 0.00 63.50 61.70 2q3r n PRO 149 Cb 0.20 -1.82 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 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 -0.44 4.27 -0.21 0.52 0.04 -1.26 -4.50 135.00 133.41 2q3r s PRO 150 Ca 0.73 1.79 -0.21 0.00 0.04 0.00 0.00 61.00 63.35 2q3r s PRO 150 Cb -0.88 -2.82 -0.02 0.00 0.04 0.00 0.00 34.50 30.81 2q3r s PRO 150 CO 0.53 -0.12 0.66 0.50 0.04 0.00 0.00 177.00 178.61 2q3r s ARG 151 N -2.06 4.20 -0.18 4.56 3.52 -0.41 -4.05 118.95 124.53 2q3r s ARG 151 Ca 0.53 0.66 -0.29 0.00 -0.13 0.00 0.00 55.73 56.50 2q3r s ARG 151 Cb -0.30 -3.59 -0.05 0.00 -1.56 0.00 0.00 34.95 29.45 2q3r s ARG 151 CO 0.38 -0.29 2.01 0.50 -0.81 0.00 0.00 175.30 177.09 2q3r s ARG 152 N 2.07 3.47 -0.24 5.12 3.52 -1.25 -2.62 118.95 129.03 2q3r s ARG 152 Ca 0.29 2.00 -0.41 0.00 -0.13 0.00 0.00 55.73 57.49 2q3r s ARG 152 Cb -0.16 -4.25 -0.17 0.00 -1.56 0.00 0.00 34.95 28.81 2q3r s ARG 152 CO 0.10 -1.70 1.62 1.28 -0.81 0.00 0.00 175.30 175.79 2q3r n LEU 153 N 10.12 1.95 -4.70 -0.88 4.77 -0.30 -4.88 117.00 123.08 2q3r n LEU 153 Ca 0.25 1.11 -0.42 0.00 -0.03 0.00 0.00 56.01 56.91 2q3r n LEU 153 Cb 0.44 -1.09 -0.03 0.00 -2.33 0.00 0.00 43.42 40.41 2q3r n LEU 153 CO 0.67 -0.67 1.33 -0.83 -1.33 0.00 0.00 177.39 176.56 2q3r s GLY 154 N 2.79 1.50 0.00 -0.72 0.00 -1.26 -4.80 107.32 104.83 2q3r s GLY 154 Ca 0.97 1.32 0.00 0.00 0.00 0.00 0.00 44.72 47.00 2q3r s GLY 154 CO 0.65 2.87 0.85 4.51 0.00 0.00 0.00 173.10 181.98 2q3r n ILE 155 N 4.50 1.42 0.38 0.90 3.06 -1.26 0.28 119.36 128.65 2q3r n ILE 155 Ca 0.16 0.47 0.12 0.00 -2.50 0.00 0.00 62.75 60.99 2q3r n ILE 155 Cb 0.39 -1.47 0.13 0.00 0.54 0.00 0.00 39.64 39.24 2q3r n ILE 155 CO 0.00 0.00 0.00 -0.33 -2.50 0.00 0.00 176.55 173.72 2q3r h GLU 156 N 0.00 0.00 -0.01 9.51 3.07 -2.02 -3.31 114.58 121.82 2q3r h GLU 156 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2q3r h GLU 156 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 2q3r h GLU 156 CO 0.00 0.00 -0.41 0.39 -1.40 0.00 0.00 179.01 177.59 2q3r n GLU 157 N -2.42 0.93 -0.03 2.33 1.02 0.14 -4.46 120.64 118.15 2q3r n GLU 157 Ca 0.02 -0.68 -0.15 0.00 -0.02 0.00 0.00 57.16 56.33 2q3r n GLU 157 Cb 0.48 -1.49 -0.09 0.00 -0.02 0.00 0.00 31.44 30.32 2q3r n GLU 157 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2q3r h ILE 158 N 1.67 1.43 -0.05 -3.67 2.04 -1.65 -2.68 117.51 114.60 2q3r h ILE 158 Ca 0.00 -1.74 -0.00 0.00 1.00 0.00 0.00 64.86 64.12 2q3r h ILE 158 Cb 0.62 2.36 -0.00 0.00 -0.74 0.00 0.00 36.82 39.06 2q3r h ILE 158 CO 0.00 0.50 0.02 -0.65 0.00 0.00 0.00 178.15 178.02 2q3r h PRO 159 N -0.18 0.07 -0.39 2.37 0.11 -1.80 -1.61 132.00 130.58 2q3r h PRO 159 Ca -0.02 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.95 2q3r h PRO 159 Cb 0.97 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 2q3r h PRO 159 CO 0.07 0.07 -0.28 0.78 -0.21 0.00 0.00 178.00 178.42 2q3r h GLY 160 N 0.13 0.96 1.32 -0.55 0.00 -1.80 -2.21 103.07 100.91 2q3r h GLY 160 Ca 0.02 -0.92 -0.04 0.00 0.00 0.00 0.00 47.33 46.39 2q3r h GLY 160 CO -0.00 0.83 0.22 -2.22 0.00 0.00 0.00 176.54 175.37 2q3r h ILE 161 N 0.69 1.22 0.00 2.60 2.04 -0.97 0.19 117.51 123.28 2q3r h ILE 161 Ca 0.07 -0.70 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 2q3r h ILE 161 Cb 0.86 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 37.47 2q3r h ILE 161 CO 0.08 0.28 -0.13 0.58 0.00 0.00 0.00 178.15 178.95 2q3r h VAL 162 N 0.86 0.73 0.00 1.67 2.07 -1.14 0.31 116.25 120.75 2q3r h VAL 162 Ca 0.20 -0.53 -0.10 0.00 0.82 0.00 0.00 66.70 67.09 2q3r h VAL 162 Cb 0.20 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2q3r h VAL 162 CO -0.02 0.13 -0.47 -1.13 0.02 0.00 0.00 177.57 176.10 2q3r h ASN 163 N 0.00 0.00 -0.65 0.57 -0.73 -0.08 -3.03 115.58 111.65 2q3r h ASN 163 Ca -0.00 0.00 -0.06 0.00 1.87 0.00 0.00 56.30 58.10 2q3r h ASN 163 Cb 0.31 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.87 2q3r h ASN 163 CO 0.02 0.46 0.17 0.44 -0.37 0.00 0.00 177.43 178.15 2q3r h ASP 164 N 0.00 1.00 -0.28 1.15 3.32 0.92 -1.26 116.42 121.27 2q3r h ASP 164 Ca -0.01 -0.20 -0.15 0.00 0.02 0.00 0.00 57.03 56.69 2q3r h ASP 164 Cb 1.36 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 2q3r h ASP 164 CO 0.06 0.96 -0.42 -0.26 -1.72 0.00 0.00 179.24 177.86 2q3r h PHE 165 N 1.01 0.96 -0.85 4.55 -1.00 -1.47 -2.33 116.94 117.82 2q3r h PHE 165 Ca 0.21 -0.32 -0.01 0.00 2.81 0.00 0.00 57.97 60.66 2q3r h PHE 165 Cb 0.35 -0.19 -0.04 0.00 3.61 0.00 0.00 35.95 39.68 2q3r h PHE 165 CO 0.03 1.11 0.50 -0.09 -1.61 0.00 0.00 178.31 178.25 2q3r h ARG 166 N 0.53 1.15 0.93 1.51 2.43 -1.38 -1.74 114.38 117.81 2q3r h ARG 166 Ca 0.03 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.05 2q3r h ARG 166 Cb 1.01 -0.24 0.01 0.00 -0.42 0.00 0.00 29.97 30.33 2q3r h ARG 166 CO 0.10 0.81 -0.45 1.25 -1.51 0.00 0.00 179.97 180.17 2q3r h LEU 167 N 1.17 -1.05 -1.40 3.80 5.85 -1.14 -1.60 115.31 120.94 2q3r h LEU 167 Ca 0.30 0.04 0.31 0.00 0.84 0.00 0.00 57.88 59.37 2q3r h LEU 167 Cb -0.04 0.27 -0.10 0.00 0.37 0.00 0.00 40.66 41.17 2q3r h LEU 167 CO -0.06 -0.73 0.72 0.00 -0.34 0.00 0.00 178.44 178.03 2q3r h ALA 168 N -1.39 2.39 -0.05 1.25 0.00 -1.30 0.58 119.26 120.75 2q3r h ALA 168 Ca -0.13 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2q3r h ALA 168 Cb 0.95 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2q3r h ALA 168 CO 0.21 -0.85 0.02 0.00 0.00 0.00 0.00 179.25 178.62 2q3r h ALA 169 N 1.61 0.06 -0.92 0.00 0.00 -0.81 0.11 119.26 119.32 2q3r h ALA 169 Ca 0.65 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.51 2q3r h ALA 169 Cb 1.80 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 19.52 2q3r h ALA 169 CO -0.32 -0.35 0.59 -0.09 0.00 0.00 0.00 179.25 179.08 2q3r h ARG 170 N -0.10 1.08 0.00 0.00 9.65 0.97 -0.40 114.38 125.58 2q3r h ARG 170 Ca 0.02 -0.07 -0.04 0.00 -1.10 0.00 0.00 59.98 58.79 2q3r h ARG 170 Cb 0.18 -0.24 -0.01 0.00 -1.39 0.00 0.00 29.97 28.51 2q3r h ARG 170 CO -0.00 0.72 -0.21 -0.91 2.80 0.00 0.00 179.97 182.36 2q3r h ASN 171 N 1.12 0.00 -0.51 -3.80 4.21 -0.22 -1.52 115.58 114.85 2q3r h ASN 171 Ca 0.38 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.76 2q3r h ASN 171 Cb 0.06 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.25 2q3r h ASN 171 CO -0.14 0.21 -0.17 0.00 -1.29 0.00 0.00 177.43 176.05 2q3r h ALA 172 N 1.79 0.71 0.00 -0.83 0.00 0.67 -0.20 119.26 121.40 2q3r h ALA 172 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2q3r h ALA 172 Cb 0.40 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2q3r h ALA 172 CO 0.03 0.67 0.00 -1.33 0.00 0.00 0.00 179.25 178.62 2q3r n MET 173 N -4.13 0.03 -0.01 0.00 2.81 -0.64 -1.62 117.12 113.57 2q3r n MET 173 Ca 0.01 0.28 -0.19 0.00 -1.81 0.00 0.00 57.70 55.99 2q3r n MET 173 Cb 0.44 -1.56 -0.14 0.00 -0.71 0.00 0.00 33.22 31.25 2q3r n MET 173 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2q3r n GLU 174 N -1.62 0.73 0.00 0.03 1.02 -0.24 -3.86 120.64 116.70 2q3r n GLU 174 Ca 0.03 0.26 0.12 0.00 -0.02 0.00 0.00 57.16 57.55 2q3r n GLU 174 Cb 0.18 -1.71 0.59 0.00 -0.02 0.00 0.00 31.44 30.47 2q3r n GLU 174 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2q3r n ALA 175 N -2.93 2.20 -0.28 0.62 0.00 -0.31 -4.90 120.51 114.91 2q3r n ALA 175 Ca -0.30 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2q3r n ALA 175 Cb 1.05 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 19.10 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 0.87 0.80 3.72 0.00 0.00 -0.90 -4.52 105.19 105.16 2q3r n GLY 176 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.15 2.08 -0.98 1.61 0.40 -0.64 -4.91 117.98 113.40 2q3r s PHE 177 Ca 0.00 1.64 0.27 0.00 -0.60 0.00 0.00 56.93 58.23 2q3r s PHE 177 Cb 0.00 -3.35 1.12 0.00 0.51 0.00 0.00 43.02 41.31 2q3r s PHE 177 CO 0.00 -2.44 1.85 -0.25 0.70 0.00 0.00 175.22 175.09 2q3r n ASP 178 N -3.16 0.06 0.00 1.36 8.00 -0.90 -4.62 116.55 117.29 2q3r n ASP 178 Ca 0.12 0.51 0.00 0.00 0.71 0.00 0.00 54.79 56.13 2q3r n ASP 178 Cb 0.51 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 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 1.26 -1.17 3.04 0.44 0.00 -1.26 -4.88 105.19 102.62 2q3r n GLY 179 Ca 0.06 -1.16 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 2q3r n GLY 179 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2q3r s VAL 180 N -3.00 0.40 -0.26 1.61 -7.23 -1.20 -2.63 120.40 108.10 2q3r s VAL 180 Ca 0.00 -1.07 -0.07 0.00 -1.81 0.00 0.00 61.98 59.03 2q3r s VAL 180 Cb 0.00 -0.55 -0.02 0.00 0.56 0.00 0.00 36.38 36.37 2q3r s VAL 180 CO 0.00 -0.45 0.06 -0.70 -0.31 0.00 0.00 175.10 173.70 2q3r s GLU 181 N -1.66 3.50 -0.22 4.82 2.12 -0.85 -2.95 118.70 123.46 2q3r s GLU 181 Ca -0.11 -0.57 -0.29 0.00 0.36 0.00 0.00 54.97 54.36 2q3r s GLU 181 Cb -0.09 -3.30 -0.01 0.00 0.26 0.00 0.00 34.13 30.99 2q3r s GLU 181 CO -0.00 -0.25 1.27 0.42 -0.54 0.00 0.00 175.26 176.16 2q3r s ILE 182 N 1.58 4.23 -0.70 -3.70 1.01 -0.47 0.67 121.20 123.82 2q3r s ILE 182 Ca 0.06 1.45 -0.26 0.00 0.00 0.00 0.00 60.65 61.90 2q3r s ILE 182 Cb -0.15 -4.07 -0.00 0.00 0.01 0.00 0.00 42.46 38.24 2q3r s ILE 182 CO 0.03 -0.28 1.67 -2.28 0.00 0.00 0.00 174.94 174.08 2q3r s HIS 183 N 3.86 1.90 -0.38 3.97 2.46 0.14 -0.87 115.29 126.37 2q3r s HIS 183 Ca 0.55 0.44 0.16 0.00 0.47 0.00 0.00 55.06 56.67 2q3r s HIS 183 Cb -0.19 -4.28 0.61 0.00 -0.13 0.00 0.00 32.58 28.58 2q3r s HIS 183 CO 0.18 -2.17 1.51 0.41 -2.47 0.00 0.00 174.74 172.20 2q3r n GLY 184 N 5.77 3.50 0.00 1.59 0.00 0.41 -4.47 105.19 111.98 2q3r n GLY 184 Ca 0.17 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 0.07 0.00 -3.68 4.61 0.00 -0.52 -4.18 120.51 116.81 2q3r n ALA 185 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.37 2q3r n ALA 185 Cb 0.93 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.39 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 -1.16 -5.14 -0.25 0.00 3.02 -1.26 -2.50 115.26 107.97 2q3r n ASN 186 Ca 0.00 -0.66 0.00 0.00 -0.03 0.00 0.00 54.58 53.89 2q3r n ASN 186 Cb 0.00 -1.74 0.00 0.00 -0.61 0.00 0.00 39.78 37.43 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 -1.12 0.00 3.29 7.41 0.00 -1.22 -4.89 105.19 108.66 2q3r n GLY 187 Ca -0.23 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.25 -3.93 -0.29 1.61 4.01 -1.04 -4.58 117.16 112.69 2q3r n TYR 188 Ca 0.00 -0.98 0.11 0.00 -0.16 0.00 0.00 57.90 56.87 2q3r n TYR 188 Cb 0.00 -0.94 0.35 0.00 -0.31 0.00 0.00 39.34 38.44 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 0.72 -0.07 7.72 5.85 -0.05 -1.69 115.31 127.78 2q3r h LEU 189 Ca -0.37 0.04 -0.25 0.00 0.84 0.00 0.00 57.88 58.14 2q3r h LEU 189 Cb 1.06 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 42.01 2q3r h LEU 189 CO 0.26 0.37 -1.00 0.40 -0.34 0.00 0.00 178.44 178.13 2q3r h ILE 190 N 0.76 1.32 -0.49 4.05 2.04 -1.78 -3.20 117.51 120.21 2q3r h ILE 190 Ca 0.46 -2.30 -0.05 0.00 1.00 0.00 0.00 64.86 63.96 2q3r h ILE 190 Cb 0.66 2.38 -0.02 0.00 -0.74 0.00 0.00 36.82 39.09 2q3r h ILE 190 CO -0.22 0.70 0.10 -0.78 0.00 0.00 0.00 178.15 177.96 2q3r h ASP 191 N 0.34 0.70 -0.48 1.72 3.58 -1.60 -2.90 116.42 117.78 2q3r h ASP 191 Ca -0.11 -0.12 0.07 0.00 0.42 0.00 0.00 57.03 57.29 2q3r h ASP 191 Cb 1.65 -0.18 -0.06 0.00 1.72 0.00 0.00 39.33 42.45 2q3r h ASP 191 CO 0.19 0.70 0.14 1.56 -2.88 0.00 0.00 179.24 178.95 2q3r h GLN 192 N 0.72 0.29 -0.27 0.28 4.20 -1.32 -0.72 115.11 118.29 2q3r h GLN 192 Ca 0.16 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.81 2q3r h GLN 192 Cb 0.30 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 2q3r h GLN 192 CO 0.00 0.19 -0.03 0.74 -0.67 0.00 0.00 178.83 179.06 2q3r h PHE 193 N 0.30 0.42 -0.08 2.96 -1.00 -1.55 -3.11 116.94 114.88 2q3r h PHE 193 Ca 0.23 -0.04 -0.23 0.00 2.81 0.00 0.00 57.97 60.74 2q3r h PHE 193 Cb 0.27 -0.12 0.01 0.00 3.61 0.00 0.00 35.95 39.72 2q3r h PHE 193 CO -0.19 0.45 -0.87 0.52 -1.61 0.00 0.00 178.31 176.61 2q3r h MET 194 N 0.39 0.66 -6.17 1.51 2.86 -1.19 -3.42 114.93 109.58 2q3r h MET 194 Ca 0.09 -0.61 -0.57 0.00 -2.06 0.00 0.00 59.70 56.55 2q3r h MET 194 Cb 0.32 0.15 -0.05 0.00 0.06 0.00 0.00 31.60 32.08 2q3r h MET 194 CO 0.01 1.21 0.73 0.15 1.06 0.00 0.00 176.91 180.07 2q3r s LYS 195 N -3.54 4.32 0.36 1.72 -0.14 -0.37 -4.84 119.74 117.25 2q3r s LYS 195 Ca -0.09 1.45 0.06 0.00 -1.36 0.00 0.00 55.97 56.02 2q3r s LYS 195 Cb 0.08 -3.61 0.68 0.00 -1.68 0.00 0.00 37.83 33.30 2q3r s LYS 195 CO 0.90 -0.52 1.91 0.38 -0.76 0.00 0.00 175.35 177.26 2q3r h ASP 196 N 7.43 0.44 0.63 2.83 3.04 -1.81 0.90 116.42 129.88 2q3r h ASP 196 Ca -0.26 -0.07 0.00 0.00 -3.24 0.00 0.00 57.03 53.46 2q3r h ASP 196 Cb 1.11 -0.11 0.00 0.00 -1.04 0.00 0.00 39.33 39.28 2q3r h ASP 196 CO 0.93 0.49 0.00 0.71 -2.04 0.00 0.00 179.24 179.33 2q3r h THR 197 N 0.46 0.00 0.00 1.15 1.35 -1.93 -3.22 112.91 110.72 2q3r h THR 197 Ca 0.10 -0.25 -0.23 0.00 -0.55 0.00 0.00 66.41 65.49 2q3r h THR 197 Cb 0.27 1.02 -0.04 0.00 -1.73 0.00 0.00 68.15 67.67 2q3r h THR 197 CO 0.00 0.00 -1.86 0.52 -0.25 0.00 0.00 175.52 173.93 2q3r n VAL 198 N -2.52 0.87 -2.94 6.82 0.31 -0.50 -4.91 118.33 115.45 2q3r n VAL 198 Ca 0.01 -0.31 -0.43 0.00 -0.01 0.00 0.00 64.34 63.59 2q3r n VAL 198 Cb 0.20 -1.15 -0.05 0.00 -0.91 0.00 0.00 33.84 31.94 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 6.31 -0.17 4.52 3.84 0.30 -4.60 114.94 119.51 2q3r s ASN 199 Ca -0.21 -0.51 0.14 0.00 0.21 0.00 0.00 52.86 52.49 2q3r s ASN 199 Cb 0.06 -2.39 0.37 0.00 -0.55 0.00 0.00 41.25 38.74 2q3r s ASN 199 CO 0.34 -1.11 1.19 -0.90 -2.79 0.00 0.00 177.10 173.83 2q3r n ASP 200 N 7.02 1.87 -4.75 -4.21 5.75 -1.26 -4.57 116.55 116.40 2q3r n ASP 200 Ca -0.01 -3.55 -0.36 0.00 -0.01 0.00 0.00 54.79 50.86 2q3r n ASP 200 Cb 0.47 -0.48 0.04 0.00 -1.03 0.00 0.00 41.12 40.12 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 -2.97 2.88 -0.13 0.11 0.52 -1.26 -4.78 118.95 113.32 2q3r s ARG 201 Ca 0.35 1.90 0.15 0.00 -0.52 0.00 0.00 55.73 57.61 2q3r s ARG 201 Cb 0.34 -1.92 0.39 0.00 0.52 0.00 0.00 34.95 34.27 2q3r s ARG 201 CO -0.04 -1.30 1.29 0.25 0.02 0.00 0.00 175.30 175.52 2q3r n THR 202 N -1.64 1.89 -2.02 0.02 -2.24 -1.26 -1.47 114.28 107.56 2q3r n THR 202 Ca 0.14 -1.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.12 2q3r n THR 202 Cb 0.49 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 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 -0.64 0.52 0.00 3.42 3.85 -1.26 -5.00 116.55 117.44 2q3r n ASP 203 Ca 0.17 0.00 0.11 0.00 -0.71 0.00 0.00 54.79 54.36 2q3r n ASP 203 Cb 0.70 0.00 0.51 0.00 -1.35 0.00 0.00 41.12 40.98 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 0.09 -0.48 0.11 0.28 -1.26 -3.21 120.64 116.18 2q3r n GLU 204 Ca 0.00 0.10 0.09 0.00 -0.16 0.00 0.00 57.16 57.19 2q3r n GLU 204 Cb 0.00 -1.50 0.31 0.00 1.43 0.00 0.00 31.44 31.68 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 -1.44 1.16 -3.83 -1.84 4.01 -1.26 -4.52 117.16 109.44 2q3r n TYR 205 Ca 0.07 -0.60 -0.04 0.00 -0.16 0.00 0.00 57.90 57.17 2q3r n TYR 205 Cb 0.24 -0.17 0.01 0.00 -0.31 0.00 0.00 39.34 39.11 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 -1.05 0.03 0.00 2.72 0.00 -1.20 -4.18 107.32 103.65 2q3r s GLY 206 Ca 0.45 -0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.92 2q3r s GLY 206 CO 0.23 1.09 0.00 0.61 0.00 0.00 0.00 173.10 175.03 2q3r n GLY 207 N -0.59 0.27 3.58 0.20 0.00 -0.54 -4.31 105.19 103.80 2q3r n GLY 207 Ca -0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.44 -0.19 0.27 1.61 1.04 -1.26 -5.00 113.70 107.73 2q3r s SER 208 Ca 0.00 -0.01 -0.00 0.00 0.48 0.00 0.00 55.95 56.42 2q3r s SER 208 Cb 0.00 0.20 0.57 0.00 0.10 0.00 0.00 66.02 66.89 2q3r s SER 208 CO 0.00 -0.33 1.75 0.25 0.98 0.00 0.00 173.24 175.89 2q3r h LEU 209 N 2.00 0.47 0.00 2.42 5.85 -1.96 0.21 115.31 124.30 2q3r h LEU 209 Ca -0.12 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2q3r h LEU 209 Cb 1.18 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2q3r h LEU 209 CO 0.25 0.17 0.00 1.67 -0.34 0.00 0.00 178.44 180.18 2q3r n GLN 210 N -4.92 0.00 -0.13 1.25 7.27 -1.26 -1.16 117.38 118.44 2q3r n GLN 210 Ca 0.18 0.56 0.23 0.00 0.07 0.00 0.00 57.00 58.04 2q3r n GLN 210 Cb 0.48 -1.41 0.65 0.00 2.41 0.00 0.00 30.24 32.37 2q3r n GLN 210 CO 0.00 0.00 0.00 -0.91 0.07 0.00 0.00 177.06 176.22 2q3r h ASN 211 N 0.00 0.12 -0.38 1.69 4.21 -1.71 -1.77 115.58 117.74 2q3r h ASN 211 Ca 0.00 0.01 -0.11 0.00 1.21 0.00 0.00 56.30 57.41 2q3r h ASN 211 Cb 0.00 -0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 37.18 2q3r h ASN 211 CO 0.00 0.05 -0.21 0.03 -1.29 0.00 0.00 177.43 176.01 2q3r h ARG 212 N 0.12 0.80 -0.00 0.81 3.08 -0.25 -3.03 114.38 115.91 2q3r h ARG 212 Ca 0.37 -0.36 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2q3r h ARG 212 Cb 1.29 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.32 2q3r h ARG 212 CO -0.05 0.99 -0.08 0.00 -1.07 0.00 0.00 179.97 179.76 2q3r h LYS 214 N 0.11 0.85 0.84 0.00 1.57 -1.31 -0.87 116.57 117.76 2q3r h LYS 214 Ca 0.00 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 2q3r h LYS 214 Cb 0.41 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 32.54 2q3r h LYS 214 CO 0.00 0.56 -0.43 0.35 -0.57 0.00 0.00 179.45 179.36 2q3r h PHE 215 N 0.88 -1.13 0.00 -1.35 3.57 -1.75 -0.68 116.94 116.48 2q3r h PHE 215 Ca 0.50 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.97 2q3r h PHE 215 Cb 0.63 0.38 -0.00 0.00 2.79 0.00 0.00 35.95 39.75 2q3r h PHE 215 CO -0.00 -0.68 -0.05 -1.00 -2.23 0.00 0.00 178.31 174.34 2q3r h PRO 216 N -1.16 0.00 -0.09 6.41 0.13 -1.77 -2.47 132.00 133.04 2q3r h PRO 216 Ca -0.12 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.95 2q3r h PRO 216 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2q3r h PRO 216 CO 0.17 0.05 -0.21 -0.07 -0.23 0.00 0.00 178.00 177.71 2q3r h LEU 217 N 0.00 0.35 -2.85 1.56 3.38 -0.89 -0.07 115.31 116.78 2q3r h LEU 217 Ca -0.00 -0.58 -0.00 0.00 0.09 0.00 0.00 57.88 57.39 2q3r h LEU 217 Cb 0.18 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2q3r h LEU 217 CO 0.01 0.86 -0.00 -0.33 0.09 0.00 0.00 178.44 179.07 2q3r h GLU 218 N -0.15 0.00 0.00 1.13 5.08 -0.68 0.28 114.58 120.24 2q3r h GLU 218 Ca -0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2q3r h GLU 218 Cb 0.81 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 2q3r h GLU 218 CO 0.05 0.00 -0.53 0.82 -1.00 0.00 0.00 179.01 178.35 2q3r h ILE 219 N 0.00 1.25 0.00 3.13 2.04 -1.15 -1.35 117.51 121.42 2q3r h ILE 219 Ca -0.00 -2.13 -0.01 0.00 1.00 0.00 0.00 64.86 63.72 2q3r h ILE 219 Cb 0.02 2.55 -0.00 0.00 -0.74 0.00 0.00 36.82 38.65 2q3r h ILE 219 CO 0.00 0.42 -0.04 0.58 0.00 0.00 0.00 178.15 179.11 2q3r h VAL 220 N -1.00 0.60 0.03 1.67 2.07 -0.52 -0.18 116.25 118.93 2q3r h VAL 220 Ca -0.14 -0.17 -0.08 0.00 0.82 0.00 0.00 66.70 67.12 2q3r h VAL 220 Cb 1.03 1.11 0.01 0.00 -1.52 0.00 0.00 31.29 31.92 2q3r h VAL 220 CO -0.08 0.04 -0.35 -0.78 0.02 0.00 0.00 177.57 176.41 2q3r h ASP 221 N 0.00 0.25 -0.13 0.57 3.58 -0.51 -3.15 116.42 117.04 2q3r h ASP 221 Ca -0.00 -0.87 -0.08 0.00 0.42 0.00 0.00 57.03 56.50 2q3r h ASP 221 Cb 0.10 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.07 2q3r h ASP 221 CO 0.01 1.09 -0.23 0.00 -2.88 0.00 0.00 179.24 177.23 2q3r h ALA 222 N 0.16 0.20 -0.51 -0.78 0.00 -0.77 -3.02 119.26 114.53 2q3r h ALA 222 Ca -0.05 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 2q3r h ALA 222 Cb 1.18 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 2q3r h ALA 222 CO 0.07 0.16 0.21 0.28 0.00 0.00 0.00 179.25 179.97 2q3r h VAL 223 N -0.03 1.21 0.11 0.00 2.07 -1.22 -1.38 116.25 117.01 2q3r h VAL 223 Ca 0.01 -0.65 0.02 0.00 0.82 0.00 0.00 66.70 66.89 2q3r h VAL 223 Cb 0.81 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 2q3r h VAL 223 CO 0.05 0.25 -0.28 0.00 0.02 0.00 0.00 177.57 177.61 2q3r h ALA 224 N 1.06 -0.47 -0.36 1.67 0.00 -1.61 -0.62 119.26 118.92 2q3r h ALA 224 Ca 0.17 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2q3r h ALA 224 Cb 0.19 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2q3r h ALA 224 CO -0.01 -0.82 0.04 0.87 0.00 0.00 0.00 179.25 179.33 2q3r h LYS 225 N -0.49 0.55 0.61 0.00 1.57 -1.48 1.01 116.57 118.32 2q3r h LYS 225 Ca 0.03 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2q3r h LYS 225 Cb 0.52 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.75 2q3r h LYS 225 CO -0.17 0.54 -0.29 1.49 -0.57 0.00 0.00 179.45 180.45 2q3r h GLU 226 N 0.53 -0.78 -0.19 3.15 4.57 -0.54 -3.36 114.58 117.96 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 0.28 0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.05 2q3r h GLU 226 CO 0.00 -0.52 0.00 0.44 -1.18 0.00 0.00 179.01 177.75 2q3r n ILE 227 N -4.25 0.34 0.00 2.32 -5.35 -0.31 -5.02 119.36 107.10 2q3r n ILE 227 Ca -0.10 -0.67 0.00 0.00 -0.27 0.00 0.00 62.75 61.71 2q3r n ILE 227 Cb 0.32 1.05 0.00 0.00 -1.74 0.00 0.00 39.64 39.28 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 0.94 2.39 0.30 3.28 0.00 0.35 -4.73 105.19 107.71 2q3r n GLY 228 Ca 0.12 -1.51 -0.08 0.00 0.00 0.00 0.00 46.02 44.55 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 1.05 -0.06 1.61 0.13 -1.79 -2.95 132.00 129.99 2q3r h PRO 229 Ca 0.00 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2q3r h PRO 229 Cb 0.00 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.01 2q3r h PRO 229 CO 0.00 0.99 0.00 -0.40 -0.23 0.00 0.00 178.00 178.36 2q3r n ASP 230 N -4.25 0.06 0.00 1.44 3.85 -1.26 -1.46 116.55 114.93 2q3r n ASP 230 Ca 0.03 -1.17 0.00 0.00 -0.71 0.00 0.00 54.79 52.94 2q3r n ASP 230 Cb 0.30 -0.03 0.00 0.00 -1.35 0.00 0.00 41.12 40.04 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 -0.43 -0.28 -4.88 0.11 1.74 -1.12 -4.68 116.66 107.13 2q3r n ARG 231 Ca 0.00 -0.41 -0.33 0.00 -0.77 0.00 0.00 57.85 56.34 2q3r n ARG 231 Cb 0.02 -0.81 -0.15 0.00 -1.02 0.00 0.00 32.46 30.50 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 -0.08 2.87 0.39 1.55 1.01 -0.53 -3.25 120.40 122.35 2q3r s VAL 232 Ca 0.00 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.27 2q3r s VAL 232 Cb 0.00 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 2q3r s VAL 232 CO 0.00 0.54 0.09 -0.83 0.00 0.00 0.00 175.10 174.90 2q3r s GLY 233 N 0.18 2.47 -0.06 4.51 0.00 -1.15 -1.72 107.32 111.55 2q3r s GLY 233 Ca -0.09 -1.42 -0.11 0.00 0.00 0.00 0.00 44.72 43.10 2q3r s GLY 233 CO 0.05 -1.86 0.26 -1.50 0.00 0.00 0.00 173.10 170.06 2q3r s ILE 234 N -3.21 0.03 -0.15 0.90 2.07 -1.20 -1.37 121.20 118.26 2q3r s ILE 234 Ca 0.26 -0.26 -0.04 0.00 -1.41 0.00 0.00 60.65 59.21 2q3r s ILE 234 Cb 0.04 -0.46 -0.03 0.00 0.13 0.00 0.00 42.46 42.14 2q3r s ILE 234 CO 0.14 -0.14 -0.03 -0.60 -1.91 0.00 0.00 174.94 172.40 2q3r s ARG 235 N -0.54 3.66 0.07 3.50 3.52 -0.05 -2.00 118.95 127.10 2q3r s ARG 235 Ca -0.06 -0.50 0.03 0.00 -0.13 0.00 0.00 55.73 55.07 2q3r s ARG 235 Cb -0.04 -2.93 -0.03 0.00 -1.56 0.00 0.00 34.95 30.39 2q3r s ARG 235 CO 0.02 0.28 -0.10 -0.48 -0.81 0.00 0.00 175.30 174.20 2q3r s LEU 236 N 0.28 2.33 -0.45 -0.88 2.34 -0.69 0.15 118.68 121.77 2q3r s LEU 236 Ca -0.02 -0.70 0.04 0.00 0.06 0.00 0.00 54.13 53.51 2q3r s LEU 236 Cb -0.14 -0.30 0.18 0.00 -0.56 0.00 0.00 46.19 45.37 2q3r s LEU 236 CO 0.03 -0.21 0.37 -1.54 -1.06 0.00 0.00 176.35 173.94 2q3r n SER 237 N 0.98 -0.00 0.00 1.48 3.41 -1.26 -2.54 113.62 115.68 2q3r n SER 237 Ca -0.19 -2.50 0.08 0.00 -0.26 0.00 0.00 58.87 56.00 2q3r n SER 237 Cb 0.56 -0.58 0.40 0.00 -0.26 0.00 0.00 64.21 64.33 2q3r n SER 237 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2q3r n PRO 238 N 2.62 0.25 -0.04 4.33 -0.04 -1.26 -3.05 135.00 137.81 2q3r n PRO 238 Ca 0.28 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.87 2q3r n PRO 238 Cb 0.47 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 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 -1.26 0.00 -1.61 0.54 3.01 -1.26 -4.49 117.46 112.39 2q3r n PHE 239 Ca 0.08 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.23 2q3r n PHE 239 Cb 0.12 -0.47 0.05 0.00 -0.01 0.00 0.00 39.48 39.16 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 -2.62 2.69 -0.03 4.37 0.00 -1.17 -4.86 121.76 120.14 2q3r s ALA 240 Ca -0.06 0.02 0.12 0.00 0.00 0.00 0.00 51.96 52.04 2q3r s ALA 240 Cb 0.06 -3.15 0.21 0.00 0.00 0.00 0.00 23.12 20.24 2q3r s ALA 240 CO 0.54 -1.21 1.09 -0.40 0.00 0.00 0.00 175.76 175.78 2q3r n ASP 241 N -3.12 0.74 -4.62 0.00 5.75 -1.26 -4.31 116.55 109.73 2q3r n ASP 241 Ca 0.07 -2.29 -0.47 0.00 -0.01 0.00 0.00 54.79 52.10 2q3r n ASP 241 Cb 0.54 -0.29 -0.03 0.00 -1.03 0.00 0.00 41.12 40.31 2q3r n ASP 241 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2q3r n TYR 242 N -0.10 1.72 -3.47 2.11 9.36 -1.26 -1.55 117.16 123.96 2q3r n TYR 242 Ca 0.05 0.55 -0.18 0.00 3.32 0.00 0.00 57.90 61.64 2q3r n TYR 242 Cb 0.84 -2.37 0.07 0.00 -0.63 0.00 0.00 39.34 37.25 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 1.96 -4.97 -4.17 2.98 2.81 -1.26 -2.94 117.12 111.53 2q3r n MET 243 Ca 0.14 0.78 -0.36 0.00 -1.81 0.00 0.00 57.70 56.44 2q3r n MET 243 Cb 0.28 -5.60 -0.04 0.00 -0.71 0.00 0.00 33.22 27.15 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 -3.98 -0.99 -0.77 0.03 1.02 -0.60 -4.82 120.64 110.54 2q3r n GLU 244 Ca -0.24 0.13 -0.03 0.00 -0.02 0.00 0.00 57.16 57.01 2q3r n GLU 244 Cb 0.66 -3.36 0.23 0.00 -0.02 0.00 0.00 31.44 28.95 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 -2.65 3.31 -4.76 1.62 3.41 -0.78 -4.79 113.62 108.99 2q3r n SER 245 Ca -0.25 -3.47 -0.33 0.00 -0.26 0.00 0.00 58.87 54.56 2q3r n SER 245 Cb 0.65 -0.65 0.06 0.00 -0.26 0.00 0.00 64.21 64.01 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 -2.05 2.21 0.09 5.00 0.00 -1.26 -4.57 107.32 106.74 2q3r s GLY 246 Ca 0.47 0.63 0.09 0.00 0.00 0.00 0.00 44.72 45.90 2q3r s GLY 246 CO 0.05 0.99 -0.20 -0.35 0.00 0.00 0.00 173.10 173.60 2q3r s ASP 247 N -2.43 3.71 0.57 1.64 -1.08 -1.26 -3.74 116.67 114.08 2q3r s ASP 247 Ca 0.69 -0.55 0.34 0.00 -0.52 0.00 0.00 52.55 52.51 2q3r s ASP 247 Cb -0.22 -0.49 1.61 0.00 -1.46 0.00 0.00 42.92 42.36 2q3r s ASP 247 CO 0.42 0.21 2.09 0.71 0.52 0.00 0.00 175.17 179.11 2q3r h THR 248 N 3.77 0.16 -1.58 1.71 1.35 -1.96 -3.32 112.91 113.04 2q3r h THR 248 Ca -0.49 -0.44 -0.45 0.00 -0.55 0.00 0.00 66.41 64.47 2q3r h THR 248 Cb 1.16 1.38 -0.31 0.00 -1.73 0.00 0.00 68.15 68.65 2q3r h THR 248 CO 0.45 0.04 -0.88 -3.20 -0.25 0.00 0.00 175.52 171.68 2q3r n ASN 249 N -3.22 -1.03 -0.02 5.36 2.85 -1.26 -5.01 115.26 112.93 2q3r n ASN 249 Ca -0.01 -2.76 -0.13 0.00 -0.11 0.00 0.00 54.58 51.57 2q3r n ASN 249 Cb 0.25 0.15 -0.09 0.00 1.24 0.00 0.00 39.78 41.32 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 4.53 0.09 -1.08 1.20 0.13 -1.79 -3.26 132.00 131.82 2q3r h PRO 250 Ca 0.08 -0.05 0.32 0.00 -0.87 0.00 0.00 66.00 65.48 2q3r h PRO 250 Cb 0.94 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.95 2q3r h PRO 250 CO 0.36 0.57 0.66 0.78 -0.23 0.00 0.00 178.00 180.14 2q3r h GLY 251 N -0.38 1.66 2.00 1.56 0.00 -1.93 0.53 103.07 106.51 2q3r h GLY 251 Ca 0.01 -0.21 -0.09 0.00 0.00 0.00 0.00 47.33 47.03 2q3r h GLY 251 CO 0.01 -0.34 -0.45 0.00 0.00 0.00 0.00 176.54 175.76 2q3r h ALA 252 N 1.72 1.24 -0.14 3.60 0.00 -1.93 -3.16 119.26 120.59 2q3r h ALA 252 Ca 0.70 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2q3r h ALA 252 Cb 1.76 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 2q3r h ALA 252 CO -0.47 0.56 0.05 1.25 0.00 0.00 0.00 179.25 180.65 2q3r h LEU 253 N 0.00 0.20 -0.66 0.00 5.85 0.01 -1.35 115.31 119.36 2q3r h LEU 253 Ca -0.00 -0.18 0.12 0.00 0.84 0.00 0.00 57.88 58.65 2q3r h LEU 253 Cb 0.81 -0.05 -0.12 0.00 0.37 0.00 0.00 40.66 41.66 2q3r h LEU 253 CO 0.06 0.33 -0.32 1.23 -0.34 0.00 0.00 178.44 179.40 2q3r h GLY 254 N 0.07 0.01 0.51 3.75 0.00 -1.50 0.60 103.07 106.51 2q3r h GLY 254 Ca 0.05 0.42 -0.03 0.00 0.00 0.00 0.00 47.33 47.77 2q3r h GLY 254 CO -0.00 -0.22 -0.25 -2.00 0.00 0.00 0.00 176.54 174.07 2q3r h LEU 255 N -0.12 -0.58 -0.91 3.11 5.85 -1.64 -0.01 115.31 121.02 2q3r h LEU 255 Ca 0.26 0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.13 2q3r h LEU 255 Cb 0.56 0.15 -0.14 0.00 0.37 0.00 0.00 40.66 41.60 2q3r h LEU 255 CO -0.73 -0.31 -0.45 0.22 -0.34 0.00 0.00 178.44 176.83 2q3r h TYR 256 N -0.90 -1.33 -0.04 1.25 3.20 -0.90 0.29 116.97 118.54 2q3r h TYR 256 Ca -0.07 0.11 0.03 0.00 3.14 0.00 0.00 58.73 61.94 2q3r h TYR 256 Cb 0.53 0.71 -0.04 0.00 1.54 0.00 0.00 36.73 39.46 2q3r h TYR 256 CO 0.05 -0.40 -0.19 0.52 -1.64 0.00 0.00 178.16 176.49 2q3r h MET 257 N -0.05 -0.28 -1.07 1.82 2.86 0.18 0.79 114.93 119.18 2q3r h MET 257 Ca 0.26 0.02 0.31 0.00 -2.06 0.00 0.00 59.70 58.23 2q3r h MET 257 Cb 0.54 0.06 -0.12 0.00 0.06 0.00 0.00 31.60 32.14 2q3r h MET 257 CO -0.91 -0.19 0.66 0.00 1.06 0.00 0.00 176.91 177.53 2q3r h ALA 258 N 0.64 2.15 0.12 6.32 0.00 0.15 -1.18 119.26 127.47 2q3r h ALA 258 Ca 0.07 0.12 -0.28 0.00 0.00 0.00 0.00 54.91 54.83 2q3r h ALA 258 Cb 0.39 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2q3r h ALA 258 CO -0.21 -0.67 -1.41 0.93 0.00 0.00 0.00 179.25 177.89 2q3r h GLU 259 N 0.36 0.25 -0.35 0.00 4.39 0.29 -3.33 114.58 116.19 2q3r h GLU 259 Ca 0.69 -0.43 0.10 0.00 0.34 0.00 0.00 59.36 60.05 2q3r h GLU 259 Cb 1.68 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 30.48 2q3r h GLU 259 CO -0.45 1.21 0.33 0.77 -1.16 0.00 0.00 179.01 179.71 2q3r h SER 260 N -0.28 0.00 0.99 1.42 0.02 0.14 -1.37 113.55 114.46 2q3r h SER 260 Ca -0.30 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.44 2q3r h SER 260 Cb 1.78 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 64.28 2q3r h SER 260 CO 0.07 0.00 -1.04 -0.07 -1.14 0.00 0.00 176.83 174.65 2q3r h LEU 261 N 0.00 0.00 -0.39 5.07 3.38 -1.37 -3.30 115.31 118.69 2q3r h LEU 261 Ca 0.17 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.18 2q3r h LEU 261 Cb 0.83 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 2q3r h LEU 261 CO -0.00 0.92 0.16 0.78 0.09 0.00 0.00 178.44 180.39 2q3r h ASN 262 N 0.00 0.20 -0.82 -0.43 2.35 -1.36 0.19 115.58 115.70 2q3r h ASN 262 Ca -0.05 0.04 0.19 0.00 -0.55 0.00 0.00 56.30 55.93 2q3r h ASN 262 Cb 1.75 0.01 -0.15 0.00 0.05 0.00 0.00 38.32 39.98 2q3r h ASN 262 CO 0.11 0.15 -0.01 0.50 -1.65 0.00 0.00 177.43 176.53 2q3r h LYS 263 N 0.33 0.07 -0.00 0.81 3.64 -1.63 1.43 116.57 121.22 2q3r h LYS 263 Ca 0.18 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2q3r h LYS 263 Cb 0.13 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2q3r h LYS 263 CO -0.16 0.05 -0.15 0.66 -2.27 0.00 0.00 179.45 177.58 2q3r n TYR 264 N -5.40 0.00 -2.98 1.91 4.02 -0.82 -5.00 117.16 108.89 2q3r n TYR 264 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 2q3r n TYR 264 Cb 0.53 -0.31 0.00 0.00 -0.02 0.00 0.00 39.34 39.54 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 1.40 0.00 3.63 2.72 0.00 0.49 -5.00 105.19 108.43 2q3r n GLY 265 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.78 1.13 0.10 -0.61 -4.36 -1.26 -4.70 121.20 110.72 2q3r s ILE 266 Ca 0.00 -2.00 -0.32 0.00 -0.26 0.00 0.00 60.65 58.07 2q3r s ILE 266 Cb 0.00 -2.42 -0.12 0.00 1.25 0.00 0.00 42.46 41.17 2q3r s ILE 266 CO 0.00 0.00 1.59 0.25 0.24 0.00 0.00 174.94 177.02 2q3r h LEU 267 N 1.63 -1.14 -7.80 0.37 5.85 -0.38 -3.44 115.31 110.40 2q3r h LEU 267 Ca -0.41 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.39 2q3r h LEU 267 Cb 1.28 0.41 -0.10 0.00 0.37 0.00 0.00 40.66 42.62 2q3r h LEU 267 CO 0.70 -0.51 -0.01 -0.72 -0.34 0.00 0.00 178.44 177.55 2q3r s TYR 268 N -5.94 -0.01 -0.12 1.25 -0.85 -1.25 -2.58 117.35 107.85 2q3r s TYR 268 Ca -0.17 -0.35 0.02 0.00 -0.52 0.00 0.00 57.07 56.06 2q3r s TYR 268 Cb 0.06 0.34 0.01 0.00 0.38 0.00 0.00 41.96 42.76 2q3r s TYR 268 CO 0.63 -0.92 -0.17 0.00 -1.52 0.00 0.00 175.55 173.56 2q3r s HIS 270 N 0.92 3.13 0.02 0.00 5.04 -0.85 -1.41 115.29 122.14 2q3r s HIS 270 Ca -0.07 -1.89 0.06 0.00 -1.54 0.00 0.00 55.06 51.62 2q3r s HIS 270 Cb -0.15 -2.00 -0.02 0.00 0.04 0.00 0.00 32.58 30.45 2q3r s HIS 270 CO -0.01 -0.81 -0.19 0.08 -2.34 0.00 0.00 174.74 171.47 2q3r s VAL 271 N 1.23 1.48 0.01 0.89 1.01 -1.11 -1.71 120.40 122.21 2q3r s VAL 271 Ca -0.03 -1.02 -0.20 0.00 0.00 0.00 0.00 61.98 60.73 2q3r s VAL 271 Cb -0.18 -1.28 -0.06 0.00 0.00 0.00 0.00 36.38 34.87 2q3r s VAL 271 CO -0.05 0.24 0.58 -0.63 0.00 0.00 0.00 175.10 175.23 2q3r s ILE 272 N -0.68 4.87 0.66 2.22 1.01 -1.05 -3.38 121.20 124.85 2q3r s ILE 272 Ca 0.06 1.21 -0.16 0.00 0.00 0.00 0.00 60.65 61.76 2q3r s ILE 272 Cb -0.08 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.48 2q3r s ILE 272 CO 0.01 0.46 1.18 -0.70 0.00 0.00 0.00 174.94 175.89 2q3r s GLU 273 N -0.46 2.63 0.00 2.79 2.56 -0.67 -4.73 118.70 120.83 2q3r s GLU 273 Ca 0.30 1.68 0.00 0.00 0.00 0.00 0.00 54.97 56.95 2q3r s GLU 273 Cb -0.18 -1.90 0.00 0.00 2.00 0.00 0.00 34.13 34.04 2q3r s GLU 273 CO 0.17 -1.44 0.00 0.00 -0.56 0.00 0.00 175.26 173.44 2q3r n ALA 274 N -2.20 0.00 -0.78 6.30 0.00 -1.26 -4.83 120.51 117.74 2q3r n ALA 274 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.41 2q3r n ALA 274 Cb 0.50 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.88 2q3r n ALA 274 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2q3r n ARG 275 N -0.98 1.86 0.00 0.00 1.74 -1.26 -5.05 116.66 112.96 2q3r n ARG 275 Ca 0.00 -1.09 0.00 0.00 -0.77 0.00 0.00 57.85 55.99 2q3r n ARG 275 Cb 0.00 -2.13 0.00 0.00 -1.02 0.00 0.00 32.46 29.31 2q3r n ARG 275 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2q3r n MET 276 N 3.20 0.00 0.00 5.56 0.00 -1.26 -5.26 117.12 119.36 2q3r n MET 276 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 57.70 58.10 2q3r n MET 276 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.67 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 0.00 0.00 3.17 -0.00 -1.26 -4.95 115.22 112.18 2q3r n HIS 287 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2q3r n HIS 287 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2q3r n HIS 287 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.34 173.97 2q3r n THR 288 N 0.00 0.00 0.58 1.59 5.66 -1.26 -4.89 114.28 115.96 2q3r n THR 288 Ca 0.00 0.00 0.06 0.00 -3.05 0.00 0.00 64.05 61.06 2q3r n THR 288 Cb 0.00 -0.28 -0.04 0.00 -1.55 0.00 0.00 70.33 68.47 2q3r n THR 288 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2q3r n LEU 289 N -0.19 1.00 0.27 1.09 4.32 -1.26 -4.52 117.00 117.71 2q3r n LEU 289 Ca 0.00 -0.63 -0.13 0.00 -0.02 0.00 0.00 56.01 55.23 2q3r n LEU 289 Cb 0.00 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.74 2q3r n LEU 289 CO 0.00 0.21 0.36 0.24 -1.22 0.00 0.00 177.39 176.98 2q3r h MET 290 N 0.73 -0.69 0.00 3.23 2.86 -1.90 -2.42 114.93 116.73 2q3r h MET 290 Ca 0.00 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 2q3r h MET 290 Cb 0.37 0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.18 2q3r h MET 290 CO 0.00 -0.42 0.00 -2.30 1.06 0.00 0.00 176.91 175.25 2q3r n PRO 291 N -5.27 0.05 -0.02 -0.22 -0.02 -1.26 -2.23 135.00 126.03 2q3r n PRO 291 Ca -0.10 0.29 -0.18 0.00 -2.02 0.00 0.00 63.50 61.49 2q3r n PRO 291 Cb 0.31 -1.50 -0.14 0.00 -0.02 0.00 0.00 33.50 32.15 2q3r n PRO 291 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2q3r h MET 292 N 0.00 0.13 0.00 -0.52 2.86 -1.72 -2.14 114.93 113.54 2q3r h MET 292 Ca 0.00 -0.23 -0.09 0.00 -2.06 0.00 0.00 59.70 57.32 2q3r h MET 292 Cb 0.06 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 2q3r h MET 292 CO 0.00 1.11 -0.45 0.07 1.06 0.00 0.00 176.91 178.70 2q3r h ARG 293 N -0.70 0.00 -0.30 1.72 -0.00 -1.10 -1.56 114.38 112.45 2q3r h ARG 293 Ca -0.12 0.00 -0.04 0.00 -0.00 0.00 0.00 59.98 59.82 2q3r h ARG 293 Cb 1.35 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.31 2q3r h ARG 293 CO 0.04 0.45 0.03 0.87 -0.00 0.00 0.00 179.97 181.36 2q3r h LYS 294 N 0.00 0.51 -0.07 0.08 1.57 -1.53 -3.25 116.57 113.87 2q3r h LYS 294 Ca -0.00 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 2q3r h LYS 294 Cb 0.91 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 2q3r h LYS 294 CO 0.06 0.63 -0.05 0.00 -0.57 0.00 0.00 179.45 179.51 2q3r h ALA 295 N 0.86 0.10 -2.54 3.86 0.00 -1.16 -3.44 119.26 116.94 2q3r h ALA 295 Ca 0.09 -0.26 -0.53 0.00 0.00 0.00 0.00 54.91 54.21 2q3r h ALA 295 Cb 0.38 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.17 2q3r h ALA 295 CO 0.01 -0.12 0.87 0.12 0.00 0.00 0.00 179.25 180.13 2q3r s PHE 296 N -4.40 2.95 0.03 0.00 5.36 -0.60 -4.76 117.98 116.56 2q3r s PHE 296 Ca -0.15 0.65 0.11 0.00 -0.96 0.00 0.00 56.93 56.58 2q3r s PHE 296 Cb 0.03 -3.86 -0.01 0.00 -0.34 0.00 0.00 43.02 38.84 2q3r s PHE 296 CO 0.71 -3.22 1.39 0.87 -1.46 0.00 0.00 175.22 173.51 2q3r h LYS 297 N 7.19 0.00 0.00 10.12 1.79 -1.84 -3.47 116.57 130.37 2q3r h LYS 297 Ca -0.42 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.05 2q3r h LYS 297 Cb 1.20 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.85 2q3r h LYS 297 CO 0.91 0.75 0.00 0.41 -1.08 0.00 0.00 179.45 180.43 2q3r n GLY 298 N 1.16 0.78 3.75 3.86 0.00 -1.26 -5.04 105.19 108.43 2q3r n GLY 298 Ca 0.01 -1.90 -0.38 0.00 0.00 0.00 0.00 46.02 43.75 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 0.79 2.24 -0.07 2.61 2.01 -1.06 -4.87 115.64 117.29 2q3r s THR 299 Ca 0.00 0.17 0.02 0.00 0.31 0.00 0.00 61.69 62.19 2q3r s THR 299 Cb 0.00 -3.08 0.02 0.00 0.01 0.00 0.00 72.50 69.44 2q3r s THR 299 CO 0.00 -0.01 -0.10 0.12 -0.69 0.00 0.00 174.62 173.94 2q3r s PHE 300 N -1.37 1.31 -0.10 4.92 5.36 -1.26 -1.50 117.98 125.34 2q3r s PHE 300 Ca 0.73 -0.49 0.02 0.00 -0.96 0.00 0.00 56.93 56.23 2q3r s PHE 300 Cb -0.38 -1.00 -0.01 0.00 -0.34 0.00 0.00 43.02 41.29 2q3r s PHE 300 CO 0.44 -0.28 -0.17 0.42 -1.46 0.00 0.00 175.22 174.17 2q3r s ILE 301 N 0.82 2.75 -0.02 3.12 1.01 -0.50 -1.55 121.20 126.83 2q3r s ILE 301 Ca -0.12 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.75 2q3r s ILE 301 Cb -0.15 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.18 2q3r s ILE 301 CO 0.02 0.55 -0.03 -0.44 0.00 0.00 0.00 174.94 175.04 2q3r s SER 302 N 0.05 4.94 0.01 3.58 0.01 -0.35 -2.74 113.70 119.19 2q3r s SER 302 Ca -0.06 -0.02 -0.19 0.00 1.31 0.00 0.00 55.95 56.98 2q3r s SER 302 Cb -0.15 -1.27 0.04 0.00 0.21 0.00 0.00 66.02 64.85 2q3r s SER 302 CO 0.05 0.31 0.43 0.00 0.41 0.00 0.00 173.24 174.43 2q3r s ALA 303 N -0.99 -1.07 0.00 1.44 0.00 -1.22 0.48 121.76 120.41 2q3r s ALA 303 Ca 0.17 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.62 2q3r s ALA 303 Cb -0.11 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.21 2q3r s ALA 303 CO 0.07 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 175.86 2q3r n GLY 304 N 0.82 0.05 0.00 0.00 0.00 -1.26 -1.66 105.19 103.14 2q3r n GLY 304 Ca -0.20 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.11 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 2.74 3.74 -0.02 0.00 -1.26 -4.43 105.19 105.96 2q3r n GLY 305 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.54 2.22 0.00 1.61 0.40 -1.26 -4.98 117.98 113.44 2q3r s PHE 306 Ca 0.00 1.59 0.00 0.00 -0.60 0.00 0.00 56.93 57.92 2q3r s PHE 306 Cb 0.00 -3.37 0.00 0.00 0.51 0.00 0.00 43.02 40.16 2q3r s PHE 306 CO 0.00 -2.31 0.00 0.25 0.70 0.00 0.00 175.22 173.86 2q3r n THR 307 N -2.66 0.00 0.00 0.64 -2.24 -1.26 -4.93 114.28 103.83 2q3r n THR 307 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2q3r n THR 307 Cb 0.51 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 2q3r n THR 307 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2q3r n ARG 308 N 0.00 0.00 -0.28 -0.78 3.00 -1.26 -3.69 116.66 113.65 2q3r n ARG 308 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.85 57.93 2q3r n ARG 308 Cb 0.00 -0.01 0.20 0.00 0.00 0.00 0.00 32.46 32.65 2q3r n ARG 308 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2q3r h GLU 309 N 0.00 0.10 -0.85 -0.14 3.07 -1.99 0.21 114.58 114.98 2q3r h GLU 309 Ca 0.00 -0.01 0.08 0.00 -0.50 0.00 0.00 59.36 58.94 2q3r h GLU 309 Cb 0.00 -0.02 -0.11 0.00 -0.84 0.00 0.00 28.75 27.78 2q3r h GLU 309 CO 0.00 0.07 -0.57 0.22 -1.40 0.00 0.00 179.01 177.32 2q3r h ASP 310 N 0.10 -2.06 -0.09 1.42 1.82 -1.94 1.83 116.42 117.50 2q3r h ASP 310 Ca 0.47 0.31 -0.05 0.00 -0.39 0.00 0.00 57.03 57.37 2q3r h ASP 310 Cb 0.88 0.90 -0.00 0.00 0.68 0.00 0.00 39.33 41.79 2q3r h ASP 310 CO -0.72 -0.28 -0.15 1.23 -1.61 0.00 0.00 179.24 177.71 2q3r h GLY 311 N -0.10 0.29 0.06 -0.78 0.00 -1.03 -2.34 103.07 99.17 2q3r h GLY 311 Ca 0.15 -0.33 0.05 0.00 0.00 0.00 0.00 47.33 47.19 2q3r h GLY 311 CO -0.86 0.30 -0.36 3.43 0.00 0.00 0.00 176.54 179.06 2q3r h ASN 312 N -0.18 -1.13 -0.59 0.19 2.35 0.21 0.24 115.58 116.67 2q3r h ASN 312 Ca 0.01 0.16 0.11 0.00 -0.55 0.00 0.00 56.30 56.03 2q3r h ASN 312 Cb 0.72 0.48 -0.09 0.00 0.05 0.00 0.00 38.32 39.48 2q3r h ASN 312 CO 0.04 -0.38 0.12 -0.08 -1.65 0.00 0.00 177.43 175.47 2q3r h GLU 313 N -0.41 0.24 -0.22 0.81 4.81 0.28 0.29 114.58 120.37 2q3r h GLU 313 Ca 0.10 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 2q3r h GLU 313 Cb 0.58 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2q3r h GLU 313 CO -0.40 0.16 -0.04 0.00 -0.73 0.00 0.00 179.01 178.00 2q3r h ALA 314 N 1.48 1.52 0.08 2.92 0.00 -0.72 -0.35 119.26 124.19 2q3r h ALA 314 Ca 0.31 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2q3r h ALA 314 Cb 0.46 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2q3r h ALA 314 CO -0.41 0.35 -0.04 0.28 0.00 0.00 0.00 179.25 179.44 2q3r h VAL 315 N 0.33 0.00 -0.65 0.00 2.07 0.19 1.31 116.25 119.49 2q3r h VAL 315 Ca 0.07 -0.48 0.12 0.00 0.82 0.00 0.00 66.70 67.24 2q3r h VAL 315 Cb 0.29 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.97 2q3r h VAL 315 CO 0.01 0.00 0.17 0.77 0.02 0.00 0.00 177.57 178.54 2q3r h SER 316 N -0.58 0.06 0.00 0.57 4.64 -0.60 0.21 113.55 117.85 2q3r h SER 316 Ca -0.01 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2q3r h SER 316 Cb 0.08 0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2q3r h SER 316 CO 0.02 0.03 0.00 0.29 -0.87 0.00 0.00 176.83 176.29 2q3r n LYS 317 N -5.10 0.94 -1.46 4.77 4.76 -0.14 -4.84 118.16 117.09 2q3r n LYS 317 Ca 0.11 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.39 2q3r n LYS 317 Cb 0.36 -1.18 -0.07 0.00 -1.84 0.00 0.00 35.03 32.30 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 0.28 1.58 0.18 0.72 0.00 0.74 -4.88 105.19 103.80 2q3r n GLY 318 Ca 0.00 -0.21 -0.06 0.00 0.00 0.00 0.00 46.02 45.74 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 0.01 0.34 -4.26 1.61 2.47 0.12 -3.46 114.38 111.21 2q3r h ARG 319 Ca -0.32 -0.22 -0.16 0.00 -1.26 0.00 0.00 59.98 58.01 2q3r h ARG 319 Cb 1.07 0.03 -0.14 0.00 -1.65 0.00 0.00 29.97 29.28 2q3r h ARG 319 CO 0.47 0.82 -0.53 -0.08 0.56 0.00 0.00 179.97 181.21 2q3r s THR 320 N -3.86 0.08 -0.24 2.04 -1.32 0.21 -4.83 115.64 107.72 2q3r s THR 320 Ca -0.05 -1.75 -0.01 0.00 -1.21 0.00 0.00 61.69 58.67 2q3r s THR 320 Cb 0.12 -2.05 -0.18 0.00 -1.51 0.00 0.00 72.50 68.89 2q3r s THR 320 CO 0.81 -0.35 -0.16 0.47 -2.21 0.00 0.00 174.62 173.19 2q3r n ASP 321 N -0.16 2.00 -4.31 8.08 8.00 -0.60 -4.37 116.55 125.19 2q3r n ASP 321 Ca -0.05 -0.04 -0.16 0.00 0.71 0.00 0.00 54.79 55.25 2q3r n ASP 321 Cb 0.64 -0.52 -0.10 0.00 -0.02 0.00 0.00 41.12 41.12 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 -6.70 2.13 -0.08 0.64 1.43 -0.78 -4.83 118.68 110.49 2q3r s LEU 322 Ca -0.34 -1.22 -0.01 0.00 -1.03 0.00 0.00 54.13 51.53 2q3r s LEU 322 Cb 0.09 -0.20 0.03 0.00 0.03 0.00 0.00 46.19 46.14 2q3r s LEU 322 CO 0.61 -0.54 -0.02 -0.69 0.23 0.00 0.00 176.35 175.94 2q3r s VAL 323 N -3.50 0.58 -0.23 -1.59 1.01 0.88 -1.21 120.40 116.34 2q3r s VAL 323 Ca 0.28 -0.01 -0.10 0.00 0.00 0.00 0.00 61.98 62.15 2q3r s VAL 323 Cb 0.06 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.70 2q3r s VAL 323 CO 0.08 0.29 0.15 0.00 0.00 0.00 0.00 175.10 175.62 2q3r s ALA 324 N 1.88 3.60 -0.04 5.51 0.00 0.18 0.12 121.76 133.00 2q3r s ALA 324 Ca 0.05 -0.87 -0.00 0.00 0.00 0.00 0.00 51.96 51.14 2q3r s ALA 324 Cb -0.12 -2.28 -0.03 0.00 0.00 0.00 0.00 23.12 20.68 2q3r s ALA 324 CO -0.06 -0.14 0.01 0.71 0.00 0.00 0.00 175.76 176.27 2q3r s TYR 325 N 0.96 3.13 0.00 0.00 2.02 -0.18 -4.21 117.35 119.08 2q3r s TYR 325 Ca 0.07 0.14 0.00 0.00 -0.37 0.00 0.00 57.07 56.91 2q3r s TYR 325 Cb -0.13 -1.73 0.00 0.00 -0.40 0.00 0.00 41.96 39.70 2q3r s TYR 325 CO 0.04 0.47 0.00 0.41 -1.57 0.00 0.00 175.55 174.90 2q3r n GLY 326 N 1.69 0.05 0.27 0.71 0.00 -1.26 -1.50 105.19 105.15 2q3r n GLY 326 Ca -0.16 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 0.00 1.61 3.08 -1.97 -0.90 114.38 116.19 2q3r h ARG 327 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 2q3r h ARG 327 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2q3r h ARG 327 CO 0.00 0.00 -0.56 -1.49 -1.07 0.00 0.00 179.97 176.85 2q3r h TRP 328 N 0.00 0.00 0.00 3.04 -0.00 -1.96 -2.93 115.95 114.10 2q3r h TRP 328 Ca 0.01 0.00 -0.17 0.00 -0.00 0.00 0.00 58.89 58.73 2q3r h TRP 328 Cb 0.03 0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 29.17 2q3r h TRP 328 CO 0.00 0.56 -1.27 0.35 -0.00 0.00 0.00 178.44 178.08 2q3r h PHE 329 N 0.00 0.00 -0.47 0.49 3.04 -1.54 -3.18 116.94 115.28 2q3r h PHE 329 Ca -0.01 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 2q3r h PHE 329 Cb 1.17 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.66 2q3r h PHE 329 CO 0.00 0.63 0.25 1.25 -2.02 0.00 0.00 178.31 178.43 2q3r h LEU 330 N 0.00 0.59 -1.77 0.59 6.46 -1.16 -2.92 115.31 117.10 2q3r h LEU 330 Ca -0.14 -0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.53 2q3r h LEU 330 Cb 1.61 -0.15 0.00 0.00 -0.73 0.00 0.00 40.66 41.39 2q3r h LEU 330 CO 0.06 0.51 0.00 0.00 -0.62 0.00 0.00 178.44 178.39 2q3r n ALA 331 N -2.28 2.63 -3.30 1.25 0.00 -1.11 -4.67 120.51 113.03 2q3r n ALA 331 Ca 0.01 -0.82 -0.12 0.00 0.00 0.00 0.00 53.44 52.51 2q3r n ALA 331 Cb 0.09 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.87 0.38 0.42 0.00 0.01 -1.10 -4.62 114.94 109.16 2q3r s ASN 332 Ca 0.29 -1.45 0.20 0.00 -0.71 0.00 0.00 52.86 51.19 2q3r s ASN 332 Cb 0.17 0.94 1.15 0.00 0.41 0.00 0.00 41.25 43.91 2q3r s ASN 332 CO 0.17 -0.22 1.80 1.55 -1.51 0.00 0.00 177.10 178.89 2q3r h PRO 333 N 6.89 0.34 -2.89 -0.60 0.13 -1.81 -2.90 132.00 131.16 2q3r h PRO 333 Ca 0.06 -0.02 -0.74 0.00 -0.87 0.00 0.00 66.00 64.43 2q3r h PRO 333 Cb 1.08 -0.08 -0.32 0.00 0.13 0.00 0.00 31.00 31.81 2q3r h PRO 333 CO 0.17 0.23 0.29 -0.40 -0.23 0.00 0.00 178.00 178.06 2q3r n ASP 334 N -4.54 5.36 -0.07 1.44 3.85 -1.26 -4.16 116.55 117.16 2q3r n ASP 334 Ca 0.23 -3.33 -0.21 0.00 -0.71 0.00 0.00 54.79 50.77 2q3r n ASP 334 Cb 0.86 -1.11 -0.12 0.00 -1.35 0.00 0.00 41.12 39.39 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 5.38 0.09 -1.17 -2.12 5.85 -1.88 -3.32 115.31 118.14 2q3r h LEU 335 Ca 0.19 -0.65 0.22 0.00 0.84 0.00 0.00 57.88 58.48 2q3r h LEU 335 Cb 0.69 -0.03 -0.10 0.00 0.37 0.00 0.00 40.66 41.59 2q3r h LEU 335 CO 1.11 1.50 0.62 -0.65 -0.34 0.00 0.00 178.44 180.68 2q3r h PRO 336 N -0.80 0.59 -0.29 5.25 0.11 -1.90 -0.67 132.00 134.29 2q3r h PRO 336 Ca -0.32 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.58 2q3r h PRO 336 Cb 1.41 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2q3r h PRO 336 CO -0.12 0.39 -0.53 -0.22 -0.21 0.00 0.00 178.00 177.30 2q3r h LYS 337 N 0.61 0.88 0.68 1.05 1.63 -1.97 -2.96 116.57 116.49 2q3r h LYS 337 Ca 0.57 -0.55 -0.03 0.00 -0.85 0.00 0.00 60.65 59.79 2q3r h LYS 337 Cb 1.11 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 2q3r h LYS 337 CO -0.34 1.19 -0.35 0.00 -3.45 0.00 0.00 179.45 176.50 2q3r h ARG 338 N 0.66 -0.91 0.00 1.90 3.08 -1.28 2.44 114.38 120.28 2q3r h ARG 338 Ca 0.02 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2q3r h ARG 338 Cb 1.14 0.21 0.00 0.00 0.08 0.00 0.00 29.97 31.40 2q3r h ARG 338 CO 0.12 -0.61 0.03 1.19 -1.07 0.00 0.00 179.97 179.63 2q3r n PHE 339 N -5.50 0.00 -0.03 3.04 3.72 -0.47 -0.32 117.46 117.89 2q3r n PHE 339 Ca -0.14 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.22 2q3r n PHE 339 Cb 0.39 -0.12 -0.04 0.00 -0.94 0.00 0.00 39.48 38.78 2q3r n PHE 339 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 2q3r n GLN 340 N -1.04 0.78 -3.13 -1.08 7.27 0.21 -4.78 117.38 115.60 2q3r n GLN 340 Ca 0.00 0.03 -0.37 0.00 0.07 0.00 0.00 57.00 56.73 2q3r n GLN 340 Cb 0.03 -1.15 -0.02 0.00 2.41 0.00 0.00 30.24 31.51 2q3r n GLN 340 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2q3r n VAL 341 N -2.61 4.29 0.00 1.69 0.31 0.80 -4.98 118.33 117.83 2q3r n VAL 341 Ca -0.12 -5.69 0.00 0.00 -0.01 0.00 0.00 64.34 58.52 2q3r n VAL 341 Cb 0.65 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.54 2q3r n VAL 341 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2q3r n ASP 342 N 1.04 0.00 -3.78 4.52 8.00 -1.06 -4.69 116.55 120.58 2q3r n ASP 342 Ca 0.28 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.66 2q3r n ASP 342 Cb 0.36 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.34 2q3r n ASP 342 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2q3r s ALA 343 N 0.00 -0.67 1.14 2.24 0.00 -1.24 -5.09 121.76 118.15 2q3r s ALA 343 Ca 0.00 0.75 -0.09 0.00 0.00 0.00 0.00 51.96 52.61 2q3r s ALA 343 Cb 0.00 -0.43 0.14 0.00 0.00 0.00 0.00 23.12 22.83 2q3r s ALA 343 CO 0.00 -0.13 0.41 -0.35 0.00 0.00 0.00 175.76 175.69 2q3r n PRO 344 N 2.88 -2.45 -4.24 0.00 -0.04 -1.26 -4.76 135.00 125.14 2q3r n PRO 344 Ca -0.13 -0.67 -0.18 0.00 -0.04 0.00 0.00 63.50 62.48 2q3r n PRO 344 Cb 0.58 -0.72 -0.11 0.00 -0.04 0.00 0.00 33.50 33.21 2q3r n PRO 344 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2q3r s LEU 345 N 0.00 2.40 0.76 1.53 1.43 -1.26 -5.04 118.68 118.50 2q3r s LEU 345 Ca 0.28 -0.80 -0.11 0.00 -1.03 0.00 0.00 54.13 52.47 2q3r s LEU 345 Cb -0.04 -0.57 0.05 0.00 0.03 0.00 0.00 46.19 45.66 2q3r s LEU 345 CO 0.23 -0.13 1.10 0.20 0.23 0.00 0.00 176.35 177.97 2q3r s ASN 346 N -2.42 4.84 0.27 2.29 0.01 -1.26 -5.05 114.94 113.62 2q3r s ASN 346 Ca 0.09 1.24 -0.14 0.00 -0.71 0.00 0.00 52.86 53.33 2q3r s ASN 346 Cb -0.05 -1.99 -0.08 0.00 0.41 0.00 0.00 41.25 39.53 2q3r s ASN 346 CO 0.03 -1.74 0.67 -0.54 -1.51 0.00 0.00 177.10 174.01 2q3r s LYS 347 N -5.23 3.98 0.12 -0.60 1.02 -1.26 -4.93 119.74 112.84 2q3r s LYS 347 Ca 0.60 0.57 -0.17 0.00 0.02 0.00 0.00 55.97 56.99 2q3r s LYS 347 Cb -0.13 -2.59 -0.07 0.00 -0.52 0.00 0.00 37.83 34.52 2q3r s LYS 347 CO 0.53 0.26 0.57 1.52 -0.92 0.00 0.00 175.35 177.31 2q3r s TYR 348 N -1.84 3.69 -1.08 3.18 -0.85 -1.26 -4.89 117.35 114.30 2q3r s TYR 348 Ca 0.49 1.17 -0.10 0.00 -0.52 0.00 0.00 57.07 58.11 2q3r s TYR 348 Cb -0.12 -2.44 0.26 0.00 0.38 0.00 0.00 41.96 40.04 2q3r s TYR 348 CO 0.19 0.48 1.09 0.34 -1.52 0.00 0.00 175.55 176.14 2q3r s ASP 349 N -1.47 7.22 0.22 -0.18 2.15 -1.26 -4.94 116.67 118.41 2q3r s ASP 349 Ca 0.35 -3.41 -0.17 0.00 0.43 0.00 0.00 52.55 49.75 2q3r s ASP 349 Cb -0.17 -2.23 0.21 0.00 -0.30 0.00 0.00 42.92 40.44 2q3r s ASP 349 CO 0.19 -0.37 1.48 0.54 -0.17 0.00 0.00 175.17 176.84 2q3r n ARG 350 N 3.17 -0.23 0.15 4.34 5.12 -1.26 -0.19 116.66 127.76 2q3r n ARG 350 Ca 0.24 1.47 0.07 0.00 -1.93 0.00 0.00 57.85 57.69 2q3r n ARG 350 Cb 0.41 -2.17 0.38 0.00 -1.16 0.00 0.00 32.46 29.91 2q3r n ARG 350 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2q3r n PRO 351 N -5.39 0.09 -0.02 5.56 -0.02 -1.26 -1.73 135.00 132.23 2q3r n PRO 351 Ca 0.09 0.57 0.02 0.00 -2.02 0.00 0.00 63.50 62.16 2q3r n PRO 351 Cb 0.37 -2.04 0.03 0.00 -0.02 0.00 0.00 33.50 31.84 2q3r n PRO 351 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2q3r n THR 352 N -2.05 0.40 -0.17 3.45 -2.24 0.74 -4.47 114.28 109.94 2q3r n THR 352 Ca -0.01 -0.70 -0.06 0.00 -2.27 0.00 0.00 64.05 61.01 2q3r n THR 352 Cb 0.26 0.84 0.04 0.00 -2.10 0.00 0.00 70.33 69.36 2q3r n THR 352 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2q3r h PHE 353 N 0.63 0.59 -0.33 4.78 0.04 -1.19 -3.19 116.94 118.27 2q3r h PHE 353 Ca 0.00 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.79 2q3r h PHE 353 Cb 0.31 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.27 2q3r h PHE 353 CO 0.03 0.34 0.00 0.66 -0.60 0.00 0.00 178.31 178.74 2q3r n TYR 354 N -4.78 0.43 -1.64 -0.55 4.01 -1.26 -4.63 117.16 108.73 2q3r n TYR 354 Ca 0.04 -0.25 -0.29 0.00 -0.16 0.00 0.00 57.90 57.24 2q3r n TYR 354 Cb 0.07 -0.00 0.16 0.00 -0.31 0.00 0.00 39.34 39.25 2q3r n TYR 354 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2q3r s THR 355 N -1.38 1.94 -0.23 -0.72 -4.23 -1.21 -4.78 115.64 105.03 2q3r s THR 355 Ca 0.34 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 60.98 2q3r s THR 355 Cb 0.20 -2.82 0.53 0.00 1.34 0.00 0.00 72.50 71.74 2q3r s THR 355 CO 0.28 0.00 1.46 -1.54 -0.54 0.00 0.00 174.62 174.28 2q3r n SER 356 N -3.83 3.34 -4.77 3.99 3.41 -1.26 -4.67 113.62 109.83 2q3r n SER 356 Ca 0.10 -3.33 -0.38 0.00 -0.26 0.00 0.00 58.87 55.00 2q3r n SER 356 Cb 0.60 -0.59 -0.05 0.00 -0.26 0.00 0.00 64.21 63.91 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 -2.14 7.14 0.47 4.04 2.15 -1.26 -4.92 116.67 122.16 2q3r s ASP 357 Ca 0.44 2.09 0.21 0.00 0.43 0.00 0.00 52.55 55.72 2q3r s ASP 357 Cb 0.37 -2.60 1.18 0.00 -0.30 0.00 0.00 42.92 41.57 2q3r s ASP 357 CO 0.05 -0.22 2.00 -0.65 -0.17 0.00 0.00 175.17 176.18 2q3r h PRO 358 N 3.30 0.00 0.00 4.34 0.11 -1.95 -3.39 132.00 134.41 2q3r h PRO 358 Ca -0.47 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 2q3r h PRO 358 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2q3r h PRO 358 CO 0.65 0.18 -0.17 0.28 -0.21 0.00 0.00 178.00 178.74 2q3r n VAL 359 N -3.88 1.28 -1.59 3.15 0.31 -1.26 -4.59 118.33 111.75 2q3r n VAL 359 Ca -0.02 0.36 -0.54 0.00 -0.01 0.00 0.00 64.34 64.14 2q3r n VAL 359 Cb 0.28 -1.71 -0.07 0.00 -0.91 0.00 0.00 33.84 31.42 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 -3.65 0.29 -1.13 2.52 0.31 -1.26 0.31 118.33 115.71 2q3r n VAL 360 Ca -0.02 -0.14 -0.05 0.00 -0.01 0.00 0.00 64.34 64.12 2q3r n VAL 360 Cb 0.09 -1.45 -0.02 0.00 -0.91 0.00 0.00 33.84 31.55 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 5.27 0.71 0.73 2.92 0.00 -1.26 -4.63 105.19 108.93 2q3r n GLY 361 Ca 0.33 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.71 0.00 -0.55 1.61 9.36 0.15 -4.59 117.16 120.43 2q3r n TYR 362 Ca -0.05 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.17 2q3r n TYR 362 Cb 0.23 0.11 0.00 0.00 -0.63 0.00 0.00 39.34 39.05 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 -2.43 0.09 1.49 2.97 -2.24 0.19 -4.79 114.28 109.56 2q3r n THR 363 Ca 0.00 -0.27 0.14 0.00 -2.27 0.00 0.00 64.05 61.65 2q3r n THR 363 Cb 0.28 1.39 0.53 0.00 -2.10 0.00 0.00 70.33 70.44 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 -0.05 1.42 -4.68 3.42 3.85 -1.22 -4.83 116.55 114.46 2q3r n ASP 364 Ca 0.00 -1.50 -0.42 0.00 -0.71 0.00 0.00 54.79 52.16 2q3r n ASP 364 Cb 0.19 -0.01 -0.03 0.00 -1.35 0.00 0.00 41.12 39.92 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 -1.97 2.51 0.44 2.11 2.02 -1.26 -4.96 117.35 116.23 2q3r s TYR 365 Ca 0.38 0.50 -0.21 0.00 -0.37 0.00 0.00 57.07 57.37 2q3r s TYR 365 Cb 0.20 -3.83 -0.10 0.00 -0.40 0.00 0.00 41.96 37.84 2q3r s TYR 365 CO 0.33 -3.26 0.98 -1.25 -1.57 0.00 0.00 175.55 170.77 2q3r s PRO 366 N 2.86 4.11 0.62 -1.71 0.04 -1.26 -4.59 135.00 135.07 2q3r s PRO 366 Ca 0.69 1.20 -0.10 0.00 0.04 0.00 0.00 61.00 62.83 2q3r s PRO 366 Cb -0.35 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 2q3r s PRO 366 CO 0.29 -0.14 1.00 -0.06 0.04 0.00 0.00 177.00 178.13 2q3r s PHE 367 N -2.11 3.54 0.00 0.56 0.40 -1.26 -4.64 117.98 114.47 2q3r s PHE 367 Ca 0.63 1.14 0.00 0.00 -0.60 0.00 0.00 56.93 58.11 2q3r s PHE 367 Cb -0.11 -2.74 0.00 0.00 0.51 0.00 0.00 43.02 40.68 2q3r s PHE 367 CO 0.15 -0.74 0.23 1.28 0.70 0.00 0.00 175.22 176.84 2q3r n LEU 368 N -2.73 0.00 0.00 -0.37 4.77 -1.26 -5.08 117.00 112.33 2q3r n LEU 368 Ca 0.05 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 2q3r n LEU 368 Cb 0.55 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 2q3r n LEU 368 CO 0.57 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 176.01